USER MOD reduce.3.24.130724 H: found=0, std=0, add=3063, rem=0, adj=99 USER MOD reduce.3.24.130724 removed 3060 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 52 GLN :FLIP amide:sc= -7.39! C(o=-17!,f=-14!) USER MOD Set 1.2: C 74 ASN :FLIP amide:sc= -6.78! C(o=-17!,f=-14!) USER MOD Set 2.1: C 56 ASN :FLIP amide:sc= -5.88! C(o=-11!,f=-5.9!) USER MOD Set 2.2: C 69 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: C 22 LYS NZ :NH3+ 164:sc= -0.0234 (180deg=-0.31) USER MOD Set 3.2: C 108 GLN : amide:sc= 0 X(o=-0.023,f=-0.49) USER MOD Set 4.1: C 1 ALA N :NH3+ 175:sc= -0.165 (180deg=-0.187) USER MOD Set 4.2: C 2 GLN : amide:sc= -1.71! C(o=-1.9!,f=-3.6!) USER MOD Set 5.1: A 13 GLN : amide:sc= -3.11! C(o=-14!,f=-26!) USER MOD Set 5.2: A 16 GLN :FLIP amide:sc= -3.41! C(o=-16!,f=-14!) USER MOD Set 5.3: B 110 GLN : amide:sc= -6.74! C(o=-14!,f=-23!) USER MOD Set 5.4: B 111 GLN : amide:sc= -0.385 K(o=-14,f=-16) USER MOD Set 6.1: A 52 GLN :FLIP amide:sc= -8.12! C(o=-18!,f=-16!) USER MOD Set 6.2: B 74 ASN :FLIP amide:sc= -7.4! C(o=-18!,f=-16!) USER MOD Set 7.1: B 56 ASN :FLIP amide:sc= -5.7! C(o=-10!,f=-5.7!) USER MOD Set 7.2: B 69 THR OG1 : rot 180:sc= 0 USER MOD Set 8.1: B 37 ASN :FLIP amide:sc= -0.455 F(o=-14,f=-9.6) USER MOD Set 8.2: C 82 ASN : amide:sc= -8.98! C(o=-9.6!,f=-14!) USER MOD Set 8.3: C 85 THR OG1 : rot -16:sc= -0.132 USER MOD Set 9.1: B 22 LYS NZ :NH3+ 162:sc= -0.038 (180deg=-0.35) USER MOD Set 9.2: B 108 GLN : amide:sc= 0 X(o=-0.038,f=-0.54) USER MOD Set10.1: B 13 GLN : amide:sc= -3.53! C(o=-14!,f=-27!) USER MOD Set10.2: B 16 GLN :FLIP amide:sc= -3.48! C(o=-16!,f=-14!) USER MOD Set10.3: C 110 GLN : amide:sc= -6.84! C(o=-14!,f=-24!) USER MOD Set10.4: C 111 GLN : amide:sc= -0.437 K(o=-14,f=-16) USER MOD Set11.1: B 1 ALA N :NH3+ 176:sc= -0.15 (180deg=-0.182) USER MOD Set11.2: B 2 GLN : amide:sc= -1.57! C(o=-1.7!,f=-3.9!) USER MOD Set12.1: A 110 GLN : amide:sc= -6.67! C(o=-14!,f=-24!) USER MOD Set12.2: A 111 GLN : amide:sc= -0.34 K(o=-14,f=-16) USER MOD Set12.3: C 13 GLN : amide:sc= -3.35! C(o=-14!,f=-26!) USER MOD Set12.4: C 16 GLN :FLIP amide:sc= -3.48! C(o=-16!,f=-14!) USER MOD Set13.1: A 82 ASN : amide:sc= -8.78! C(o=-9.4!,f=-13!) USER MOD Set13.2: A 85 THR OG1 : rot -18:sc= -0.0368 USER MOD Set13.3: C 37 ASN :FLIP amide:sc= -0.544 F(o=-13,f=-9.4) USER MOD Set14.1: A 74 ASN :FLIP amide:sc= -7.21! C(o=-17!,f=-15!) USER MOD Set14.2: C 52 GLN :FLIP amide:sc= -8.1! C(o=-18!,f=-15!) USER MOD Set15.1: A 56 ASN :FLIP amide:sc= -6.05! C(o=-11!,f=-6.1!) USER MOD Set15.2: A 69 THR OG1 : rot 180:sc= 0 USER MOD Set16.1: A 37 ASN :FLIP amide:sc= -0.44 F(o=-13,f=-9.3) USER MOD Set16.2: B 82 ASN : amide:sc= -8.95! C(o=-9.3!,f=-13!) USER MOD Set16.3: B 85 THR OG1 : rot -19:sc= 0.101 USER MOD Set17.1: A 35 THR OG1 : rot 86:sc= 0.193 USER MOD Set17.2: B 35 THR OG1 : rot 85:sc= 0.242 USER MOD Set17.3: C 35 THR OG1 : rot 87:sc= 0.2 USER MOD Set18.1: A 24 GLN : amide:sc= -1.7 K(o=-5.1,f=-15!) USER MOD Set18.2: B 24 GLN : amide:sc= -1.71 K(o=-5.1,f=-15!) USER MOD Set18.3: C 24 GLN : amide:sc= -1.71 K(o=-5.1,f=-16!) USER MOD Set19.1: A 22 LYS NZ :NH3+ 163:sc= -0.0126 (180deg=-0.342) USER MOD Set19.2: A 108 GLN : amide:sc= 0 X(o=-0.013,f=-0.47) USER MOD Set20.1: A 1 ALA N :NH3+ 177:sc= -0.135 (180deg=-0.158) USER MOD Set20.2: A 2 GLN : amide:sc= -1.7! C(o=-1.8!,f=-4!) USER MOD Single : A 3 SER OG : rot 53:sc= 0.758 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 GLN :FLIP amide:sc= 0 F(o=-1.4!,f=0) USER MOD Single : A 14 GLN : amide:sc= -2.35 X(o=-2.3,f=-2.6!) USER MOD Single : A 15 GLN :FLIP amide:sc= 0 F(o=-1.3!,f=0) USER MOD Single : A 25 GLN :FLIP amide:sc= -5.24! C(o=-7.7!,f=-5.2!) USER MOD Single : A 31 THR OG1 : rot -32:sc= 0.666 USER MOD Single : A 36 LYS NZ :NH3+ 132:sc= -2.94! (180deg=-4.62!) USER MOD Single : A 39 GLN : amide:sc= 0.356 X(o=0.36,f=-0.07) USER MOD Single : A 40 THR OG1 : rot -81:sc= 0.682 USER MOD Single : A 43 THR OG1 : rot -34:sc= 0.56 USER MOD Single : A 47 LYS NZ :NH3+ 159:sc= -0.0212 (180deg=-0.572) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 GLN :FLIP amide:sc= 0 F(o=-1.3,f=0) USER MOD Single : A 64 GLN :FLIP amide:sc= -3.88! C(o=-12!,f=-3.9!) USER MOD Single : A 67 HIS : no HD1:sc= -0.155 X(o=-0.16,f=-0.0088) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 SER OG : rot 60:sc= 1.09 USER MOD Single : A 78 THR OG1 : rot 105:sc= -0.0594 USER MOD Single : A 80 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.132) USER MOD Single : A 83 ASN : amide:sc= -0.0456 X(o=-0.046,f=0) USER MOD Single : A 87 GLN : amide:sc= -0.0164 K(o=-0.016,f=-1.5!) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 ASN :FLIP amide:sc= -3.7! C(o=-6.6!,f=-3.7!) USER MOD Single : A 101 THR OG1 : rot -13:sc= 0.558 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 ASN : amide:sc= -1.19 X(o=-1.2,f=-1.4) USER MOD Single : A 115 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 119 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 120 LYS NZ :NH3+ 170:sc= -1.03 (180deg=-1.41) USER MOD Single : A 122 ASN :FLIP amide:sc= -0.903 F(o=-2.4!,f=-0.9) USER MOD Single : A 123 SER OG : rot 27:sc= 1.07 USER MOD Single : B 3 SER OG : rot 58:sc= 0.689 USER MOD Single : B 5 THR OG1 : rot 180:sc= 0 USER MOD Single : B 12 GLN :FLIP amide:sc= 0 F(o=-1.3!,f=0) USER MOD Single : B 14 GLN : amide:sc= -2.68 X(o=-2.7,f=-2.9!) USER MOD Single : B 15 GLN :FLIP amide:sc= 0 F(o=-1.5!,f=0) USER MOD Single : B 25 GLN :FLIP amide:sc= -5.42! C(o=-7.5!,f=-5.4!) USER MOD Single : B 31 THR OG1 : rot -36:sc= 0.643 USER MOD Single : B 36 LYS NZ :NH3+ 136:sc= -3.05 (180deg=-4.85!) USER MOD Single : B 39 GLN : amide:sc= 0.391 X(o=0.39,f=-0.013) USER MOD Single : B 40 THR OG1 : rot -75:sc= 0.686 USER MOD Single : B 43 THR OG1 : rot -37:sc= 0.713 USER MOD Single : B 47 LYS NZ :NH3+ 158:sc= -0.0136 (180deg=-0.558) USER MOD Single : B 48 TYR OH : rot 180:sc= 0 USER MOD Single : B 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 54 GLN :FLIP amide:sc= 0 F(o=-1.4,f=0) USER MOD Single : B 64 GLN :FLIP amide:sc= -4.09! C(o=-12!,f=-4.1!) USER MOD Single : B 67 HIS : no HD1:sc= -0.104 X(o=-0.1,f=-0.012) USER MOD Single : B 68 THR OG1 : rot 180:sc= 0 USER MOD Single : B 76 SER OG : rot 67:sc= 1.07 USER MOD Single : B 78 THR OG1 : rot 100:sc= 0.0813 USER MOD Single : B 80 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.107) USER MOD Single : B 83 ASN : amide:sc= -0.0612 X(o=-0.061,f=0) USER MOD Single : B 87 GLN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD Single : B 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 99 ASN :FLIP amide:sc= -3.9! C(o=-6.8!,f=-3.9!) USER MOD Single : B 101 THR OG1 : rot -18:sc= 0.63 USER MOD Single : B 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 114 ASN : amide:sc= -1.38 X(o=-1.4,f=-1.3) USER MOD Single : B 115 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 116 TYR OH : rot 180:sc= 0 USER MOD Single : B 119 GLN : amide:sc= -0.0105 K(o=-0.011,f=-1.1) USER MOD Single : B 120 LYS NZ :NH3+ 169:sc= -1.03 (180deg=-1.45) USER MOD Single : B 122 ASN :FLIP amide:sc= -1.03 F(o=-2.5!,f=-1) USER MOD Single : B 123 SER OG : rot 25:sc= 1.05 USER MOD Single : C 3 SER OG : rot 62:sc= 0.757 USER MOD Single : C 5 THR OG1 : rot 180:sc= 0 USER MOD Single : C 12 GLN :FLIP amide:sc= 0 F(o=-1.3!,f=0) USER MOD Single : C 14 GLN : amide:sc= -2.69 X(o=-2.7,f=-2.6) USER MOD Single : C 15 GLN :FLIP amide:sc= 0 F(o=-1.3!,f=0) USER MOD Single : C 25 GLN :FLIP amide:sc= -5.44! C(o=-7.2!,f=-5.4!) USER MOD Single : C 31 THR OG1 : rot -34:sc= 0.574 USER MOD Single : C 36 LYS NZ :NH3+ -101:sc= -3.17 (180deg=-4.7!) USER MOD Single : C 39 GLN : amide:sc= 0.422 X(o=0.42,f=-0.00035) USER MOD Single : C 40 THR OG1 : rot -66:sc= 0.722 USER MOD Single : C 43 THR OG1 : rot -41:sc= 0.436 USER MOD Single : C 47 LYS NZ :NH3+ 160:sc= -0.0296 (180deg=-0.546) USER MOD Single : C 48 TYR OH : rot 180:sc= 0 USER MOD Single : C 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 54 GLN :FLIP amide:sc=-0.00637 F(o=-1.3,f=-0.0064) USER MOD Single : C 64 GLN :FLIP amide:sc= -4.15 F(o=-12!,f=-4.1) USER MOD Single : C 67 HIS : no HD1:sc= -0.138 X(o=-0.14,f=-0.00076) USER MOD Single : C 68 THR OG1 : rot 180:sc= 0 USER MOD Single : C 76 SER OG : rot 66:sc= 0.969 USER MOD Single : C 78 THR OG1 : rot 100:sc= -0.0744 USER MOD Single : C 80 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.14) USER MOD Single : C 83 ASN : amide:sc= -0.0754 X(o=-0.075,f=0) USER MOD Single : C 87 GLN : amide:sc=-0.000738 K(o=-0.00074,f=-1.5!) USER MOD Single : C 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 99 ASN :FLIP amide:sc= -3.45! C(o=-5.8!,f=-3.5!) USER MOD Single : C 101 THR OG1 : rot -18:sc= 0.636 USER MOD Single : C 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 114 ASN : amide:sc= -1.17 X(o=-1.2,f=-1.4) USER MOD Single : C 115 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 116 TYR OH : rot 180:sc= 0 USER MOD Single : C 119 GLN : amide:sc=-0.00927 K(o=-0.0093,f=-1.2) USER MOD Single : C 120 LYS NZ :NH3+ 171:sc= -0.981 (180deg=-1.36) USER MOD Single : C 122 ASN :FLIP amide:sc= -0.998 F(o=-2.4!,f=-1) USER MOD Single : C 123 SER OG : rot 23:sc= 0.969 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 27.362 -41.356 -9.348 1.00 0.82 N ATOM 2 CA ALA A 1 28.387 -40.284 -9.497 1.00 0.80 C ATOM 3 C ALA A 1 27.703 -38.917 -9.437 1.00 0.71 C ATOM 4 O ALA A 1 28.314 -37.893 -9.672 1.00 0.70 O ATOM 5 CB ALA A 1 29.101 -40.443 -10.841 1.00 0.90 C ATOM 0 H1 ALA A 1 27.817 -42.287 -9.439 1.00 0.82 H new ATOM 0 H2 ALA A 1 26.914 -41.280 -8.413 1.00 0.82 H new ATOM 0 H3 ALA A 1 26.639 -41.250 -10.088 1.00 0.82 H new ATOM 0 HA ALA A 1 29.116 -40.361 -8.690 1.00 0.80 H new ATOM 0 HB1 ALA A 1 29.850 -39.659 -10.950 1.00 0.90 H new ATOM 0 HB2 ALA A 1 29.587 -41.418 -10.882 1.00 0.90 H new ATOM 0 HB3 ALA A 1 28.375 -40.366 -11.650 1.00 0.90 H new ATOM 13 N GLN A 2 26.438 -38.895 -9.122 1.00 0.67 N ATOM 14 CA GLN A 2 25.706 -37.599 -9.044 1.00 0.60 C ATOM 15 C GLN A 2 26.077 -36.879 -7.743 1.00 0.52 C ATOM 16 O GLN A 2 26.318 -37.499 -6.726 1.00 0.52 O ATOM 17 CB GLN A 2 24.197 -37.860 -9.063 1.00 0.62 C ATOM 18 CG GLN A 2 23.784 -38.413 -10.431 1.00 0.72 C ATOM 19 CD GLN A 2 24.195 -39.884 -10.536 1.00 1.27 C ATOM 20 OE1 GLN A 2 24.091 -40.625 -9.578 1.00 2.00 O ATOM 21 NE2 GLN A 2 24.654 -40.344 -11.667 1.00 1.87 N ATOM 0 H GLN A 2 25.877 -39.721 -8.914 1.00 0.67 H new ATOM 0 HA GLN A 2 25.980 -36.979 -9.897 1.00 0.60 H new ATOM 0 HB2 GLN A 2 23.931 -38.569 -8.279 1.00 0.62 H new ATOM 0 HB3 GLN A 2 23.656 -36.937 -8.855 1.00 0.62 H new ATOM 0 HG2 GLN A 2 22.706 -38.316 -10.564 1.00 0.72 H new ATOM 0 HG3 GLN A 2 24.256 -37.835 -11.226 1.00 0.72 H new ATOM 0 HE21 GLN A 2 24.742 -39.724 -12.472 1.00 1.87 H new ATOM 0 HE22 GLN A 2 24.925 -41.324 -11.747 1.00 1.87 H new ATOM 30 N SER A 3 26.120 -35.573 -7.767 1.00 0.47 N ATOM 31 CA SER A 3 26.471 -34.807 -6.533 1.00 0.41 C ATOM 32 C SER A 3 25.199 -34.545 -5.729 1.00 0.37 C ATOM 33 O SER A 3 24.812 -33.413 -5.506 1.00 0.34 O ATOM 34 CB SER A 3 27.109 -33.477 -6.930 1.00 0.40 C ATOM 35 OG SER A 3 26.092 -32.570 -7.333 1.00 1.37 O ATOM 0 H SER A 3 25.927 -35.002 -8.590 1.00 0.47 H new ATOM 0 HA SER A 3 27.174 -35.380 -5.928 1.00 0.41 H new ATOM 0 HB2 SER A 3 27.669 -33.064 -6.091 1.00 0.40 H new ATOM 0 HB3 SER A 3 27.819 -33.629 -7.743 1.00 0.40 H new ATOM 0 HG SER A 3 25.408 -32.514 -6.634 1.00 1.37 H new ATOM 41 N ARG A 4 24.551 -35.586 -5.283 1.00 0.41 N ATOM 42 CA ARG A 4 23.309 -35.409 -4.483 1.00 0.42 C ATOM 43 C ARG A 4 23.640 -34.643 -3.200 1.00 0.42 C ATOM 44 O ARG A 4 22.896 -33.781 -2.773 1.00 0.43 O ATOM 45 CB ARG A 4 22.723 -36.781 -4.141 1.00 0.51 C ATOM 46 CG ARG A 4 22.166 -37.424 -5.416 1.00 0.90 C ATOM 47 CD ARG A 4 21.595 -38.808 -5.091 1.00 1.03 C ATOM 48 NE ARG A 4 22.691 -39.683 -4.589 1.00 1.97 N ATOM 49 CZ ARG A 4 22.420 -40.824 -4.014 1.00 2.55 C ATOM 50 NH1 ARG A 4 21.183 -41.221 -3.890 1.00 2.53 N ATOM 51 NH2 ARG A 4 23.390 -41.573 -3.568 1.00 3.57 N ATOM 0 H ARG A 4 24.830 -36.554 -5.439 1.00 0.41 H new ATOM 0 HA ARG A 4 22.576 -34.844 -5.058 1.00 0.42 H new ATOM 0 HB2 ARG A 4 23.491 -37.419 -3.704 1.00 0.51 H new ATOM 0 HB3 ARG A 4 21.933 -36.677 -3.397 1.00 0.51 H new ATOM 0 HG2 ARG A 4 21.389 -36.791 -5.844 1.00 0.90 H new ATOM 0 HG3 ARG A 4 22.954 -37.512 -6.164 1.00 0.90 H new ATOM 0 HD2 ARG A 4 20.808 -38.723 -4.341 1.00 1.03 H new ATOM 0 HD3 ARG A 4 21.142 -39.246 -5.980 1.00 1.03 H new ATOM 0 HE ARG A 4 23.662 -39.388 -4.695 1.00 1.97 H new ATOM 0 HH11 ARG A 4 20.423 -40.639 -4.243 1.00 2.53 H new ATOM 0 HH12 ARG A 4 20.976 -42.113 -3.440 1.00 2.53 H new ATOM 0 HH21 ARG A 4 24.358 -41.267 -3.669 1.00 3.57 H new ATOM 0 HH22 ARG A 4 23.181 -42.464 -3.119 1.00 3.57 H new ATOM 65 N THR A 5 24.754 -34.938 -2.584 1.00 0.45 N ATOM 66 CA THR A 5 25.125 -34.212 -1.338 1.00 0.49 C ATOM 67 C THR A 5 25.263 -32.717 -1.644 1.00 0.44 C ATOM 68 O THR A 5 24.775 -31.880 -0.915 1.00 0.46 O ATOM 69 CB THR A 5 26.448 -34.759 -0.790 1.00 0.54 C ATOM 70 OG1 THR A 5 26.663 -34.238 0.516 1.00 0.68 O ATOM 71 CG2 THR A 5 27.607 -34.348 -1.703 1.00 0.57 C ATOM 0 H THR A 5 25.420 -35.648 -2.890 1.00 0.45 H new ATOM 0 HA THR A 5 24.347 -34.357 -0.588 1.00 0.49 H new ATOM 0 HB THR A 5 26.399 -35.847 -0.751 1.00 0.54 H new ATOM 0 HG1 THR A 5 27.507 -34.586 0.872 1.00 0.68 H new ATOM 0 HG21 THR A 5 28.542 -34.742 -1.304 1.00 0.57 H new ATOM 0 HG22 THR A 5 27.442 -34.749 -2.703 1.00 0.57 H new ATOM 0 HG23 THR A 5 27.663 -33.261 -1.752 1.00 0.57 H new ATOM 79 N LEU A 6 25.916 -32.375 -2.723 1.00 0.39 N ATOM 80 CA LEU A 6 26.064 -30.934 -3.069 1.00 0.36 C ATOM 81 C LEU A 6 24.675 -30.328 -3.250 1.00 0.32 C ATOM 82 O LEU A 6 24.387 -29.243 -2.787 1.00 0.33 O ATOM 83 CB LEU A 6 26.867 -30.796 -4.373 1.00 0.35 C ATOM 84 CG LEU A 6 27.030 -29.313 -4.745 1.00 0.35 C ATOM 85 CD1 LEU A 6 27.798 -28.568 -3.639 1.00 0.41 C ATOM 86 CD2 LEU A 6 27.795 -29.211 -6.070 1.00 0.36 C ATOM 0 H LEU A 6 26.350 -33.028 -3.375 1.00 0.39 H new ATOM 0 HA LEU A 6 26.593 -30.412 -2.272 1.00 0.36 H new ATOM 0 HB2 LEU A 6 27.847 -31.258 -4.255 1.00 0.35 H new ATOM 0 HB3 LEU A 6 26.359 -31.326 -5.179 1.00 0.35 H new ATOM 0 HG LEU A 6 26.046 -28.856 -4.852 1.00 0.35 H new ATOM 0 HD11 LEU A 6 27.907 -27.519 -3.915 1.00 0.41 H new ATOM 0 HD12 LEU A 6 27.248 -28.642 -2.701 1.00 0.41 H new ATOM 0 HD13 LEU A 6 28.785 -29.015 -3.517 1.00 0.41 H new ATOM 0 HD21 LEU A 6 27.915 -28.162 -6.341 1.00 0.36 H new ATOM 0 HD22 LEU A 6 28.777 -29.672 -5.960 1.00 0.36 H new ATOM 0 HD23 LEU A 6 27.238 -29.727 -6.852 1.00 0.36 H new ATOM 98 N LEU A 7 23.811 -31.034 -3.925 1.00 0.29 N ATOM 99 CA LEU A 7 22.431 -30.526 -4.151 1.00 0.26 C ATOM 100 C LEU A 7 21.732 -30.305 -2.811 1.00 0.30 C ATOM 101 O LEU A 7 21.024 -29.334 -2.630 1.00 0.29 O ATOM 102 CB LEU A 7 21.648 -31.527 -5.008 1.00 0.27 C ATOM 103 CG LEU A 7 22.168 -31.482 -6.460 1.00 0.24 C ATOM 104 CD1 LEU A 7 21.778 -32.773 -7.202 1.00 0.27 C ATOM 105 CD2 LEU A 7 21.576 -30.266 -7.204 1.00 0.23 C ATOM 0 H LEU A 7 24.005 -31.949 -4.333 1.00 0.29 H new ATOM 0 HA LEU A 7 22.477 -29.573 -4.678 1.00 0.26 H new ATOM 0 HB2 LEU A 7 21.758 -32.533 -4.602 1.00 0.27 H new ATOM 0 HB3 LEU A 7 20.585 -31.288 -4.984 1.00 0.27 H new ATOM 0 HG LEU A 7 23.254 -31.393 -6.434 1.00 0.24 H new ATOM 0 HD11 LEU A 7 22.150 -32.731 -8.226 1.00 0.27 H new ATOM 0 HD12 LEU A 7 22.215 -33.632 -6.692 1.00 0.27 H new ATOM 0 HD13 LEU A 7 20.693 -32.872 -7.214 1.00 0.27 H new ATOM 0 HD21 LEU A 7 21.952 -30.247 -8.227 1.00 0.23 H new ATOM 0 HD22 LEU A 7 20.489 -30.342 -7.218 1.00 0.23 H new ATOM 0 HD23 LEU A 7 21.869 -29.349 -6.693 1.00 0.23 H new ATOM 117 N ALA A 8 21.924 -31.181 -1.863 1.00 0.34 N ATOM 118 CA ALA A 8 21.258 -30.978 -0.547 1.00 0.39 C ATOM 119 C ALA A 8 21.739 -29.646 0.023 1.00 0.38 C ATOM 120 O ALA A 8 20.972 -28.879 0.564 1.00 0.38 O ATOM 121 CB ALA A 8 21.642 -32.108 0.414 1.00 0.45 C ATOM 0 H ALA A 8 22.504 -32.016 -1.941 1.00 0.34 H new ATOM 0 HA ALA A 8 20.175 -30.977 -0.672 1.00 0.39 H new ATOM 0 HB1 ALA A 8 21.151 -31.952 1.374 1.00 0.45 H new ATOM 0 HB2 ALA A 8 21.326 -33.064 -0.004 1.00 0.45 H new ATOM 0 HB3 ALA A 8 22.723 -32.113 0.556 1.00 0.45 H new ATOM 127 N GLY A 9 22.999 -29.350 -0.125 1.00 0.38 N ATOM 128 CA GLY A 9 23.515 -28.051 0.385 1.00 0.38 C ATOM 129 C GLY A 9 22.898 -26.916 -0.434 1.00 0.34 C ATOM 130 O GLY A 9 22.413 -25.941 0.103 1.00 0.34 O ATOM 0 H GLY A 9 23.691 -29.949 -0.575 1.00 0.38 H new ATOM 0 HA2 GLY A 9 23.265 -27.934 1.439 1.00 0.38 H new ATOM 0 HA3 GLY A 9 24.602 -28.022 0.310 1.00 0.38 H new ATOM 134 N ILE A 10 22.902 -27.041 -1.736 1.00 0.30 N ATOM 135 CA ILE A 10 22.313 -25.970 -2.590 1.00 0.27 C ATOM 136 C ILE A 10 20.835 -25.804 -2.241 1.00 0.25 C ATOM 137 O ILE A 10 20.356 -24.704 -2.054 1.00 0.25 O ATOM 138 CB ILE A 10 22.456 -26.356 -4.065 1.00 0.24 C ATOM 139 CG1 ILE A 10 23.934 -26.322 -4.455 1.00 0.28 C ATOM 140 CG2 ILE A 10 21.684 -25.364 -4.941 1.00 0.25 C ATOM 141 CD1 ILE A 10 24.125 -27.018 -5.803 1.00 0.26 C ATOM 0 H ILE A 10 23.287 -27.838 -2.243 1.00 0.30 H new ATOM 0 HA ILE A 10 22.836 -25.030 -2.413 1.00 0.27 H new ATOM 0 HB ILE A 10 22.054 -27.358 -4.213 1.00 0.24 H new ATOM 0 HG12 ILE A 10 24.281 -25.290 -4.515 1.00 0.28 H new ATOM 0 HG13 ILE A 10 24.534 -26.817 -3.691 1.00 0.28 H new ATOM 0 HG21 ILE A 10 21.790 -25.645 -5.989 1.00 0.25 H new ATOM 0 HG22 ILE A 10 20.629 -25.380 -4.666 1.00 0.25 H new ATOM 0 HG23 ILE A 10 22.082 -24.360 -4.792 1.00 0.25 H new ATOM 0 HD11 ILE A 10 25.179 -26.993 -6.079 1.00 0.26 H new ATOM 0 HD12 ILE A 10 23.794 -28.054 -5.728 1.00 0.26 H new ATOM 0 HD13 ILE A 10 23.538 -26.504 -6.564 1.00 0.26 H new ATOM 153 N VAL A 11 20.101 -26.883 -2.154 1.00 0.25 N ATOM 154 CA VAL A 11 18.655 -26.756 -1.813 1.00 0.27 C ATOM 155 C VAL A 11 18.535 -26.081 -0.444 1.00 0.28 C ATOM 156 O VAL A 11 17.807 -25.122 -0.275 1.00 0.28 O ATOM 157 CB VAL A 11 17.999 -28.142 -1.762 1.00 0.30 C ATOM 158 CG1 VAL A 11 16.578 -28.020 -1.195 1.00 0.35 C ATOM 159 CG2 VAL A 11 17.934 -28.734 -3.175 1.00 0.29 C ATOM 0 H VAL A 11 20.436 -27.835 -2.302 1.00 0.25 H new ATOM 0 HA VAL A 11 18.150 -26.160 -2.573 1.00 0.27 H new ATOM 0 HB VAL A 11 18.591 -28.795 -1.121 1.00 0.30 H new ATOM 0 HG11 VAL A 11 16.114 -29.006 -1.160 1.00 0.35 H new ATOM 0 HG12 VAL A 11 16.622 -27.604 -0.189 1.00 0.35 H new ATOM 0 HG13 VAL A 11 15.987 -27.364 -1.833 1.00 0.35 H new ATOM 0 HG21 VAL A 11 17.468 -29.718 -3.136 1.00 0.29 H new ATOM 0 HG22 VAL A 11 17.345 -28.079 -3.817 1.00 0.29 H new ATOM 0 HG23 VAL A 11 18.943 -28.826 -3.578 1.00 0.29 H new ATOM 169 N GLN A 12 19.259 -26.567 0.530 1.00 0.31 N ATOM 170 CA GLN A 12 19.206 -25.944 1.882 1.00 0.34 C ATOM 171 C GLN A 12 19.687 -24.495 1.786 1.00 0.31 C ATOM 172 O GLN A 12 19.146 -23.608 2.418 1.00 0.32 O ATOM 173 CB GLN A 12 20.102 -26.723 2.850 1.00 0.39 C ATOM 174 CG GLN A 12 19.472 -28.087 3.144 1.00 1.19 C ATOM 175 CD GLN A 12 20.366 -28.868 4.109 1.00 1.63 C ATOM 176 OE1 GLN A 12 21.571 -28.437 4.356 1.00 1.99 O flip ATOM 177 NE2 GLN A 12 19.962 -29.882 4.645 1.00 2.40 N flip ATOM 0 H GLN A 12 19.884 -27.369 0.446 1.00 0.31 H new ATOM 0 HA GLN A 12 18.181 -25.966 2.253 1.00 0.34 H new ATOM 0 HB2 GLN A 12 21.094 -26.854 2.418 1.00 0.39 H new ATOM 0 HB3 GLN A 12 20.229 -26.162 3.776 1.00 0.39 H new ATOM 0 HG2 GLN A 12 18.480 -27.955 3.577 1.00 1.19 H new ATOM 0 HG3 GLN A 12 19.343 -28.647 2.218 1.00 1.19 H new ATOM 0 HE21 GLN A 12 19.019 -30.220 4.452 1.00 2.40 H new ATOM 0 HE22 GLN A 12 20.566 -30.395 5.287 1.00 2.40 H new ATOM 186 N GLN A 13 20.702 -24.248 1.003 1.00 0.29 N ATOM 187 CA GLN A 13 21.214 -22.856 0.872 1.00 0.28 C ATOM 188 C GLN A 13 20.087 -21.975 0.338 1.00 0.24 C ATOM 189 O GLN A 13 19.883 -20.869 0.797 1.00 0.25 O ATOM 190 CB GLN A 13 22.394 -22.844 -0.105 1.00 0.28 C ATOM 191 CG GLN A 13 22.987 -21.432 -0.215 1.00 0.30 C ATOM 192 CD GLN A 13 23.671 -21.058 1.100 1.00 0.38 C ATOM 193 OE1 GLN A 13 23.922 -21.908 1.931 1.00 0.84 O ATOM 194 NE2 GLN A 13 23.997 -19.813 1.319 1.00 0.63 N ATOM 0 H GLN A 13 21.197 -24.948 0.450 1.00 0.29 H new ATOM 0 HA GLN A 13 21.549 -22.480 1.839 1.00 0.28 H new ATOM 0 HB2 GLN A 13 23.161 -23.541 0.233 1.00 0.28 H new ATOM 0 HB3 GLN A 13 22.064 -23.184 -1.087 1.00 0.28 H new ATOM 0 HG2 GLN A 13 23.705 -21.391 -1.034 1.00 0.30 H new ATOM 0 HG3 GLN A 13 22.200 -20.713 -0.444 1.00 0.30 H new ATOM 0 HE21 GLN A 13 23.786 -19.100 0.621 1.00 0.63 H new ATOM 0 HE22 GLN A 13 24.463 -19.553 2.188 1.00 0.63 H new ATOM 203 N GLN A 14 19.339 -22.459 -0.613 1.00 0.22 N ATOM 204 CA GLN A 14 18.215 -21.646 -1.146 1.00 0.20 C ATOM 205 C GLN A 14 17.203 -21.405 -0.027 1.00 0.22 C ATOM 206 O GLN A 14 16.666 -20.324 0.119 1.00 0.21 O ATOM 207 CB GLN A 14 17.535 -22.397 -2.293 1.00 0.20 C ATOM 208 CG GLN A 14 18.464 -22.433 -3.506 1.00 0.18 C ATOM 209 CD GLN A 14 17.781 -23.185 -4.651 1.00 0.19 C ATOM 210 OE1 GLN A 14 17.590 -24.383 -4.581 1.00 0.29 O ATOM 211 NE2 GLN A 14 17.394 -22.524 -5.709 1.00 0.23 N ATOM 0 H GLN A 14 19.457 -23.377 -1.041 1.00 0.22 H new ATOM 0 HA GLN A 14 18.594 -20.693 -1.516 1.00 0.20 H new ATOM 0 HB2 GLN A 14 17.289 -23.412 -1.981 1.00 0.20 H new ATOM 0 HB3 GLN A 14 16.597 -21.908 -2.555 1.00 0.20 H new ATOM 0 HG2 GLN A 14 18.710 -21.418 -3.819 1.00 0.18 H new ATOM 0 HG3 GLN A 14 19.402 -22.922 -3.244 1.00 0.18 H new ATOM 0 HE21 GLN A 14 17.554 -21.518 -5.769 1.00 0.23 H new ATOM 0 HE22 GLN A 14 16.932 -23.013 -6.475 1.00 0.23 H new ATOM 220 N GLN A 15 16.939 -22.407 0.772 1.00 0.26 N ATOM 221 CA GLN A 15 15.966 -22.223 1.882 1.00 0.29 C ATOM 222 C GLN A 15 16.473 -21.125 2.818 1.00 0.28 C ATOM 223 O GLN A 15 15.729 -20.252 3.221 1.00 0.29 O ATOM 224 CB GLN A 15 15.792 -23.534 2.655 1.00 0.34 C ATOM 225 CG GLN A 15 14.692 -23.355 3.707 1.00 0.38 C ATOM 226 CD GLN A 15 14.470 -24.672 4.453 1.00 0.44 C ATOM 227 OE1 GLN A 15 14.985 -25.772 3.979 1.00 0.81 O flip ATOM 228 NE2 GLN A 15 13.815 -24.702 5.477 1.00 0.81 N flip ATOM 0 H GLN A 15 17.353 -23.337 0.702 1.00 0.26 H new ATOM 0 HA GLN A 15 14.999 -21.933 1.471 1.00 0.29 H new ATOM 0 HB2 GLN A 15 15.530 -24.342 1.971 1.00 0.34 H new ATOM 0 HB3 GLN A 15 16.729 -23.814 3.135 1.00 0.34 H new ATOM 0 HG2 GLN A 15 14.973 -22.571 4.410 1.00 0.38 H new ATOM 0 HG3 GLN A 15 13.766 -23.037 3.228 1.00 0.38 H new ATOM 0 HE21 GLN A 15 13.411 -23.843 5.850 1.00 0.81 H new ATOM 0 HE22 GLN A 15 13.669 -25.587 5.963 1.00 0.81 H new ATOM 237 N GLN A 16 17.736 -21.151 3.163 1.00 0.28 N ATOM 238 CA GLN A 16 18.266 -20.092 4.064 1.00 0.29 C ATOM 239 C GLN A 16 18.091 -18.733 3.392 1.00 0.25 C ATOM 240 O GLN A 16 17.721 -17.763 4.022 1.00 0.25 O ATOM 241 CB GLN A 16 19.752 -20.335 4.357 1.00 0.31 C ATOM 242 CG GLN A 16 19.905 -21.565 5.256 1.00 0.36 C ATOM 243 CD GLN A 16 21.388 -21.806 5.546 1.00 0.39 C ATOM 244 OE1 GLN A 16 22.288 -21.200 4.824 1.00 0.92 O flip ATOM 245 NE2 GLN A 16 21.731 -22.547 6.444 1.00 0.87 N flip ATOM 0 H GLN A 16 18.413 -21.852 2.862 1.00 0.28 H new ATOM 0 HA GLN A 16 17.718 -20.114 5.006 1.00 0.29 H new ATOM 0 HB2 GLN A 16 20.297 -20.484 3.425 1.00 0.31 H new ATOM 0 HB3 GLN A 16 20.185 -19.461 4.843 1.00 0.31 H new ATOM 0 HG2 GLN A 16 19.361 -21.416 6.189 1.00 0.36 H new ATOM 0 HG3 GLN A 16 19.472 -22.439 4.770 1.00 0.36 H new ATOM 0 HE21 GLN A 16 21.028 -23.022 7.010 1.00 0.87 H new ATOM 0 HE22 GLN A 16 22.722 -22.695 6.633 1.00 0.87 H new ATOM 254 N LEU A 17 18.342 -18.656 2.115 1.00 0.22 N ATOM 255 CA LEU A 17 18.172 -17.359 1.410 1.00 0.19 C ATOM 256 C LEU A 17 16.697 -16.964 1.457 1.00 0.18 C ATOM 257 O LEU A 17 16.356 -15.821 1.690 1.00 0.18 O ATOM 258 CB LEU A 17 18.627 -17.505 -0.045 1.00 0.16 C ATOM 259 CG LEU A 17 20.152 -17.672 -0.102 1.00 0.18 C ATOM 260 CD1 LEU A 17 20.564 -18.037 -1.531 1.00 0.18 C ATOM 261 CD2 LEU A 17 20.857 -16.368 0.334 1.00 0.20 C ATOM 0 H LEU A 17 18.656 -19.432 1.533 1.00 0.22 H new ATOM 0 HA LEU A 17 18.773 -16.589 1.893 1.00 0.19 H new ATOM 0 HB2 LEU A 17 18.141 -18.367 -0.502 1.00 0.16 H new ATOM 0 HB3 LEU A 17 18.327 -16.628 -0.619 1.00 0.16 H new ATOM 0 HG LEU A 17 20.450 -18.467 0.581 1.00 0.18 H new ATOM 0 HD11 LEU A 17 21.646 -18.157 -1.578 1.00 0.18 H new ATOM 0 HD12 LEU A 17 20.082 -18.971 -1.821 1.00 0.18 H new ATOM 0 HD13 LEU A 17 20.257 -17.243 -2.212 1.00 0.18 H new ATOM 0 HD21 LEU A 17 21.937 -16.505 0.287 1.00 0.20 H new ATOM 0 HD22 LEU A 17 20.565 -15.556 -0.332 1.00 0.20 H new ATOM 0 HD23 LEU A 17 20.566 -16.121 1.355 1.00 0.20 H new ATOM 273 N LEU A 18 15.814 -17.906 1.257 1.00 0.19 N ATOM 274 CA LEU A 18 14.363 -17.582 1.314 1.00 0.20 C ATOM 275 C LEU A 18 14.030 -17.055 2.709 1.00 0.22 C ATOM 276 O LEU A 18 13.277 -16.114 2.866 1.00 0.22 O ATOM 277 CB LEU A 18 13.538 -18.847 1.027 1.00 0.22 C ATOM 278 CG LEU A 18 12.031 -18.535 1.085 1.00 0.25 C ATOM 279 CD1 LEU A 18 11.662 -17.483 0.025 1.00 0.26 C ATOM 280 CD2 LEU A 18 11.241 -19.826 0.827 1.00 0.29 C ATOM 0 H LEU A 18 16.036 -18.881 1.058 1.00 0.19 H new ATOM 0 HA LEU A 18 14.123 -16.826 0.566 1.00 0.20 H new ATOM 0 HB2 LEU A 18 13.796 -19.241 0.044 1.00 0.22 H new ATOM 0 HB3 LEU A 18 13.783 -19.621 1.755 1.00 0.22 H new ATOM 0 HG LEU A 18 11.784 -18.139 2.070 1.00 0.25 H new ATOM 0 HD11 LEU A 18 10.594 -17.272 0.078 1.00 0.26 H new ATOM 0 HD12 LEU A 18 12.222 -16.567 0.211 1.00 0.26 H new ATOM 0 HD13 LEU A 18 11.908 -17.863 -0.966 1.00 0.26 H new ATOM 0 HD21 LEU A 18 10.173 -19.613 0.867 1.00 0.29 H new ATOM 0 HD22 LEU A 18 11.497 -20.218 -0.157 1.00 0.29 H new ATOM 0 HD23 LEU A 18 11.492 -20.565 1.588 1.00 0.29 H new ATOM 292 N ASP A 19 14.579 -17.664 3.725 1.00 0.25 N ATOM 293 CA ASP A 19 14.285 -17.202 5.106 1.00 0.28 C ATOM 294 C ASP A 19 14.727 -15.745 5.253 1.00 0.26 C ATOM 295 O ASP A 19 13.976 -14.906 5.706 1.00 0.27 O ATOM 296 CB ASP A 19 15.034 -18.086 6.110 1.00 0.32 C ATOM 297 CG ASP A 19 14.724 -17.626 7.538 1.00 0.36 C ATOM 298 OD1 ASP A 19 14.328 -16.486 7.702 1.00 1.13 O ATOM 299 OD2 ASP A 19 14.893 -18.425 8.445 1.00 1.12 O ATOM 0 H ASP A 19 15.216 -18.458 3.656 1.00 0.25 H new ATOM 0 HA ASP A 19 13.215 -17.273 5.302 1.00 0.28 H new ATOM 0 HB2 ASP A 19 14.740 -19.128 5.982 1.00 0.32 H new ATOM 0 HB3 ASP A 19 16.107 -18.033 5.926 1.00 0.32 H new ATOM 304 N VAL A 20 15.934 -15.428 4.869 1.00 0.25 N ATOM 305 CA VAL A 20 16.393 -14.014 4.989 1.00 0.24 C ATOM 306 C VAL A 20 15.486 -13.118 4.160 1.00 0.21 C ATOM 307 O VAL A 20 15.063 -12.069 4.600 1.00 0.22 O ATOM 308 CB VAL A 20 17.831 -13.872 4.485 1.00 0.24 C ATOM 309 CG1 VAL A 20 18.234 -12.396 4.548 1.00 0.24 C ATOM 310 CG2 VAL A 20 18.770 -14.708 5.364 1.00 0.30 C ATOM 0 H VAL A 20 16.616 -16.079 4.481 1.00 0.25 H new ATOM 0 HA VAL A 20 16.354 -13.722 6.038 1.00 0.24 H new ATOM 0 HB VAL A 20 17.901 -14.227 3.457 1.00 0.24 H new ATOM 0 HG11 VAL A 20 19.258 -12.283 4.191 1.00 0.24 H new ATOM 0 HG12 VAL A 20 17.564 -11.809 3.920 1.00 0.24 H new ATOM 0 HG13 VAL A 20 18.168 -12.044 5.578 1.00 0.24 H new ATOM 0 HG21 VAL A 20 19.793 -14.605 5.003 1.00 0.30 H new ATOM 0 HG22 VAL A 20 18.712 -14.358 6.395 1.00 0.30 H new ATOM 0 HG23 VAL A 20 18.473 -15.756 5.320 1.00 0.30 H new ATOM 320 N VAL A 21 15.182 -13.522 2.962 1.00 0.18 N ATOM 321 CA VAL A 21 14.302 -12.687 2.112 1.00 0.17 C ATOM 322 C VAL A 21 12.966 -12.528 2.831 1.00 0.22 C ATOM 323 O VAL A 21 12.417 -11.447 2.912 1.00 0.21 O ATOM 324 CB VAL A 21 14.106 -13.375 0.757 1.00 0.17 C ATOM 325 CG1 VAL A 21 13.058 -12.622 -0.061 1.00 0.20 C ATOM 326 CG2 VAL A 21 15.434 -13.380 -0.009 1.00 0.14 C ATOM 0 H VAL A 21 15.504 -14.392 2.537 1.00 0.18 H new ATOM 0 HA VAL A 21 14.744 -11.706 1.938 1.00 0.17 H new ATOM 0 HB VAL A 21 13.770 -14.399 0.921 1.00 0.17 H new ATOM 0 HG11 VAL A 21 12.923 -13.116 -1.023 1.00 0.20 H new ATOM 0 HG12 VAL A 21 12.111 -12.615 0.479 1.00 0.20 H new ATOM 0 HG13 VAL A 21 13.391 -11.597 -0.223 1.00 0.20 H new ATOM 0 HG21 VAL A 21 15.296 -13.869 -0.973 1.00 0.14 H new ATOM 0 HG22 VAL A 21 15.767 -12.354 -0.167 1.00 0.14 H new ATOM 0 HG23 VAL A 21 16.185 -13.920 0.568 1.00 0.14 H new ATOM 336 N LYS A 22 12.449 -13.597 3.377 1.00 0.27 N ATOM 337 CA LYS A 22 11.161 -13.505 4.118 1.00 0.32 C ATOM 338 C LYS A 22 11.345 -12.546 5.297 1.00 0.32 C ATOM 339 O LYS A 22 10.504 -11.715 5.573 1.00 0.33 O ATOM 340 CB LYS A 22 10.771 -14.891 4.635 1.00 0.39 C ATOM 341 CG LYS A 22 9.397 -14.827 5.308 1.00 0.46 C ATOM 342 CD LYS A 22 9.017 -16.218 5.823 1.00 0.75 C ATOM 343 CE LYS A 22 7.643 -16.162 6.498 1.00 1.12 C ATOM 344 NZ LYS A 22 6.595 -15.871 5.478 1.00 1.91 N ATOM 0 H LYS A 22 12.864 -14.528 3.341 1.00 0.27 H new ATOM 0 HA LYS A 22 10.374 -13.137 3.460 1.00 0.32 H new ATOM 0 HB2 LYS A 22 10.749 -15.604 3.811 1.00 0.39 H new ATOM 0 HB3 LYS A 22 11.517 -15.248 5.345 1.00 0.39 H new ATOM 0 HG2 LYS A 22 9.417 -14.115 6.133 1.00 0.46 H new ATOM 0 HG3 LYS A 22 8.649 -14.473 4.599 1.00 0.46 H new ATOM 0 HD2 LYS A 22 8.998 -16.929 4.997 1.00 0.75 H new ATOM 0 HD3 LYS A 22 9.767 -16.571 6.531 1.00 0.75 H new ATOM 0 HE2 LYS A 22 7.431 -17.110 6.992 1.00 1.12 H new ATOM 0 HE3 LYS A 22 7.637 -15.392 7.270 1.00 1.12 H new ATOM 0 HZ1 LYS A 22 5.660 -16.113 5.863 1.00 1.91 H new ATOM 0 HZ2 LYS A 22 6.618 -14.860 5.235 1.00 1.91 H new ATOM 0 HZ3 LYS A 22 6.775 -16.437 4.624 1.00 1.91 H new ATOM 358 N ARG A 23 12.455 -12.652 5.987 1.00 0.33 N ATOM 359 CA ARG A 23 12.711 -11.745 7.143 1.00 0.34 C ATOM 360 C ARG A 23 12.745 -10.303 6.640 1.00 0.29 C ATOM 361 O ARG A 23 12.235 -9.398 7.274 1.00 0.29 O ATOM 362 CB ARG A 23 14.077 -12.077 7.766 1.00 0.38 C ATOM 363 CG ARG A 23 14.046 -13.445 8.467 1.00 0.59 C ATOM 364 CD ARG A 23 13.399 -13.337 9.852 1.00 0.93 C ATOM 365 NE ARG A 23 13.612 -14.620 10.580 1.00 0.81 N ATOM 366 CZ ARG A 23 13.379 -14.694 11.861 1.00 1.05 C ATOM 367 NH1 ARG A 23 12.950 -13.649 12.510 1.00 1.68 N ATOM 368 NH2 ARG A 23 13.578 -15.816 12.492 1.00 1.08 N ATOM 0 H ARG A 23 13.194 -13.329 5.797 1.00 0.33 H new ATOM 0 HA ARG A 23 11.925 -11.873 7.887 1.00 0.34 H new ATOM 0 HB2 ARG A 23 14.843 -12.079 6.991 1.00 0.38 H new ATOM 0 HB3 ARG A 23 14.351 -11.303 8.483 1.00 0.38 H new ATOM 0 HG2 ARG A 23 13.491 -14.158 7.857 1.00 0.59 H new ATOM 0 HG3 ARG A 23 15.061 -13.831 8.565 1.00 0.59 H new ATOM 0 HD2 ARG A 23 13.836 -12.509 10.410 1.00 0.93 H new ATOM 0 HD3 ARG A 23 12.333 -13.129 9.756 1.00 0.93 H new ATOM 0 HE ARG A 23 13.941 -15.443 10.075 1.00 0.81 H new ATOM 0 HH11 ARG A 23 12.795 -12.770 12.016 1.00 1.68 H new ATOM 0 HH12 ARG A 23 12.769 -13.710 13.512 1.00 1.68 H new ATOM 0 HH21 ARG A 23 13.915 -16.634 11.984 1.00 1.08 H new ATOM 0 HH22 ARG A 23 13.397 -15.877 13.494 1.00 1.08 H new ATOM 382 N GLN A 24 13.341 -10.086 5.498 1.00 0.24 N ATOM 383 CA GLN A 24 13.413 -8.710 4.941 1.00 0.19 C ATOM 384 C GLN A 24 12.000 -8.182 4.718 1.00 0.19 C ATOM 385 O GLN A 24 11.709 -7.032 4.970 1.00 0.18 O ATOM 386 CB GLN A 24 14.185 -8.719 3.620 1.00 0.16 C ATOM 387 CG GLN A 24 15.671 -8.950 3.905 1.00 0.17 C ATOM 388 CD GLN A 24 16.435 -9.091 2.587 1.00 0.16 C ATOM 389 OE1 GLN A 24 15.889 -9.539 1.599 1.00 0.18 O ATOM 390 NE2 GLN A 24 17.686 -8.724 2.533 1.00 0.18 N ATOM 0 H GLN A 24 13.782 -10.807 4.927 1.00 0.24 H new ATOM 0 HA GLN A 24 13.935 -8.061 5.645 1.00 0.19 H new ATOM 0 HB2 GLN A 24 13.802 -9.503 2.967 1.00 0.16 H new ATOM 0 HB3 GLN A 24 14.046 -7.773 3.098 1.00 0.16 H new ATOM 0 HG2 GLN A 24 16.074 -8.118 4.482 1.00 0.17 H new ATOM 0 HG3 GLN A 24 15.800 -9.848 4.509 1.00 0.17 H new ATOM 0 HE21 GLN A 24 18.143 -8.348 3.363 1.00 0.18 H new ATOM 0 HE22 GLN A 24 18.206 -8.813 1.660 1.00 0.18 H new ATOM 399 N GLN A 25 11.112 -9.013 4.252 1.00 0.21 N ATOM 400 CA GLN A 25 9.722 -8.544 4.019 1.00 0.23 C ATOM 401 C GLN A 25 9.137 -8.058 5.346 1.00 0.25 C ATOM 402 O GLN A 25 8.597 -6.971 5.433 1.00 0.25 O ATOM 403 CB GLN A 25 8.886 -9.709 3.473 1.00 0.28 C ATOM 404 CG GLN A 25 7.420 -9.288 3.320 1.00 0.32 C ATOM 405 CD GLN A 25 7.321 -8.036 2.445 1.00 0.34 C ATOM 406 OE1 GLN A 25 8.175 -7.865 1.475 1.00 1.06 O flip ATOM 407 NE2 GLN A 25 6.464 -7.203 2.655 1.00 1.13 N flip ATOM 0 H GLN A 25 11.288 -9.991 4.024 1.00 0.21 H new ATOM 0 HA GLN A 25 9.713 -7.727 3.298 1.00 0.23 H new ATOM 0 HB2 GLN A 25 9.282 -10.029 2.509 1.00 0.28 H new ATOM 0 HB3 GLN A 25 8.957 -10.563 4.146 1.00 0.28 H new ATOM 0 HG2 GLN A 25 6.845 -10.099 2.874 1.00 0.32 H new ATOM 0 HG3 GLN A 25 6.986 -9.091 4.300 1.00 0.32 H new ATOM 0 HE21 GLN A 25 5.797 -7.338 3.414 1.00 1.13 H new ATOM 0 HE22 GLN A 25 6.411 -6.368 2.072 1.00 1.13 H new ATOM 416 N GLU A 26 9.249 -8.841 6.384 1.00 0.27 N ATOM 417 CA GLU A 26 8.710 -8.398 7.702 1.00 0.29 C ATOM 418 C GLU A 26 9.440 -7.130 8.146 1.00 0.26 C ATOM 419 O GLU A 26 8.837 -6.186 8.607 1.00 0.26 O ATOM 420 CB GLU A 26 8.913 -9.502 8.739 1.00 0.34 C ATOM 421 CG GLU A 26 7.986 -10.676 8.423 1.00 0.54 C ATOM 422 CD GLU A 26 8.236 -11.804 9.424 1.00 1.19 C ATOM 423 OE1 GLU A 26 9.097 -11.636 10.274 1.00 1.94 O ATOM 424 OE2 GLU A 26 7.560 -12.816 9.328 1.00 1.85 O ATOM 0 H GLU A 26 9.687 -9.762 6.378 1.00 0.27 H new ATOM 0 HA GLU A 26 7.644 -8.189 7.609 1.00 0.29 H new ATOM 0 HB2 GLU A 26 9.951 -9.833 8.734 1.00 0.34 H new ATOM 0 HB3 GLU A 26 8.705 -9.120 9.738 1.00 0.34 H new ATOM 0 HG2 GLU A 26 6.945 -10.355 8.472 1.00 0.54 H new ATOM 0 HG3 GLU A 26 8.163 -11.030 7.407 1.00 0.54 H new ATOM 431 N LEU A 27 10.736 -7.097 7.990 1.00 0.24 N ATOM 432 CA LEU A 27 11.515 -5.889 8.385 1.00 0.22 C ATOM 433 C LEU A 27 11.117 -4.724 7.483 1.00 0.19 C ATOM 434 O LEU A 27 10.981 -3.602 7.922 1.00 0.19 O ATOM 435 CB LEU A 27 13.011 -6.191 8.258 1.00 0.22 C ATOM 436 CG LEU A 27 13.844 -4.917 8.456 1.00 0.22 C ATOM 437 CD1 LEU A 27 13.473 -4.237 9.779 1.00 0.25 C ATOM 438 CD2 LEU A 27 15.328 -5.301 8.489 1.00 0.23 C ATOM 0 H LEU A 27 11.292 -7.860 7.603 1.00 0.24 H new ATOM 0 HA LEU A 27 11.302 -5.620 9.420 1.00 0.22 H new ATOM 0 HB2 LEU A 27 13.300 -6.938 8.997 1.00 0.22 H new ATOM 0 HB3 LEU A 27 13.218 -6.617 7.277 1.00 0.22 H new ATOM 0 HG LEU A 27 13.645 -4.226 7.637 1.00 0.22 H new ATOM 0 HD11 LEU A 27 14.072 -3.335 9.905 1.00 0.25 H new ATOM 0 HD12 LEU A 27 12.416 -3.972 9.768 1.00 0.25 H new ATOM 0 HD13 LEU A 27 13.667 -4.920 10.606 1.00 0.25 H new ATOM 0 HD21 LEU A 27 15.933 -4.405 8.629 1.00 0.23 H new ATOM 0 HD22 LEU A 27 15.507 -5.992 9.313 1.00 0.23 H new ATOM 0 HD23 LEU A 27 15.601 -5.779 7.548 1.00 0.23 H new ATOM 450 N LEU A 28 10.929 -4.984 6.222 1.00 0.18 N ATOM 451 CA LEU A 28 10.536 -3.891 5.296 1.00 0.18 C ATOM 452 C LEU A 28 9.212 -3.298 5.770 1.00 0.20 C ATOM 453 O LEU A 28 9.017 -2.100 5.754 1.00 0.20 O ATOM 454 CB LEU A 28 10.366 -4.472 3.885 1.00 0.18 C ATOM 455 CG LEU A 28 11.743 -4.696 3.228 1.00 0.18 C ATOM 456 CD1 LEU A 28 11.625 -5.741 2.104 1.00 0.21 C ATOM 457 CD2 LEU A 28 12.264 -3.377 2.631 1.00 0.22 C ATOM 0 H LEU A 28 11.030 -5.904 5.793 1.00 0.18 H new ATOM 0 HA LEU A 28 11.300 -3.114 5.280 1.00 0.18 H new ATOM 0 HB2 LEU A 28 9.822 -5.415 3.936 1.00 0.18 H new ATOM 0 HB3 LEU A 28 9.770 -3.793 3.274 1.00 0.18 H new ATOM 0 HG LEU A 28 12.437 -5.052 3.989 1.00 0.18 H new ATOM 0 HD11 LEU A 28 12.602 -5.894 1.645 1.00 0.21 H new ATOM 0 HD12 LEU A 28 11.268 -6.683 2.519 1.00 0.21 H new ATOM 0 HD13 LEU A 28 10.921 -5.387 1.351 1.00 0.21 H new ATOM 0 HD21 LEU A 28 13.237 -3.546 2.169 1.00 0.22 H new ATOM 0 HD22 LEU A 28 11.563 -3.016 1.878 1.00 0.22 H new ATOM 0 HD23 LEU A 28 12.362 -2.633 3.422 1.00 0.22 H new ATOM 469 N ARG A 29 8.302 -4.120 6.209 1.00 0.22 N ATOM 470 CA ARG A 29 7.006 -3.580 6.697 1.00 0.24 C ATOM 471 C ARG A 29 7.262 -2.675 7.904 1.00 0.24 C ATOM 472 O ARG A 29 6.657 -1.631 8.045 1.00 0.24 O ATOM 473 CB ARG A 29 6.090 -4.732 7.106 1.00 0.27 C ATOM 474 CG ARG A 29 5.641 -5.491 5.858 1.00 0.29 C ATOM 475 CD ARG A 29 4.724 -6.644 6.264 1.00 0.33 C ATOM 476 NE ARG A 29 4.313 -7.406 5.050 1.00 0.38 N ATOM 477 CZ ARG A 29 3.799 -8.596 5.177 1.00 0.88 C ATOM 478 NH1 ARG A 29 3.629 -9.107 6.366 1.00 1.83 N ATOM 479 NH2 ARG A 29 3.453 -9.277 4.118 1.00 0.86 N ATOM 0 H ARG A 29 8.399 -5.135 6.251 1.00 0.22 H new ATOM 0 HA ARG A 29 6.527 -3.007 5.903 1.00 0.24 H new ATOM 0 HB2 ARG A 29 6.614 -5.404 7.785 1.00 0.27 H new ATOM 0 HB3 ARG A 29 5.223 -4.348 7.643 1.00 0.27 H new ATOM 0 HG2 ARG A 29 5.118 -4.818 5.179 1.00 0.29 H new ATOM 0 HG3 ARG A 29 6.509 -5.874 5.321 1.00 0.29 H new ATOM 0 HD2 ARG A 29 5.239 -7.303 6.963 1.00 0.33 H new ATOM 0 HD3 ARG A 29 3.844 -6.258 6.779 1.00 0.33 H new ATOM 0 HE ARG A 29 4.434 -6.997 4.124 1.00 0.38 H new ATOM 0 HH11 ARG A 29 3.898 -8.575 7.193 1.00 1.83 H new ATOM 0 HH12 ARG A 29 3.227 -10.039 6.468 1.00 1.83 H new ATOM 0 HH21 ARG A 29 3.585 -8.877 3.189 1.00 0.86 H new ATOM 0 HH22 ARG A 29 3.051 -10.209 4.220 1.00 0.86 H new ATOM 493 N LEU A 30 8.160 -3.057 8.776 1.00 0.23 N ATOM 494 CA LEU A 30 8.442 -2.199 9.961 1.00 0.23 C ATOM 495 C LEU A 30 8.959 -0.843 9.486 1.00 0.21 C ATOM 496 O LEU A 30 8.552 0.190 9.975 1.00 0.22 O ATOM 497 CB LEU A 30 9.512 -2.852 10.842 1.00 0.24 C ATOM 498 CG LEU A 30 9.045 -4.224 11.335 1.00 0.27 C ATOM 499 CD1 LEU A 30 10.169 -4.866 12.151 1.00 0.29 C ATOM 500 CD2 LEU A 30 7.789 -4.085 12.213 1.00 0.33 C ATOM 0 H LEU A 30 8.704 -3.918 8.718 1.00 0.23 H new ATOM 0 HA LEU A 30 7.524 -2.076 10.536 1.00 0.23 H new ATOM 0 HB2 LEU A 30 10.439 -2.959 10.278 1.00 0.24 H new ATOM 0 HB3 LEU A 30 9.730 -2.209 11.695 1.00 0.24 H new ATOM 0 HG LEU A 30 8.799 -4.847 10.475 1.00 0.27 H new ATOM 0 HD11 LEU A 30 9.847 -5.844 12.507 1.00 0.29 H new ATOM 0 HD12 LEU A 30 11.053 -4.981 11.524 1.00 0.29 H new ATOM 0 HD13 LEU A 30 10.409 -4.230 13.003 1.00 0.29 H new ATOM 0 HD21 LEU A 30 7.472 -5.071 12.554 1.00 0.33 H new ATOM 0 HD22 LEU A 30 8.016 -3.458 13.076 1.00 0.33 H new ATOM 0 HD23 LEU A 30 6.988 -3.627 11.632 1.00 0.33 H new ATOM 512 N THR A 31 9.854 -0.832 8.536 1.00 0.19 N ATOM 513 CA THR A 31 10.387 0.468 8.049 1.00 0.17 C ATOM 514 C THR A 31 9.233 1.293 7.504 1.00 0.17 C ATOM 515 O THR A 31 9.139 2.482 7.731 1.00 0.17 O ATOM 516 CB THR A 31 11.410 0.221 6.939 1.00 0.17 C ATOM 517 OG1 THR A 31 10.795 -0.505 5.883 1.00 0.18 O ATOM 518 CG2 THR A 31 12.590 -0.576 7.494 1.00 0.19 C ATOM 0 H THR A 31 10.236 -1.661 8.080 1.00 0.19 H new ATOM 0 HA THR A 31 10.872 1.001 8.867 1.00 0.17 H new ATOM 0 HB THR A 31 11.771 1.177 6.559 1.00 0.17 H new ATOM 0 HG1 THR A 31 10.105 -1.096 6.251 1.00 0.18 H new ATOM 0 HG21 THR A 31 13.317 -0.750 6.701 1.00 0.19 H new ATOM 0 HG22 THR A 31 13.061 -0.014 8.301 1.00 0.19 H new ATOM 0 HG23 THR A 31 12.235 -1.533 7.877 1.00 0.19 H new ATOM 526 N VAL A 32 8.337 0.664 6.805 1.00 0.18 N ATOM 527 CA VAL A 32 7.174 1.402 6.265 1.00 0.19 C ATOM 528 C VAL A 32 6.333 1.893 7.445 1.00 0.20 C ATOM 529 O VAL A 32 5.818 2.993 7.438 1.00 0.20 O ATOM 530 CB VAL A 32 6.346 0.459 5.385 1.00 0.21 C ATOM 531 CG1 VAL A 32 5.019 1.124 5.012 1.00 0.23 C ATOM 532 CG2 VAL A 32 7.132 0.137 4.111 1.00 0.22 C ATOM 0 H VAL A 32 8.362 -0.332 6.585 1.00 0.18 H new ATOM 0 HA VAL A 32 7.499 2.251 5.663 1.00 0.19 H new ATOM 0 HB VAL A 32 6.142 -0.460 5.934 1.00 0.21 H new ATOM 0 HG11 VAL A 32 4.436 0.448 4.387 1.00 0.23 H new ATOM 0 HG12 VAL A 32 4.459 1.353 5.919 1.00 0.23 H new ATOM 0 HG13 VAL A 32 5.215 2.046 4.465 1.00 0.23 H new ATOM 0 HG21 VAL A 32 6.547 -0.534 3.482 1.00 0.22 H new ATOM 0 HG22 VAL A 32 7.336 1.059 3.567 1.00 0.22 H new ATOM 0 HG23 VAL A 32 8.074 -0.344 4.376 1.00 0.22 H new ATOM 542 N TRP A 33 6.184 1.074 8.454 1.00 0.21 N ATOM 543 CA TRP A 33 5.368 1.482 9.633 1.00 0.23 C ATOM 544 C TRP A 33 5.954 2.739 10.292 1.00 0.22 C ATOM 545 O TRP A 33 5.250 3.697 10.535 1.00 0.23 O ATOM 546 CB TRP A 33 5.340 0.345 10.654 1.00 0.25 C ATOM 547 CG TRP A 33 4.521 0.765 11.830 1.00 0.27 C ATOM 548 CD1 TRP A 33 3.186 0.580 11.949 1.00 0.32 C ATOM 549 CD2 TRP A 33 4.951 1.438 13.048 1.00 0.27 C ATOM 550 NE1 TRP A 33 2.770 1.097 13.163 1.00 0.33 N ATOM 551 CE2 TRP A 33 3.821 1.634 13.877 1.00 0.31 C ATOM 552 CE3 TRP A 33 6.200 1.891 13.512 1.00 0.26 C ATOM 553 CZ2 TRP A 33 3.924 2.257 15.122 1.00 0.32 C ATOM 554 CZ3 TRP A 33 6.308 2.518 14.763 1.00 0.28 C ATOM 555 CH2 TRP A 33 5.173 2.701 15.566 1.00 0.31 C ATOM 0 H TRP A 33 6.592 0.141 8.511 1.00 0.21 H new ATOM 0 HA TRP A 33 4.356 1.703 9.293 1.00 0.23 H new ATOM 0 HB2 TRP A 33 4.919 -0.554 10.204 1.00 0.25 H new ATOM 0 HB3 TRP A 33 6.354 0.098 10.970 1.00 0.25 H new ATOM 0 HD1 TRP A 33 2.549 0.106 11.216 1.00 0.32 H new ATOM 0 HE1 TRP A 33 1.804 1.083 13.490 1.00 0.33 H new ATOM 0 HE3 TRP A 33 7.081 1.755 12.902 1.00 0.26 H new ATOM 0 HZ2 TRP A 33 3.047 2.395 15.737 1.00 0.32 H new ATOM 0 HZ3 TRP A 33 7.271 2.862 15.109 1.00 0.28 H new ATOM 0 HH2 TRP A 33 5.264 3.185 16.527 1.00 0.31 H new ATOM 566 N GLY A 34 7.234 2.759 10.578 1.00 0.22 N ATOM 567 CA GLY A 34 7.820 3.968 11.215 1.00 0.23 C ATOM 568 C GLY A 34 7.655 5.155 10.273 1.00 0.22 C ATOM 569 O GLY A 34 7.256 6.228 10.674 1.00 0.23 O ATOM 0 H GLY A 34 7.888 1.997 10.398 1.00 0.22 H new ATOM 0 HA2 GLY A 34 7.326 4.170 12.165 1.00 0.23 H new ATOM 0 HA3 GLY A 34 8.875 3.804 11.433 1.00 0.23 H new ATOM 573 N THR A 35 7.956 4.969 9.017 1.00 0.22 N ATOM 574 CA THR A 35 7.815 6.086 8.046 1.00 0.24 C ATOM 575 C THR A 35 6.361 6.561 8.005 1.00 0.23 C ATOM 576 O THR A 35 6.077 7.740 8.119 1.00 0.24 O ATOM 577 CB THR A 35 8.238 5.590 6.659 1.00 0.27 C ATOM 578 OG1 THR A 35 9.632 5.318 6.662 1.00 0.30 O ATOM 579 CG2 THR A 35 7.918 6.648 5.603 1.00 0.30 C ATOM 0 H THR A 35 8.293 4.091 8.623 1.00 0.22 H new ATOM 0 HA THR A 35 8.447 6.920 8.350 1.00 0.24 H new ATOM 0 HB THR A 35 7.690 4.679 6.420 1.00 0.27 H new ATOM 0 HG1 THR A 35 9.787 4.406 6.986 1.00 0.30 H new ATOM 0 HG21 THR A 35 8.222 6.286 4.621 1.00 0.30 H new ATOM 0 HG22 THR A 35 6.846 6.847 5.600 1.00 0.30 H new ATOM 0 HG23 THR A 35 8.457 7.567 5.834 1.00 0.30 H new ATOM 587 N LYS A 36 5.433 5.657 7.854 1.00 0.25 N ATOM 588 CA LYS A 36 4.004 6.071 7.817 1.00 0.28 C ATOM 589 C LYS A 36 3.618 6.639 9.184 1.00 0.28 C ATOM 590 O LYS A 36 2.903 7.617 9.286 1.00 0.30 O ATOM 591 CB LYS A 36 3.115 4.869 7.480 1.00 0.32 C ATOM 592 CG LYS A 36 1.726 5.370 7.077 1.00 0.46 C ATOM 593 CD LYS A 36 0.757 4.188 6.958 1.00 0.77 C ATOM 594 CE LYS A 36 1.214 3.238 5.842 1.00 1.44 C ATOM 595 NZ LYS A 36 2.234 2.293 6.379 1.00 2.00 N ATOM 0 H LYS A 36 5.601 4.656 7.755 1.00 0.25 H new ATOM 0 HA LYS A 36 3.863 6.831 7.049 1.00 0.28 H new ATOM 0 HB2 LYS A 36 3.556 4.291 6.668 1.00 0.32 H new ATOM 0 HB3 LYS A 36 3.040 4.204 8.340 1.00 0.32 H new ATOM 0 HG2 LYS A 36 1.357 6.080 7.817 1.00 0.46 H new ATOM 0 HG3 LYS A 36 1.783 5.901 6.127 1.00 0.46 H new ATOM 0 HD2 LYS A 36 0.709 3.651 7.905 1.00 0.77 H new ATOM 0 HD3 LYS A 36 -0.248 4.552 6.746 1.00 0.77 H new ATOM 0 HE2 LYS A 36 0.361 2.684 5.449 1.00 1.44 H new ATOM 0 HE3 LYS A 36 1.632 3.809 5.013 1.00 1.44 H new ATOM 0 HZ1 LYS A 36 1.991 1.322 6.096 1.00 2.00 H new ATOM 0 HZ2 LYS A 36 3.170 2.540 6.000 1.00 2.00 H new ATOM 0 HZ3 LYS A 36 2.253 2.356 7.417 1.00 2.00 H new ATOM 609 N ASN A 37 4.092 6.026 10.238 1.00 0.27 N ATOM 610 CA ASN A 37 3.764 6.514 11.608 1.00 0.30 C ATOM 611 C ASN A 37 4.270 7.956 11.766 1.00 0.29 C ATOM 612 O ASN A 37 3.607 8.793 12.340 1.00 0.32 O ATOM 613 CB ASN A 37 4.423 5.607 12.647 1.00 0.32 C ATOM 614 CG ASN A 37 4.075 6.103 14.053 1.00 0.37 C ATOM 615 OD1 ASN A 37 5.031 6.461 14.867 1.00 0.74 O flip ATOM 616 ND2 ASN A 37 2.918 6.163 14.417 1.00 0.47 N flip ATOM 0 H ASN A 37 4.695 5.204 10.207 1.00 0.27 H new ATOM 0 HA ASN A 37 2.685 6.494 11.758 1.00 0.30 H new ATOM 0 HB2 ASN A 37 4.082 4.580 12.517 1.00 0.32 H new ATOM 0 HB3 ASN A 37 5.504 5.603 12.508 1.00 0.32 H new ATOM 0 HD21 ASN A 37 2.169 5.884 13.783 1.00 0.47 H new ATOM 0 HD22 ASN A 37 2.695 6.492 15.356 1.00 0.47 H new ATOM 623 N LEU A 38 5.430 8.261 11.246 1.00 0.26 N ATOM 624 CA LEU A 38 5.946 9.656 11.363 1.00 0.27 C ATOM 625 C LEU A 38 4.955 10.594 10.689 1.00 0.26 C ATOM 626 O LEU A 38 4.697 11.684 11.162 1.00 0.28 O ATOM 627 CB LEU A 38 7.314 9.778 10.687 1.00 0.26 C ATOM 628 CG LEU A 38 8.386 9.092 11.546 1.00 0.30 C ATOM 629 CD1 LEU A 38 9.682 8.981 10.736 1.00 0.33 C ATOM 630 CD2 LEU A 38 8.650 9.906 12.836 1.00 0.35 C ATOM 0 H LEU A 38 6.038 7.610 10.749 1.00 0.26 H new ATOM 0 HA LEU A 38 6.059 9.917 12.415 1.00 0.27 H new ATOM 0 HB2 LEU A 38 7.282 9.322 9.698 1.00 0.26 H new ATOM 0 HB3 LEU A 38 7.567 10.829 10.546 1.00 0.26 H new ATOM 0 HG LEU A 38 8.035 8.099 11.827 1.00 0.30 H new ATOM 0 HD11 LEU A 38 10.448 8.495 11.340 1.00 0.33 H new ATOM 0 HD12 LEU A 38 9.500 8.392 9.837 1.00 0.33 H new ATOM 0 HD13 LEU A 38 10.021 9.978 10.454 1.00 0.33 H new ATOM 0 HD21 LEU A 38 9.412 9.405 13.433 1.00 0.35 H new ATOM 0 HD22 LEU A 38 8.995 10.906 12.571 1.00 0.35 H new ATOM 0 HD23 LEU A 38 7.729 9.981 13.414 1.00 0.35 H new ATOM 642 N GLN A 39 4.384 10.184 9.594 1.00 0.25 N ATOM 643 CA GLN A 39 3.403 11.067 8.918 1.00 0.29 C ATOM 644 C GLN A 39 2.263 11.336 9.900 1.00 0.33 C ATOM 645 O GLN A 39 1.772 12.442 10.005 1.00 0.35 O ATOM 646 CB GLN A 39 2.849 10.369 7.678 1.00 0.32 C ATOM 647 CG GLN A 39 1.965 11.339 6.889 1.00 0.40 C ATOM 648 CD GLN A 39 1.472 10.655 5.612 1.00 0.45 C ATOM 649 OE1 GLN A 39 1.053 9.516 5.642 1.00 0.85 O ATOM 650 NE2 GLN A 39 1.510 11.304 4.481 1.00 0.97 N ATOM 0 H GLN A 39 4.553 9.285 9.143 1.00 0.25 H new ATOM 0 HA GLN A 39 3.879 11.999 8.614 1.00 0.29 H new ATOM 0 HB2 GLN A 39 3.668 10.017 7.051 1.00 0.32 H new ATOM 0 HB3 GLN A 39 2.272 9.492 7.970 1.00 0.32 H new ATOM 0 HG2 GLN A 39 1.117 11.652 7.498 1.00 0.40 H new ATOM 0 HG3 GLN A 39 2.527 12.239 6.639 1.00 0.40 H new ATOM 0 HE21 GLN A 39 1.862 12.261 4.454 1.00 0.97 H new ATOM 0 HE22 GLN A 39 1.188 10.854 3.624 1.00 0.97 H new ATOM 659 N THR A 40 1.843 10.343 10.641 1.00 0.36 N ATOM 660 CA THR A 40 0.755 10.591 11.625 1.00 0.42 C ATOM 661 C THR A 40 1.239 11.655 12.614 1.00 0.41 C ATOM 662 O THR A 40 0.501 12.544 12.988 1.00 0.43 O ATOM 663 CB THR A 40 0.403 9.301 12.379 1.00 0.47 C ATOM 664 OG1 THR A 40 1.463 8.952 13.256 1.00 0.46 O ATOM 665 CG2 THR A 40 0.171 8.165 11.384 1.00 0.49 C ATOM 0 H THR A 40 2.201 9.388 10.607 1.00 0.36 H new ATOM 0 HA THR A 40 -0.140 10.932 11.105 1.00 0.42 H new ATOM 0 HB THR A 40 -0.506 9.465 12.957 1.00 0.47 H new ATOM 0 HG1 THR A 40 2.167 8.492 12.752 1.00 0.46 H new ATOM 0 HG21 THR A 40 -0.078 7.252 11.925 1.00 0.49 H new ATOM 0 HG22 THR A 40 -0.650 8.427 10.717 1.00 0.49 H new ATOM 0 HG23 THR A 40 1.076 8.004 10.798 1.00 0.49 H new ATOM 673 N ARG A 41 2.485 11.595 13.025 1.00 0.39 N ATOM 674 CA ARG A 41 2.993 12.636 13.963 1.00 0.39 C ATOM 675 C ARG A 41 2.884 13.997 13.282 1.00 0.36 C ATOM 676 O ARG A 41 2.530 14.985 13.893 1.00 0.37 O ATOM 677 CB ARG A 41 4.463 12.391 14.332 1.00 0.43 C ATOM 678 CG ARG A 41 4.602 11.155 15.227 1.00 0.55 C ATOM 679 CD ARG A 41 6.026 11.126 15.805 1.00 0.66 C ATOM 680 NE ARG A 41 6.371 9.756 16.305 1.00 0.89 N ATOM 681 CZ ARG A 41 5.634 9.140 17.186 1.00 1.04 C ATOM 682 NH1 ARG A 41 4.626 9.745 17.748 1.00 1.22 N ATOM 683 NH2 ARG A 41 5.944 7.927 17.549 1.00 1.32 N ATOM 0 H ARG A 41 3.160 10.880 12.754 1.00 0.39 H new ATOM 0 HA ARG A 41 2.398 12.599 14.875 1.00 0.39 H new ATOM 0 HB2 ARG A 41 5.053 12.257 13.425 1.00 0.43 H new ATOM 0 HB3 ARG A 41 4.864 13.265 14.846 1.00 0.43 H new ATOM 0 HG2 ARG A 41 3.868 11.186 16.032 1.00 0.55 H new ATOM 0 HG3 ARG A 41 4.408 10.249 14.653 1.00 0.55 H new ATOM 0 HD2 ARG A 41 6.740 11.429 15.039 1.00 0.66 H new ATOM 0 HD3 ARG A 41 6.107 11.846 16.619 1.00 0.66 H new ATOM 0 HE ARG A 41 7.206 9.293 15.946 1.00 0.89 H new ATOM 0 HH11 ARG A 41 4.407 10.710 17.500 1.00 1.22 H new ATOM 0 HH12 ARG A 41 4.056 9.254 18.436 1.00 1.22 H new ATOM 0 HH21 ARG A 41 6.759 7.466 17.144 1.00 1.32 H new ATOM 0 HH22 ARG A 41 5.372 7.439 18.238 1.00 1.32 H new ATOM 697 N VAL A 42 3.194 14.056 12.013 1.00 0.33 N ATOM 698 CA VAL A 42 3.106 15.354 11.298 1.00 0.35 C ATOM 699 C VAL A 42 1.665 15.849 11.370 1.00 0.38 C ATOM 700 O VAL A 42 1.412 16.999 11.650 1.00 0.40 O ATOM 701 CB VAL A 42 3.535 15.176 9.833 1.00 0.37 C ATOM 702 CG1 VAL A 42 3.215 16.446 9.041 1.00 0.43 C ATOM 703 CG2 VAL A 42 5.041 14.910 9.773 1.00 0.38 C ATOM 0 H VAL A 42 3.502 13.265 11.448 1.00 0.33 H new ATOM 0 HA VAL A 42 3.770 16.083 11.763 1.00 0.35 H new ATOM 0 HB VAL A 42 2.994 14.334 9.400 1.00 0.37 H new ATOM 0 HG11 VAL A 42 3.521 16.314 8.003 1.00 0.43 H new ATOM 0 HG12 VAL A 42 2.143 16.640 9.081 1.00 0.43 H new ATOM 0 HG13 VAL A 42 3.753 17.290 9.474 1.00 0.43 H new ATOM 0 HG21 VAL A 42 5.347 14.783 8.735 1.00 0.38 H new ATOM 0 HG22 VAL A 42 5.577 15.753 10.209 1.00 0.38 H new ATOM 0 HG23 VAL A 42 5.273 14.004 10.333 1.00 0.38 H new ATOM 713 N THR A 43 0.710 14.991 11.134 1.00 0.39 N ATOM 714 CA THR A 43 -0.709 15.443 11.209 1.00 0.45 C ATOM 715 C THR A 43 -1.003 15.959 12.621 1.00 0.44 C ATOM 716 O THR A 43 -1.675 16.956 12.799 1.00 0.47 O ATOM 717 CB THR A 43 -1.644 14.274 10.888 1.00 0.50 C ATOM 718 OG1 THR A 43 -1.442 13.231 11.830 1.00 0.50 O ATOM 719 CG2 THR A 43 -1.352 13.754 9.478 1.00 0.51 C ATOM 0 H THR A 43 0.847 14.009 10.895 1.00 0.39 H new ATOM 0 HA THR A 43 -0.872 16.241 10.485 1.00 0.45 H new ATOM 0 HB THR A 43 -2.678 14.614 10.940 1.00 0.50 H new ATOM 0 HG1 THR A 43 -0.497 13.203 12.090 1.00 0.50 H new ATOM 0 HG21 THR A 43 -2.019 12.922 9.252 1.00 0.51 H new ATOM 0 HG22 THR A 43 -1.512 14.554 8.755 1.00 0.51 H new ATOM 0 HG23 THR A 43 -0.317 13.415 9.422 1.00 0.51 H new ATOM 727 N ALA A 44 -0.498 15.293 13.626 1.00 0.42 N ATOM 728 CA ALA A 44 -0.748 15.758 15.022 1.00 0.43 C ATOM 729 C ALA A 44 -0.034 17.090 15.232 1.00 0.39 C ATOM 730 O ALA A 44 -0.572 18.017 15.801 1.00 0.39 O ATOM 731 CB ALA A 44 -0.207 14.722 16.009 1.00 0.45 C ATOM 0 H ALA A 44 0.073 14.452 13.542 1.00 0.42 H new ATOM 0 HA ALA A 44 -1.818 15.883 15.187 1.00 0.43 H new ATOM 0 HB1 ALA A 44 -0.389 15.061 17.029 1.00 0.45 H new ATOM 0 HB2 ALA A 44 -0.710 13.769 15.848 1.00 0.45 H new ATOM 0 HB3 ALA A 44 0.865 14.597 15.854 1.00 0.45 H new ATOM 737 N ILE A 45 1.168 17.193 14.745 1.00 0.35 N ATOM 738 CA ILE A 45 1.937 18.460 14.874 1.00 0.32 C ATOM 739 C ILE A 45 1.169 19.586 14.177 1.00 0.32 C ATOM 740 O ILE A 45 1.120 20.703 14.653 1.00 0.31 O ATOM 741 CB ILE A 45 3.329 18.288 14.254 1.00 0.31 C ATOM 742 CG1 ILE A 45 4.155 17.348 15.145 1.00 0.32 C ATOM 743 CG2 ILE A 45 4.028 19.650 14.154 1.00 0.30 C ATOM 744 CD1 ILE A 45 5.405 16.876 14.396 1.00 0.33 C ATOM 0 H ILE A 45 1.657 16.443 14.256 1.00 0.35 H new ATOM 0 HA ILE A 45 2.060 18.714 15.927 1.00 0.32 H new ATOM 0 HB ILE A 45 3.236 17.866 13.253 1.00 0.31 H new ATOM 0 HG12 ILE A 45 4.443 17.863 16.061 1.00 0.32 H new ATOM 0 HG13 ILE A 45 3.552 16.489 15.439 1.00 0.32 H new ATOM 0 HG21 ILE A 45 5.016 19.520 13.713 1.00 0.30 H new ATOM 0 HG22 ILE A 45 3.436 20.318 13.528 1.00 0.30 H new ATOM 0 HG23 ILE A 45 4.129 20.081 15.150 1.00 0.30 H new ATOM 0 HD11 ILE A 45 5.983 16.210 15.037 1.00 0.33 H new ATOM 0 HD12 ILE A 45 5.108 16.343 13.493 1.00 0.33 H new ATOM 0 HD13 ILE A 45 6.014 17.738 14.125 1.00 0.33 H new ATOM 756 N GLU A 46 0.579 19.299 13.050 1.00 0.35 N ATOM 757 CA GLU A 46 -0.178 20.349 12.313 1.00 0.37 C ATOM 758 C GLU A 46 -1.302 20.868 13.204 1.00 0.38 C ATOM 759 O GLU A 46 -1.567 22.052 13.266 1.00 0.38 O ATOM 760 CB GLU A 46 -0.782 19.723 11.052 1.00 0.44 C ATOM 761 CG GLU A 46 0.327 19.421 10.036 1.00 1.20 C ATOM 762 CD GLU A 46 0.736 20.703 9.311 1.00 1.67 C ATOM 763 OE1 GLU A 46 0.077 21.049 8.345 1.00 2.17 O ATOM 764 OE2 GLU A 46 1.707 21.312 9.728 1.00 2.26 O ATOM 0 H GLU A 46 0.589 18.380 12.607 1.00 0.35 H new ATOM 0 HA GLU A 46 0.484 21.171 12.041 1.00 0.37 H new ATOM 0 HB2 GLU A 46 -1.311 18.806 11.309 1.00 0.44 H new ATOM 0 HB3 GLU A 46 -1.514 20.401 10.614 1.00 0.44 H new ATOM 0 HG2 GLU A 46 1.190 18.990 10.544 1.00 1.20 H new ATOM 0 HG3 GLU A 46 -0.021 18.681 9.315 1.00 1.20 H new ATOM 771 N LYS A 47 -1.949 19.995 13.911 1.00 0.41 N ATOM 772 CA LYS A 47 -3.035 20.443 14.815 1.00 0.44 C ATOM 773 C LYS A 47 -2.456 21.417 15.848 1.00 0.41 C ATOM 774 O LYS A 47 -2.977 22.494 16.070 1.00 0.42 O ATOM 775 CB LYS A 47 -3.629 19.217 15.514 1.00 0.48 C ATOM 776 CG LYS A 47 -4.750 19.652 16.451 1.00 1.21 C ATOM 777 CD LYS A 47 -5.367 18.419 17.112 1.00 1.55 C ATOM 778 CE LYS A 47 -6.233 18.856 18.295 1.00 2.31 C ATOM 779 NZ LYS A 47 -7.180 19.914 17.848 1.00 2.88 N ATOM 0 H LYS A 47 -1.774 18.990 13.903 1.00 0.41 H new ATOM 0 HA LYS A 47 -3.818 20.950 14.251 1.00 0.44 H new ATOM 0 HB2 LYS A 47 -4.013 18.515 14.774 1.00 0.48 H new ATOM 0 HB3 LYS A 47 -2.854 18.696 16.076 1.00 0.48 H new ATOM 0 HG2 LYS A 47 -4.361 20.329 17.211 1.00 1.21 H new ATOM 0 HG3 LYS A 47 -5.511 20.200 15.895 1.00 1.21 H new ATOM 0 HD2 LYS A 47 -5.970 17.869 16.390 1.00 1.55 H new ATOM 0 HD3 LYS A 47 -4.582 17.744 17.452 1.00 1.55 H new ATOM 0 HE2 LYS A 47 -6.784 18.003 18.692 1.00 2.31 H new ATOM 0 HE3 LYS A 47 -5.604 19.232 19.102 1.00 2.31 H new ATOM 0 HZ1 LYS A 47 -7.982 19.963 18.508 1.00 2.88 H new ATOM 0 HZ2 LYS A 47 -6.691 20.832 17.828 1.00 2.88 H new ATOM 0 HZ3 LYS A 47 -7.529 19.687 16.895 1.00 2.88 H new ATOM 793 N TYR A 48 -1.377 21.045 16.481 1.00 0.38 N ATOM 794 CA TYR A 48 -0.759 21.945 17.493 1.00 0.36 C ATOM 795 C TYR A 48 -0.320 23.250 16.821 1.00 0.33 C ATOM 796 O TYR A 48 -0.479 24.319 17.369 1.00 0.33 O ATOM 797 CB TYR A 48 0.443 21.245 18.144 1.00 0.37 C ATOM 798 CG TYR A 48 -0.052 20.274 19.195 1.00 0.41 C ATOM 799 CD1 TYR A 48 -0.453 20.743 20.454 1.00 0.45 C ATOM 800 CD2 TYR A 48 -0.118 18.906 18.909 1.00 0.41 C ATOM 801 CE1 TYR A 48 -0.916 19.847 21.422 1.00 0.51 C ATOM 802 CE2 TYR A 48 -0.582 18.009 19.880 1.00 0.46 C ATOM 803 CZ TYR A 48 -0.980 18.478 21.135 1.00 0.51 C ATOM 804 OH TYR A 48 -1.439 17.592 22.090 1.00 0.57 O ATOM 0 H TYR A 48 -0.897 20.156 16.340 1.00 0.38 H new ATOM 0 HA TYR A 48 -1.489 22.178 18.268 1.00 0.36 H new ATOM 0 HB2 TYR A 48 1.023 20.716 17.388 1.00 0.37 H new ATOM 0 HB3 TYR A 48 1.106 21.982 18.597 1.00 0.37 H new ATOM 0 HD1 TYR A 48 -0.404 21.799 20.676 1.00 0.45 H new ATOM 0 HD2 TYR A 48 0.189 18.542 17.940 1.00 0.41 H new ATOM 0 HE1 TYR A 48 -1.224 20.211 22.391 1.00 0.51 H new ATOM 0 HE2 TYR A 48 -0.632 16.953 19.658 1.00 0.46 H new ATOM 0 HH TYR A 48 -1.420 16.682 21.728 1.00 0.57 H new ATOM 814 N LEU A 49 0.223 23.177 15.633 1.00 0.31 N ATOM 815 CA LEU A 49 0.660 24.425 14.940 1.00 0.29 C ATOM 816 C LEU A 49 -0.555 25.338 14.746 1.00 0.32 C ATOM 817 O LEU A 49 -0.472 26.538 14.904 1.00 0.32 O ATOM 818 CB LEU A 49 1.284 24.090 13.572 1.00 0.29 C ATOM 819 CG LEU A 49 2.679 23.455 13.749 1.00 0.25 C ATOM 820 CD1 LEU A 49 3.158 22.910 12.398 1.00 0.28 C ATOM 821 CD2 LEU A 49 3.688 24.509 14.246 1.00 0.25 C ATOM 0 H LEU A 49 0.382 22.312 15.116 1.00 0.31 H new ATOM 0 HA LEU A 49 1.411 24.930 15.547 1.00 0.29 H new ATOM 0 HB2 LEU A 49 0.634 23.405 13.028 1.00 0.29 H new ATOM 0 HB3 LEU A 49 1.365 24.996 12.972 1.00 0.29 H new ATOM 0 HG LEU A 49 2.611 22.650 14.481 1.00 0.25 H new ATOM 0 HD11 LEU A 49 4.144 22.460 12.516 1.00 0.28 H new ATOM 0 HD12 LEU A 49 2.456 22.157 12.040 1.00 0.28 H new ATOM 0 HD13 LEU A 49 3.216 23.725 11.677 1.00 0.28 H new ATOM 0 HD21 LEU A 49 4.668 24.047 14.366 1.00 0.25 H new ATOM 0 HD22 LEU A 49 3.756 25.319 13.520 1.00 0.25 H new ATOM 0 HD23 LEU A 49 3.355 24.908 15.204 1.00 0.25 H new ATOM 833 N LYS A 50 -1.684 24.780 14.419 1.00 0.35 N ATOM 834 CA LYS A 50 -2.901 25.615 14.217 1.00 0.39 C ATOM 835 C LYS A 50 -3.200 26.368 15.517 1.00 0.39 C ATOM 836 O LYS A 50 -3.568 27.527 15.506 1.00 0.41 O ATOM 837 CB LYS A 50 -4.081 24.703 13.853 1.00 0.44 C ATOM 838 CG LYS A 50 -5.364 25.526 13.633 1.00 1.03 C ATOM 839 CD LYS A 50 -5.228 26.397 12.376 1.00 1.21 C ATOM 840 CE LYS A 50 -6.617 26.821 11.891 1.00 1.58 C ATOM 841 NZ LYS A 50 -6.475 27.789 10.768 1.00 2.18 N ATOM 0 H LYS A 50 -1.819 23.778 14.282 1.00 0.35 H new ATOM 0 HA LYS A 50 -2.742 26.331 13.410 1.00 0.39 H new ATOM 0 HB2 LYS A 50 -3.846 24.140 12.950 1.00 0.44 H new ATOM 0 HB3 LYS A 50 -4.243 23.976 14.649 1.00 0.44 H new ATOM 0 HG2 LYS A 50 -6.220 24.858 13.531 1.00 1.03 H new ATOM 0 HG3 LYS A 50 -5.554 26.156 14.502 1.00 1.03 H new ATOM 0 HD2 LYS A 50 -4.624 27.277 12.595 1.00 1.21 H new ATOM 0 HD3 LYS A 50 -4.711 25.843 11.592 1.00 1.21 H new ATOM 0 HE2 LYS A 50 -7.182 25.948 11.564 1.00 1.58 H new ATOM 0 HE3 LYS A 50 -7.177 27.275 12.709 1.00 1.58 H new ATOM 0 HZ1 LYS A 50 -7.418 28.078 10.437 1.00 2.18 H new ATOM 0 HZ2 LYS A 50 -5.951 28.626 11.095 1.00 2.18 H new ATOM 0 HZ3 LYS A 50 -5.957 27.340 9.986 1.00 2.18 H new ATOM 855 N ASP A 51 -3.040 25.728 16.637 1.00 0.38 N ATOM 856 CA ASP A 51 -3.309 26.421 17.929 1.00 0.40 C ATOM 857 C ASP A 51 -2.384 27.635 18.035 1.00 0.38 C ATOM 858 O ASP A 51 -2.775 28.689 18.491 1.00 0.40 O ATOM 859 CB ASP A 51 -3.032 25.470 19.094 1.00 0.42 C ATOM 860 CG ASP A 51 -3.350 26.177 20.413 1.00 1.29 C ATOM 861 OD1 ASP A 51 -2.683 27.154 20.717 1.00 1.96 O ATOM 862 OD2 ASP A 51 -4.256 25.732 21.095 1.00 2.07 O ATOM 0 H ASP A 51 -2.736 24.758 16.717 1.00 0.38 H new ATOM 0 HA ASP A 51 -4.351 26.737 17.967 1.00 0.40 H new ATOM 0 HB2 ASP A 51 -3.639 24.570 18.995 1.00 0.42 H new ATOM 0 HB3 ASP A 51 -1.989 25.154 19.080 1.00 0.42 H new ATOM 867 N GLN A 52 -1.156 27.489 17.619 1.00 0.36 N ATOM 868 CA GLN A 52 -0.196 28.628 17.692 1.00 0.38 C ATOM 869 C GLN A 52 -0.723 29.806 16.855 1.00 0.38 C ATOM 870 O GLN A 52 -0.617 30.950 17.253 1.00 0.40 O ATOM 871 CB GLN A 52 1.184 28.164 17.176 1.00 0.42 C ATOM 872 CG GLN A 52 2.085 27.776 18.358 1.00 1.31 C ATOM 873 CD GLN A 52 1.335 26.821 19.292 1.00 2.37 C ATOM 874 OE1 GLN A 52 0.498 25.957 18.789 1.00 3.28 O flip ATOM 875 NE2 GLN A 52 1.513 26.862 20.492 1.00 2.59 N flip ATOM 0 H GLN A 52 -0.774 26.627 17.230 1.00 0.36 H new ATOM 0 HA GLN A 52 -0.092 28.960 18.725 1.00 0.38 H new ATOM 0 HB2 GLN A 52 1.063 27.313 16.506 1.00 0.42 H new ATOM 0 HB3 GLN A 52 1.652 28.961 16.598 1.00 0.42 H new ATOM 0 HG2 GLN A 52 2.995 27.301 17.992 1.00 1.31 H new ATOM 0 HG3 GLN A 52 2.389 28.669 18.904 1.00 1.31 H new ATOM 0 HE21 GLN A 52 2.167 27.537 20.888 1.00 2.59 H new ATOM 0 HE22 GLN A 52 1.008 26.221 21.105 1.00 2.59 H new ATOM 884 N ALA A 53 -1.294 29.547 15.709 1.00 0.39 N ATOM 885 CA ALA A 53 -1.821 30.664 14.883 1.00 0.45 C ATOM 886 C ALA A 53 -2.862 31.421 15.706 1.00 0.47 C ATOM 887 O ALA A 53 -2.932 32.633 15.681 1.00 0.53 O ATOM 888 CB ALA A 53 -2.478 30.108 13.618 1.00 0.49 C ATOM 0 H ALA A 53 -1.416 28.615 15.313 1.00 0.39 H new ATOM 0 HA ALA A 53 -1.008 31.330 14.595 1.00 0.45 H new ATOM 0 HB1 ALA A 53 -2.863 30.931 13.016 1.00 0.49 H new ATOM 0 HB2 ALA A 53 -1.741 29.550 13.041 1.00 0.49 H new ATOM 0 HB3 ALA A 53 -3.299 29.447 13.895 1.00 0.49 H new ATOM 894 N GLN A 54 -3.662 30.711 16.447 1.00 0.45 N ATOM 895 CA GLN A 54 -4.696 31.382 17.281 1.00 0.50 C ATOM 896 C GLN A 54 -4.004 32.328 18.269 1.00 0.55 C ATOM 897 O GLN A 54 -4.477 33.415 18.533 1.00 0.62 O ATOM 898 CB GLN A 54 -5.507 30.323 18.040 1.00 0.51 C ATOM 899 CG GLN A 54 -6.596 31.002 18.875 1.00 0.58 C ATOM 900 CD GLN A 54 -7.410 29.937 19.615 1.00 0.62 C ATOM 901 OE1 GLN A 54 -7.379 28.699 19.200 1.00 0.97 O flip ATOM 902 NE2 GLN A 54 -8.083 30.236 20.582 1.00 1.03 N flip ATOM 0 H GLN A 54 -3.645 29.693 16.512 1.00 0.45 H new ATOM 0 HA GLN A 54 -5.372 31.956 16.647 1.00 0.50 H new ATOM 0 HB2 GLN A 54 -5.959 29.624 17.336 1.00 0.51 H new ATOM 0 HB3 GLN A 54 -4.849 29.743 18.687 1.00 0.51 H new ATOM 0 HG2 GLN A 54 -6.145 31.691 19.589 1.00 0.58 H new ATOM 0 HG3 GLN A 54 -7.249 31.591 18.231 1.00 0.58 H new ATOM 0 HE21 GLN A 54 -8.108 31.203 20.907 1.00 1.03 H new ATOM 0 HE22 GLN A 54 -8.623 29.520 21.069 1.00 1.03 H new ATOM 911 N LEU A 55 -2.891 31.926 18.819 1.00 0.54 N ATOM 912 CA LEU A 55 -2.176 32.808 19.789 1.00 0.62 C ATOM 913 C LEU A 55 -1.520 33.967 19.033 1.00 0.66 C ATOM 914 O LEU A 55 -0.632 33.770 18.227 1.00 0.60 O ATOM 915 CB LEU A 55 -1.093 31.992 20.499 1.00 0.60 C ATOM 916 CG LEU A 55 -1.723 30.765 21.168 1.00 0.63 C ATOM 917 CD1 LEU A 55 -0.628 29.948 21.862 1.00 0.65 C ATOM 918 CD2 LEU A 55 -2.772 31.209 22.203 1.00 0.78 C ATOM 0 H LEU A 55 -2.445 31.026 18.640 1.00 0.54 H new ATOM 0 HA LEU A 55 -2.882 33.202 20.519 1.00 0.62 H new ATOM 0 HB2 LEU A 55 -0.334 31.678 19.783 1.00 0.60 H new ATOM 0 HB3 LEU A 55 -0.592 32.608 21.246 1.00 0.60 H new ATOM 0 HG LEU A 55 -2.212 30.153 20.410 1.00 0.63 H new ATOM 0 HD11 LEU A 55 -1.073 29.075 22.339 1.00 0.65 H new ATOM 0 HD12 LEU A 55 0.107 29.624 21.125 1.00 0.65 H new ATOM 0 HD13 LEU A 55 -0.138 30.563 22.617 1.00 0.65 H new ATOM 0 HD21 LEU A 55 -3.214 30.330 22.673 1.00 0.78 H new ATOM 0 HD22 LEU A 55 -2.294 31.826 22.964 1.00 0.78 H new ATOM 0 HD23 LEU A 55 -3.552 31.786 21.706 1.00 0.78 H new ATOM 930 N ASN A 56 -1.953 35.179 19.291 1.00 0.78 N ATOM 931 CA ASN A 56 -1.364 36.369 18.597 1.00 0.86 C ATOM 932 C ASN A 56 -1.077 37.474 19.618 1.00 0.97 C ATOM 933 O ASN A 56 0.057 37.831 19.864 1.00 0.92 O ATOM 934 CB ASN A 56 -2.359 36.875 17.552 1.00 0.92 C ATOM 935 CG ASN A 56 -2.553 35.795 16.486 1.00 0.85 C ATOM 936 OD1 ASN A 56 -3.675 35.130 16.444 1.00 1.37 O flip ATOM 937 ND2 ASN A 56 -1.672 35.548 15.687 1.00 1.36 N flip ATOM 0 H ASN A 56 -2.694 35.396 19.957 1.00 0.78 H new ATOM 0 HA ASN A 56 -0.430 36.088 18.110 1.00 0.86 H new ATOM 0 HB2 ASN A 56 -3.312 37.114 18.024 1.00 0.92 H new ATOM 0 HB3 ASN A 56 -1.991 37.793 17.095 1.00 0.92 H new ATOM 0 HD21 ASN A 56 -0.795 36.067 15.719 1.00 1.36 H new ATOM 0 HD22 ASN A 56 -1.810 34.822 14.984 1.00 1.36 H new ATOM 944 N ALA A 57 -2.103 38.014 20.216 1.00 1.13 N ATOM 945 CA ALA A 57 -1.911 39.097 21.226 1.00 1.24 C ATOM 946 C ALA A 57 -3.080 39.065 22.215 1.00 1.36 C ATOM 947 O ALA A 57 -4.201 39.399 21.885 1.00 1.50 O ATOM 948 CB ALA A 57 -1.859 40.452 20.513 1.00 1.33 C ATOM 0 H ALA A 57 -3.074 37.750 20.048 1.00 1.13 H new ATOM 0 HA ALA A 57 -0.976 38.946 21.766 1.00 1.24 H new ATOM 0 HB1 ALA A 57 -1.719 41.245 21.248 1.00 1.33 H new ATOM 0 HB2 ALA A 57 -1.028 40.460 19.807 1.00 1.33 H new ATOM 0 HB3 ALA A 57 -2.793 40.616 19.976 1.00 1.33 H new ATOM 954 N TRP A 58 -2.819 38.642 23.423 1.00 1.35 N ATOM 955 CA TRP A 58 -3.894 38.553 24.463 1.00 1.48 C ATOM 956 C TRP A 58 -3.747 39.681 25.487 1.00 1.33 C ATOM 957 O TRP A 58 -2.680 39.921 26.014 1.00 1.26 O ATOM 958 CB TRP A 58 -3.769 37.212 25.184 1.00 1.68 C ATOM 959 CG TRP A 58 -4.205 36.117 24.268 1.00 1.88 C ATOM 960 CD1 TRP A 58 -3.380 35.385 23.488 1.00 1.95 C ATOM 961 CD2 TRP A 58 -5.553 35.621 24.022 1.00 2.05 C ATOM 962 NE1 TRP A 58 -4.135 34.469 22.778 1.00 2.16 N ATOM 963 CE2 TRP A 58 -5.480 34.575 23.072 1.00 2.23 C ATOM 964 CE3 TRP A 58 -6.819 35.971 24.524 1.00 2.08 C ATOM 965 CZ2 TRP A 58 -6.622 33.899 22.635 1.00 2.44 C ATOM 966 CZ3 TRP A 58 -7.970 35.295 24.087 1.00 2.29 C ATOM 967 CH2 TRP A 58 -7.872 34.261 23.144 1.00 2.47 C ATOM 0 H TRP A 58 -1.895 38.350 23.741 1.00 1.35 H new ATOM 0 HA TRP A 58 -4.866 38.641 23.978 1.00 1.48 H new ATOM 0 HB2 TRP A 58 -2.738 37.050 25.498 1.00 1.68 H new ATOM 0 HB3 TRP A 58 -4.381 37.213 26.086 1.00 1.68 H new ATOM 0 HD1 TRP A 58 -2.307 35.497 23.429 1.00 1.95 H new ATOM 0 HE1 TRP A 58 -3.745 33.797 22.117 1.00 2.16 H new ATOM 0 HE3 TRP A 58 -6.907 36.765 25.251 1.00 2.08 H new ATOM 0 HZ2 TRP A 58 -6.539 33.103 21.910 1.00 2.44 H new ATOM 0 HZ3 TRP A 58 -8.937 35.573 24.480 1.00 2.29 H new ATOM 0 HH2 TRP A 58 -8.761 33.746 22.812 1.00 2.47 H new ATOM 978 N GLY A 59 -4.818 40.360 25.790 1.00 1.34 N ATOM 979 CA GLY A 59 -4.748 41.455 26.798 1.00 1.27 C ATOM 980 C GLY A 59 -3.976 42.634 26.222 1.00 1.16 C ATOM 981 O GLY A 59 -3.535 43.508 26.942 1.00 1.14 O ATOM 0 H GLY A 59 -5.740 40.204 25.383 1.00 1.34 H new ATOM 0 HA2 GLY A 59 -5.753 41.769 27.079 1.00 1.27 H new ATOM 0 HA3 GLY A 59 -4.261 41.097 27.705 1.00 1.27 H new ATOM 985 N ALA A 60 -3.808 42.672 24.932 1.00 1.14 N ATOM 986 CA ALA A 60 -3.054 43.794 24.322 1.00 1.12 C ATOM 987 C ALA A 60 -3.911 45.060 24.360 1.00 1.02 C ATOM 988 O ALA A 60 -3.699 45.982 23.602 1.00 1.05 O ATOM 989 CB ALA A 60 -2.730 43.419 22.868 1.00 1.20 C ATOM 0 H ALA A 60 -4.160 41.975 24.276 1.00 1.14 H new ATOM 0 HA ALA A 60 -2.131 43.980 24.871 1.00 1.12 H new ATOM 0 HB1 ALA A 60 -2.175 44.231 22.398 1.00 1.20 H new ATOM 0 HB2 ALA A 60 -2.128 42.510 22.852 1.00 1.20 H new ATOM 0 HB3 ALA A 60 -3.657 43.249 22.321 1.00 1.20 H new ATOM 995 N ALA A 61 -4.868 45.126 25.247 1.00 0.96 N ATOM 996 CA ALA A 61 -5.713 46.349 25.325 1.00 0.92 C ATOM 997 C ALA A 61 -6.386 46.435 26.700 1.00 1.17 C ATOM 998 O ALA A 61 -7.247 45.638 27.020 1.00 1.25 O ATOM 999 CB ALA A 61 -6.778 46.287 24.229 1.00 0.72 C ATOM 0 H ALA A 61 -5.099 44.391 25.916 1.00 0.96 H new ATOM 0 HA ALA A 61 -5.091 47.233 25.185 1.00 0.92 H new ATOM 0 HB1 ALA A 61 -7.403 47.179 24.278 1.00 0.72 H new ATOM 0 HB2 ALA A 61 -6.294 46.236 23.254 1.00 0.72 H new ATOM 0 HB3 ALA A 61 -7.398 45.402 24.373 1.00 0.72 H new ATOM 1005 N PHE A 62 -6.024 47.409 27.504 1.00 1.49 N ATOM 1006 CA PHE A 62 -6.665 47.563 28.853 1.00 1.80 C ATOM 1007 C PHE A 62 -7.578 48.797 28.862 1.00 1.70 C ATOM 1008 O PHE A 62 -8.056 49.213 29.900 1.00 1.94 O ATOM 1009 CB PHE A 62 -5.577 47.699 29.932 1.00 2.32 C ATOM 1010 CG PHE A 62 -5.062 46.327 30.317 1.00 2.70 C ATOM 1011 CD1 PHE A 62 -5.697 45.618 31.345 1.00 2.88 C ATOM 1012 CD2 PHE A 62 -3.962 45.764 29.656 1.00 2.93 C ATOM 1013 CE1 PHE A 62 -5.238 44.350 31.712 1.00 3.25 C ATOM 1014 CE2 PHE A 62 -3.502 44.492 30.026 1.00 3.28 C ATOM 1015 CZ PHE A 62 -4.141 43.787 31.054 1.00 3.42 C ATOM 0 H PHE A 62 -5.311 48.105 27.284 1.00 1.49 H new ATOM 0 HA PHE A 62 -7.268 46.680 29.067 1.00 1.80 H new ATOM 0 HB2 PHE A 62 -4.758 48.314 29.560 1.00 2.32 H new ATOM 0 HB3 PHE A 62 -5.982 48.205 30.808 1.00 2.32 H new ATOM 0 HD1 PHE A 62 -6.544 46.053 31.855 1.00 2.88 H new ATOM 0 HD2 PHE A 62 -3.470 46.308 28.864 1.00 2.93 H new ATOM 0 HE1 PHE A 62 -5.731 43.805 32.504 1.00 3.25 H new ATOM 0 HE2 PHE A 62 -2.655 44.056 29.518 1.00 3.28 H new ATOM 0 HZ PHE A 62 -3.786 42.808 31.338 1.00 3.42 H new ATOM 1025 N ARG A 63 -7.860 49.356 27.710 1.00 1.42 N ATOM 1026 CA ARG A 63 -8.784 50.533 27.638 1.00 1.40 C ATOM 1027 C ARG A 63 -9.764 50.297 26.490 1.00 1.24 C ATOM 1028 O ARG A 63 -10.325 51.218 25.930 1.00 1.34 O ATOM 1029 CB ARG A 63 -7.990 51.815 27.375 1.00 1.66 C ATOM 1030 CG ARG A 63 -7.148 52.161 28.604 1.00 2.30 C ATOM 1031 CD ARG A 63 -6.379 53.460 28.350 1.00 2.72 C ATOM 1032 NE ARG A 63 -7.342 54.590 28.221 1.00 3.14 N ATOM 1033 CZ ARG A 63 -6.918 55.821 28.317 1.00 3.66 C ATOM 1034 NH1 ARG A 63 -5.657 56.060 28.550 1.00 3.90 N ATOM 1035 NH2 ARG A 63 -7.756 56.812 28.186 1.00 4.35 N ATOM 0 H ARG A 63 -7.488 49.047 26.812 1.00 1.42 H new ATOM 0 HA ARG A 63 -9.317 50.644 28.582 1.00 1.40 H new ATOM 0 HB2 ARG A 63 -7.345 51.683 26.506 1.00 1.66 H new ATOM 0 HB3 ARG A 63 -8.670 52.635 27.146 1.00 1.66 H new ATOM 0 HG2 ARG A 63 -7.790 52.271 29.478 1.00 2.30 H new ATOM 0 HG3 ARG A 63 -6.452 51.351 28.820 1.00 2.30 H new ATOM 0 HD2 ARG A 63 -5.686 53.651 29.169 1.00 2.72 H new ATOM 0 HD3 ARG A 63 -5.783 53.371 27.442 1.00 2.72 H new ATOM 0 HE ARG A 63 -8.331 54.402 28.058 1.00 3.14 H new ATOM 0 HH11 ARG A 63 -5.002 55.285 28.657 1.00 3.90 H new ATOM 0 HH12 ARG A 63 -5.326 57.022 28.625 1.00 3.90 H new ATOM 0 HH21 ARG A 63 -8.743 56.625 28.009 1.00 4.35 H new ATOM 0 HH22 ARG A 63 -7.424 57.774 28.261 1.00 4.35 H new ATOM 1049 N GLN A 64 -9.978 49.056 26.149 1.00 1.12 N ATOM 1050 CA GLN A 64 -10.925 48.715 25.049 1.00 1.12 C ATOM 1051 C GLN A 64 -11.561 47.366 25.360 1.00 1.12 C ATOM 1052 O GLN A 64 -10.965 46.539 26.021 1.00 1.09 O ATOM 1053 CB GLN A 64 -10.185 48.620 23.708 1.00 1.17 C ATOM 1054 CG GLN A 64 -9.662 50.006 23.278 1.00 1.37 C ATOM 1055 CD GLN A 64 -8.279 50.267 23.888 1.00 1.77 C ATOM 1056 OE1 GLN A 64 -7.825 49.472 24.817 1.00 2.44 O flip ATOM 1057 NE2 GLN A 64 -7.602 51.204 23.509 1.00 1.84 N flip ATOM 0 H GLN A 64 -9.531 48.253 26.592 1.00 1.12 H new ATOM 0 HA GLN A 64 -11.684 49.494 24.975 1.00 1.12 H new ATOM 0 HB2 GLN A 64 -9.352 47.922 23.794 1.00 1.17 H new ATOM 0 HB3 GLN A 64 -10.855 48.225 22.944 1.00 1.17 H new ATOM 0 HG2 GLN A 64 -9.603 50.059 22.191 1.00 1.37 H new ATOM 0 HG3 GLN A 64 -10.360 50.780 23.597 1.00 1.37 H new ATOM 0 HE21 GLN A 64 -7.955 51.827 22.783 1.00 1.84 H new ATOM 0 HE22 GLN A 64 -6.682 51.366 23.918 1.00 1.84 H new ATOM 1066 N VAL A 65 -12.753 47.120 24.880 1.00 1.28 N ATOM 1067 CA VAL A 65 -13.412 45.803 25.140 1.00 1.44 C ATOM 1068 C VAL A 65 -13.331 44.954 23.868 1.00 1.49 C ATOM 1069 O VAL A 65 -14.334 44.544 23.316 1.00 1.73 O ATOM 1070 CB VAL A 65 -14.884 46.034 25.500 1.00 1.71 C ATOM 1071 CG1 VAL A 65 -15.469 44.759 26.107 1.00 1.94 C ATOM 1072 CG2 VAL A 65 -14.990 47.171 26.517 1.00 1.68 C ATOM 0 H VAL A 65 -13.299 47.774 24.319 1.00 1.28 H new ATOM 0 HA VAL A 65 -12.913 45.293 25.964 1.00 1.44 H new ATOM 0 HB VAL A 65 -15.438 46.297 24.599 1.00 1.71 H new ATOM 0 HG11 VAL A 65 -16.516 44.925 26.363 1.00 1.94 H new ATOM 0 HG12 VAL A 65 -15.396 43.946 25.385 1.00 1.94 H new ATOM 0 HG13 VAL A 65 -14.913 44.496 27.007 1.00 1.94 H new ATOM 0 HG21 VAL A 65 -16.037 47.334 26.772 1.00 1.68 H new ATOM 0 HG22 VAL A 65 -14.434 46.907 27.417 1.00 1.68 H new ATOM 0 HG23 VAL A 65 -14.575 48.083 26.088 1.00 1.68 H new ATOM 1082 N ALA A 66 -12.134 44.684 23.401 1.00 1.31 N ATOM 1083 CA ALA A 66 -11.972 43.856 22.169 1.00 1.38 C ATOM 1084 C ALA A 66 -10.650 43.082 22.234 1.00 1.17 C ATOM 1085 O ALA A 66 -9.729 43.460 22.931 1.00 1.01 O ATOM 1086 CB ALA A 66 -11.962 44.769 20.942 1.00 1.51 C ATOM 0 H ALA A 66 -11.262 45.004 23.823 1.00 1.31 H new ATOM 0 HA ALA A 66 -12.800 43.151 22.098 1.00 1.38 H new ATOM 0 HB1 ALA A 66 -11.844 44.167 20.041 1.00 1.51 H new ATOM 0 HB2 ALA A 66 -12.902 45.319 20.890 1.00 1.51 H new ATOM 0 HB3 ALA A 66 -11.133 45.473 21.019 1.00 1.51 H new ATOM 1092 N HIS A 67 -10.550 42.008 21.492 1.00 1.23 N ATOM 1093 CA HIS A 67 -9.293 41.191 21.470 1.00 1.06 C ATOM 1094 C HIS A 67 -8.874 40.968 20.017 1.00 1.10 C ATOM 1095 O HIS A 67 -9.681 40.601 19.184 1.00 1.27 O ATOM 1096 CB HIS A 67 -9.539 39.843 22.156 1.00 1.11 C ATOM 1097 CG HIS A 67 -9.551 40.032 23.651 1.00 1.13 C ATOM 1098 ND1 HIS A 67 -10.498 39.428 24.470 1.00 1.36 N ATOM 1099 CD2 HIS A 67 -8.735 40.752 24.492 1.00 1.02 C ATOM 1100 CE1 HIS A 67 -10.229 39.792 25.738 1.00 1.39 C ATOM 1101 NE2 HIS A 67 -9.165 40.598 25.802 1.00 1.19 N ATOM 0 H HIS A 67 -11.295 41.656 20.891 1.00 1.23 H new ATOM 0 HA HIS A 67 -8.501 41.716 22.004 1.00 1.06 H new ATOM 0 HB2 HIS A 67 -10.489 39.423 21.825 1.00 1.11 H new ATOM 0 HB3 HIS A 67 -8.761 39.133 21.875 1.00 1.11 H new ATOM 0 HD2 HIS A 67 -7.889 41.346 24.180 1.00 1.02 H new ATOM 0 HE1 HIS A 67 -10.802 39.473 26.596 1.00 1.39 H new ATOM 0 HE2 HIS A 67 -8.755 41.013 26.639 1.00 1.19 H new ATOM 1109 N THR A 68 -7.622 41.189 19.695 1.00 1.01 N ATOM 1110 CA THR A 68 -7.174 40.993 18.281 1.00 1.12 C ATOM 1111 C THR A 68 -6.562 39.602 18.137 1.00 0.99 C ATOM 1112 O THR A 68 -5.548 39.288 18.729 1.00 0.86 O ATOM 1113 CB THR A 68 -6.130 42.057 17.923 1.00 1.20 C ATOM 1114 OG1 THR A 68 -5.755 41.906 16.559 1.00 1.39 O ATOM 1115 CG2 THR A 68 -4.887 41.905 18.811 1.00 1.09 C ATOM 0 H THR A 68 -6.897 41.494 20.344 1.00 1.01 H new ATOM 0 HA THR A 68 -8.027 41.087 17.608 1.00 1.12 H new ATOM 0 HB THR A 68 -6.561 43.045 18.084 1.00 1.20 H new ATOM 0 HG1 THR A 68 -5.089 42.586 16.326 1.00 1.39 H new ATOM 0 HG21 THR A 68 -4.155 42.667 18.545 1.00 1.09 H new ATOM 0 HG22 THR A 68 -5.170 42.023 19.857 1.00 1.09 H new ATOM 0 HG23 THR A 68 -4.452 40.917 18.662 1.00 1.09 H new ATOM 1123 N THR A 69 -7.186 38.761 17.349 1.00 1.06 N ATOM 1124 CA THR A 69 -6.674 37.372 17.139 1.00 0.95 C ATOM 1125 C THR A 69 -6.354 37.176 15.660 1.00 0.99 C ATOM 1126 O THR A 69 -7.212 37.303 14.810 1.00 1.16 O ATOM 1127 CB THR A 69 -7.744 36.361 17.565 1.00 1.05 C ATOM 1128 OG1 THR A 69 -7.244 35.046 17.374 1.00 1.09 O ATOM 1129 CG2 THR A 69 -9.016 36.552 16.730 1.00 1.28 C ATOM 0 H THR A 69 -8.040 38.982 16.836 1.00 1.06 H new ATOM 0 HA THR A 69 -5.774 37.220 17.735 1.00 0.95 H new ATOM 0 HB THR A 69 -7.987 36.517 18.616 1.00 1.05 H new ATOM 0 HG1 THR A 69 -7.924 34.395 17.647 1.00 1.09 H new ATOM 0 HG21 THR A 69 -9.768 35.828 17.042 1.00 1.28 H new ATOM 0 HG22 THR A 69 -9.400 37.561 16.878 1.00 1.28 H new ATOM 0 HG23 THR A 69 -8.785 36.403 15.675 1.00 1.28 H new ATOM 1137 N VAL A 70 -5.124 36.869 15.349 1.00 0.89 N ATOM 1138 CA VAL A 70 -4.722 36.658 13.925 1.00 0.97 C ATOM 1139 C VAL A 70 -4.346 35.183 13.730 1.00 0.85 C ATOM 1140 O VAL A 70 -3.227 34.793 13.995 1.00 0.80 O ATOM 1141 CB VAL A 70 -3.502 37.528 13.622 1.00 1.07 C ATOM 1142 CG1 VAL A 70 -2.986 37.216 12.213 1.00 1.24 C ATOM 1143 CG2 VAL A 70 -3.899 39.002 13.705 1.00 1.18 C ATOM 0 H VAL A 70 -4.371 36.754 16.027 1.00 0.89 H new ATOM 0 HA VAL A 70 -5.543 36.924 13.259 1.00 0.97 H new ATOM 0 HB VAL A 70 -2.717 37.319 14.348 1.00 1.07 H new ATOM 0 HG11 VAL A 70 -2.116 37.837 11.998 1.00 1.24 H new ATOM 0 HG12 VAL A 70 -2.705 36.165 12.153 1.00 1.24 H new ATOM 0 HG13 VAL A 70 -3.769 37.424 11.484 1.00 1.24 H new ATOM 0 HG21 VAL A 70 -3.031 39.625 13.489 1.00 1.18 H new ATOM 0 HG22 VAL A 70 -4.684 39.209 12.978 1.00 1.18 H new ATOM 0 HG23 VAL A 70 -4.265 39.224 14.707 1.00 1.18 H new ATOM 1153 N PRO A 71 -5.265 34.360 13.277 1.00 0.84 N ATOM 1154 CA PRO A 71 -4.996 32.912 13.062 1.00 0.75 C ATOM 1155 C PRO A 71 -4.334 32.655 11.705 1.00 0.74 C ATOM 1156 O PRO A 71 -4.884 31.989 10.848 1.00 0.78 O ATOM 1157 CB PRO A 71 -6.394 32.291 13.128 1.00 0.83 C ATOM 1158 CG PRO A 71 -7.302 33.346 12.574 1.00 0.99 C ATOM 1159 CD PRO A 71 -6.658 34.702 12.917 1.00 0.98 C ATOM 0 HA PRO A 71 -4.304 32.494 13.793 1.00 0.75 H new ATOM 0 HB2 PRO A 71 -6.448 31.373 12.542 1.00 0.83 H new ATOM 0 HB3 PRO A 71 -6.665 32.032 14.152 1.00 0.83 H new ATOM 0 HG2 PRO A 71 -7.416 33.232 11.496 1.00 0.99 H new ATOM 0 HG3 PRO A 71 -8.298 33.268 13.010 1.00 0.99 H new ATOM 0 HD2 PRO A 71 -6.694 35.386 12.069 1.00 0.98 H new ATOM 0 HD3 PRO A 71 -7.174 35.191 13.743 1.00 0.98 H new ATOM 1167 N TRP A 72 -3.149 33.172 11.512 1.00 0.72 N ATOM 1168 CA TRP A 72 -2.441 32.954 10.219 1.00 0.75 C ATOM 1169 C TRP A 72 -2.073 31.470 10.132 1.00 0.67 C ATOM 1170 O TRP A 72 -1.529 30.931 11.075 1.00 0.60 O ATOM 1171 CB TRP A 72 -1.155 33.780 10.202 1.00 0.78 C ATOM 1172 CG TRP A 72 -0.555 33.739 8.833 1.00 0.84 C ATOM 1173 CD1 TRP A 72 -1.018 34.425 7.763 1.00 0.94 C ATOM 1174 CD2 TRP A 72 0.605 32.988 8.368 1.00 0.84 C ATOM 1175 NE1 TRP A 72 -0.213 34.147 6.672 1.00 0.99 N ATOM 1176 CE2 TRP A 72 0.800 33.266 6.995 1.00 0.93 C ATOM 1177 CE3 TRP A 72 1.500 32.103 8.999 1.00 0.79 C ATOM 1178 CZ2 TRP A 72 1.844 32.689 6.271 1.00 0.97 C ATOM 1179 CZ3 TRP A 72 2.552 31.517 8.272 1.00 0.84 C ATOM 1180 CH2 TRP A 72 2.723 31.811 6.912 1.00 0.92 C ATOM 0 H TRP A 72 -2.642 33.735 12.195 1.00 0.72 H new ATOM 0 HA TRP A 72 -3.075 33.249 9.383 1.00 0.75 H new ATOM 0 HB2 TRP A 72 -1.368 34.810 10.487 1.00 0.78 H new ATOM 0 HB3 TRP A 72 -0.448 33.387 10.933 1.00 0.78 H new ATOM 0 HD1 TRP A 72 -1.875 35.082 7.760 1.00 0.94 H new ATOM 0 HE1 TRP A 72 -0.351 34.544 5.743 1.00 0.99 H new ATOM 0 HE3 TRP A 72 1.378 31.873 10.047 1.00 0.79 H new ATOM 0 HZ2 TRP A 72 1.972 32.919 5.224 1.00 0.97 H new ATOM 0 HZ3 TRP A 72 3.232 30.837 8.764 1.00 0.84 H new ATOM 0 HH2 TRP A 72 3.534 31.359 6.360 1.00 0.92 H new ATOM 1191 N PRO A 73 -2.365 30.786 9.044 1.00 0.71 N ATOM 1192 CA PRO A 73 -2.037 29.342 8.944 1.00 0.66 C ATOM 1193 C PRO A 73 -0.653 29.044 9.527 1.00 0.58 C ATOM 1194 O PRO A 73 0.279 29.808 9.368 1.00 0.61 O ATOM 1195 CB PRO A 73 -2.071 29.080 7.436 1.00 0.75 C ATOM 1196 CG PRO A 73 -3.092 30.040 6.912 1.00 0.84 C ATOM 1197 CD PRO A 73 -3.021 31.281 7.817 1.00 0.82 C ATOM 0 HA PRO A 73 -2.726 28.709 9.504 1.00 0.66 H new ATOM 0 HB2 PRO A 73 -1.095 29.251 6.981 1.00 0.75 H new ATOM 0 HB3 PRO A 73 -2.348 28.048 7.218 1.00 0.75 H new ATOM 0 HG2 PRO A 73 -2.883 30.302 5.875 1.00 0.84 H new ATOM 0 HG3 PRO A 73 -4.088 29.599 6.934 1.00 0.84 H new ATOM 0 HD2 PRO A 73 -2.447 32.083 7.352 1.00 0.82 H new ATOM 0 HD3 PRO A 73 -4.013 31.680 8.027 1.00 0.82 H new ATOM 1205 N ASN A 74 -0.520 27.936 10.195 1.00 0.52 N ATOM 1206 CA ASN A 74 0.791 27.551 10.800 1.00 0.48 C ATOM 1207 C ASN A 74 1.036 26.086 10.479 1.00 0.50 C ATOM 1208 O ASN A 74 2.139 25.580 10.556 1.00 0.80 O ATOM 1209 CB ASN A 74 0.718 27.746 12.313 1.00 0.47 C ATOM 1210 CG ASN A 74 2.092 27.504 12.938 1.00 0.53 C ATOM 1211 OD1 ASN A 74 3.136 27.408 12.167 1.00 1.17 O flip ATOM 1212 ND2 ASN A 74 2.214 27.403 14.143 1.00 1.26 N flip ATOM 0 H ASN A 74 -1.274 27.267 10.352 1.00 0.52 H new ATOM 0 HA ASN A 74 1.600 28.164 10.403 1.00 0.48 H new ATOM 0 HB2 ASN A 74 0.378 28.756 12.542 1.00 0.47 H new ATOM 0 HB3 ASN A 74 -0.012 27.059 12.742 1.00 0.47 H new ATOM 0 HD21 ASN A 74 1.395 27.478 14.747 1.00 1.26 H new ATOM 0 HD22 ASN A 74 3.135 27.243 14.551 1.00 1.26 H new ATOM 1219 N ALA A 75 -0.016 25.410 10.123 1.00 0.47 N ATOM 1220 CA ALA A 75 0.066 23.971 9.788 1.00 0.47 C ATOM 1221 C ALA A 75 0.352 23.836 8.297 1.00 0.46 C ATOM 1222 O ALA A 75 -0.363 24.368 7.471 1.00 0.47 O ATOM 1223 CB ALA A 75 -1.276 23.312 10.122 1.00 0.53 C ATOM 0 H ALA A 75 -0.952 25.808 10.049 1.00 0.47 H new ATOM 0 HA ALA A 75 0.859 23.487 10.357 1.00 0.47 H new ATOM 0 HB1 ALA A 75 -1.230 22.250 9.880 1.00 0.53 H new ATOM 0 HB2 ALA A 75 -1.486 23.433 11.185 1.00 0.53 H new ATOM 0 HB3 ALA A 75 -2.068 23.783 9.539 1.00 0.53 H new ATOM 1229 N SER A 76 1.384 23.133 7.934 1.00 0.47 N ATOM 1230 CA SER A 76 1.680 22.989 6.487 1.00 0.48 C ATOM 1231 C SER A 76 0.803 21.868 5.951 1.00 0.48 C ATOM 1232 O SER A 76 1.168 20.710 5.958 1.00 0.49 O ATOM 1233 CB SER A 76 3.151 22.620 6.296 1.00 0.54 C ATOM 1234 OG SER A 76 3.357 21.279 6.718 1.00 1.38 O ATOM 0 H SER A 76 2.027 22.658 8.567 1.00 0.47 H new ATOM 0 HA SER A 76 1.483 23.922 5.960 1.00 0.48 H new ATOM 0 HB2 SER A 76 3.433 22.731 5.249 1.00 0.54 H new ATOM 0 HB3 SER A 76 3.785 23.296 6.870 1.00 0.54 H new ATOM 0 HG SER A 76 2.792 20.679 6.188 1.00 1.38 H new ATOM 1240 N LEU A 77 -0.366 22.216 5.499 1.00 0.50 N ATOM 1241 CA LEU A 77 -1.297 21.190 4.973 1.00 0.53 C ATOM 1242 C LEU A 77 -0.831 20.765 3.587 1.00 0.52 C ATOM 1243 O LEU A 77 -0.433 21.577 2.779 1.00 0.55 O ATOM 1244 CB LEU A 77 -2.702 21.783 4.886 1.00 0.61 C ATOM 1245 CG LEU A 77 -3.131 22.286 6.269 1.00 0.65 C ATOM 1246 CD1 LEU A 77 -4.504 22.957 6.162 1.00 0.75 C ATOM 1247 CD2 LEU A 77 -3.201 21.113 7.265 1.00 0.66 C ATOM 0 H LEU A 77 -0.717 23.173 5.472 1.00 0.50 H new ATOM 0 HA LEU A 77 -1.313 20.324 5.635 1.00 0.53 H new ATOM 0 HB2 LEU A 77 -2.718 22.603 4.168 1.00 0.61 H new ATOM 0 HB3 LEU A 77 -3.404 21.031 4.527 1.00 0.61 H new ATOM 0 HG LEU A 77 -2.398 23.008 6.629 1.00 0.65 H new ATOM 0 HD11 LEU A 77 -4.811 23.316 7.144 1.00 0.75 H new ATOM 0 HD12 LEU A 77 -4.445 23.798 5.471 1.00 0.75 H new ATOM 0 HD13 LEU A 77 -5.234 22.236 5.794 1.00 0.75 H new ATOM 0 HD21 LEU A 77 -3.507 21.484 8.243 1.00 0.66 H new ATOM 0 HD22 LEU A 77 -3.926 20.379 6.912 1.00 0.66 H new ATOM 0 HD23 LEU A 77 -2.220 20.645 7.345 1.00 0.66 H new ATOM 1259 N THR A 78 -0.882 19.497 3.307 1.00 0.51 N ATOM 1260 CA THR A 78 -0.450 18.996 1.970 1.00 0.51 C ATOM 1261 C THR A 78 -1.425 17.901 1.532 1.00 0.57 C ATOM 1262 O THR A 78 -1.192 16.736 1.753 1.00 0.66 O ATOM 1263 CB THR A 78 0.959 18.403 2.104 1.00 0.54 C ATOM 1264 OG1 THR A 78 1.384 17.927 0.834 1.00 0.61 O ATOM 1265 CG2 THR A 78 0.964 17.241 3.121 1.00 0.63 C ATOM 0 H THR A 78 -1.207 18.776 3.951 1.00 0.51 H new ATOM 0 HA THR A 78 -0.441 19.802 1.236 1.00 0.51 H new ATOM 0 HB THR A 78 1.639 19.177 2.460 1.00 0.54 H new ATOM 0 HG1 THR A 78 2.036 18.551 0.452 1.00 0.61 H new ATOM 0 HG21 THR A 78 1.972 16.833 3.203 1.00 0.63 H new ATOM 0 HG22 THR A 78 0.641 17.609 4.095 1.00 0.63 H new ATOM 0 HG23 THR A 78 0.283 16.460 2.784 1.00 0.63 H new ATOM 1273 N PRO A 79 -2.521 18.276 0.925 1.00 0.65 N ATOM 1274 CA PRO A 79 -3.560 17.328 0.456 1.00 0.77 C ATOM 1275 C PRO A 79 -3.486 17.009 -1.044 1.00 0.67 C ATOM 1276 O PRO A 79 -3.624 15.877 -1.458 1.00 0.70 O ATOM 1277 CB PRO A 79 -4.829 18.124 0.743 1.00 0.98 C ATOM 1278 CG PRO A 79 -4.452 19.552 0.438 1.00 0.96 C ATOM 1279 CD PRO A 79 -2.923 19.660 0.636 1.00 0.75 C ATOM 0 HA PRO A 79 -3.475 16.354 0.938 1.00 0.77 H new ATOM 0 HB2 PRO A 79 -5.658 17.790 0.119 1.00 0.98 H new ATOM 0 HB3 PRO A 79 -5.144 18.009 1.780 1.00 0.98 H new ATOM 0 HG2 PRO A 79 -4.730 19.816 -0.582 1.00 0.96 H new ATOM 0 HG3 PRO A 79 -4.977 20.241 1.100 1.00 0.96 H new ATOM 0 HD2 PRO A 79 -2.428 20.045 -0.256 1.00 0.75 H new ATOM 0 HD3 PRO A 79 -2.670 20.332 1.456 1.00 0.75 H new ATOM 1287 N LYS A 80 -3.329 18.006 -1.859 1.00 0.66 N ATOM 1288 CA LYS A 80 -3.308 17.773 -3.332 1.00 0.66 C ATOM 1289 C LYS A 80 -1.953 17.260 -3.834 1.00 0.63 C ATOM 1290 O LYS A 80 -1.907 16.403 -4.696 1.00 0.65 O ATOM 1291 CB LYS A 80 -3.640 19.079 -4.067 1.00 0.79 C ATOM 1292 CG LYS A 80 -5.115 19.438 -3.870 1.00 1.31 C ATOM 1293 CD LYS A 80 -5.425 20.742 -4.612 1.00 1.46 C ATOM 1294 CE LYS A 80 -6.900 21.104 -4.429 1.00 2.32 C ATOM 1295 NZ LYS A 80 -7.137 21.560 -3.032 1.00 2.96 N ATOM 0 H LYS A 80 -3.213 18.978 -1.573 1.00 0.66 H new ATOM 0 HA LYS A 80 -4.054 17.005 -3.539 1.00 0.66 H new ATOM 0 HB2 LYS A 80 -3.009 19.885 -3.693 1.00 0.79 H new ATOM 0 HB3 LYS A 80 -3.423 18.972 -5.130 1.00 0.79 H new ATOM 0 HG2 LYS A 80 -5.749 18.634 -4.244 1.00 1.31 H new ATOM 0 HG3 LYS A 80 -5.335 19.550 -2.808 1.00 1.31 H new ATOM 0 HD2 LYS A 80 -4.794 21.546 -4.233 1.00 1.46 H new ATOM 0 HD3 LYS A 80 -5.197 20.631 -5.672 1.00 1.46 H new ATOM 0 HE2 LYS A 80 -7.181 21.890 -5.130 1.00 2.32 H new ATOM 0 HE3 LYS A 80 -7.526 20.240 -4.651 1.00 2.32 H new ATOM 0 HZ1 LYS A 80 -8.080 21.994 -2.964 1.00 2.96 H new ATOM 0 HZ2 LYS A 80 -7.083 20.746 -2.387 1.00 2.96 H new ATOM 0 HZ3 LYS A 80 -6.414 22.259 -2.768 1.00 2.96 H new ATOM 1309 N TRP A 81 -0.852 17.812 -3.380 1.00 0.64 N ATOM 1310 CA TRP A 81 0.480 17.373 -3.935 1.00 0.67 C ATOM 1311 C TRP A 81 1.153 16.235 -3.146 1.00 0.62 C ATOM 1312 O TRP A 81 1.279 15.140 -3.651 1.00 0.63 O ATOM 1313 CB TRP A 81 1.425 18.586 -4.063 1.00 0.72 C ATOM 1314 CG TRP A 81 1.890 19.089 -2.732 1.00 0.68 C ATOM 1315 CD1 TRP A 81 3.017 18.689 -2.095 1.00 0.69 C ATOM 1316 CD2 TRP A 81 1.292 20.118 -1.896 1.00 0.67 C ATOM 1317 NE1 TRP A 81 3.121 19.372 -0.898 1.00 0.68 N ATOM 1318 CE2 TRP A 81 2.089 20.275 -0.737 1.00 0.65 C ATOM 1319 CE3 TRP A 81 0.141 20.913 -2.024 1.00 0.70 C ATOM 1320 CZ2 TRP A 81 1.755 21.192 0.259 1.00 0.65 C ATOM 1321 CZ3 TRP A 81 -0.195 21.839 -1.025 1.00 0.71 C ATOM 1322 CH2 TRP A 81 0.612 21.979 0.115 1.00 0.67 C ATOM 0 H TRP A 81 -0.811 18.535 -2.662 1.00 0.64 H new ATOM 0 HA TRP A 81 0.274 16.955 -4.921 1.00 0.67 H new ATOM 0 HB2 TRP A 81 2.290 18.308 -4.666 1.00 0.72 H new ATOM 0 HB3 TRP A 81 0.912 19.389 -4.593 1.00 0.72 H new ATOM 0 HD1 TRP A 81 3.720 17.956 -2.463 1.00 0.69 H new ATOM 0 HE1 TRP A 81 3.867 19.227 -0.218 1.00 0.68 H new ATOM 0 HE3 TRP A 81 -0.488 20.811 -2.896 1.00 0.70 H new ATOM 0 HZ2 TRP A 81 2.377 21.292 1.136 1.00 0.65 H new ATOM 0 HZ3 TRP A 81 -1.080 22.448 -1.134 1.00 0.71 H new ATOM 0 HH2 TRP A 81 0.348 22.695 0.880 1.00 0.67 H new ATOM 1333 N ASN A 82 1.648 16.470 -1.964 1.00 0.59 N ATOM 1334 CA ASN A 82 2.376 15.375 -1.249 1.00 0.59 C ATOM 1335 C ASN A 82 1.428 14.235 -0.849 1.00 0.53 C ATOM 1336 O ASN A 82 1.735 13.078 -1.053 1.00 0.49 O ATOM 1337 CB ASN A 82 3.084 15.951 -0.003 1.00 0.69 C ATOM 1338 CG ASN A 82 4.412 15.220 0.244 1.00 1.07 C ATOM 1339 OD1 ASN A 82 5.289 15.742 0.906 1.00 0.96 O ATOM 1340 ND2 ASN A 82 4.594 14.026 -0.255 1.00 1.86 N ATOM 0 H ASN A 82 1.584 17.357 -1.464 1.00 0.59 H new ATOM 0 HA ASN A 82 3.119 14.958 -1.928 1.00 0.59 H new ATOM 0 HB2 ASN A 82 3.268 17.016 -0.142 1.00 0.69 H new ATOM 0 HB3 ASN A 82 2.438 15.850 0.869 1.00 0.69 H new ATOM 0 HD21 ASN A 82 5.471 13.532 -0.089 1.00 1.86 H new ATOM 0 HD22 ASN A 82 3.859 13.588 -0.810 1.00 1.86 H new ATOM 1347 N ASN A 83 0.288 14.531 -0.287 1.00 0.56 N ATOM 1348 CA ASN A 83 -0.632 13.420 0.108 1.00 0.57 C ATOM 1349 C ASN A 83 -1.021 12.611 -1.126 1.00 0.52 C ATOM 1350 O ASN A 83 -1.050 11.397 -1.094 1.00 0.51 O ATOM 1351 CB ASN A 83 -1.890 13.980 0.770 1.00 0.66 C ATOM 1352 CG ASN A 83 -2.836 12.831 1.129 1.00 1.21 C ATOM 1353 OD1 ASN A 83 -3.992 12.846 0.760 1.00 1.99 O ATOM 1354 ND2 ASN A 83 -2.393 11.830 1.837 1.00 1.83 N ATOM 0 H ASN A 83 -0.044 15.474 -0.086 1.00 0.56 H new ATOM 0 HA ASN A 83 -0.116 12.775 0.820 1.00 0.57 H new ATOM 0 HB2 ASN A 83 -1.623 14.539 1.667 1.00 0.66 H new ATOM 0 HB3 ASN A 83 -2.388 14.678 0.096 1.00 0.66 H new ATOM 0 HD21 ASN A 83 -3.018 11.061 2.080 1.00 1.83 H new ATOM 0 HD22 ASN A 83 -1.422 11.816 2.148 1.00 1.83 H new ATOM 1361 N GLU A 84 -1.310 13.262 -2.222 1.00 0.52 N ATOM 1362 CA GLU A 84 -1.680 12.497 -3.443 1.00 0.52 C ATOM 1363 C GLU A 84 -0.505 11.595 -3.805 1.00 0.46 C ATOM 1364 O GLU A 84 -0.671 10.428 -4.100 1.00 0.47 O ATOM 1365 CB GLU A 84 -1.975 13.465 -4.594 1.00 0.55 C ATOM 1366 CG GLU A 84 -2.380 12.684 -5.850 1.00 1.26 C ATOM 1367 CD GLU A 84 -3.681 11.919 -5.587 1.00 1.71 C ATOM 1368 OE1 GLU A 84 -4.376 12.270 -4.647 1.00 2.23 O ATOM 1369 OE2 GLU A 84 -3.959 10.994 -6.332 1.00 2.29 O ATOM 0 H GLU A 84 -1.306 14.277 -2.322 1.00 0.52 H new ATOM 0 HA GLU A 84 -2.573 11.898 -3.262 1.00 0.52 H new ATOM 0 HB2 GLU A 84 -2.774 14.149 -4.308 1.00 0.55 H new ATOM 0 HB3 GLU A 84 -1.095 14.073 -4.803 1.00 0.55 H new ATOM 0 HG2 GLU A 84 -2.513 13.368 -6.688 1.00 1.26 H new ATOM 0 HG3 GLU A 84 -1.588 11.989 -6.128 1.00 1.26 H new ATOM 1376 N THR A 85 0.689 12.122 -3.757 1.00 0.44 N ATOM 1377 CA THR A 85 1.878 11.289 -4.066 1.00 0.42 C ATOM 1378 C THR A 85 2.062 10.279 -2.938 1.00 0.38 C ATOM 1379 O THR A 85 2.425 9.143 -3.167 1.00 0.39 O ATOM 1380 CB THR A 85 3.125 12.167 -4.183 1.00 0.44 C ATOM 1381 OG1 THR A 85 3.313 12.885 -2.974 1.00 0.43 O ATOM 1382 CG2 THR A 85 2.955 13.144 -5.347 1.00 0.49 C ATOM 0 H THR A 85 0.888 13.093 -3.517 1.00 0.44 H new ATOM 0 HA THR A 85 1.731 10.774 -5.015 1.00 0.42 H new ATOM 0 HB THR A 85 3.997 11.540 -4.367 1.00 0.44 H new ATOM 0 HG1 THR A 85 2.478 12.887 -2.461 1.00 0.43 H new ATOM 0 HG21 THR A 85 3.844 13.769 -5.430 1.00 0.49 H new ATOM 0 HG22 THR A 85 2.816 12.586 -6.273 1.00 0.49 H new ATOM 0 HG23 THR A 85 2.083 13.774 -5.169 1.00 0.49 H new ATOM 1390 N TRP A 86 1.822 10.681 -1.715 1.00 0.36 N ATOM 1391 CA TRP A 86 1.991 9.725 -0.591 1.00 0.34 C ATOM 1392 C TRP A 86 1.053 8.541 -0.803 1.00 0.34 C ATOM 1393 O TRP A 86 1.418 7.401 -0.607 1.00 0.34 O ATOM 1394 CB TRP A 86 1.659 10.383 0.751 1.00 0.34 C ATOM 1395 CG TRP A 86 2.156 9.488 1.845 1.00 0.32 C ATOM 1396 CD1 TRP A 86 1.449 8.499 2.445 1.00 0.34 C ATOM 1397 CD2 TRP A 86 3.471 9.479 2.458 1.00 0.29 C ATOM 1398 NE1 TRP A 86 2.261 7.882 3.387 1.00 0.33 N ATOM 1399 CE2 TRP A 86 3.517 8.455 3.430 1.00 0.29 C ATOM 1400 CE3 TRP A 86 4.618 10.257 2.261 1.00 0.27 C ATOM 1401 CZ2 TRP A 86 4.669 8.212 4.178 1.00 0.28 C ATOM 1402 CZ3 TRP A 86 5.776 10.019 3.016 1.00 0.26 C ATOM 1403 CH2 TRP A 86 5.802 8.999 3.971 1.00 0.27 C ATOM 0 H TRP A 86 1.520 11.619 -1.453 1.00 0.36 H new ATOM 0 HA TRP A 86 3.031 9.398 -0.570 1.00 0.34 H new ATOM 0 HB2 TRP A 86 2.128 11.364 0.820 1.00 0.34 H new ATOM 0 HB3 TRP A 86 0.584 10.536 0.844 1.00 0.34 H new ATOM 0 HD1 TRP A 86 0.425 8.235 2.227 1.00 0.34 H new ATOM 0 HE1 TRP A 86 1.966 7.102 3.975 1.00 0.33 H new ATOM 0 HE3 TRP A 86 4.611 11.045 1.523 1.00 0.27 H new ATOM 0 HZ2 TRP A 86 4.684 7.420 4.912 1.00 0.28 H new ATOM 0 HZ3 TRP A 86 6.654 10.628 2.858 1.00 0.26 H new ATOM 0 HH2 TRP A 86 6.698 8.820 4.548 1.00 0.27 H new ATOM 1414 N GLN A 87 -0.157 8.795 -1.213 1.00 0.37 N ATOM 1415 CA GLN A 87 -1.087 7.665 -1.442 1.00 0.39 C ATOM 1416 C GLN A 87 -0.478 6.765 -2.505 1.00 0.37 C ATOM 1417 O GLN A 87 -0.488 5.560 -2.389 1.00 0.38 O ATOM 1418 CB GLN A 87 -2.443 8.198 -1.905 1.00 0.43 C ATOM 1419 CG GLN A 87 -3.122 8.910 -0.737 1.00 0.46 C ATOM 1420 CD GLN A 87 -4.415 9.566 -1.215 1.00 0.53 C ATOM 1421 OE1 GLN A 87 -4.557 9.878 -2.378 1.00 1.21 O ATOM 1422 NE2 GLN A 87 -5.371 9.787 -0.356 1.00 1.03 N ATOM 0 H GLN A 87 -0.536 9.724 -1.396 1.00 0.37 H new ATOM 0 HA GLN A 87 -1.241 7.101 -0.522 1.00 0.39 H new ATOM 0 HB2 GLN A 87 -2.312 8.886 -2.740 1.00 0.43 H new ATOM 0 HB3 GLN A 87 -3.068 7.379 -2.261 1.00 0.43 H new ATOM 0 HG2 GLN A 87 -3.337 8.198 0.060 1.00 0.46 H new ATOM 0 HG3 GLN A 87 -2.454 9.663 -0.320 1.00 0.46 H new ATOM 0 HE21 GLN A 87 -5.249 9.524 0.622 1.00 1.03 H new ATOM 0 HE22 GLN A 87 -6.241 10.223 -0.662 1.00 1.03 H new ATOM 1431 N GLU A 88 0.090 7.342 -3.525 1.00 0.37 N ATOM 1432 CA GLU A 88 0.729 6.505 -4.570 1.00 0.37 C ATOM 1433 C GLU A 88 1.883 5.742 -3.921 1.00 0.34 C ATOM 1434 O GLU A 88 2.087 4.575 -4.171 1.00 0.35 O ATOM 1435 CB GLU A 88 1.277 7.402 -5.680 1.00 0.39 C ATOM 1436 CG GLU A 88 0.118 8.032 -6.457 1.00 1.18 C ATOM 1437 CD GLU A 88 0.682 8.935 -7.558 1.00 1.42 C ATOM 1438 OE1 GLU A 88 1.891 9.094 -7.600 1.00 1.93 O ATOM 1439 OE2 GLU A 88 -0.101 9.449 -8.340 1.00 1.96 O ATOM 0 H GLU A 88 0.138 8.349 -3.678 1.00 0.37 H new ATOM 0 HA GLU A 88 0.004 5.813 -4.998 1.00 0.37 H new ATOM 0 HB2 GLU A 88 1.907 8.182 -5.252 1.00 0.39 H new ATOM 0 HB3 GLU A 88 1.905 6.820 -6.354 1.00 0.39 H new ATOM 0 HG2 GLU A 88 -0.508 7.254 -6.893 1.00 1.18 H new ATOM 0 HG3 GLU A 88 -0.515 8.611 -5.784 1.00 1.18 H new ATOM 1446 N TRP A 89 2.630 6.393 -3.069 1.00 0.32 N ATOM 1447 CA TRP A 89 3.757 5.700 -2.388 1.00 0.30 C ATOM 1448 C TRP A 89 3.207 4.524 -1.586 1.00 0.30 C ATOM 1449 O TRP A 89 3.684 3.413 -1.689 1.00 0.30 O ATOM 1450 CB TRP A 89 4.454 6.699 -1.460 1.00 0.28 C ATOM 1451 CG TRP A 89 5.431 6.000 -0.573 1.00 0.25 C ATOM 1452 CD1 TRP A 89 6.653 5.570 -0.945 1.00 0.25 C ATOM 1453 CD2 TRP A 89 5.289 5.665 0.840 1.00 0.24 C ATOM 1454 NE1 TRP A 89 7.266 4.977 0.142 1.00 0.23 N ATOM 1455 CE2 TRP A 89 6.468 5.014 1.266 1.00 0.23 C ATOM 1456 CE3 TRP A 89 4.260 5.856 1.780 1.00 0.26 C ATOM 1457 CZ2 TRP A 89 6.624 4.568 2.578 1.00 0.23 C ATOM 1458 CZ3 TRP A 89 4.413 5.411 3.103 1.00 0.26 C ATOM 1459 CH2 TRP A 89 5.594 4.769 3.501 1.00 0.25 C ATOM 0 H TRP A 89 2.507 7.374 -2.817 1.00 0.32 H new ATOM 0 HA TRP A 89 4.474 5.324 -3.117 1.00 0.30 H new ATOM 0 HB2 TRP A 89 4.969 7.455 -2.052 1.00 0.28 H new ATOM 0 HB3 TRP A 89 3.712 7.219 -0.854 1.00 0.28 H new ATOM 0 HD1 TRP A 89 7.082 5.672 -1.931 1.00 0.25 H new ATOM 0 HE1 TRP A 89 8.197 4.562 0.116 1.00 0.23 H new ATOM 0 HE3 TRP A 89 3.346 6.348 1.482 1.00 0.26 H new ATOM 0 HZ2 TRP A 89 7.534 4.071 2.879 1.00 0.23 H new ATOM 0 HZ3 TRP A 89 3.617 5.564 3.817 1.00 0.26 H new ATOM 0 HH2 TRP A 89 5.708 4.430 4.520 1.00 0.25 H new ATOM 1470 N GLU A 90 2.205 4.759 -0.790 1.00 0.31 N ATOM 1471 CA GLU A 90 1.621 3.651 0.012 1.00 0.33 C ATOM 1472 C GLU A 90 1.062 2.585 -0.936 1.00 0.33 C ATOM 1473 O GLU A 90 1.247 1.402 -0.730 1.00 0.34 O ATOM 1474 CB GLU A 90 0.500 4.208 0.896 1.00 0.37 C ATOM 1475 CG GLU A 90 -0.103 3.085 1.745 1.00 0.85 C ATOM 1476 CD GLU A 90 -1.196 3.661 2.650 1.00 1.16 C ATOM 1477 OE1 GLU A 90 -1.435 4.855 2.572 1.00 1.68 O ATOM 1478 OE2 GLU A 90 -1.780 2.897 3.401 1.00 1.81 O ATOM 0 H GLU A 90 1.765 5.670 -0.660 1.00 0.31 H new ATOM 0 HA GLU A 90 2.387 3.202 0.644 1.00 0.33 H new ATOM 0 HB2 GLU A 90 0.891 4.994 1.542 1.00 0.37 H new ATOM 0 HB3 GLU A 90 -0.273 4.661 0.275 1.00 0.37 H new ATOM 0 HG2 GLU A 90 -0.520 2.311 1.101 1.00 0.85 H new ATOM 0 HG3 GLU A 90 0.673 2.614 2.348 1.00 0.85 H new ATOM 1485 N ARG A 91 0.377 2.996 -1.972 1.00 0.34 N ATOM 1486 CA ARG A 91 -0.193 2.003 -2.929 1.00 0.36 C ATOM 1487 C ARG A 91 0.929 1.224 -3.613 1.00 0.34 C ATOM 1488 O ARG A 91 0.847 0.023 -3.765 1.00 0.35 O ATOM 1489 CB ARG A 91 -1.028 2.726 -3.992 1.00 0.40 C ATOM 1490 CG ARG A 91 -2.338 3.266 -3.388 1.00 0.44 C ATOM 1491 CD ARG A 91 -3.225 2.119 -2.866 1.00 1.07 C ATOM 1492 NE ARG A 91 -3.017 0.891 -3.685 1.00 1.68 N ATOM 1493 CZ ARG A 91 -3.414 -0.264 -3.231 1.00 2.31 C ATOM 1494 NH1 ARG A 91 -4.015 -0.337 -2.075 1.00 2.62 N ATOM 1495 NH2 ARG A 91 -3.216 -1.343 -3.935 1.00 3.18 N ATOM 0 H ARG A 91 0.189 3.973 -2.196 1.00 0.34 H new ATOM 0 HA ARG A 91 -0.826 1.309 -2.376 1.00 0.36 H new ATOM 0 HB2 ARG A 91 -0.452 3.549 -4.415 1.00 0.40 H new ATOM 0 HB3 ARG A 91 -1.255 2.042 -4.810 1.00 0.40 H new ATOM 0 HG2 ARG A 91 -2.110 3.953 -2.573 1.00 0.44 H new ATOM 0 HG3 ARG A 91 -2.882 3.836 -4.142 1.00 0.44 H new ATOM 0 HD2 ARG A 91 -2.988 1.913 -1.822 1.00 1.07 H new ATOM 0 HD3 ARG A 91 -4.273 2.415 -2.902 1.00 1.07 H new ATOM 0 HE ARG A 91 -2.566 0.955 -4.597 1.00 1.68 H new ATOM 0 HH11 ARG A 91 -4.173 0.509 -1.528 1.00 2.62 H new ATOM 0 HH12 ARG A 91 -4.326 -1.240 -1.718 1.00 2.62 H new ATOM 0 HH21 ARG A 91 -2.751 -1.283 -4.841 1.00 3.18 H new ATOM 0 HH22 ARG A 91 -3.526 -2.248 -3.580 1.00 3.18 H new ATOM 1509 N LYS A 92 1.985 1.881 -4.016 1.00 0.34 N ATOM 1510 CA LYS A 92 3.091 1.136 -4.672 1.00 0.34 C ATOM 1511 C LYS A 92 3.629 0.093 -3.698 1.00 0.31 C ATOM 1512 O LYS A 92 3.911 -1.028 -4.068 1.00 0.32 O ATOM 1513 CB LYS A 92 4.204 2.101 -5.083 1.00 0.34 C ATOM 1514 CG LYS A 92 3.748 2.922 -6.293 1.00 0.68 C ATOM 1515 CD LYS A 92 4.863 3.886 -6.701 1.00 1.08 C ATOM 1516 CE LYS A 92 4.423 4.707 -7.914 1.00 1.41 C ATOM 1517 NZ LYS A 92 5.569 5.535 -8.388 1.00 2.14 N ATOM 0 H LYS A 92 2.126 2.887 -3.920 1.00 0.34 H new ATOM 0 HA LYS A 92 2.719 0.640 -5.569 1.00 0.34 H new ATOM 0 HB2 LYS A 92 4.451 2.763 -4.253 1.00 0.34 H new ATOM 0 HB3 LYS A 92 5.109 1.546 -5.327 1.00 0.34 H new ATOM 0 HG2 LYS A 92 3.502 2.260 -7.124 1.00 0.68 H new ATOM 0 HG3 LYS A 92 2.843 3.478 -6.049 1.00 0.68 H new ATOM 0 HD2 LYS A 92 5.104 4.549 -5.870 1.00 1.08 H new ATOM 0 HD3 LYS A 92 5.769 3.328 -6.938 1.00 1.08 H new ATOM 0 HE2 LYS A 92 4.082 4.046 -8.711 1.00 1.41 H new ATOM 0 HE3 LYS A 92 3.582 5.347 -7.649 1.00 1.41 H new ATOM 0 HZ1 LYS A 92 5.275 6.095 -9.213 1.00 2.14 H new ATOM 0 HZ2 LYS A 92 5.874 6.174 -7.626 1.00 2.14 H new ATOM 0 HZ3 LYS A 92 6.359 4.914 -8.656 1.00 2.14 H new ATOM 1531 N VAL A 93 3.744 0.442 -2.449 1.00 0.29 N ATOM 1532 CA VAL A 93 4.229 -0.546 -1.448 1.00 0.28 C ATOM 1533 C VAL A 93 3.261 -1.729 -1.410 1.00 0.29 C ATOM 1534 O VAL A 93 3.665 -2.873 -1.367 1.00 0.29 O ATOM 1535 CB VAL A 93 4.291 0.116 -0.066 1.00 0.28 C ATOM 1536 CG1 VAL A 93 4.536 -0.950 1.015 1.00 0.29 C ATOM 1537 CG2 VAL A 93 5.434 1.137 -0.046 1.00 0.28 C ATOM 0 H VAL A 93 3.524 1.366 -2.078 1.00 0.29 H new ATOM 0 HA VAL A 93 5.225 -0.895 -1.722 1.00 0.28 H new ATOM 0 HB VAL A 93 3.345 0.618 0.137 1.00 0.28 H new ATOM 0 HG11 VAL A 93 4.579 -0.472 1.994 1.00 0.29 H new ATOM 0 HG12 VAL A 93 3.723 -1.676 1.001 1.00 0.29 H new ATOM 0 HG13 VAL A 93 5.480 -1.458 0.818 1.00 0.29 H new ATOM 0 HG21 VAL A 93 5.482 1.610 0.935 1.00 0.28 H new ATOM 0 HG22 VAL A 93 6.377 0.631 -0.251 1.00 0.28 H new ATOM 0 HG23 VAL A 93 5.257 1.897 -0.807 1.00 0.28 H new ATOM 1547 N ASP A 94 1.984 -1.457 -1.417 1.00 0.30 N ATOM 1548 CA ASP A 94 0.989 -2.565 -1.371 1.00 0.32 C ATOM 1549 C ASP A 94 1.157 -3.480 -2.586 1.00 0.33 C ATOM 1550 O ASP A 94 1.082 -4.687 -2.474 1.00 0.35 O ATOM 1551 CB ASP A 94 -0.428 -1.984 -1.372 1.00 0.35 C ATOM 1552 CG ASP A 94 -0.701 -1.295 -0.035 1.00 1.26 C ATOM 1553 OD1 ASP A 94 -0.058 -1.655 0.937 1.00 2.03 O ATOM 1554 OD2 ASP A 94 -1.554 -0.422 -0.004 1.00 1.96 O ATOM 0 H ASP A 94 1.588 -0.518 -1.453 1.00 0.30 H new ATOM 0 HA ASP A 94 1.152 -3.143 -0.462 1.00 0.32 H new ATOM 0 HB2 ASP A 94 -0.539 -1.271 -2.189 1.00 0.35 H new ATOM 0 HB3 ASP A 94 -1.157 -2.777 -1.539 1.00 0.35 H new ATOM 1559 N PHE A 95 1.376 -2.927 -3.750 1.00 0.34 N ATOM 1560 CA PHE A 95 1.536 -3.799 -4.947 1.00 0.36 C ATOM 1561 C PHE A 95 2.819 -4.619 -4.823 1.00 0.34 C ATOM 1562 O PHE A 95 2.829 -5.808 -5.072 1.00 0.35 O ATOM 1563 CB PHE A 95 1.599 -2.942 -6.216 1.00 0.39 C ATOM 1564 CG PHE A 95 0.219 -2.428 -6.558 1.00 0.43 C ATOM 1565 CD1 PHE A 95 -0.761 -3.311 -7.026 1.00 0.47 C ATOM 1566 CD2 PHE A 95 -0.083 -1.068 -6.411 1.00 0.43 C ATOM 1567 CE1 PHE A 95 -2.039 -2.838 -7.346 1.00 0.51 C ATOM 1568 CE2 PHE A 95 -1.360 -0.594 -6.730 1.00 0.47 C ATOM 1569 CZ PHE A 95 -2.338 -1.479 -7.198 1.00 0.51 C ATOM 0 H PHE A 95 1.450 -1.924 -3.921 1.00 0.34 H new ATOM 0 HA PHE A 95 0.680 -4.471 -5.010 1.00 0.36 H new ATOM 0 HB2 PHE A 95 2.282 -2.105 -6.067 1.00 0.39 H new ATOM 0 HB3 PHE A 95 1.993 -3.531 -7.044 1.00 0.39 H new ATOM 0 HD1 PHE A 95 -0.531 -4.360 -7.141 1.00 0.47 H new ATOM 0 HD2 PHE A 95 0.671 -0.384 -6.051 1.00 0.43 H new ATOM 0 HE1 PHE A 95 -2.794 -3.521 -7.707 1.00 0.51 H new ATOM 0 HE2 PHE A 95 -1.591 0.455 -6.615 1.00 0.47 H new ATOM 0 HZ PHE A 95 -3.324 -1.113 -7.445 1.00 0.51 H new ATOM 1579 N LEU A 96 3.902 -4.003 -4.432 1.00 0.33 N ATOM 1580 CA LEU A 96 5.163 -4.774 -4.290 1.00 0.32 C ATOM 1581 C LEU A 96 5.028 -5.713 -3.095 1.00 0.31 C ATOM 1582 O LEU A 96 5.450 -6.852 -3.133 1.00 0.32 O ATOM 1583 CB LEU A 96 6.333 -3.811 -4.060 1.00 0.32 C ATOM 1584 CG LEU A 96 6.467 -2.848 -5.247 1.00 0.33 C ATOM 1585 CD1 LEU A 96 7.615 -1.874 -4.969 1.00 0.35 C ATOM 1586 CD2 LEU A 96 6.757 -3.635 -6.539 1.00 0.36 C ATOM 0 H LEU A 96 3.965 -3.010 -4.208 1.00 0.33 H new ATOM 0 HA LEU A 96 5.352 -5.350 -5.196 1.00 0.32 H new ATOM 0 HB2 LEU A 96 6.174 -3.247 -3.141 1.00 0.32 H new ATOM 0 HB3 LEU A 96 7.258 -4.374 -3.933 1.00 0.32 H new ATOM 0 HG LEU A 96 5.535 -2.298 -5.375 1.00 0.33 H new ATOM 0 HD11 LEU A 96 7.719 -1.185 -5.807 1.00 0.35 H new ATOM 0 HD12 LEU A 96 7.402 -1.311 -4.060 1.00 0.35 H new ATOM 0 HD13 LEU A 96 8.543 -2.432 -4.841 1.00 0.35 H new ATOM 0 HD21 LEU A 96 6.850 -2.941 -7.375 1.00 0.36 H new ATOM 0 HD22 LEU A 96 7.687 -4.192 -6.425 1.00 0.36 H new ATOM 0 HD23 LEU A 96 5.940 -4.329 -6.733 1.00 0.36 H new ATOM 1598 N GLU A 97 4.426 -5.244 -2.033 1.00 0.31 N ATOM 1599 CA GLU A 97 4.252 -6.113 -0.841 1.00 0.32 C ATOM 1600 C GLU A 97 3.420 -7.339 -1.230 1.00 0.34 C ATOM 1601 O GLU A 97 3.787 -8.462 -0.950 1.00 0.36 O ATOM 1602 CB GLU A 97 3.543 -5.331 0.269 1.00 0.34 C ATOM 1603 CG GLU A 97 3.398 -6.219 1.506 1.00 0.95 C ATOM 1604 CD GLU A 97 2.786 -5.407 2.647 1.00 1.22 C ATOM 1605 OE1 GLU A 97 2.845 -4.190 2.580 1.00 1.86 O ATOM 1606 OE2 GLU A 97 2.284 -6.014 3.579 1.00 1.69 O ATOM 0 H GLU A 97 4.050 -4.300 -1.944 1.00 0.31 H new ATOM 0 HA GLU A 97 5.227 -6.437 -0.477 1.00 0.32 H new ATOM 0 HB2 GLU A 97 4.111 -4.434 0.517 1.00 0.34 H new ATOM 0 HB3 GLU A 97 2.562 -5.002 -0.073 1.00 0.34 H new ATOM 0 HG2 GLU A 97 2.767 -7.078 1.278 1.00 0.95 H new ATOM 0 HG3 GLU A 97 4.372 -6.608 1.804 1.00 0.95 H new ATOM 1613 N GLU A 98 2.303 -7.136 -1.885 1.00 0.35 N ATOM 1614 CA GLU A 98 1.467 -8.303 -2.290 1.00 0.37 C ATOM 1615 C GLU A 98 2.276 -9.197 -3.231 1.00 0.36 C ATOM 1616 O GLU A 98 2.250 -10.407 -3.128 1.00 0.38 O ATOM 1617 CB GLU A 98 0.204 -7.808 -3.006 1.00 0.41 C ATOM 1618 CG GLU A 98 -0.716 -8.993 -3.334 1.00 1.18 C ATOM 1619 CD GLU A 98 -1.235 -9.612 -2.035 1.00 1.32 C ATOM 1620 OE1 GLU A 98 -1.141 -8.958 -1.010 1.00 1.77 O ATOM 1621 OE2 GLU A 98 -1.720 -10.729 -2.088 1.00 1.85 O ATOM 0 H GLU A 98 1.939 -6.222 -2.153 1.00 0.35 H new ATOM 0 HA GLU A 98 1.177 -8.871 -1.406 1.00 0.37 H new ATOM 0 HB2 GLU A 98 -0.323 -7.092 -2.376 1.00 0.41 H new ATOM 0 HB3 GLU A 98 0.477 -7.285 -3.923 1.00 0.41 H new ATOM 0 HG2 GLU A 98 -1.552 -8.659 -3.949 1.00 1.18 H new ATOM 0 HG3 GLU A 98 -0.172 -9.740 -3.913 1.00 1.18 H new ATOM 1628 N ASN A 99 2.990 -8.611 -4.152 1.00 0.35 N ATOM 1629 CA ASN A 99 3.794 -9.429 -5.100 1.00 0.36 C ATOM 1630 C ASN A 99 4.830 -10.237 -4.319 1.00 0.34 C ATOM 1631 O ASN A 99 5.013 -11.416 -4.547 1.00 0.35 O ATOM 1632 CB ASN A 99 4.507 -8.505 -6.091 1.00 0.37 C ATOM 1633 CG ASN A 99 3.480 -7.878 -7.035 1.00 1.26 C ATOM 1634 OD1 ASN A 99 3.699 -6.684 -7.518 1.00 2.16 O flip ATOM 1635 ND2 ASN A 99 2.462 -8.474 -7.325 1.00 1.83 N flip ATOM 0 H ASN A 99 3.051 -7.602 -4.288 1.00 0.35 H new ATOM 0 HA ASN A 99 3.138 -10.108 -5.645 1.00 0.36 H new ATOM 0 HB2 ASN A 99 5.046 -7.725 -5.554 1.00 0.37 H new ATOM 0 HB3 ASN A 99 5.246 -9.068 -6.662 1.00 0.37 H new ATOM 0 HD21 ASN A 99 2.292 -9.406 -6.948 1.00 1.83 H new ATOM 0 HD22 ASN A 99 1.778 -8.042 -7.946 1.00 1.83 H new ATOM 1642 N ILE A 100 5.510 -9.609 -3.395 1.00 0.32 N ATOM 1643 CA ILE A 100 6.530 -10.344 -2.598 1.00 0.30 C ATOM 1644 C ILE A 100 5.855 -11.494 -1.847 1.00 0.32 C ATOM 1645 O ILE A 100 6.314 -12.618 -1.880 1.00 0.33 O ATOM 1646 CB ILE A 100 7.205 -9.391 -1.601 1.00 0.29 C ATOM 1647 CG1 ILE A 100 8.089 -8.404 -2.375 1.00 0.29 C ATOM 1648 CG2 ILE A 100 8.074 -10.196 -0.619 1.00 0.29 C ATOM 1649 CD1 ILE A 100 8.569 -7.295 -1.434 1.00 0.30 C ATOM 0 H ILE A 100 5.402 -8.622 -3.160 1.00 0.32 H new ATOM 0 HA ILE A 100 7.290 -10.746 -3.268 1.00 0.30 H new ATOM 0 HB ILE A 100 6.444 -8.848 -1.041 1.00 0.29 H new ATOM 0 HG12 ILE A 100 8.944 -8.926 -2.804 1.00 0.29 H new ATOM 0 HG13 ILE A 100 7.529 -7.973 -3.205 1.00 0.29 H new ATOM 0 HG21 ILE A 100 8.551 -9.516 0.087 1.00 0.29 H new ATOM 0 HG22 ILE A 100 7.448 -10.903 -0.075 1.00 0.29 H new ATOM 0 HG23 ILE A 100 8.839 -10.740 -1.172 1.00 0.29 H new ATOM 0 HD11 ILE A 100 9.197 -6.596 -1.986 1.00 0.30 H new ATOM 0 HD12 ILE A 100 7.708 -6.766 -1.026 1.00 0.30 H new ATOM 0 HD13 ILE A 100 9.145 -7.733 -0.619 1.00 0.30 H new ATOM 1661 N THR A 101 4.771 -11.224 -1.168 1.00 0.33 N ATOM 1662 CA THR A 101 4.084 -12.312 -0.417 1.00 0.36 C ATOM 1663 C THR A 101 3.652 -13.407 -1.392 1.00 0.38 C ATOM 1664 O THR A 101 3.805 -14.582 -1.123 1.00 0.40 O ATOM 1665 CB THR A 101 2.849 -11.749 0.294 1.00 0.39 C ATOM 1666 OG1 THR A 101 2.023 -11.082 -0.650 1.00 0.40 O ATOM 1667 CG2 THR A 101 3.285 -10.766 1.380 1.00 0.39 C ATOM 0 H THR A 101 4.335 -10.304 -1.102 1.00 0.33 H new ATOM 0 HA THR A 101 4.768 -12.728 0.322 1.00 0.36 H new ATOM 0 HB THR A 101 2.290 -12.565 0.752 1.00 0.39 H new ATOM 0 HG1 THR A 101 2.520 -10.951 -1.484 1.00 0.40 H new ATOM 0 HG21 THR A 101 2.405 -10.367 1.884 1.00 0.39 H new ATOM 0 HG22 THR A 101 3.916 -11.281 2.105 1.00 0.39 H new ATOM 0 HG23 THR A 101 3.845 -9.948 0.927 1.00 0.39 H new ATOM 1675 N ALA A 102 3.121 -13.036 -2.525 1.00 0.39 N ATOM 1676 CA ALA A 102 2.696 -14.067 -3.512 1.00 0.42 C ATOM 1677 C ALA A 102 3.912 -14.902 -3.918 1.00 0.41 C ATOM 1678 O ALA A 102 3.879 -16.116 -3.904 1.00 0.43 O ATOM 1679 CB ALA A 102 2.096 -13.390 -4.747 1.00 0.44 C ATOM 0 H ALA A 102 2.964 -12.069 -2.808 1.00 0.39 H new ATOM 0 HA ALA A 102 1.941 -14.713 -3.063 1.00 0.42 H new ATOM 0 HB1 ALA A 102 1.787 -14.150 -5.465 1.00 0.44 H new ATOM 0 HB2 ALA A 102 1.231 -12.797 -4.452 1.00 0.44 H new ATOM 0 HB3 ALA A 102 2.842 -12.741 -5.205 1.00 0.44 H new ATOM 1685 N LEU A 103 4.987 -14.256 -4.281 1.00 0.38 N ATOM 1686 CA LEU A 103 6.205 -15.005 -4.688 1.00 0.37 C ATOM 1687 C LEU A 103 6.687 -15.873 -3.522 1.00 0.35 C ATOM 1688 O LEU A 103 7.056 -17.017 -3.702 1.00 0.37 O ATOM 1689 CB LEU A 103 7.299 -14.012 -5.072 1.00 0.35 C ATOM 1690 CG LEU A 103 6.941 -13.292 -6.385 1.00 0.36 C ATOM 1691 CD1 LEU A 103 7.953 -12.168 -6.637 1.00 0.38 C ATOM 1692 CD2 LEU A 103 6.956 -14.283 -7.567 1.00 0.44 C ATOM 0 H LEU A 103 5.072 -13.240 -4.313 1.00 0.38 H new ATOM 0 HA LEU A 103 5.974 -15.644 -5.540 1.00 0.37 H new ATOM 0 HB2 LEU A 103 7.430 -13.281 -4.274 1.00 0.35 H new ATOM 0 HB3 LEU A 103 8.249 -14.535 -5.185 1.00 0.35 H new ATOM 0 HG LEU A 103 5.938 -12.873 -6.299 1.00 0.36 H new ATOM 0 HD11 LEU A 103 7.703 -11.655 -7.566 1.00 0.38 H new ATOM 0 HD12 LEU A 103 7.921 -11.458 -5.811 1.00 0.38 H new ATOM 0 HD13 LEU A 103 8.955 -12.591 -6.714 1.00 0.38 H new ATOM 0 HD21 LEU A 103 6.701 -13.756 -8.487 1.00 0.44 H new ATOM 0 HD22 LEU A 103 7.950 -14.720 -7.663 1.00 0.44 H new ATOM 0 HD23 LEU A 103 6.228 -15.074 -7.388 1.00 0.44 H new ATOM 1704 N LEU A 104 6.693 -15.344 -2.326 1.00 0.33 N ATOM 1705 CA LEU A 104 7.154 -16.164 -1.169 1.00 0.33 C ATOM 1706 C LEU A 104 6.262 -17.394 -1.040 1.00 0.38 C ATOM 1707 O LEU A 104 6.734 -18.488 -0.797 1.00 0.39 O ATOM 1708 CB LEU A 104 7.089 -15.345 0.127 1.00 0.33 C ATOM 1709 CG LEU A 104 8.166 -14.245 0.126 1.00 0.29 C ATOM 1710 CD1 LEU A 104 7.923 -13.305 1.311 1.00 0.31 C ATOM 1711 CD2 LEU A 104 9.573 -14.867 0.246 1.00 0.27 C ATOM 0 H LEU A 104 6.402 -14.392 -2.103 1.00 0.33 H new ATOM 0 HA LEU A 104 8.187 -16.469 -1.338 1.00 0.33 H new ATOM 0 HB2 LEU A 104 6.102 -14.895 0.230 1.00 0.33 H new ATOM 0 HB3 LEU A 104 7.232 -16.001 0.986 1.00 0.33 H new ATOM 0 HG LEU A 104 8.107 -13.691 -0.811 1.00 0.29 H new ATOM 0 HD11 LEU A 104 8.682 -12.523 1.317 1.00 0.31 H new ATOM 0 HD12 LEU A 104 6.936 -12.852 1.219 1.00 0.31 H new ATOM 0 HD13 LEU A 104 7.978 -13.871 2.241 1.00 0.31 H new ATOM 0 HD21 LEU A 104 10.322 -14.075 0.244 1.00 0.27 H new ATOM 0 HD22 LEU A 104 9.644 -15.431 1.176 1.00 0.27 H new ATOM 0 HD23 LEU A 104 9.749 -15.535 -0.597 1.00 0.27 H new ATOM 1723 N GLU A 105 4.979 -17.239 -1.213 1.00 0.41 N ATOM 1724 CA GLU A 105 4.088 -18.420 -1.107 1.00 0.45 C ATOM 1725 C GLU A 105 4.508 -19.436 -2.166 1.00 0.46 C ATOM 1726 O GLU A 105 4.655 -20.609 -1.893 1.00 0.48 O ATOM 1727 CB GLU A 105 2.633 -18.003 -1.338 1.00 0.49 C ATOM 1728 CG GLU A 105 1.720 -19.222 -1.176 1.00 0.54 C ATOM 1729 CD GLU A 105 0.263 -18.807 -1.397 1.00 1.15 C ATOM 1730 OE1 GLU A 105 0.007 -17.616 -1.466 1.00 1.82 O ATOM 1731 OE2 GLU A 105 -0.575 -19.690 -1.488 1.00 1.84 O ATOM 0 H GLU A 105 4.516 -16.354 -1.421 1.00 0.41 H new ATOM 0 HA GLU A 105 4.169 -18.858 -0.112 1.00 0.45 H new ATOM 0 HB2 GLU A 105 2.349 -17.226 -0.628 1.00 0.49 H new ATOM 0 HB3 GLU A 105 2.519 -17.580 -2.336 1.00 0.49 H new ATOM 0 HG2 GLU A 105 2.000 -19.996 -1.890 1.00 0.54 H new ATOM 0 HG3 GLU A 105 1.840 -19.649 -0.180 1.00 0.54 H new ATOM 1738 N GLU A 106 4.708 -18.992 -3.375 1.00 0.46 N ATOM 1739 CA GLU A 106 5.125 -19.932 -4.448 1.00 0.48 C ATOM 1740 C GLU A 106 6.530 -20.441 -4.137 1.00 0.44 C ATOM 1741 O GLU A 106 6.833 -21.603 -4.316 1.00 0.46 O ATOM 1742 CB GLU A 106 5.125 -19.203 -5.792 1.00 0.49 C ATOM 1743 CG GLU A 106 3.682 -18.902 -6.203 1.00 1.17 C ATOM 1744 CD GLU A 106 3.674 -18.152 -7.536 1.00 1.67 C ATOM 1745 OE1 GLU A 106 4.736 -17.723 -7.958 1.00 2.27 O ATOM 1746 OE2 GLU A 106 2.606 -18.013 -8.108 1.00 2.26 O ATOM 0 H GLU A 106 4.601 -18.020 -3.665 1.00 0.46 H new ATOM 0 HA GLU A 106 4.432 -20.772 -4.499 1.00 0.48 H new ATOM 0 HB2 GLU A 106 5.695 -18.277 -5.717 1.00 0.49 H new ATOM 0 HB3 GLU A 106 5.611 -19.815 -6.551 1.00 0.49 H new ATOM 0 HG2 GLU A 106 3.118 -19.830 -6.293 1.00 1.17 H new ATOM 0 HG3 GLU A 106 3.192 -18.304 -5.435 1.00 1.17 H new ATOM 1753 N ALA A 107 7.388 -19.579 -3.660 1.00 0.40 N ATOM 1754 CA ALA A 107 8.768 -20.019 -3.323 1.00 0.38 C ATOM 1755 C ALA A 107 8.700 -21.109 -2.256 1.00 0.40 C ATOM 1756 O ALA A 107 9.324 -22.144 -2.374 1.00 0.41 O ATOM 1757 CB ALA A 107 9.577 -18.830 -2.803 1.00 0.34 C ATOM 0 H ALA A 107 7.191 -18.593 -3.490 1.00 0.40 H new ATOM 0 HA ALA A 107 9.255 -20.414 -4.215 1.00 0.38 H new ATOM 0 HB1 ALA A 107 10.587 -19.157 -2.557 1.00 0.34 H new ATOM 0 HB2 ALA A 107 9.622 -18.057 -3.570 1.00 0.34 H new ATOM 0 HB3 ALA A 107 9.099 -18.427 -1.910 1.00 0.34 H new ATOM 1763 N GLN A 108 7.941 -20.893 -1.211 1.00 0.42 N ATOM 1764 CA GLN A 108 7.836 -21.934 -0.150 1.00 0.46 C ATOM 1765 C GLN A 108 7.281 -23.218 -0.763 1.00 0.51 C ATOM 1766 O GLN A 108 7.806 -24.293 -0.563 1.00 0.53 O ATOM 1767 CB GLN A 108 6.895 -21.454 0.951 1.00 0.50 C ATOM 1768 CG GLN A 108 7.561 -20.318 1.723 1.00 0.48 C ATOM 1769 CD GLN A 108 6.621 -19.837 2.827 1.00 0.98 C ATOM 1770 OE1 GLN A 108 5.991 -20.635 3.493 1.00 1.69 O ATOM 1771 NE2 GLN A 108 6.482 -18.559 3.035 1.00 1.58 N ATOM 0 H GLN A 108 7.394 -20.047 -1.049 1.00 0.42 H new ATOM 0 HA GLN A 108 8.822 -22.121 0.275 1.00 0.46 H new ATOM 0 HB2 GLN A 108 5.954 -21.113 0.518 1.00 0.50 H new ATOM 0 HB3 GLN A 108 6.656 -22.276 1.625 1.00 0.50 H new ATOM 0 HG2 GLN A 108 8.502 -20.659 2.154 1.00 0.48 H new ATOM 0 HG3 GLN A 108 7.799 -19.495 1.049 1.00 0.48 H new ATOM 0 HE21 GLN A 108 7.011 -17.891 2.475 1.00 1.58 H new ATOM 0 HE22 GLN A 108 5.844 -18.226 3.758 1.00 1.58 H new ATOM 1780 N ILE A 109 6.224 -23.108 -1.520 1.00 0.53 N ATOM 1781 CA ILE A 109 5.638 -24.317 -2.152 1.00 0.58 C ATOM 1782 C ILE A 109 6.691 -24.951 -3.059 1.00 0.56 C ATOM 1783 O ILE A 109 6.943 -26.139 -3.001 1.00 0.58 O ATOM 1784 CB ILE A 109 4.412 -23.912 -2.975 1.00 0.61 C ATOM 1785 CG1 ILE A 109 3.310 -23.429 -2.030 1.00 0.64 C ATOM 1786 CG2 ILE A 109 3.905 -25.119 -3.771 1.00 0.67 C ATOM 1787 CD1 ILE A 109 2.185 -22.782 -2.840 1.00 0.67 C ATOM 0 H ILE A 109 5.743 -22.232 -1.726 1.00 0.53 H new ATOM 0 HA ILE A 109 5.332 -25.034 -1.390 1.00 0.58 H new ATOM 0 HB ILE A 109 4.684 -23.113 -3.665 1.00 0.61 H new ATOM 0 HG12 ILE A 109 2.920 -24.267 -1.452 1.00 0.64 H new ATOM 0 HG13 ILE A 109 3.717 -22.712 -1.317 1.00 0.64 H new ATOM 0 HG21 ILE A 109 3.032 -24.829 -4.356 1.00 0.67 H new ATOM 0 HG22 ILE A 109 4.691 -25.469 -4.441 1.00 0.67 H new ATOM 0 HG23 ILE A 109 3.631 -25.919 -3.083 1.00 0.67 H new ATOM 0 HD11 ILE A 109 1.401 -22.439 -2.165 1.00 0.67 H new ATOM 0 HD12 ILE A 109 2.580 -21.933 -3.398 1.00 0.67 H new ATOM 0 HD13 ILE A 109 1.771 -23.512 -3.535 1.00 0.67 H new ATOM 1799 N GLN A 110 7.317 -24.162 -3.896 1.00 0.53 N ATOM 1800 CA GLN A 110 8.364 -24.717 -4.800 1.00 0.52 C ATOM 1801 C GLN A 110 9.550 -25.207 -3.961 1.00 0.48 C ATOM 1802 O GLN A 110 10.131 -26.239 -4.235 1.00 0.50 O ATOM 1803 CB GLN A 110 8.836 -23.625 -5.765 1.00 0.51 C ATOM 1804 CG GLN A 110 9.887 -24.199 -6.720 1.00 1.18 C ATOM 1805 CD GLN A 110 10.290 -23.135 -7.740 1.00 1.47 C ATOM 1806 OE1 GLN A 110 9.644 -22.113 -7.855 1.00 2.12 O ATOM 1807 NE2 GLN A 110 11.343 -23.329 -8.487 1.00 1.93 N ATOM 0 H GLN A 110 7.147 -23.161 -3.991 1.00 0.53 H new ATOM 0 HA GLN A 110 7.952 -25.550 -5.370 1.00 0.52 H new ATOM 0 HB2 GLN A 110 7.990 -23.236 -6.331 1.00 0.51 H new ATOM 0 HB3 GLN A 110 9.257 -22.789 -5.206 1.00 0.51 H new ATOM 0 HG2 GLN A 110 10.761 -24.528 -6.159 1.00 1.18 H new ATOM 0 HG3 GLN A 110 9.488 -25.075 -7.232 1.00 1.18 H new ATOM 0 HE21 GLN A 110 11.886 -24.187 -8.390 1.00 1.93 H new ATOM 0 HE22 GLN A 110 11.623 -22.622 -9.167 1.00 1.93 H new ATOM 1816 N GLN A 111 9.915 -24.475 -2.940 1.00 0.45 N ATOM 1817 CA GLN A 111 11.062 -24.904 -2.089 1.00 0.43 C ATOM 1818 C GLN A 111 10.766 -26.271 -1.469 1.00 0.49 C ATOM 1819 O GLN A 111 11.583 -27.169 -1.503 1.00 0.49 O ATOM 1820 CB GLN A 111 11.291 -23.876 -0.975 1.00 0.42 C ATOM 1821 CG GLN A 111 12.599 -24.187 -0.240 1.00 0.42 C ATOM 1822 CD GLN A 111 13.784 -23.878 -1.158 1.00 0.37 C ATOM 1823 OE1 GLN A 111 13.779 -22.885 -1.860 1.00 0.37 O ATOM 1824 NE2 GLN A 111 14.806 -24.691 -1.181 1.00 0.40 N ATOM 0 H GLN A 111 9.469 -23.601 -2.660 1.00 0.45 H new ATOM 0 HA GLN A 111 11.957 -24.975 -2.707 1.00 0.43 H new ATOM 0 HB2 GLN A 111 11.331 -22.872 -1.397 1.00 0.42 H new ATOM 0 HB3 GLN A 111 10.456 -23.894 -0.274 1.00 0.42 H new ATOM 0 HG2 GLN A 111 12.667 -23.593 0.672 1.00 0.42 H new ATOM 0 HG3 GLN A 111 12.620 -25.235 0.060 1.00 0.42 H new ATOM 0 HE21 GLN A 111 14.809 -25.523 -0.592 1.00 0.40 H new ATOM 0 HE22 GLN A 111 15.601 -24.493 -1.788 1.00 0.40 H new ATOM 1833 N GLU A 112 9.605 -26.440 -0.896 1.00 0.53 N ATOM 1834 CA GLU A 112 9.277 -27.752 -0.271 1.00 0.60 C ATOM 1835 C GLU A 112 9.299 -28.858 -1.334 1.00 0.62 C ATOM 1836 O GLU A 112 9.769 -29.950 -1.087 1.00 0.64 O ATOM 1837 CB GLU A 112 7.885 -27.682 0.381 1.00 0.66 C ATOM 1838 CG GLU A 112 7.981 -26.991 1.748 1.00 1.29 C ATOM 1839 CD GLU A 112 8.563 -25.586 1.589 1.00 1.72 C ATOM 1840 OE1 GLU A 112 9.744 -25.483 1.300 1.00 2.27 O ATOM 1841 OE2 GLU A 112 7.820 -24.637 1.766 1.00 2.24 O ATOM 0 H GLU A 112 8.874 -25.731 -0.834 1.00 0.53 H new ATOM 0 HA GLU A 112 10.020 -27.980 0.493 1.00 0.60 H new ATOM 0 HB2 GLU A 112 7.199 -27.135 -0.265 1.00 0.66 H new ATOM 0 HB3 GLU A 112 7.479 -28.686 0.500 1.00 0.66 H new ATOM 0 HG2 GLU A 112 6.993 -26.934 2.205 1.00 1.29 H new ATOM 0 HG3 GLU A 112 8.609 -27.579 2.418 1.00 1.29 H new ATOM 1848 N LYS A 113 8.801 -28.592 -2.512 1.00 0.62 N ATOM 1849 CA LYS A 113 8.808 -29.649 -3.565 1.00 0.65 C ATOM 1850 C LYS A 113 10.250 -29.979 -3.953 1.00 0.60 C ATOM 1851 O LYS A 113 10.594 -31.123 -4.175 1.00 0.63 O ATOM 1852 CB LYS A 113 8.040 -29.174 -4.804 1.00 0.68 C ATOM 1853 CG LYS A 113 6.540 -29.101 -4.492 1.00 0.75 C ATOM 1854 CD LYS A 113 5.744 -28.925 -5.792 1.00 1.27 C ATOM 1855 CE LYS A 113 6.070 -27.576 -6.435 1.00 1.52 C ATOM 1856 NZ LYS A 113 5.058 -27.276 -7.486 1.00 2.10 N ATOM 0 H LYS A 113 8.394 -27.699 -2.789 1.00 0.62 H new ATOM 0 HA LYS A 113 8.322 -30.541 -3.169 1.00 0.65 H new ATOM 0 HB2 LYS A 113 8.404 -28.195 -5.115 1.00 0.68 H new ATOM 0 HB3 LYS A 113 8.215 -29.857 -5.635 1.00 0.68 H new ATOM 0 HG2 LYS A 113 6.221 -30.009 -3.980 1.00 0.75 H new ATOM 0 HG3 LYS A 113 6.340 -28.268 -3.817 1.00 0.75 H new ATOM 0 HD2 LYS A 113 5.982 -29.733 -6.484 1.00 1.27 H new ATOM 0 HD3 LYS A 113 4.676 -28.988 -5.584 1.00 1.27 H new ATOM 0 HE2 LYS A 113 6.071 -26.790 -5.679 1.00 1.52 H new ATOM 0 HE3 LYS A 113 7.069 -27.600 -6.871 1.00 1.52 H new ATOM 0 HZ1 LYS A 113 5.276 -26.359 -7.926 1.00 2.10 H new ATOM 0 HZ2 LYS A 113 5.079 -28.022 -8.211 1.00 2.10 H new ATOM 0 HZ3 LYS A 113 4.112 -27.237 -7.056 1.00 2.10 H new ATOM 1870 N ASN A 114 11.097 -28.991 -4.052 1.00 0.53 N ATOM 1871 CA ASN A 114 12.508 -29.271 -4.440 1.00 0.48 C ATOM 1872 C ASN A 114 13.146 -30.208 -3.412 1.00 0.49 C ATOM 1873 O ASN A 114 13.828 -31.149 -3.762 1.00 0.50 O ATOM 1874 CB ASN A 114 13.296 -27.960 -4.494 1.00 0.44 C ATOM 1875 CG ASN A 114 12.797 -27.112 -5.667 1.00 0.46 C ATOM 1876 OD1 ASN A 114 12.676 -25.909 -5.553 1.00 1.19 O ATOM 1877 ND2 ASN A 114 12.497 -27.692 -6.796 1.00 1.18 N ATOM 0 H ASN A 114 10.875 -28.010 -3.883 1.00 0.53 H new ATOM 0 HA ASN A 114 12.525 -29.744 -5.422 1.00 0.48 H new ATOM 0 HB2 ASN A 114 13.176 -27.413 -3.559 1.00 0.44 H new ATOM 0 HB3 ASN A 114 14.360 -28.167 -4.608 1.00 0.44 H new ATOM 0 HD21 ASN A 114 12.161 -27.135 -7.582 1.00 1.18 H new ATOM 0 HD22 ASN A 114 12.598 -28.702 -6.893 1.00 1.18 H new ATOM 1884 N MET A 115 12.917 -29.976 -2.146 1.00 0.50 N ATOM 1885 CA MET A 115 13.506 -30.880 -1.119 1.00 0.53 C ATOM 1886 C MET A 115 12.825 -32.245 -1.218 1.00 0.60 C ATOM 1887 O MET A 115 13.458 -33.280 -1.118 1.00 0.63 O ATOM 1888 CB MET A 115 13.287 -30.283 0.275 1.00 0.56 C ATOM 1889 CG MET A 115 13.954 -31.173 1.328 1.00 0.71 C ATOM 1890 SD MET A 115 13.713 -30.447 2.971 1.00 0.94 S ATOM 1891 CE MET A 115 14.459 -31.790 3.932 1.00 1.45 C ATOM 0 H MET A 115 12.353 -29.207 -1.783 1.00 0.50 H new ATOM 0 HA MET A 115 14.577 -30.993 -1.288 1.00 0.53 H new ATOM 0 HB2 MET A 115 13.703 -29.276 0.320 1.00 0.56 H new ATOM 0 HB3 MET A 115 12.220 -30.197 0.481 1.00 0.56 H new ATOM 0 HG2 MET A 115 13.528 -32.176 1.295 1.00 0.71 H new ATOM 0 HG3 MET A 115 15.018 -31.272 1.115 1.00 0.71 H new ATOM 0 HE1 MET A 115 14.416 -31.545 4.993 1.00 1.45 H new ATOM 0 HE2 MET A 115 13.912 -32.715 3.750 1.00 1.45 H new ATOM 0 HE3 MET A 115 15.499 -31.919 3.631 1.00 1.45 H new ATOM 1901 N TYR A 116 11.536 -32.254 -1.429 1.00 0.65 N ATOM 1902 CA TYR A 116 10.803 -33.546 -1.552 1.00 0.73 C ATOM 1903 C TYR A 116 11.370 -34.342 -2.733 1.00 0.71 C ATOM 1904 O TYR A 116 11.642 -35.521 -2.625 1.00 0.76 O ATOM 1905 CB TYR A 116 9.317 -33.271 -1.793 1.00 0.78 C ATOM 1906 CG TYR A 116 8.571 -34.580 -1.910 1.00 0.87 C ATOM 1907 CD1 TYR A 116 8.428 -35.200 -3.158 1.00 0.91 C ATOM 1908 CD2 TYR A 116 8.024 -35.179 -0.767 1.00 0.95 C ATOM 1909 CE1 TYR A 116 7.738 -36.414 -3.262 1.00 1.01 C ATOM 1910 CE2 TYR A 116 7.334 -36.392 -0.872 1.00 1.04 C ATOM 1911 CZ TYR A 116 7.191 -37.010 -2.120 1.00 1.07 C ATOM 1912 OH TYR A 116 6.510 -38.205 -2.223 1.00 1.18 O ATOM 0 H TYR A 116 10.958 -31.419 -1.522 1.00 0.65 H new ATOM 0 HA TYR A 116 10.922 -34.119 -0.633 1.00 0.73 H new ATOM 0 HB2 TYR A 116 8.909 -32.680 -0.973 1.00 0.78 H new ATOM 0 HB3 TYR A 116 9.188 -32.685 -2.703 1.00 0.78 H new ATOM 0 HD1 TYR A 116 8.850 -34.742 -4.040 1.00 0.91 H new ATOM 0 HD2 TYR A 116 8.135 -34.704 0.196 1.00 0.95 H new ATOM 0 HE1 TYR A 116 7.628 -36.891 -4.225 1.00 1.01 H new ATOM 0 HE2 TYR A 116 6.912 -36.851 0.010 1.00 1.04 H new ATOM 0 HH TYR A 116 6.196 -38.480 -1.336 1.00 1.18 H new ATOM 1922 N GLU A 117 11.544 -33.705 -3.866 1.00 0.67 N ATOM 1923 CA GLU A 117 12.087 -34.429 -5.052 1.00 0.68 C ATOM 1924 C GLU A 117 13.476 -34.983 -4.727 1.00 0.64 C ATOM 1925 O GLU A 117 13.813 -36.094 -5.086 1.00 0.68 O ATOM 1926 CB GLU A 117 12.184 -33.461 -6.232 1.00 0.65 C ATOM 1927 CG GLU A 117 10.776 -33.107 -6.720 1.00 0.72 C ATOM 1928 CD GLU A 117 10.875 -32.127 -7.889 1.00 0.73 C ATOM 1929 OE1 GLU A 117 11.968 -31.654 -8.147 1.00 1.29 O ATOM 1930 OE2 GLU A 117 9.855 -31.868 -8.508 1.00 1.28 O ATOM 0 H GLU A 117 11.334 -32.719 -4.018 1.00 0.67 H new ATOM 0 HA GLU A 117 11.424 -35.255 -5.310 1.00 0.68 H new ATOM 0 HB2 GLU A 117 12.714 -32.557 -5.932 1.00 0.65 H new ATOM 0 HB3 GLU A 117 12.758 -33.913 -7.041 1.00 0.65 H new ATOM 0 HG2 GLU A 117 10.250 -34.009 -7.031 1.00 0.72 H new ATOM 0 HG3 GLU A 117 10.198 -32.665 -5.908 1.00 0.72 H new ATOM 1937 N LEU A 118 14.279 -34.221 -4.036 1.00 0.58 N ATOM 1938 CA LEU A 118 15.639 -34.706 -3.668 1.00 0.55 C ATOM 1939 C LEU A 118 15.502 -35.971 -2.819 1.00 0.64 C ATOM 1940 O LEU A 118 16.233 -36.928 -2.988 1.00 0.66 O ATOM 1941 CB LEU A 118 16.366 -33.612 -2.875 1.00 0.51 C ATOM 1942 CG LEU A 118 17.767 -34.085 -2.467 1.00 0.51 C ATOM 1943 CD1 LEU A 118 18.609 -34.407 -3.711 1.00 0.53 C ATOM 1944 CD2 LEU A 118 18.444 -32.974 -1.659 1.00 0.53 C ATOM 0 H LEU A 118 14.051 -33.282 -3.710 1.00 0.58 H new ATOM 0 HA LEU A 118 16.214 -34.936 -4.565 1.00 0.55 H new ATOM 0 HB2 LEU A 118 16.443 -32.707 -3.478 1.00 0.51 H new ATOM 0 HB3 LEU A 118 15.790 -33.355 -1.986 1.00 0.51 H new ATOM 0 HG LEU A 118 17.683 -34.990 -1.865 1.00 0.51 H new ATOM 0 HD11 LEU A 118 19.600 -34.741 -3.403 1.00 0.53 H new ATOM 0 HD12 LEU A 118 18.123 -35.195 -4.286 1.00 0.53 H new ATOM 0 HD13 LEU A 118 18.703 -33.513 -4.328 1.00 0.53 H new ATOM 0 HD21 LEU A 118 19.442 -33.297 -1.362 1.00 0.53 H new ATOM 0 HD22 LEU A 118 18.520 -32.075 -2.270 1.00 0.53 H new ATOM 0 HD23 LEU A 118 17.852 -32.759 -0.769 1.00 0.53 H new ATOM 1956 N GLN A 119 14.562 -35.983 -1.912 1.00 0.70 N ATOM 1957 CA GLN A 119 14.361 -37.184 -1.056 1.00 0.81 C ATOM 1958 C GLN A 119 14.000 -38.387 -1.927 1.00 0.86 C ATOM 1959 O GLN A 119 14.453 -39.486 -1.699 1.00 0.92 O ATOM 1960 CB GLN A 119 13.236 -36.920 -0.054 1.00 0.88 C ATOM 1961 CG GLN A 119 13.706 -35.898 0.984 1.00 0.87 C ATOM 1962 CD GLN A 119 12.555 -35.566 1.934 1.00 0.95 C ATOM 1963 OE1 GLN A 119 11.404 -35.596 1.544 1.00 1.28 O ATOM 1964 NE2 GLN A 119 12.818 -35.253 3.174 1.00 1.46 N ATOM 0 H GLN A 119 13.923 -35.209 -1.728 1.00 0.70 H new ATOM 0 HA GLN A 119 15.284 -37.396 -0.516 1.00 0.81 H new ATOM 0 HB2 GLN A 119 12.353 -36.547 -0.573 1.00 0.88 H new ATOM 0 HB3 GLN A 119 12.948 -37.849 0.439 1.00 0.88 H new ATOM 0 HG2 GLN A 119 14.551 -36.297 1.545 1.00 0.87 H new ATOM 0 HG3 GLN A 119 14.053 -34.992 0.486 1.00 0.87 H new ATOM 0 HE21 GLN A 119 13.784 -35.228 3.500 1.00 1.46 H new ATOM 0 HE22 GLN A 119 12.057 -35.033 3.817 1.00 1.46 H new ATOM 1973 N LYS A 120 13.190 -38.190 -2.927 1.00 0.85 N ATOM 1974 CA LYS A 120 12.800 -39.332 -3.801 1.00 0.93 C ATOM 1975 C LYS A 120 14.056 -39.915 -4.442 1.00 0.90 C ATOM 1976 O LYS A 120 14.203 -41.116 -4.559 1.00 0.98 O ATOM 1977 CB LYS A 120 11.843 -38.842 -4.895 1.00 0.95 C ATOM 1978 CG LYS A 120 10.485 -38.452 -4.283 1.00 1.01 C ATOM 1979 CD LYS A 120 9.593 -39.702 -4.088 1.00 1.57 C ATOM 1980 CE LYS A 120 8.689 -39.901 -5.312 1.00 1.88 C ATOM 1981 NZ LYS A 120 9.528 -40.100 -6.528 1.00 2.44 N ATOM 0 H LYS A 120 12.781 -37.290 -3.178 1.00 0.85 H new ATOM 0 HA LYS A 120 12.299 -40.097 -3.207 1.00 0.93 H new ATOM 0 HB2 LYS A 120 12.277 -37.985 -5.410 1.00 0.95 H new ATOM 0 HB3 LYS A 120 11.702 -39.624 -5.641 1.00 0.95 H new ATOM 0 HG2 LYS A 120 10.641 -37.958 -3.324 1.00 1.01 H new ATOM 0 HG3 LYS A 120 9.980 -37.737 -4.932 1.00 1.01 H new ATOM 0 HD2 LYS A 120 10.216 -40.584 -3.940 1.00 1.57 H new ATOM 0 HD3 LYS A 120 8.984 -39.588 -3.191 1.00 1.57 H new ATOM 0 HE2 LYS A 120 8.040 -40.764 -5.161 1.00 1.88 H new ATOM 0 HE3 LYS A 120 8.041 -39.034 -5.443 1.00 1.88 H new ATOM 0 HZ1 LYS A 120 8.925 -40.401 -7.320 1.00 2.44 H new ATOM 0 HZ2 LYS A 120 10.001 -39.207 -6.773 1.00 2.44 H new ATOM 0 HZ3 LYS A 120 10.244 -40.831 -6.340 1.00 2.44 H new ATOM 1995 N LEU A 121 14.970 -39.083 -4.846 1.00 0.79 N ATOM 1996 CA LEU A 121 16.215 -39.606 -5.462 1.00 0.78 C ATOM 1997 C LEU A 121 16.909 -40.503 -4.439 1.00 0.86 C ATOM 1998 O LEU A 121 17.329 -41.601 -4.750 1.00 0.95 O ATOM 1999 CB LEU A 121 17.135 -38.441 -5.834 1.00 0.67 C ATOM 2000 CG LEU A 121 16.441 -37.522 -6.850 1.00 0.66 C ATOM 2001 CD1 LEU A 121 17.355 -36.333 -7.156 1.00 0.61 C ATOM 2002 CD2 LEU A 121 16.149 -38.293 -8.151 1.00 0.76 C ATOM 0 H LEU A 121 14.909 -38.067 -4.777 1.00 0.79 H new ATOM 0 HA LEU A 121 15.982 -40.171 -6.365 1.00 0.78 H new ATOM 0 HB2 LEU A 121 17.397 -37.875 -4.940 1.00 0.67 H new ATOM 0 HB3 LEU A 121 18.066 -38.823 -6.254 1.00 0.67 H new ATOM 0 HG LEU A 121 15.499 -37.169 -6.430 1.00 0.66 H new ATOM 0 HD11 LEU A 121 16.868 -35.676 -7.877 1.00 0.61 H new ATOM 0 HD12 LEU A 121 17.553 -35.780 -6.238 1.00 0.61 H new ATOM 0 HD13 LEU A 121 18.296 -36.695 -7.572 1.00 0.61 H new ATOM 0 HD21 LEU A 121 15.657 -37.631 -8.864 1.00 0.76 H new ATOM 0 HD22 LEU A 121 17.085 -38.654 -8.578 1.00 0.76 H new ATOM 0 HD23 LEU A 121 15.498 -39.140 -7.934 1.00 0.76 H new ATOM 2014 N ASN A 122 17.017 -40.047 -3.214 1.00 0.88 N ATOM 2015 CA ASN A 122 17.667 -40.866 -2.145 1.00 1.02 C ATOM 2016 C ASN A 122 16.721 -40.983 -0.946 1.00 1.08 C ATOM 2017 O ASN A 122 17.046 -40.576 0.150 1.00 1.15 O ATOM 2018 CB ASN A 122 18.956 -40.172 -1.700 1.00 1.10 C ATOM 2019 CG ASN A 122 19.683 -41.050 -0.678 1.00 1.31 C ATOM 2020 OD1 ASN A 122 20.358 -42.088 -1.088 1.00 1.78 O flip ATOM 2021 ND2 ASN A 122 19.636 -40.787 0.507 1.00 1.70 N flip ATOM 0 H ASN A 122 16.679 -39.135 -2.908 1.00 0.88 H new ATOM 0 HA ASN A 122 17.893 -41.860 -2.531 1.00 1.02 H new ATOM 0 HB2 ASN A 122 19.599 -39.989 -2.561 1.00 1.10 H new ATOM 0 HB3 ASN A 122 18.726 -39.201 -1.262 1.00 1.10 H new ATOM 0 HD21 ASN A 122 19.108 -39.975 0.829 1.00 1.70 H new ATOM 0 HD22 ASN A 122 20.124 -41.378 1.180 1.00 1.70 H new ATOM 2028 N SER A 123 15.553 -41.547 -1.140 1.00 1.09 N ATOM 2029 CA SER A 123 14.595 -41.698 -0.002 1.00 1.18 C ATOM 2030 C SER A 123 14.860 -43.033 0.697 1.00 1.37 C ATOM 2031 O SER A 123 14.161 -43.329 1.651 1.00 1.92 O ATOM 2032 CB SER A 123 13.157 -41.683 -0.533 1.00 1.16 C ATOM 2033 OG SER A 123 12.332 -42.462 0.325 1.00 1.83 O ATOM 2034 OXT SER A 123 15.761 -43.736 0.266 1.00 1.65 O ATOM 0 H SER A 123 15.223 -41.908 -2.035 1.00 1.09 H new ATOM 0 HA SER A 123 14.729 -40.875 0.701 1.00 1.18 H new ATOM 0 HB2 SER A 123 12.786 -40.659 -0.583 1.00 1.16 H new ATOM 0 HB3 SER A 123 13.127 -42.082 -1.547 1.00 1.16 H new ATOM 0 HG SER A 123 12.711 -42.466 1.229 1.00 1.83 H new TER 2040 SER A 123 ATOM 2041 N ALA B 1 29.102 -37.362 -16.923 1.00 0.82 N ATOM 2042 CA ALA B 1 27.865 -36.805 -17.534 1.00 0.80 C ATOM 2043 C ALA B 1 27.192 -35.857 -16.537 1.00 0.71 C ATOM 2044 O ALA B 1 26.092 -35.390 -16.753 1.00 0.71 O ATOM 2045 CB ALA B 1 26.911 -37.948 -17.882 1.00 0.91 C ATOM 0 H1 ALA B 1 29.526 -38.058 -17.570 1.00 0.82 H new ATOM 0 H2 ALA B 1 29.780 -36.593 -16.749 1.00 0.82 H new ATOM 0 H3 ALA B 1 28.866 -37.826 -16.022 1.00 0.82 H new ATOM 0 HA ALA B 1 28.118 -36.257 -18.442 1.00 0.80 H new ATOM 0 HB1 ALA B 1 26.004 -37.541 -18.330 1.00 0.91 H new ATOM 0 HB2 ALA B 1 27.394 -38.622 -18.589 1.00 0.91 H new ATOM 0 HB3 ALA B 1 26.654 -38.496 -16.976 1.00 0.91 H new ATOM 2053 N GLN B 2 27.849 -35.577 -15.446 1.00 0.67 N ATOM 2054 CA GLN B 2 27.258 -34.663 -14.426 1.00 0.60 C ATOM 2055 C GLN B 2 27.368 -33.212 -14.908 1.00 0.52 C ATOM 2056 O GLN B 2 28.313 -32.839 -15.575 1.00 0.52 O ATOM 2057 CB GLN B 2 28.010 -34.818 -13.102 1.00 0.62 C ATOM 2058 CG GLN B 2 27.745 -36.206 -12.510 1.00 0.72 C ATOM 2059 CD GLN B 2 28.556 -37.254 -13.277 1.00 1.27 C ATOM 2060 OE1 GLN B 2 29.690 -37.011 -13.638 1.00 2.00 O ATOM 2061 NE2 GLN B 2 28.021 -38.417 -13.539 1.00 1.88 N ATOM 0 H GLN B 2 28.773 -35.943 -15.215 1.00 0.67 H new ATOM 0 HA GLN B 2 26.208 -34.917 -14.280 1.00 0.60 H new ATOM 0 HB2 GLN B 2 29.079 -34.680 -13.263 1.00 0.62 H new ATOM 0 HB3 GLN B 2 27.691 -34.047 -12.400 1.00 0.62 H new ATOM 0 HG2 GLN B 2 28.018 -36.221 -11.455 1.00 0.72 H new ATOM 0 HG3 GLN B 2 26.682 -36.440 -12.568 1.00 0.72 H new ATOM 0 HE21 GLN B 2 27.069 -38.620 -13.235 1.00 1.88 H new ATOM 0 HE22 GLN B 2 28.556 -39.122 -14.047 1.00 1.88 H new ATOM 2070 N SER B 3 26.410 -32.389 -14.571 1.00 0.47 N ATOM 2071 CA SER B 3 26.455 -30.961 -15.000 1.00 0.41 C ATOM 2072 C SER B 3 27.233 -30.152 -13.964 1.00 0.37 C ATOM 2073 O SER B 3 26.712 -29.245 -13.341 1.00 0.34 O ATOM 2074 CB SER B 3 25.031 -30.416 -15.103 1.00 0.41 C ATOM 2075 OG SER B 3 24.548 -30.117 -13.800 1.00 1.37 O ATOM 0 H SER B 3 25.595 -32.646 -14.014 1.00 0.47 H new ATOM 0 HA SER B 3 26.944 -30.884 -15.971 1.00 0.41 H new ATOM 0 HB2 SER B 3 25.016 -29.520 -15.724 1.00 0.41 H new ATOM 0 HB3 SER B 3 24.383 -31.148 -15.585 1.00 0.41 H new ATOM 0 HG SER B 3 25.146 -29.471 -13.369 1.00 1.37 H new ATOM 2081 N ARG B 4 28.486 -30.471 -13.782 1.00 0.41 N ATOM 2082 CA ARG B 4 29.311 -29.720 -12.797 1.00 0.42 C ATOM 2083 C ARG B 4 29.401 -28.253 -13.225 1.00 0.42 C ATOM 2084 O ARG B 4 29.333 -27.356 -12.409 1.00 0.43 O ATOM 2085 CB ARG B 4 30.711 -30.339 -12.734 1.00 0.51 C ATOM 2086 CG ARG B 4 30.628 -31.717 -12.066 1.00 0.91 C ATOM 2087 CD ARG B 4 32.020 -32.357 -12.015 1.00 1.03 C ATOM 2088 NE ARG B 4 32.510 -32.566 -13.407 1.00 1.97 N ATOM 2089 CZ ARG B 4 33.761 -32.857 -13.633 1.00 2.55 C ATOM 2090 NH1 ARG B 4 34.594 -32.997 -12.637 1.00 2.53 N ATOM 2091 NH2 ARG B 4 34.177 -33.018 -14.860 1.00 3.56 N ATOM 0 H ARG B 4 28.973 -31.220 -14.274 1.00 0.41 H new ATOM 0 HA ARG B 4 28.852 -29.774 -11.810 1.00 0.42 H new ATOM 0 HB2 ARG B 4 31.125 -30.433 -13.738 1.00 0.51 H new ATOM 0 HB3 ARG B 4 31.383 -29.690 -12.172 1.00 0.51 H new ATOM 0 HG2 ARG B 4 30.226 -31.618 -11.057 1.00 0.91 H new ATOM 0 HG3 ARG B 4 29.943 -32.359 -12.620 1.00 0.91 H new ATOM 0 HD2 ARG B 4 32.709 -31.716 -11.466 1.00 1.03 H new ATOM 0 HD3 ARG B 4 31.978 -33.308 -11.484 1.00 1.03 H new ATOM 0 HE ARG B 4 31.861 -32.481 -14.190 1.00 1.97 H new ATOM 0 HH11 ARG B 4 34.267 -32.879 -11.678 1.00 2.53 H new ATOM 0 HH12 ARG B 4 35.572 -33.225 -12.818 1.00 2.53 H new ATOM 0 HH21 ARG B 4 33.524 -32.916 -15.637 1.00 3.56 H new ATOM 0 HH22 ARG B 4 35.155 -33.246 -15.041 1.00 3.56 H new ATOM 2105 N THR B 5 29.545 -27.997 -14.498 1.00 0.45 N ATOM 2106 CA THR B 5 29.627 -26.582 -14.960 1.00 0.49 C ATOM 2107 C THR B 5 28.335 -25.853 -14.585 1.00 0.44 C ATOM 2108 O THR B 5 28.361 -24.748 -14.082 1.00 0.46 O ATOM 2109 CB THR B 5 29.827 -26.544 -16.481 1.00 0.54 C ATOM 2110 OG1 THR B 5 30.142 -25.217 -16.882 1.00 0.68 O ATOM 2111 CG2 THR B 5 28.551 -27.006 -17.188 1.00 0.57 C ATOM 0 H THR B 5 29.609 -28.701 -15.233 1.00 0.45 H new ATOM 0 HA THR B 5 30.473 -26.089 -14.480 1.00 0.49 H new ATOM 0 HB THR B 5 30.644 -27.212 -16.753 1.00 0.54 H new ATOM 0 HG1 THR B 5 30.272 -25.191 -17.853 1.00 0.68 H new ATOM 0 HG21 THR B 5 28.702 -26.976 -18.267 1.00 0.57 H new ATOM 0 HG22 THR B 5 28.315 -28.025 -16.883 1.00 0.57 H new ATOM 0 HG23 THR B 5 27.726 -26.346 -16.918 1.00 0.57 H new ATOM 2119 N LEU B 6 27.201 -26.466 -14.812 1.00 0.39 N ATOM 2120 CA LEU B 6 25.917 -25.800 -14.448 1.00 0.36 C ATOM 2121 C LEU B 6 25.913 -25.527 -12.945 1.00 0.32 C ATOM 2122 O LEU B 6 25.525 -24.467 -12.492 1.00 0.33 O ATOM 2123 CB LEU B 6 24.742 -26.718 -14.811 1.00 0.35 C ATOM 2124 CG LEU B 6 23.409 -26.046 -14.441 1.00 0.35 C ATOM 2125 CD1 LEU B 6 23.239 -24.732 -15.221 1.00 0.41 C ATOM 2126 CD2 LEU B 6 22.262 -27.004 -14.778 1.00 0.37 C ATOM 0 H LEU B 6 27.110 -27.392 -15.230 1.00 0.39 H new ATOM 0 HA LEU B 6 25.817 -24.862 -14.993 1.00 0.36 H new ATOM 0 HB2 LEU B 6 24.761 -26.941 -15.878 1.00 0.35 H new ATOM 0 HB3 LEU B 6 24.837 -27.668 -14.285 1.00 0.35 H new ATOM 0 HG LEU B 6 23.401 -25.817 -13.375 1.00 0.35 H new ATOM 0 HD11 LEU B 6 22.291 -24.267 -14.949 1.00 0.41 H new ATOM 0 HD12 LEU B 6 24.058 -24.055 -14.977 1.00 0.41 H new ATOM 0 HD13 LEU B 6 23.247 -24.940 -16.291 1.00 0.41 H new ATOM 0 HD21 LEU B 6 21.311 -26.538 -14.520 1.00 0.37 H new ATOM 0 HD22 LEU B 6 22.278 -27.230 -15.844 1.00 0.37 H new ATOM 0 HD23 LEU B 6 22.380 -27.927 -14.210 1.00 0.37 H new ATOM 2138 N LEU B 7 26.347 -26.482 -12.173 1.00 0.29 N ATOM 2139 CA LEU B 7 26.384 -26.301 -10.696 1.00 0.27 C ATOM 2140 C LEU B 7 27.285 -25.120 -10.339 1.00 0.30 C ATOM 2141 O LEU B 7 26.977 -24.343 -9.457 1.00 0.29 O ATOM 2142 CB LEU B 7 26.888 -27.583 -10.031 1.00 0.27 C ATOM 2143 CG LEU B 7 25.799 -28.671 -10.114 1.00 0.24 C ATOM 2144 CD1 LEU B 7 26.432 -30.060 -9.922 1.00 0.28 C ATOM 2145 CD2 LEU B 7 24.721 -28.445 -9.030 1.00 0.23 C ATOM 0 H LEU B 7 26.680 -27.387 -12.504 1.00 0.29 H new ATOM 0 HA LEU B 7 25.378 -26.091 -10.332 1.00 0.27 H new ATOM 0 HB2 LEU B 7 27.798 -27.927 -10.523 1.00 0.27 H new ATOM 0 HB3 LEU B 7 27.143 -27.388 -8.989 1.00 0.27 H new ATOM 0 HG LEU B 7 25.330 -28.614 -11.096 1.00 0.24 H new ATOM 0 HD11 LEU B 7 25.657 -30.824 -9.982 1.00 0.28 H new ATOM 0 HD12 LEU B 7 27.173 -30.233 -10.702 1.00 0.28 H new ATOM 0 HD13 LEU B 7 26.915 -30.108 -8.946 1.00 0.28 H new ATOM 0 HD21 LEU B 7 23.961 -29.223 -9.105 1.00 0.23 H new ATOM 0 HD22 LEU B 7 25.183 -28.483 -8.044 1.00 0.23 H new ATOM 0 HD23 LEU B 7 24.257 -27.470 -9.176 1.00 0.23 H new ATOM 2157 N ALA B 8 28.395 -24.966 -11.010 1.00 0.35 N ATOM 2158 CA ALA B 8 29.283 -23.823 -10.679 1.00 0.39 C ATOM 2159 C ALA B 8 28.493 -22.534 -10.896 1.00 0.38 C ATOM 2160 O ALA B 8 28.573 -21.609 -10.115 1.00 0.38 O ATOM 2161 CB ALA B 8 30.504 -23.829 -11.599 1.00 0.45 C ATOM 0 H ALA B 8 28.719 -25.574 -11.762 1.00 0.35 H new ATOM 0 HA ALA B 8 29.621 -23.898 -9.646 1.00 0.39 H new ATOM 0 HB1 ALA B 8 31.151 -22.988 -11.350 1.00 0.45 H new ATOM 0 HB2 ALA B 8 31.054 -24.761 -11.468 1.00 0.45 H new ATOM 0 HB3 ALA B 8 30.179 -23.743 -12.636 1.00 0.45 H new ATOM 2167 N GLY B 9 27.710 -22.477 -11.936 1.00 0.38 N ATOM 2168 CA GLY B 9 26.895 -21.260 -12.185 1.00 0.39 C ATOM 2169 C GLY B 9 25.839 -21.138 -11.083 1.00 0.34 C ATOM 2170 O GLY B 9 25.650 -20.090 -10.502 1.00 0.34 O ATOM 0 H GLY B 9 27.600 -23.222 -12.624 1.00 0.38 H new ATOM 0 HA2 GLY B 9 27.532 -20.375 -12.197 1.00 0.39 H new ATOM 0 HA3 GLY B 9 26.415 -21.321 -13.162 1.00 0.39 H new ATOM 2174 N ILE B 10 25.156 -22.211 -10.784 1.00 0.30 N ATOM 2175 CA ILE B 10 24.120 -22.165 -9.712 1.00 0.27 C ATOM 2176 C ILE B 10 24.776 -21.764 -8.390 1.00 0.26 C ATOM 2177 O ILE B 10 24.295 -20.896 -7.690 1.00 0.25 O ATOM 2178 CB ILE B 10 23.469 -23.544 -9.570 1.00 0.25 C ATOM 2179 CG1 ILE B 10 22.650 -23.845 -10.827 1.00 0.28 C ATOM 2180 CG2 ILE B 10 22.543 -23.558 -8.352 1.00 0.26 C ATOM 2181 CD1 ILE B 10 22.264 -25.325 -10.845 1.00 0.26 C ATOM 0 H ILE B 10 25.271 -23.118 -11.236 1.00 0.30 H new ATOM 0 HA ILE B 10 23.356 -21.433 -9.973 1.00 0.27 H new ATOM 0 HB ILE B 10 24.246 -24.298 -9.442 1.00 0.25 H new ATOM 0 HG12 ILE B 10 21.754 -23.225 -10.847 1.00 0.28 H new ATOM 0 HG13 ILE B 10 23.228 -23.599 -11.718 1.00 0.28 H new ATOM 0 HG21 ILE B 10 22.083 -24.541 -8.256 1.00 0.26 H new ATOM 0 HG22 ILE B 10 23.120 -23.338 -7.454 1.00 0.26 H new ATOM 0 HG23 ILE B 10 21.766 -22.804 -8.477 1.00 0.26 H new ATOM 0 HD11 ILE B 10 21.681 -25.538 -11.741 1.00 0.26 H new ATOM 0 HD12 ILE B 10 23.166 -25.936 -10.846 1.00 0.26 H new ATOM 0 HD13 ILE B 10 21.669 -25.557 -9.961 1.00 0.26 H new ATOM 2193 N VAL B 11 25.872 -22.383 -8.039 1.00 0.26 N ATOM 2194 CA VAL B 11 26.536 -22.016 -6.754 1.00 0.27 C ATOM 2195 C VAL B 11 26.916 -20.533 -6.810 1.00 0.29 C ATOM 2196 O VAL B 11 26.613 -19.771 -5.913 1.00 0.28 O ATOM 2197 CB VAL B 11 27.799 -22.862 -6.556 1.00 0.30 C ATOM 2198 CG1 VAL B 11 28.592 -22.332 -5.355 1.00 0.35 C ATOM 2199 CG2 VAL B 11 27.404 -24.319 -6.301 1.00 0.29 C ATOM 0 H VAL B 11 26.331 -23.117 -8.578 1.00 0.26 H new ATOM 0 HA VAL B 11 25.857 -22.200 -5.922 1.00 0.27 H new ATOM 0 HB VAL B 11 28.416 -22.803 -7.453 1.00 0.30 H new ATOM 0 HG11 VAL B 11 29.489 -22.935 -5.217 1.00 0.35 H new ATOM 0 HG12 VAL B 11 28.876 -21.295 -5.535 1.00 0.35 H new ATOM 0 HG13 VAL B 11 27.975 -22.388 -4.458 1.00 0.35 H new ATOM 0 HG21 VAL B 11 28.302 -24.920 -6.160 1.00 0.29 H new ATOM 0 HG22 VAL B 11 26.785 -24.377 -5.406 1.00 0.29 H new ATOM 0 HG23 VAL B 11 26.843 -24.699 -7.155 1.00 0.29 H new ATOM 2209 N GLN B 12 27.561 -20.117 -7.868 1.00 0.32 N ATOM 2210 CA GLN B 12 27.942 -18.681 -7.999 1.00 0.34 C ATOM 2211 C GLN B 12 26.676 -17.824 -8.005 1.00 0.32 C ATOM 2212 O GLN B 12 26.629 -16.762 -7.416 1.00 0.32 O ATOM 2213 CB GLN B 12 28.723 -18.464 -9.296 1.00 0.39 C ATOM 2214 CG GLN B 12 30.102 -19.115 -9.177 1.00 1.18 C ATOM 2215 CD GLN B 12 30.883 -18.899 -10.475 1.00 1.63 C ATOM 2216 OE1 GLN B 12 30.258 -18.456 -11.534 1.00 1.99 O flip ATOM 2217 NE2 GLN B 12 32.076 -19.128 -10.524 1.00 2.40 N flip ATOM 0 H GLN B 12 27.841 -20.711 -8.648 1.00 0.32 H new ATOM 0 HA GLN B 12 28.573 -18.394 -7.158 1.00 0.34 H new ATOM 0 HB2 GLN B 12 28.178 -18.893 -10.137 1.00 0.39 H new ATOM 0 HB3 GLN B 12 28.829 -17.398 -9.495 1.00 0.39 H new ATOM 0 HG2 GLN B 12 30.647 -18.686 -8.337 1.00 1.18 H new ATOM 0 HG3 GLN B 12 29.996 -20.181 -8.977 1.00 1.18 H new ATOM 0 HE21 GLN B 12 32.563 -19.474 -9.697 1.00 2.40 H new ATOM 0 HE22 GLN B 12 32.590 -18.974 -11.392 1.00 2.40 H new ATOM 2226 N GLN B 13 25.649 -18.276 -8.673 1.00 0.30 N ATOM 2227 CA GLN B 13 24.389 -17.485 -8.716 1.00 0.28 C ATOM 2228 C GLN B 13 23.877 -17.306 -7.288 1.00 0.25 C ATOM 2229 O GLN B 13 23.439 -16.239 -6.908 1.00 0.25 O ATOM 2230 CB GLN B 13 23.349 -18.243 -9.550 1.00 0.28 C ATOM 2231 CG GLN B 13 22.060 -17.420 -9.678 1.00 0.30 C ATOM 2232 CD GLN B 13 22.320 -16.183 -10.537 1.00 0.38 C ATOM 2233 OE1 GLN B 13 23.326 -16.101 -11.217 1.00 0.84 O ATOM 2234 NE2 GLN B 13 21.443 -15.214 -10.550 1.00 0.64 N ATOM 0 H GLN B 13 25.629 -19.156 -9.189 1.00 0.30 H new ATOM 0 HA GLN B 13 24.568 -16.509 -9.167 1.00 0.28 H new ATOM 0 HB2 GLN B 13 23.752 -18.455 -10.540 1.00 0.28 H new ATOM 0 HB3 GLN B 13 23.130 -19.203 -9.083 1.00 0.28 H new ATOM 0 HG2 GLN B 13 21.273 -18.027 -10.126 1.00 0.30 H new ATOM 0 HG3 GLN B 13 21.709 -17.121 -8.690 1.00 0.30 H new ATOM 0 HE21 GLN B 13 20.600 -15.282 -9.980 1.00 0.64 H new ATOM 0 HE22 GLN B 13 21.602 -14.390 -11.130 1.00 0.64 H new ATOM 2243 N GLN B 14 23.948 -18.331 -6.483 1.00 0.22 N ATOM 2244 CA GLN B 14 23.481 -18.188 -5.079 1.00 0.20 C ATOM 2245 C GLN B 14 24.361 -17.164 -4.368 1.00 0.22 C ATOM 2246 O GLN B 14 23.884 -16.342 -3.611 1.00 0.21 O ATOM 2247 CB GLN B 14 23.588 -19.534 -4.362 1.00 0.20 C ATOM 2248 CG GLN B 14 22.542 -20.500 -4.920 1.00 0.18 C ATOM 2249 CD GLN B 14 22.659 -21.843 -4.198 1.00 0.20 C ATOM 2250 OE1 GLN B 14 23.621 -22.564 -4.382 1.00 0.29 O ATOM 2251 NE2 GLN B 14 21.716 -22.212 -3.375 1.00 0.24 N ATOM 0 H GLN B 14 24.306 -19.252 -6.735 1.00 0.22 H new ATOM 0 HA GLN B 14 22.442 -17.858 -5.069 1.00 0.20 H new ATOM 0 HB2 GLN B 14 24.587 -19.949 -4.494 1.00 0.20 H new ATOM 0 HB3 GLN B 14 23.438 -19.399 -3.291 1.00 0.20 H new ATOM 0 HG2 GLN B 14 21.542 -20.088 -4.786 1.00 0.18 H new ATOM 0 HG3 GLN B 14 22.690 -20.636 -5.991 1.00 0.18 H new ATOM 0 HE21 GLN B 14 20.909 -21.608 -3.220 1.00 0.24 H new ATOM 0 HE22 GLN B 14 21.786 -23.105 -2.886 1.00 0.24 H new ATOM 2260 N GLN B 15 25.646 -17.197 -4.610 1.00 0.26 N ATOM 2261 CA GLN B 15 26.541 -16.213 -3.948 1.00 0.29 C ATOM 2262 C GLN B 15 26.125 -14.800 -4.356 1.00 0.28 C ATOM 2263 O GLN B 15 26.030 -13.913 -3.532 1.00 0.29 O ATOM 2264 CB GLN B 15 27.995 -16.468 -4.355 1.00 0.34 C ATOM 2265 CG GLN B 15 28.909 -15.534 -3.558 1.00 0.38 C ATOM 2266 CD GLN B 15 30.369 -15.805 -3.922 1.00 0.44 C ATOM 2267 OE1 GLN B 15 30.674 -16.882 -4.591 1.00 0.82 O flip ATOM 2268 NE2 GLN B 15 31.245 -15.029 -3.589 1.00 0.81 N flip ATOM 0 H GLN B 15 26.108 -17.859 -5.233 1.00 0.26 H new ATOM 0 HA GLN B 15 26.458 -16.319 -2.866 1.00 0.29 H new ATOM 0 HB2 GLN B 15 28.262 -17.508 -4.165 1.00 0.34 H new ATOM 0 HB3 GLN B 15 28.122 -16.296 -5.424 1.00 0.34 H new ATOM 0 HG2 GLN B 15 28.658 -14.495 -3.772 1.00 0.38 H new ATOM 0 HG3 GLN B 15 28.757 -15.686 -2.489 1.00 0.38 H new ATOM 0 HE21 GLN B 15 31.008 -14.186 -3.066 1.00 0.81 H new ATOM 0 HE22 GLN B 15 32.216 -15.221 -3.833 1.00 0.81 H new ATOM 2277 N GLN B 16 25.865 -14.577 -5.621 1.00 0.28 N ATOM 2278 CA GLN B 16 25.446 -13.214 -6.051 1.00 0.29 C ATOM 2279 C GLN B 16 24.152 -12.839 -5.334 1.00 0.25 C ATOM 2280 O GLN B 16 23.978 -11.721 -4.892 1.00 0.26 O ATOM 2281 CB GLN B 16 25.226 -13.175 -7.567 1.00 0.31 C ATOM 2282 CG GLN B 16 26.573 -13.292 -8.284 1.00 0.36 C ATOM 2283 CD GLN B 16 26.350 -13.253 -9.797 1.00 0.39 C ATOM 2284 OE1 GLN B 16 25.147 -13.413 -10.272 1.00 0.93 O flip ATOM 2285 NE2 GLN B 16 27.283 -13.076 -10.556 1.00 0.87 N flip ATOM 0 H GLN B 16 25.925 -15.273 -6.364 1.00 0.28 H new ATOM 0 HA GLN B 16 26.231 -12.502 -5.796 1.00 0.29 H new ATOM 0 HB2 GLN B 16 24.569 -13.990 -7.870 1.00 0.31 H new ATOM 0 HB3 GLN B 16 24.732 -12.245 -7.849 1.00 0.31 H new ATOM 0 HG2 GLN B 16 27.230 -12.477 -7.981 1.00 0.36 H new ATOM 0 HG3 GLN B 16 27.068 -14.222 -8.002 1.00 0.36 H new ATOM 0 HE21 GLN B 16 28.225 -12.951 -10.186 1.00 0.87 H new ATOM 0 HE22 GLN B 16 27.124 -13.053 -11.563 1.00 0.87 H new ATOM 2294 N LEU B 17 23.246 -13.770 -5.203 1.00 0.22 N ATOM 2295 CA LEU B 17 21.974 -13.465 -4.500 1.00 0.19 C ATOM 2296 C LEU B 17 22.284 -13.148 -3.038 1.00 0.18 C ATOM 2297 O LEU B 17 21.738 -12.228 -2.462 1.00 0.18 O ATOM 2298 CB LEU B 17 21.038 -14.675 -4.584 1.00 0.16 C ATOM 2299 CG LEU B 17 20.540 -14.851 -6.027 1.00 0.18 C ATOM 2300 CD1 LEU B 17 19.795 -16.185 -6.142 1.00 0.18 C ATOM 2301 CD2 LEU B 17 19.600 -13.689 -6.421 1.00 0.20 C ATOM 0 H LEU B 17 23.334 -14.724 -5.552 1.00 0.22 H new ATOM 0 HA LEU B 17 21.486 -12.609 -4.966 1.00 0.19 H new ATOM 0 HB2 LEU B 17 21.561 -15.574 -4.258 1.00 0.16 H new ATOM 0 HB3 LEU B 17 20.191 -14.538 -3.912 1.00 0.16 H new ATOM 0 HG LEU B 17 21.395 -14.846 -6.703 1.00 0.18 H new ATOM 0 HD11 LEU B 17 19.439 -16.316 -7.164 1.00 0.18 H new ATOM 0 HD12 LEU B 17 20.470 -17.002 -5.885 1.00 0.18 H new ATOM 0 HD13 LEU B 17 18.946 -16.188 -5.459 1.00 0.18 H new ATOM 0 HD21 LEU B 17 19.257 -13.830 -7.446 1.00 0.20 H new ATOM 0 HD22 LEU B 17 18.741 -13.672 -5.750 1.00 0.20 H new ATOM 0 HD23 LEU B 17 20.138 -12.744 -6.345 1.00 0.20 H new ATOM 2313 N LEU B 18 23.174 -13.892 -2.438 1.00 0.19 N ATOM 2314 CA LEU B 18 23.535 -13.615 -1.021 1.00 0.20 C ATOM 2315 C LEU B 18 24.114 -12.204 -0.928 1.00 0.22 C ATOM 2316 O LEU B 18 23.819 -11.459 -0.014 1.00 0.22 O ATOM 2317 CB LEU B 18 24.578 -14.637 -0.542 1.00 0.22 C ATOM 2318 CG LEU B 18 24.969 -14.370 0.922 1.00 0.25 C ATOM 2319 CD1 LEU B 18 23.738 -14.487 1.837 1.00 0.26 C ATOM 2320 CD2 LEU B 18 26.030 -15.391 1.353 1.00 0.29 C ATOM 0 H LEU B 18 23.664 -14.677 -2.867 1.00 0.19 H new ATOM 0 HA LEU B 18 22.649 -13.694 -0.391 1.00 0.20 H new ATOM 0 HB2 LEU B 18 24.177 -15.646 -0.638 1.00 0.22 H new ATOM 0 HB3 LEU B 18 25.463 -14.584 -1.175 1.00 0.22 H new ATOM 0 HG LEU B 18 25.370 -13.360 1.006 1.00 0.25 H new ATOM 0 HD11 LEU B 18 24.032 -14.295 2.869 1.00 0.26 H new ATOM 0 HD12 LEU B 18 22.987 -13.758 1.532 1.00 0.26 H new ATOM 0 HD13 LEU B 18 23.321 -15.491 1.759 1.00 0.26 H new ATOM 0 HD21 LEU B 18 26.312 -15.207 2.390 1.00 0.29 H new ATOM 0 HD22 LEU B 18 25.624 -16.398 1.260 1.00 0.29 H new ATOM 0 HD23 LEU B 18 26.909 -15.294 0.716 1.00 0.29 H new ATOM 2332 N ASP B 19 24.938 -11.828 -1.869 1.00 0.25 N ATOM 2333 CA ASP B 19 25.537 -10.468 -1.822 1.00 0.28 C ATOM 2334 C ASP B 19 24.419 -9.425 -1.865 1.00 0.26 C ATOM 2335 O ASP B 19 24.375 -8.523 -1.054 1.00 0.27 O ATOM 2336 CB ASP B 19 26.472 -10.284 -3.021 1.00 0.32 C ATOM 2337 CG ASP B 19 27.110 -8.891 -2.977 1.00 0.35 C ATOM 2338 OD1 ASP B 19 26.550 -8.019 -2.331 1.00 1.13 O ATOM 2339 OD2 ASP B 19 28.147 -8.720 -3.594 1.00 1.12 O ATOM 0 H ASP B 19 25.220 -12.402 -2.664 1.00 0.25 H new ATOM 0 HA ASP B 19 26.108 -10.345 -0.902 1.00 0.28 H new ATOM 0 HB2 ASP B 19 27.248 -11.049 -3.009 1.00 0.32 H new ATOM 0 HB3 ASP B 19 25.915 -10.409 -3.950 1.00 0.32 H new ATOM 2344 N VAL B 20 23.505 -9.538 -2.791 1.00 0.25 N ATOM 2345 CA VAL B 20 22.403 -8.542 -2.853 1.00 0.24 C ATOM 2346 C VAL B 20 21.620 -8.576 -1.547 1.00 0.21 C ATOM 2347 O VAL B 20 21.301 -7.553 -0.974 1.00 0.23 O ATOM 2348 CB VAL B 20 21.454 -8.864 -4.010 1.00 0.24 C ATOM 2349 CG1 VAL B 20 20.294 -7.863 -3.990 1.00 0.24 C ATOM 2350 CG2 VAL B 20 22.205 -8.760 -5.340 1.00 0.30 C ATOM 0 H VAL B 20 23.475 -10.271 -3.500 1.00 0.25 H new ATOM 0 HA VAL B 20 22.833 -7.553 -3.010 1.00 0.24 H new ATOM 0 HB VAL B 20 21.069 -9.878 -3.901 1.00 0.24 H new ATOM 0 HG11 VAL B 20 19.610 -8.082 -4.810 1.00 0.24 H new ATOM 0 HG12 VAL B 20 19.761 -7.942 -3.042 1.00 0.24 H new ATOM 0 HG13 VAL B 20 20.684 -6.852 -4.103 1.00 0.24 H new ATOM 0 HG21 VAL B 20 21.525 -8.990 -6.161 1.00 0.30 H new ATOM 0 HG22 VAL B 20 22.591 -7.748 -5.462 1.00 0.30 H new ATOM 0 HG23 VAL B 20 23.034 -9.468 -5.346 1.00 0.30 H new ATOM 2360 N VAL B 21 21.310 -9.746 -1.066 1.00 0.18 N ATOM 2361 CA VAL B 21 20.552 -9.834 0.204 1.00 0.18 C ATOM 2362 C VAL B 21 21.381 -9.160 1.297 1.00 0.22 C ATOM 2363 O VAL B 21 20.873 -8.392 2.089 1.00 0.21 O ATOM 2364 CB VAL B 21 20.319 -11.309 0.546 1.00 0.18 C ATOM 2365 CG1 VAL B 21 19.698 -11.425 1.938 1.00 0.21 C ATOM 2366 CG2 VAL B 21 19.373 -11.932 -0.491 1.00 0.15 C ATOM 0 H VAL B 21 21.549 -10.639 -1.497 1.00 0.18 H new ATOM 0 HA VAL B 21 19.585 -9.338 0.117 1.00 0.18 H new ATOM 0 HB VAL B 21 21.273 -11.837 0.533 1.00 0.18 H new ATOM 0 HG11 VAL B 21 19.534 -12.476 2.177 1.00 0.21 H new ATOM 0 HG12 VAL B 21 20.371 -10.986 2.674 1.00 0.21 H new ATOM 0 HG13 VAL B 21 18.745 -10.896 1.957 1.00 0.21 H new ATOM 0 HG21 VAL B 21 19.207 -12.982 -0.248 1.00 0.15 H new ATOM 0 HG22 VAL B 21 18.421 -11.402 -0.480 1.00 0.15 H new ATOM 0 HG23 VAL B 21 19.819 -11.855 -1.483 1.00 0.15 H new ATOM 2376 N LYS B 22 22.660 -9.425 1.326 1.00 0.27 N ATOM 2377 CA LYS B 22 23.530 -8.776 2.346 1.00 0.32 C ATOM 2378 C LYS B 22 23.480 -7.260 2.135 1.00 0.32 C ATOM 2379 O LYS B 22 23.385 -6.494 3.072 1.00 0.33 O ATOM 2380 CB LYS B 22 24.968 -9.275 2.181 1.00 0.38 C ATOM 2381 CG LYS B 22 25.847 -8.698 3.292 1.00 0.45 C ATOM 2382 CD LYS B 22 27.279 -9.203 3.116 1.00 0.75 C ATOM 2383 CE LYS B 22 28.166 -8.632 4.225 1.00 1.12 C ATOM 2384 NZ LYS B 22 27.753 -9.199 5.540 1.00 1.91 N ATOM 0 H LYS B 22 23.138 -10.062 0.688 1.00 0.27 H new ATOM 0 HA LYS B 22 23.182 -9.022 3.349 1.00 0.32 H new ATOM 0 HB2 LYS B 22 24.991 -10.364 2.215 1.00 0.38 H new ATOM 0 HB3 LYS B 22 25.356 -8.978 1.207 1.00 0.38 H new ATOM 0 HG2 LYS B 22 25.827 -7.609 3.259 1.00 0.45 H new ATOM 0 HG3 LYS B 22 25.462 -8.995 4.268 1.00 0.45 H new ATOM 0 HD2 LYS B 22 27.297 -10.292 3.147 1.00 0.75 H new ATOM 0 HD3 LYS B 22 27.663 -8.905 2.140 1.00 0.75 H new ATOM 0 HE2 LYS B 22 29.211 -8.871 4.027 1.00 1.12 H new ATOM 0 HE3 LYS B 22 28.085 -7.545 4.245 1.00 1.12 H new ATOM 0 HZ1 LYS B 22 28.518 -9.064 6.232 1.00 1.91 H new ATOM 0 HZ2 LYS B 22 26.895 -8.714 5.873 1.00 1.91 H new ATOM 0 HZ3 LYS B 22 27.558 -10.215 5.434 1.00 1.91 H new ATOM 2398 N ARG B 23 23.534 -6.823 0.901 1.00 0.32 N ATOM 2399 CA ARG B 23 23.478 -5.359 0.618 1.00 0.34 C ATOM 2400 C ARG B 23 22.143 -4.812 1.125 1.00 0.28 C ATOM 2401 O ARG B 23 22.070 -3.736 1.685 1.00 0.29 O ATOM 2402 CB ARG B 23 23.556 -5.125 -0.894 1.00 0.38 C ATOM 2403 CG ARG B 23 24.949 -5.481 -1.435 1.00 0.59 C ATOM 2404 CD ARG B 23 25.946 -4.345 -1.172 1.00 0.93 C ATOM 2405 NE ARG B 23 27.204 -4.628 -1.920 1.00 0.81 N ATOM 2406 CZ ARG B 23 28.105 -3.695 -2.066 1.00 1.05 C ATOM 2407 NH1 ARG B 23 27.912 -2.513 -1.548 1.00 1.67 N ATOM 2408 NH2 ARG B 23 29.199 -3.945 -2.730 1.00 1.08 N ATOM 0 H ARG B 23 23.615 -7.419 0.078 1.00 0.32 H new ATOM 0 HA ARG B 23 24.311 -4.859 1.112 1.00 0.34 H new ATOM 0 HB2 ARG B 23 22.801 -5.728 -1.398 1.00 0.38 H new ATOM 0 HB3 ARG B 23 23.331 -4.082 -1.116 1.00 0.38 H new ATOM 0 HG2 ARG B 23 25.303 -6.397 -0.963 1.00 0.59 H new ATOM 0 HG3 ARG B 23 24.889 -5.676 -2.506 1.00 0.59 H new ATOM 0 HD2 ARG B 23 25.524 -3.391 -1.490 1.00 0.93 H new ATOM 0 HD3 ARG B 23 26.152 -4.263 -0.105 1.00 0.93 H new ATOM 0 HE ARG B 23 27.361 -5.554 -2.319 1.00 0.81 H new ATOM 0 HH11 ARG B 23 27.056 -2.317 -1.028 1.00 1.67 H new ATOM 0 HH12 ARG B 23 28.617 -1.785 -1.663 1.00 1.67 H new ATOM 0 HH21 ARG B 23 29.350 -4.869 -3.135 1.00 1.08 H new ATOM 0 HH22 ARG B 23 29.904 -3.217 -2.845 1.00 1.08 H new ATOM 2422 N GLN B 24 21.084 -5.553 0.933 1.00 0.24 N ATOM 2423 CA GLN B 24 19.751 -5.086 1.401 1.00 0.19 C ATOM 2424 C GLN B 24 19.790 -4.889 2.913 1.00 0.19 C ATOM 2425 O GLN B 24 19.239 -3.943 3.438 1.00 0.19 O ATOM 2426 CB GLN B 24 18.679 -6.118 1.035 1.00 0.16 C ATOM 2427 CG GLN B 24 18.438 -6.084 -0.476 1.00 0.17 C ATOM 2428 CD GLN B 24 17.464 -7.197 -0.868 1.00 0.16 C ATOM 2429 OE1 GLN B 24 17.409 -8.227 -0.225 1.00 0.19 O ATOM 2430 NE2 GLN B 24 16.691 -7.030 -1.907 1.00 0.18 N ATOM 0 H GLN B 24 21.087 -6.463 0.471 1.00 0.24 H new ATOM 0 HA GLN B 24 19.506 -4.140 0.918 1.00 0.19 H new ATOM 0 HB2 GLN B 24 18.998 -7.114 1.342 1.00 0.16 H new ATOM 0 HB3 GLN B 24 17.753 -5.902 1.567 1.00 0.16 H new ATOM 0 HG2 GLN B 24 18.034 -5.115 -0.768 1.00 0.17 H new ATOM 0 HG3 GLN B 24 19.381 -6.209 -1.007 1.00 0.17 H new ATOM 0 HE21 GLN B 24 16.739 -6.165 -2.445 1.00 0.18 H new ATOM 0 HE22 GLN B 24 16.039 -7.765 -2.181 1.00 0.18 H new ATOM 2439 N GLN B 25 20.440 -5.767 3.620 1.00 0.21 N ATOM 2440 CA GLN B 25 20.505 -5.613 5.097 1.00 0.23 C ATOM 2441 C GLN B 25 21.171 -4.279 5.427 1.00 0.25 C ATOM 2442 O GLN B 25 20.658 -3.497 6.199 1.00 0.25 O ATOM 2443 CB GLN B 25 21.326 -6.766 5.685 1.00 0.28 C ATOM 2444 CG GLN B 25 21.494 -6.588 7.198 1.00 0.32 C ATOM 2445 CD GLN B 25 20.123 -6.446 7.863 1.00 0.34 C ATOM 2446 OE1 GLN B 25 19.105 -7.094 7.374 1.00 1.06 O flip ATOM 2447 NE2 GLN B 25 19.979 -5.734 8.837 1.00 1.13 N flip ATOM 0 H GLN B 25 20.926 -6.580 3.242 1.00 0.21 H new ATOM 0 HA GLN B 25 19.502 -5.632 5.523 1.00 0.23 H new ATOM 0 HB2 GLN B 25 20.832 -7.715 5.477 1.00 0.28 H new ATOM 0 HB3 GLN B 25 22.305 -6.805 5.206 1.00 0.28 H new ATOM 0 HG2 GLN B 25 22.024 -7.444 7.617 1.00 0.32 H new ATOM 0 HG3 GLN B 25 22.100 -5.706 7.404 1.00 0.32 H new ATOM 0 HE21 GLN B 25 20.777 -5.226 9.220 1.00 1.13 H new ATOM 0 HE22 GLN B 25 19.061 -5.644 9.272 1.00 1.13 H new ATOM 2456 N GLU B 26 22.300 -3.996 4.837 1.00 0.27 N ATOM 2457 CA GLU B 26 22.972 -2.694 5.116 1.00 0.29 C ATOM 2458 C GLU B 26 22.056 -1.547 4.683 1.00 0.26 C ATOM 2459 O GLU B 26 21.893 -0.574 5.387 1.00 0.26 O ATOM 2460 CB GLU B 26 24.290 -2.621 4.345 1.00 0.33 C ATOM 2461 CG GLU B 26 25.292 -3.603 4.955 1.00 0.53 C ATOM 2462 CD GLU B 26 26.586 -3.576 4.140 1.00 1.19 C ATOM 2463 OE1 GLU B 26 26.615 -2.894 3.126 1.00 1.94 O ATOM 2464 OE2 GLU B 26 27.526 -4.242 4.540 1.00 1.85 O ATOM 0 H GLU B 26 22.784 -4.605 4.178 1.00 0.27 H new ATOM 0 HA GLU B 26 23.177 -2.611 6.183 1.00 0.29 H new ATOM 0 HB2 GLU B 26 24.123 -2.860 3.295 1.00 0.33 H new ATOM 0 HB3 GLU B 26 24.689 -1.607 4.381 1.00 0.33 H new ATOM 0 HG2 GLU B 26 25.496 -3.335 5.992 1.00 0.53 H new ATOM 0 HG3 GLU B 26 24.874 -4.610 4.962 1.00 0.53 H new ATOM 2471 N LEU B 27 21.442 -1.672 3.535 1.00 0.24 N ATOM 2472 CA LEU B 27 20.521 -0.605 3.050 1.00 0.22 C ATOM 2473 C LEU B 27 19.309 -0.529 3.978 1.00 0.19 C ATOM 2474 O LEU B 27 18.825 0.537 4.304 1.00 0.19 O ATOM 2475 CB LEU B 27 20.089 -0.926 1.615 1.00 0.21 C ATOM 2476 CG LEU B 27 18.987 0.033 1.151 1.00 0.21 C ATOM 2477 CD1 LEU B 27 19.429 1.487 1.342 1.00 0.25 C ATOM 2478 CD2 LEU B 27 18.709 -0.219 -0.336 1.00 0.23 C ATOM 0 H LEU B 27 21.541 -2.472 2.910 1.00 0.24 H new ATOM 0 HA LEU B 27 21.025 0.361 3.054 1.00 0.22 H new ATOM 0 HB2 LEU B 27 20.947 -0.852 0.947 1.00 0.21 H new ATOM 0 HB3 LEU B 27 19.730 -1.954 1.560 1.00 0.21 H new ATOM 0 HG LEU B 27 18.087 -0.140 1.741 1.00 0.21 H new ATOM 0 HD11 LEU B 27 18.635 2.155 1.008 1.00 0.25 H new ATOM 0 HD12 LEU B 27 19.636 1.669 2.397 1.00 0.25 H new ATOM 0 HD13 LEU B 27 20.330 1.673 0.758 1.00 0.25 H new ATOM 0 HD21 LEU B 27 17.926 0.457 -0.679 1.00 0.23 H new ATOM 0 HD22 LEU B 27 19.618 -0.043 -0.911 1.00 0.23 H new ATOM 0 HD23 LEU B 27 18.385 -1.250 -0.476 1.00 0.23 H new ATOM 2490 N LEU B 28 18.820 -1.655 4.413 1.00 0.18 N ATOM 2491 CA LEU B 28 17.649 -1.650 5.327 1.00 0.18 C ATOM 2492 C LEU B 28 18.014 -0.879 6.591 1.00 0.20 C ATOM 2493 O LEU B 28 17.228 -0.115 7.110 1.00 0.21 O ATOM 2494 CB LEU B 28 17.294 -3.098 5.691 1.00 0.19 C ATOM 2495 CG LEU B 28 16.536 -3.770 4.527 1.00 0.19 C ATOM 2496 CD1 LEU B 28 16.653 -5.302 4.637 1.00 0.21 C ATOM 2497 CD2 LEU B 28 15.048 -3.373 4.572 1.00 0.22 C ATOM 0 H LEU B 28 19.182 -2.578 4.174 1.00 0.18 H new ATOM 0 HA LEU B 28 16.795 -1.177 4.843 1.00 0.18 H new ATOM 0 HB2 LEU B 28 18.202 -3.658 5.914 1.00 0.19 H new ATOM 0 HB3 LEU B 28 16.680 -3.114 6.592 1.00 0.19 H new ATOM 0 HG LEU B 28 16.975 -3.438 3.586 1.00 0.19 H new ATOM 0 HD11 LEU B 28 16.115 -5.768 3.812 1.00 0.21 H new ATOM 0 HD12 LEU B 28 17.703 -5.591 4.595 1.00 0.21 H new ATOM 0 HD13 LEU B 28 16.224 -5.633 5.583 1.00 0.21 H new ATOM 0 HD21 LEU B 28 14.519 -3.851 3.748 1.00 0.22 H new ATOM 0 HD22 LEU B 28 14.614 -3.696 5.518 1.00 0.22 H new ATOM 0 HD23 LEU B 28 14.957 -2.290 4.482 1.00 0.22 H new ATOM 2509 N ARG B 29 19.206 -1.059 7.085 1.00 0.22 N ATOM 2510 CA ARG B 29 19.609 -0.316 8.305 1.00 0.24 C ATOM 2511 C ARG B 29 19.585 1.185 8.009 1.00 0.24 C ATOM 2512 O ARG B 29 19.160 1.980 8.826 1.00 0.25 O ATOM 2513 CB ARG B 29 21.022 -0.738 8.720 1.00 0.28 C ATOM 2514 CG ARG B 29 20.989 -2.174 9.247 1.00 0.29 C ATOM 2515 CD ARG B 29 22.397 -2.596 9.662 1.00 0.33 C ATOM 2516 NE ARG B 29 22.376 -4.007 10.134 1.00 0.38 N ATOM 2517 CZ ARG B 29 23.491 -4.674 10.230 1.00 0.88 C ATOM 2518 NH1 ARG B 29 24.620 -4.095 9.922 1.00 1.82 N ATOM 2519 NH2 ARG B 29 23.479 -5.917 10.629 1.00 0.86 N ATOM 0 H ARG B 29 19.913 -1.684 6.698 1.00 0.22 H new ATOM 0 HA ARG B 29 18.917 -0.539 9.117 1.00 0.24 H new ATOM 0 HB2 ARG B 29 21.699 -0.667 7.869 1.00 0.28 H new ATOM 0 HB3 ARG B 29 21.403 -0.066 9.488 1.00 0.28 H new ATOM 0 HG2 ARG B 29 20.311 -2.245 10.097 1.00 0.29 H new ATOM 0 HG3 ARG B 29 20.608 -2.846 8.478 1.00 0.29 H new ATOM 0 HD2 ARG B 29 23.081 -2.494 8.820 1.00 0.33 H new ATOM 0 HD3 ARG B 29 22.765 -1.943 10.453 1.00 0.33 H new ATOM 0 HE ARG B 29 21.492 -4.451 10.382 1.00 0.38 H new ATOM 0 HH11 ARG B 29 24.626 -3.125 9.608 1.00 1.82 H new ATOM 0 HH12 ARG B 29 25.496 -4.613 9.996 1.00 1.82 H new ATOM 0 HH21 ARG B 29 22.595 -6.368 10.866 1.00 0.86 H new ATOM 0 HH22 ARG B 29 24.353 -6.437 10.703 1.00 0.86 H new ATOM 2533 N LEU B 30 20.029 1.585 6.843 1.00 0.23 N ATOM 2534 CA LEU B 30 20.015 3.040 6.515 1.00 0.23 C ATOM 2535 C LEU B 30 18.573 3.545 6.538 1.00 0.21 C ATOM 2536 O LEU B 30 18.283 4.595 7.075 1.00 0.22 O ATOM 2537 CB LEU B 30 20.591 3.273 5.116 1.00 0.24 C ATOM 2538 CG LEU B 30 22.037 2.770 5.035 1.00 0.27 C ATOM 2539 CD1 LEU B 30 22.546 2.956 3.605 1.00 0.29 C ATOM 2540 CD2 LEU B 30 22.935 3.553 6.007 1.00 0.33 C ATOM 0 H LEU B 30 20.396 0.974 6.113 1.00 0.23 H new ATOM 0 HA LEU B 30 20.619 3.573 7.250 1.00 0.23 H new ATOM 0 HB2 LEU B 30 19.979 2.758 4.375 1.00 0.24 H new ATOM 0 HB3 LEU B 30 20.556 4.336 4.875 1.00 0.24 H new ATOM 0 HG LEU B 30 22.066 1.716 5.310 1.00 0.27 H new ATOM 0 HD11 LEU B 30 23.574 2.601 3.536 1.00 0.29 H new ATOM 0 HD12 LEU B 30 21.919 2.387 2.919 1.00 0.29 H new ATOM 0 HD13 LEU B 30 22.508 4.013 3.340 1.00 0.29 H new ATOM 0 HD21 LEU B 30 23.958 3.183 5.936 1.00 0.33 H new ATOM 0 HD22 LEU B 30 22.914 4.612 5.749 1.00 0.33 H new ATOM 0 HD23 LEU B 30 22.571 3.420 7.026 1.00 0.33 H new ATOM 2552 N THR B 31 17.661 2.809 5.964 1.00 0.19 N ATOM 2553 CA THR B 31 16.247 3.273 5.963 1.00 0.18 C ATOM 2554 C THR B 31 15.781 3.416 7.402 1.00 0.18 C ATOM 2555 O THR B 31 15.108 4.364 7.759 1.00 0.18 O ATOM 2556 CB THR B 31 15.367 2.246 5.241 1.00 0.17 C ATOM 2557 OG1 THR B 31 15.475 0.986 5.892 1.00 0.18 O ATOM 2558 CG2 THR B 31 15.819 2.117 3.786 1.00 0.19 C ATOM 0 H THR B 31 17.832 1.916 5.501 1.00 0.19 H new ATOM 0 HA THR B 31 16.172 4.231 5.448 1.00 0.18 H new ATOM 0 HB THR B 31 14.328 2.576 5.266 1.00 0.17 H new ATOM 0 HG1 THR B 31 16.392 0.862 6.215 1.00 0.18 H new ATOM 0 HG21 THR B 31 15.193 1.387 3.274 1.00 0.19 H new ATOM 0 HG22 THR B 31 15.729 3.083 3.290 1.00 0.19 H new ATOM 0 HG23 THR B 31 16.858 1.789 3.755 1.00 0.19 H new ATOM 2566 N VAL B 32 16.155 2.493 8.236 1.00 0.18 N ATOM 2567 CA VAL B 32 15.757 2.581 9.659 1.00 0.20 C ATOM 2568 C VAL B 32 16.429 3.814 10.268 1.00 0.20 C ATOM 2569 O VAL B 32 15.846 4.529 11.056 1.00 0.21 O ATOM 2570 CB VAL B 32 16.219 1.314 10.390 1.00 0.22 C ATOM 2571 CG1 VAL B 32 16.028 1.482 11.899 1.00 0.23 C ATOM 2572 CG2 VAL B 32 15.392 0.121 9.905 1.00 0.22 C ATOM 0 H VAL B 32 16.720 1.680 7.991 1.00 0.18 H new ATOM 0 HA VAL B 32 14.674 2.667 9.752 1.00 0.20 H new ATOM 0 HB VAL B 32 17.275 1.143 10.180 1.00 0.22 H new ATOM 0 HG11 VAL B 32 16.358 0.578 12.410 1.00 0.23 H new ATOM 0 HG12 VAL B 32 16.615 2.331 12.248 1.00 0.23 H new ATOM 0 HG13 VAL B 32 14.974 1.656 12.115 1.00 0.23 H new ATOM 0 HG21 VAL B 32 15.717 -0.782 10.422 1.00 0.22 H new ATOM 0 HG22 VAL B 32 14.338 0.300 10.115 1.00 0.22 H new ATOM 0 HG23 VAL B 32 15.531 -0.006 8.831 1.00 0.22 H new ATOM 2582 N TRP B 33 17.665 4.055 9.913 1.00 0.21 N ATOM 2583 CA TRP B 33 18.388 5.232 10.472 1.00 0.23 C ATOM 2584 C TRP B 33 17.667 6.537 10.114 1.00 0.22 C ATOM 2585 O TRP B 33 17.409 7.360 10.971 1.00 0.23 O ATOM 2586 CB TRP B 33 19.809 5.270 9.916 1.00 0.25 C ATOM 2587 CG TRP B 33 20.527 6.452 10.483 1.00 0.27 C ATOM 2588 CD1 TRP B 33 21.242 6.447 11.632 1.00 0.32 C ATOM 2589 CD2 TRP B 33 20.612 7.807 9.955 1.00 0.27 C ATOM 2590 NE1 TRP B 33 21.758 7.712 11.841 1.00 0.33 N ATOM 2591 CE2 TRP B 33 21.399 8.585 10.835 1.00 0.31 C ATOM 2592 CE3 TRP B 33 20.086 8.428 8.810 1.00 0.26 C ATOM 2593 CZ2 TRP B 33 21.657 9.932 10.587 1.00 0.32 C ATOM 2594 CZ3 TRP B 33 20.343 9.785 8.555 1.00 0.29 C ATOM 2595 CH2 TRP B 33 21.127 10.535 9.442 1.00 0.31 C ATOM 0 H TRP B 33 18.203 3.486 9.260 1.00 0.21 H new ATOM 0 HA TRP B 33 18.415 5.136 11.557 1.00 0.23 H new ATOM 0 HB2 TRP B 33 20.337 4.351 10.172 1.00 0.25 H new ATOM 0 HB3 TRP B 33 19.785 5.331 8.828 1.00 0.25 H new ATOM 0 HD1 TRP B 33 21.386 5.595 12.279 1.00 0.32 H new ATOM 0 HE1 TRP B 33 22.335 7.969 12.642 1.00 0.33 H new ATOM 0 HE3 TRP B 33 19.480 7.858 8.121 1.00 0.26 H new ATOM 0 HZ2 TRP B 33 22.262 10.506 11.274 1.00 0.32 H new ATOM 0 HZ3 TRP B 33 19.935 10.253 7.671 1.00 0.29 H new ATOM 0 HH2 TRP B 33 21.322 11.578 9.241 1.00 0.31 H new ATOM 2606 N GLY B 34 17.330 6.746 8.864 1.00 0.22 N ATOM 2607 CA GLY B 34 16.633 8.003 8.500 1.00 0.23 C ATOM 2608 C GLY B 34 15.297 8.056 9.233 1.00 0.22 C ATOM 2609 O GLY B 34 14.924 9.065 9.794 1.00 0.23 O ATOM 0 H GLY B 34 17.508 6.103 8.092 1.00 0.22 H new ATOM 0 HA2 GLY B 34 17.245 8.865 8.768 1.00 0.23 H new ATOM 0 HA3 GLY B 34 16.474 8.048 7.423 1.00 0.23 H new ATOM 2613 N THR B 35 14.575 6.974 9.233 1.00 0.22 N ATOM 2614 CA THR B 35 13.260 6.955 9.929 1.00 0.24 C ATOM 2615 C THR B 35 13.451 7.260 11.417 1.00 0.24 C ATOM 2616 O THR B 35 12.786 8.113 11.980 1.00 0.24 O ATOM 2617 CB THR B 35 12.634 5.566 9.761 1.00 0.27 C ATOM 2618 OG1 THR B 35 12.303 5.365 8.393 1.00 0.30 O ATOM 2619 CG2 THR B 35 11.377 5.450 10.621 1.00 0.30 C ATOM 0 H THR B 35 14.839 6.099 8.780 1.00 0.22 H new ATOM 0 HA THR B 35 12.605 7.713 9.498 1.00 0.24 H new ATOM 0 HB THR B 35 13.348 4.807 10.080 1.00 0.27 H new ATOM 0 HG1 THR B 35 13.090 5.036 7.911 1.00 0.30 H new ATOM 0 HG21 THR B 35 10.940 4.460 10.495 1.00 0.30 H new ATOM 0 HG22 THR B 35 11.638 5.601 11.669 1.00 0.30 H new ATOM 0 HG23 THR B 35 10.655 6.207 10.314 1.00 0.30 H new ATOM 2627 N LYS B 36 14.357 6.578 12.060 1.00 0.25 N ATOM 2628 CA LYS B 36 14.585 6.841 13.506 1.00 0.28 C ATOM 2629 C LYS B 36 15.142 8.257 13.666 1.00 0.28 C ATOM 2630 O LYS B 36 14.782 8.982 14.573 1.00 0.30 O ATOM 2631 CB LYS B 36 15.578 5.820 14.072 1.00 0.32 C ATOM 2632 CG LYS B 36 15.522 5.859 15.599 1.00 0.47 C ATOM 2633 CD LYS B 36 16.659 5.012 16.187 1.00 0.77 C ATOM 2634 CE LYS B 36 16.485 3.542 15.787 1.00 1.44 C ATOM 2635 NZ LYS B 36 17.083 3.319 14.441 1.00 2.01 N ATOM 0 H LYS B 36 14.946 5.854 11.649 1.00 0.25 H new ATOM 0 HA LYS B 36 13.646 6.751 14.051 1.00 0.28 H new ATOM 0 HB2 LYS B 36 15.335 4.820 13.713 1.00 0.32 H new ATOM 0 HB3 LYS B 36 16.587 6.046 13.727 1.00 0.32 H new ATOM 0 HG2 LYS B 36 15.606 6.888 15.948 1.00 0.47 H new ATOM 0 HG3 LYS B 36 14.560 5.482 15.946 1.00 0.47 H new ATOM 0 HD2 LYS B 36 17.620 5.382 15.830 1.00 0.77 H new ATOM 0 HD3 LYS B 36 16.666 5.103 17.273 1.00 0.77 H new ATOM 0 HE2 LYS B 36 16.965 2.895 16.521 1.00 1.44 H new ATOM 0 HE3 LYS B 36 15.427 3.280 15.774 1.00 1.44 H new ATOM 0 HZ1 LYS B 36 17.635 2.438 14.448 1.00 2.01 H new ATOM 0 HZ2 LYS B 36 16.325 3.248 13.732 1.00 2.01 H new ATOM 0 HZ3 LYS B 36 17.707 4.116 14.202 1.00 2.01 H new ATOM 2649 N ASN B 37 16.019 8.654 12.783 1.00 0.27 N ATOM 2650 CA ASN B 37 16.612 10.021 12.866 1.00 0.30 C ATOM 2651 C ASN B 37 15.491 11.066 12.762 1.00 0.29 C ATOM 2652 O ASN B 37 15.493 12.058 13.459 1.00 0.32 O ATOM 2653 CB ASN B 37 17.622 10.216 11.736 1.00 0.32 C ATOM 2654 CG ASN B 37 18.235 11.613 11.830 1.00 0.37 C ATOM 2655 OD1 ASN B 37 18.082 12.450 10.843 1.00 0.74 O flip ATOM 2656 ND2 ASN B 37 18.862 11.949 12.816 1.00 0.48 N flip ATOM 0 H ASN B 37 16.352 8.087 12.003 1.00 0.27 H new ATOM 0 HA ASN B 37 17.127 10.140 13.819 1.00 0.30 H new ATOM 0 HB2 ASN B 37 18.404 9.460 11.800 1.00 0.32 H new ATOM 0 HB3 ASN B 37 17.132 10.087 10.771 1.00 0.32 H new ATOM 0 HD21 ASN B 37 18.983 11.296 13.590 1.00 0.48 H new ATOM 0 HD22 ASN B 37 19.267 12.884 12.869 1.00 0.48 H new ATOM 2663 N LEU B 38 14.523 10.847 11.910 1.00 0.26 N ATOM 2664 CA LEU B 38 13.405 11.829 11.795 1.00 0.27 C ATOM 2665 C LEU B 38 12.722 11.938 13.151 1.00 0.26 C ATOM 2666 O LEU B 38 12.327 13.008 13.574 1.00 0.28 O ATOM 2667 CB LEU B 38 12.396 11.367 10.740 1.00 0.26 C ATOM 2668 CG LEU B 38 12.981 11.562 9.333 1.00 0.30 C ATOM 2669 CD1 LEU B 38 12.085 10.844 8.320 1.00 0.34 C ATOM 2670 CD2 LEU B 38 13.059 13.065 8.979 1.00 0.35 C ATOM 0 H LEU B 38 14.458 10.037 11.293 1.00 0.26 H new ATOM 0 HA LEU B 38 13.797 12.799 11.490 1.00 0.27 H new ATOM 0 HB2 LEU B 38 12.148 10.317 10.897 1.00 0.26 H new ATOM 0 HB3 LEU B 38 11.469 11.932 10.839 1.00 0.26 H new ATOM 0 HG LEU B 38 13.989 11.148 9.305 1.00 0.30 H new ATOM 0 HD11 LEU B 38 12.491 10.976 7.317 1.00 0.34 H new ATOM 0 HD12 LEU B 38 12.045 9.781 8.558 1.00 0.34 H new ATOM 0 HD13 LEU B 38 11.080 11.263 8.362 1.00 0.34 H new ATOM 0 HD21 LEU B 38 13.476 13.182 7.979 1.00 0.35 H new ATOM 0 HD22 LEU B 38 12.059 13.498 9.008 1.00 0.35 H new ATOM 0 HD23 LEU B 38 13.697 13.576 9.700 1.00 0.35 H new ATOM 2682 N GLN B 39 12.582 10.845 13.848 1.00 0.26 N ATOM 2683 CA GLN B 39 11.933 10.921 15.177 1.00 0.29 C ATOM 2684 C GLN B 39 12.760 11.860 16.049 1.00 0.33 C ATOM 2685 O GLN B 39 12.224 12.664 16.787 1.00 0.35 O ATOM 2686 CB GLN B 39 11.903 9.530 15.814 1.00 0.32 C ATOM 2687 CG GLN B 39 11.092 9.568 17.109 1.00 0.40 C ATOM 2688 CD GLN B 39 10.996 8.157 17.689 1.00 0.45 C ATOM 2689 OE1 GLN B 39 11.975 7.443 17.741 1.00 0.84 O ATOM 2690 NE2 GLN B 39 9.848 7.721 18.125 1.00 0.98 N ATOM 0 H GLN B 39 12.886 9.916 13.556 1.00 0.26 H new ATOM 0 HA GLN B 39 10.911 11.288 15.081 1.00 0.29 H new ATOM 0 HB2 GLN B 39 11.464 8.812 15.121 1.00 0.32 H new ATOM 0 HB3 GLN B 39 12.919 9.193 16.021 1.00 0.32 H new ATOM 0 HG2 GLN B 39 11.565 10.237 17.828 1.00 0.40 H new ATOM 0 HG3 GLN B 39 10.094 9.962 16.915 1.00 0.40 H new ATOM 0 HE21 GLN B 39 9.025 8.321 18.081 1.00 0.98 H new ATOM 0 HE22 GLN B 39 9.773 6.779 18.510 1.00 0.98 H new ATOM 2699 N THR B 40 14.065 11.792 15.963 1.00 0.36 N ATOM 2700 CA THR B 40 14.887 12.718 16.784 1.00 0.42 C ATOM 2701 C THR B 40 14.529 14.150 16.382 1.00 0.41 C ATOM 2702 O THR B 40 14.395 15.021 17.217 1.00 0.43 O ATOM 2703 CB THR B 40 16.384 12.470 16.549 1.00 0.47 C ATOM 2704 OG1 THR B 40 16.742 12.907 15.248 1.00 0.46 O ATOM 2705 CG2 THR B 40 16.691 10.975 16.697 1.00 0.49 C ATOM 0 H THR B 40 14.585 11.146 15.369 1.00 0.36 H new ATOM 0 HA THR B 40 14.682 12.553 17.842 1.00 0.42 H new ATOM 0 HB THR B 40 16.961 13.028 17.286 1.00 0.47 H new ATOM 0 HG1 THR B 40 16.409 12.267 14.585 1.00 0.46 H new ATOM 0 HG21 THR B 40 17.754 10.804 16.529 1.00 0.49 H new ATOM 0 HG22 THR B 40 16.424 10.647 17.702 1.00 0.49 H new ATOM 0 HG23 THR B 40 16.113 10.411 15.965 1.00 0.49 H new ATOM 2713 N ARG B 41 14.337 14.402 15.107 1.00 0.39 N ATOM 2714 CA ARG B 41 13.955 15.781 14.691 1.00 0.40 C ATOM 2715 C ARG B 41 12.627 16.135 15.353 1.00 0.36 C ATOM 2716 O ARG B 41 12.423 17.244 15.807 1.00 0.37 O ATOM 2717 CB ARG B 41 13.777 15.876 13.170 1.00 0.43 C ATOM 2718 CG ARG B 41 15.128 15.760 12.453 1.00 0.55 C ATOM 2719 CD ARG B 41 14.946 16.171 10.983 1.00 0.66 C ATOM 2720 NE ARG B 41 16.080 15.658 10.148 1.00 0.89 N ATOM 2721 CZ ARG B 41 17.320 15.938 10.425 1.00 1.05 C ATOM 2722 NH1 ARG B 41 17.616 16.773 11.384 1.00 1.23 N ATOM 2723 NH2 ARG B 41 18.272 15.420 9.697 1.00 1.32 N ATOM 0 H ARG B 41 14.427 13.722 14.352 1.00 0.39 H new ATOM 0 HA ARG B 41 14.747 16.466 14.993 1.00 0.40 H new ATOM 0 HB2 ARG B 41 13.110 15.085 12.828 1.00 0.43 H new ATOM 0 HB3 ARG B 41 13.305 16.824 12.914 1.00 0.43 H new ATOM 0 HG2 ARG B 41 15.867 16.400 12.935 1.00 0.55 H new ATOM 0 HG3 ARG B 41 15.502 14.738 12.516 1.00 0.55 H new ATOM 0 HD2 ARG B 41 14.002 15.779 10.604 1.00 0.66 H new ATOM 0 HD3 ARG B 41 14.894 17.257 10.907 1.00 0.66 H new ATOM 0 HE ARG B 41 15.874 15.072 9.339 1.00 0.89 H new ATOM 0 HH11 ARG B 41 16.872 17.213 11.925 1.00 1.23 H new ATOM 0 HH12 ARG B 41 18.592 16.985 11.592 1.00 1.23 H new ATOM 0 HH21 ARG B 41 18.040 14.802 8.919 1.00 1.32 H new ATOM 0 HH22 ARG B 41 19.247 15.633 9.906 1.00 1.32 H new ATOM 2737 N VAL B 42 11.716 15.200 15.416 1.00 0.33 N ATOM 2738 CA VAL B 42 10.408 15.497 16.051 1.00 0.35 C ATOM 2739 C VAL B 42 10.657 15.901 17.502 1.00 0.38 C ATOM 2740 O VAL B 42 10.100 16.862 17.988 1.00 0.40 O ATOM 2741 CB VAL B 42 9.502 14.259 15.992 1.00 0.37 C ATOM 2742 CG1 VAL B 42 8.257 14.482 16.856 1.00 0.43 C ATOM 2743 CG2 VAL B 42 9.073 14.008 14.542 1.00 0.38 C ATOM 0 H VAL B 42 11.824 14.251 15.057 1.00 0.33 H new ATOM 0 HA VAL B 42 9.911 16.309 15.521 1.00 0.35 H new ATOM 0 HB VAL B 42 10.052 13.396 16.368 1.00 0.37 H new ATOM 0 HG11 VAL B 42 7.619 13.600 16.809 1.00 0.43 H new ATOM 0 HG12 VAL B 42 8.558 14.658 17.889 1.00 0.43 H new ATOM 0 HG13 VAL B 42 7.707 15.347 16.486 1.00 0.43 H new ATOM 0 HG21 VAL B 42 8.430 13.129 14.500 1.00 0.38 H new ATOM 0 HG22 VAL B 42 8.528 14.875 14.169 1.00 0.38 H new ATOM 0 HG23 VAL B 42 9.956 13.841 13.925 1.00 0.38 H new ATOM 2753 N THR B 43 11.500 15.187 18.201 1.00 0.39 N ATOM 2754 CA THR B 43 11.771 15.564 19.616 1.00 0.45 C ATOM 2755 C THR B 43 12.352 16.982 19.665 1.00 0.44 C ATOM 2756 O THR B 43 12.010 17.774 20.519 1.00 0.47 O ATOM 2757 CB THR B 43 12.772 14.582 20.233 1.00 0.50 C ATOM 2758 OG1 THR B 43 13.987 14.619 19.502 1.00 0.50 O ATOM 2759 CG2 THR B 43 12.192 13.164 20.195 1.00 0.51 C ATOM 0 H THR B 43 12.006 14.370 17.858 1.00 0.39 H new ATOM 0 HA THR B 43 10.839 15.530 20.181 1.00 0.45 H new ATOM 0 HB THR B 43 12.964 14.865 21.268 1.00 0.50 H new ATOM 0 HG1 THR B 43 13.792 14.734 18.549 1.00 0.50 H new ATOM 0 HG21 THR B 43 12.906 12.467 20.634 1.00 0.51 H new ATOM 0 HG22 THR B 43 11.262 13.136 20.762 1.00 0.51 H new ATOM 0 HG23 THR B 43 11.996 12.879 19.161 1.00 0.51 H new ATOM 2767 N ALA B 44 13.223 17.312 18.747 1.00 0.42 N ATOM 2768 CA ALA B 44 13.813 18.682 18.742 1.00 0.43 C ATOM 2769 C ALA B 44 12.716 19.691 18.406 1.00 0.39 C ATOM 2770 O ALA B 44 12.600 20.735 19.016 1.00 0.39 O ATOM 2771 CB ALA B 44 14.919 18.753 17.691 1.00 0.45 C ATOM 0 H ALA B 44 13.550 16.694 18.004 1.00 0.42 H new ATOM 0 HA ALA B 44 14.234 18.911 19.721 1.00 0.43 H new ATOM 0 HB1 ALA B 44 15.352 19.753 17.685 1.00 0.45 H new ATOM 0 HB2 ALA B 44 15.694 18.024 17.928 1.00 0.45 H new ATOM 0 HB3 ALA B 44 14.502 18.533 16.708 1.00 0.45 H new ATOM 2777 N ILE B 45 11.896 19.363 17.450 1.00 0.35 N ATOM 2778 CA ILE B 45 10.775 20.260 17.065 1.00 0.32 C ATOM 2779 C ILE B 45 9.857 20.472 18.270 1.00 0.32 C ATOM 2780 O ILE B 45 9.359 21.556 18.502 1.00 0.31 O ATOM 2781 CB ILE B 45 10.004 19.652 15.889 1.00 0.31 C ATOM 2782 CG1 ILE B 45 10.883 19.717 14.633 1.00 0.32 C ATOM 2783 CG2 ILE B 45 8.710 20.436 15.649 1.00 0.30 C ATOM 2784 CD1 ILE B 45 10.299 18.825 13.532 1.00 0.33 C ATOM 0 H ILE B 45 11.956 18.499 16.912 1.00 0.35 H new ATOM 0 HA ILE B 45 11.167 21.228 16.752 1.00 0.32 H new ATOM 0 HB ILE B 45 9.752 18.616 16.115 1.00 0.31 H new ATOM 0 HG12 ILE B 45 10.950 20.746 14.280 1.00 0.32 H new ATOM 0 HG13 ILE B 45 11.897 19.395 14.872 1.00 0.32 H new ATOM 0 HG21 ILE B 45 8.168 19.997 14.811 1.00 0.30 H new ATOM 0 HG22 ILE B 45 8.089 20.396 16.544 1.00 0.30 H new ATOM 0 HG23 ILE B 45 8.951 21.474 15.421 1.00 0.30 H new ATOM 0 HD11 ILE B 45 10.931 18.880 12.646 1.00 0.33 H new ATOM 0 HD12 ILE B 45 10.255 17.794 13.884 1.00 0.33 H new ATOM 0 HD13 ILE B 45 9.294 19.166 13.282 1.00 0.33 H new ATOM 2796 N GLU B 46 9.619 19.438 19.030 1.00 0.34 N ATOM 2797 CA GLU B 46 8.726 19.568 20.212 1.00 0.36 C ATOM 2798 C GLU B 46 9.315 20.602 21.159 1.00 0.38 C ATOM 2799 O GLU B 46 8.612 21.421 21.718 1.00 0.38 O ATOM 2800 CB GLU B 46 8.656 18.212 20.923 1.00 0.43 C ATOM 2801 CG GLU B 46 7.843 17.221 20.081 1.00 1.20 C ATOM 2802 CD GLU B 46 6.346 17.485 20.265 1.00 1.67 C ATOM 2803 OE1 GLU B 46 5.791 16.984 21.228 1.00 2.17 O ATOM 2804 OE2 GLU B 46 5.778 18.174 19.433 1.00 2.26 O ATOM 0 H GLU B 46 10.007 18.506 18.881 1.00 0.34 H new ATOM 0 HA GLU B 46 7.728 19.878 19.903 1.00 0.36 H new ATOM 0 HB2 GLU B 46 9.662 17.825 21.085 1.00 0.43 H new ATOM 0 HB3 GLU B 46 8.197 18.330 21.905 1.00 0.43 H new ATOM 0 HG2 GLU B 46 8.112 17.318 19.029 1.00 1.20 H new ATOM 0 HG3 GLU B 46 8.080 16.199 20.377 1.00 1.20 H new ATOM 2811 N LYS B 47 10.602 20.588 21.329 1.00 0.41 N ATOM 2812 CA LYS B 47 11.234 21.588 22.221 1.00 0.43 C ATOM 2813 C LYS B 47 10.937 22.997 21.688 1.00 0.41 C ATOM 2814 O LYS B 47 10.494 23.869 22.411 1.00 0.42 O ATOM 2815 CB LYS B 47 12.745 21.341 22.243 1.00 0.48 C ATOM 2816 CG LYS B 47 13.419 22.359 23.155 1.00 1.21 C ATOM 2817 CD LYS B 47 14.921 22.087 23.198 1.00 1.54 C ATOM 2818 CE LYS B 47 15.633 23.281 23.827 1.00 2.31 C ATOM 2819 NZ LYS B 47 14.969 23.631 25.113 1.00 2.88 N ATOM 0 H LYS B 47 11.243 19.928 20.889 1.00 0.41 H new ATOM 0 HA LYS B 47 10.837 21.500 23.232 1.00 0.43 H new ATOM 0 HB2 LYS B 47 12.953 20.330 22.594 1.00 0.48 H new ATOM 0 HB3 LYS B 47 13.150 21.418 21.234 1.00 0.48 H new ATOM 0 HG2 LYS B 47 13.232 23.369 22.791 1.00 1.21 H new ATOM 0 HG3 LYS B 47 12.999 22.299 24.159 1.00 1.21 H new ATOM 0 HD2 LYS B 47 15.122 21.184 23.775 1.00 1.54 H new ATOM 0 HD3 LYS B 47 15.299 21.913 22.191 1.00 1.54 H new ATOM 0 HE2 LYS B 47 16.683 23.043 24.000 1.00 2.31 H new ATOM 0 HE3 LYS B 47 15.607 24.133 23.148 1.00 2.31 H new ATOM 0 HZ1 LYS B 47 15.632 24.163 25.712 1.00 2.88 H new ATOM 0 HZ2 LYS B 47 14.129 24.215 24.923 1.00 2.88 H new ATOM 0 HZ3 LYS B 47 14.681 22.760 25.603 1.00 2.88 H new ATOM 2833 N TYR B 48 11.173 23.224 20.423 1.00 0.38 N ATOM 2834 CA TYR B 48 10.901 24.570 19.843 1.00 0.36 C ATOM 2835 C TYR B 48 9.407 24.896 19.978 1.00 0.32 C ATOM 2836 O TYR B 48 9.035 26.008 20.289 1.00 0.33 O ATOM 2837 CB TYR B 48 11.325 24.593 18.368 1.00 0.37 C ATOM 2838 CG TYR B 48 12.827 24.777 18.278 1.00 0.40 C ATOM 2839 CD1 TYR B 48 13.392 26.051 18.447 1.00 0.45 C ATOM 2840 CD2 TYR B 48 13.654 23.674 18.037 1.00 0.41 C ATOM 2841 CE1 TYR B 48 14.779 26.220 18.371 1.00 0.51 C ATOM 2842 CE2 TYR B 48 15.042 23.842 17.962 1.00 0.46 C ATOM 2843 CZ TYR B 48 15.605 25.115 18.128 1.00 0.51 C ATOM 2844 OH TYR B 48 16.975 25.278 18.052 1.00 0.57 O ATOM 0 H TYR B 48 11.542 22.535 19.767 1.00 0.38 H new ATOM 0 HA TYR B 48 11.475 25.323 20.383 1.00 0.36 H new ATOM 0 HB2 TYR B 48 11.032 23.664 17.879 1.00 0.37 H new ATOM 0 HB3 TYR B 48 10.816 25.403 17.845 1.00 0.37 H new ATOM 0 HD1 TYR B 48 12.755 26.902 18.636 1.00 0.45 H new ATOM 0 HD2 TYR B 48 13.221 22.693 17.909 1.00 0.41 H new ATOM 0 HE1 TYR B 48 15.212 27.201 18.500 1.00 0.51 H new ATOM 0 HE2 TYR B 48 15.679 22.990 17.776 1.00 0.46 H new ATOM 0 HH TYR B 48 17.398 24.411 17.879 1.00 0.57 H new ATOM 2854 N LEU B 49 8.547 23.934 19.766 1.00 0.30 N ATOM 2855 CA LEU B 49 7.082 24.203 19.896 1.00 0.29 C ATOM 2856 C LEU B 49 6.786 24.668 21.325 1.00 0.32 C ATOM 2857 O LEU B 49 5.994 25.564 21.540 1.00 0.32 O ATOM 2858 CB LEU B 49 6.275 22.931 19.581 1.00 0.29 C ATOM 2859 CG LEU B 49 6.290 22.629 18.069 1.00 0.25 C ATOM 2860 CD1 LEU B 49 5.694 21.236 17.825 1.00 0.27 C ATOM 2861 CD2 LEU B 49 5.449 23.667 17.305 1.00 0.25 C ATOM 0 H LEU B 49 8.793 22.978 19.510 1.00 0.30 H new ATOM 0 HA LEU B 49 6.792 24.979 19.188 1.00 0.29 H new ATOM 0 HB2 LEU B 49 6.692 22.086 20.129 1.00 0.29 H new ATOM 0 HB3 LEU B 49 5.247 23.055 19.921 1.00 0.29 H new ATOM 0 HG LEU B 49 7.320 22.670 17.714 1.00 0.25 H new ATOM 0 HD11 LEU B 49 5.703 21.019 16.757 1.00 0.27 H new ATOM 0 HD12 LEU B 49 6.287 20.489 18.352 1.00 0.27 H new ATOM 0 HD13 LEU B 49 4.668 21.210 18.192 1.00 0.27 H new ATOM 0 HD21 LEU B 49 5.470 23.439 16.239 1.00 0.25 H new ATOM 0 HD22 LEU B 49 4.420 23.636 17.662 1.00 0.25 H new ATOM 0 HD23 LEU B 49 5.861 24.662 17.472 1.00 0.25 H new ATOM 2873 N LYS B 50 7.418 24.077 22.300 1.00 0.35 N ATOM 2874 CA LYS B 50 7.164 24.489 23.709 1.00 0.39 C ATOM 2875 C LYS B 50 7.517 25.971 23.856 1.00 0.39 C ATOM 2876 O LYS B 50 6.826 26.719 24.523 1.00 0.41 O ATOM 2877 CB LYS B 50 8.047 23.647 24.642 1.00 0.44 C ATOM 2878 CG LYS B 50 7.822 24.035 26.114 1.00 1.03 C ATOM 2879 CD LYS B 50 6.405 23.641 26.559 1.00 1.21 C ATOM 2880 CE LYS B 50 6.351 23.569 28.088 1.00 1.58 C ATOM 2881 NZ LYS B 50 4.943 23.343 28.520 1.00 2.18 N ATOM 0 H LYS B 50 8.099 23.327 22.183 1.00 0.35 H new ATOM 0 HA LYS B 50 6.117 24.335 23.969 1.00 0.39 H new ATOM 0 HB2 LYS B 50 7.824 22.589 24.503 1.00 0.44 H new ATOM 0 HB3 LYS B 50 9.096 23.788 24.381 1.00 0.44 H new ATOM 0 HG2 LYS B 50 8.560 23.539 26.745 1.00 1.03 H new ATOM 0 HG3 LYS B 50 7.965 25.108 26.240 1.00 1.03 H new ATOM 0 HD2 LYS B 50 5.682 24.370 26.193 1.00 1.21 H new ATOM 0 HD3 LYS B 50 6.132 22.677 26.129 1.00 1.21 H new ATOM 0 HE2 LYS B 50 6.988 22.762 28.448 1.00 1.58 H new ATOM 0 HE3 LYS B 50 6.733 24.494 28.521 1.00 1.58 H new ATOM 0 HZ1 LYS B 50 4.902 23.293 29.558 1.00 2.18 H new ATOM 0 HZ2 LYS B 50 4.347 24.128 28.187 1.00 2.18 H new ATOM 0 HZ3 LYS B 50 4.595 22.450 28.117 1.00 2.18 H new ATOM 2895 N ASP B 51 8.578 26.407 23.237 1.00 0.38 N ATOM 2896 CA ASP B 51 8.957 27.845 23.343 1.00 0.40 C ATOM 2897 C ASP B 51 7.804 28.695 22.800 1.00 0.38 C ATOM 2898 O ASP B 51 7.471 29.728 23.340 1.00 0.40 O ATOM 2899 CB ASP B 51 10.211 28.109 22.512 1.00 0.42 C ATOM 2900 CG ASP B 51 10.612 29.580 22.644 1.00 1.29 C ATOM 2901 OD1 ASP B 51 9.848 30.421 22.203 1.00 1.96 O ATOM 2902 OD2 ASP B 51 11.676 29.839 23.186 1.00 2.07 O ATOM 0 H ASP B 51 9.197 25.834 22.664 1.00 0.38 H new ATOM 0 HA ASP B 51 9.157 28.099 24.384 1.00 0.40 H new ATOM 0 HB2 ASP B 51 11.025 27.468 22.849 1.00 0.42 H new ATOM 0 HB3 ASP B 51 10.025 27.864 21.466 1.00 0.42 H new ATOM 2907 N GLN B 52 7.193 28.264 21.732 1.00 0.36 N ATOM 2908 CA GLN B 52 6.058 29.041 21.150 1.00 0.38 C ATOM 2909 C GLN B 52 4.932 29.171 22.186 1.00 0.38 C ATOM 2910 O GLN B 52 4.315 30.210 22.305 1.00 0.40 O ATOM 2911 CB GLN B 52 5.555 28.327 19.877 1.00 0.42 C ATOM 2912 CG GLN B 52 6.193 28.956 18.630 1.00 1.31 C ATOM 2913 CD GLN B 52 7.708 29.070 18.824 1.00 2.37 C ATOM 2914 OE1 GLN B 52 8.341 28.141 19.481 1.00 3.28 O flip ATOM 2915 NE2 GLN B 52 8.321 30.016 18.371 1.00 2.59 N flip ATOM 0 H GLN B 52 7.430 27.406 21.234 1.00 0.36 H new ATOM 0 HA GLN B 52 6.392 30.043 20.882 1.00 0.38 H new ATOM 0 HB2 GLN B 52 5.801 27.266 19.925 1.00 0.42 H new ATOM 0 HB3 GLN B 52 4.469 28.400 19.815 1.00 0.42 H new ATOM 0 HG2 GLN B 52 5.974 28.348 17.752 1.00 1.31 H new ATOM 0 HG3 GLN B 52 5.765 29.942 18.449 1.00 1.31 H new ATOM 0 HE21 GLN B 52 7.827 30.745 17.856 1.00 2.59 H new ATOM 0 HE22 GLN B 52 9.330 30.082 18.506 1.00 2.59 H new ATOM 2924 N ALA B 53 4.656 28.140 22.939 1.00 0.39 N ATOM 2925 CA ALA B 53 3.574 28.239 23.955 1.00 0.45 C ATOM 2926 C ALA B 53 3.923 29.374 24.916 1.00 0.47 C ATOM 2927 O ALA B 53 3.073 30.143 25.326 1.00 0.53 O ATOM 2928 CB ALA B 53 3.477 26.925 24.735 1.00 0.50 C ATOM 0 H ALA B 53 5.131 27.239 22.894 1.00 0.39 H new ATOM 0 HA ALA B 53 2.619 28.434 23.467 1.00 0.45 H new ATOM 0 HB1 ALA B 53 2.683 27.001 25.478 1.00 0.50 H new ATOM 0 HB2 ALA B 53 3.253 26.109 24.047 1.00 0.50 H new ATOM 0 HB3 ALA B 53 4.425 26.728 25.235 1.00 0.50 H new ATOM 2934 N GLN B 54 5.175 29.496 25.261 1.00 0.45 N ATOM 2935 CA GLN B 54 5.590 30.584 26.189 1.00 0.50 C ATOM 2936 C GLN B 54 5.241 31.937 25.559 1.00 0.55 C ATOM 2937 O GLN B 54 4.806 32.848 26.232 1.00 0.62 O ATOM 2938 CB GLN B 54 7.102 30.492 26.437 1.00 0.51 C ATOM 2939 CG GLN B 54 7.540 31.590 27.408 1.00 0.58 C ATOM 2940 CD GLN B 54 9.042 31.475 27.670 1.00 0.62 C ATOM 2941 OE1 GLN B 54 9.650 30.346 27.427 1.00 0.97 O flip ATOM 2942 NE2 GLN B 54 9.668 32.421 28.106 1.00 1.03 N flip ATOM 0 H GLN B 54 5.929 28.889 24.940 1.00 0.45 H new ATOM 0 HA GLN B 54 5.068 30.484 27.141 1.00 0.50 H new ATOM 0 HB2 GLN B 54 7.353 29.513 26.845 1.00 0.51 H new ATOM 0 HB3 GLN B 54 7.640 30.592 25.495 1.00 0.51 H new ATOM 0 HG2 GLN B 54 7.307 32.571 26.993 1.00 0.58 H new ATOM 0 HG3 GLN B 54 6.990 31.502 28.345 1.00 0.58 H new ATOM 0 HE21 GLN B 54 9.193 33.303 28.296 1.00 1.03 H new ATOM 0 HE22 GLN B 54 10.669 32.333 28.282 1.00 1.03 H new ATOM 2951 N LEU B 55 5.423 32.076 24.274 1.00 0.54 N ATOM 2952 CA LEU B 55 5.096 33.372 23.608 1.00 0.62 C ATOM 2953 C LEU B 55 3.576 33.534 23.523 1.00 0.66 C ATOM 2954 O LEU B 55 2.897 32.777 22.861 1.00 0.60 O ATOM 2955 CB LEU B 55 5.683 33.368 22.194 1.00 0.60 C ATOM 2956 CG LEU B 55 7.188 33.086 22.259 1.00 0.63 C ATOM 2957 CD1 LEU B 55 7.761 33.064 20.838 1.00 0.65 C ATOM 2958 CD2 LEU B 55 7.888 34.177 23.087 1.00 0.78 C ATOM 0 H LEU B 55 5.784 31.349 23.656 1.00 0.54 H new ATOM 0 HA LEU B 55 5.517 34.197 24.183 1.00 0.62 H new ATOM 0 HB2 LEU B 55 5.187 32.611 21.587 1.00 0.60 H new ATOM 0 HB3 LEU B 55 5.504 34.330 21.713 1.00 0.60 H new ATOM 0 HG LEU B 55 7.356 32.119 22.734 1.00 0.63 H new ATOM 0 HD11 LEU B 55 8.832 32.864 20.880 1.00 0.65 H new ATOM 0 HD12 LEU B 55 7.268 32.283 20.259 1.00 0.65 H new ATOM 0 HD13 LEU B 55 7.591 34.030 20.362 1.00 0.65 H new ATOM 0 HD21 LEU B 55 8.958 33.971 23.130 1.00 0.78 H new ATOM 0 HD22 LEU B 55 7.724 35.149 22.621 1.00 0.78 H new ATOM 0 HD23 LEU B 55 7.479 34.185 24.098 1.00 0.78 H new ATOM 2970 N ASN B 56 3.040 34.523 24.192 1.00 0.78 N ATOM 2971 CA ASN B 56 1.561 34.756 24.165 1.00 0.86 C ATOM 2972 C ASN B 56 1.276 36.243 23.946 1.00 0.97 C ATOM 2973 O ASN B 56 0.737 36.643 22.935 1.00 0.92 O ATOM 2974 CB ASN B 56 0.966 34.313 25.500 1.00 0.92 C ATOM 2975 CG ASN B 56 1.175 32.806 25.663 1.00 0.85 C ATOM 2976 OD1 ASN B 56 2.055 32.371 26.523 1.00 1.37 O flip ATOM 2977 ND2 ASN B 56 0.543 32.016 24.990 1.00 1.36 N flip ATOM 0 H ASN B 56 3.567 35.185 24.761 1.00 0.78 H new ATOM 0 HA ASN B 56 1.114 34.184 23.352 1.00 0.86 H new ATOM 0 HB2 ASN B 56 1.441 34.850 26.321 1.00 0.92 H new ATOM 0 HB3 ASN B 56 -0.097 34.552 25.536 1.00 0.92 H new ATOM 0 HD21 ASN B 56 -0.145 32.355 24.318 1.00 1.36 H new ATOM 0 HD22 ASN B 56 0.700 31.014 25.098 1.00 1.36 H new ATOM 2984 N ALA B 57 1.637 37.065 24.893 1.00 1.13 N ATOM 2985 CA ALA B 57 1.393 38.531 24.758 1.00 1.24 C ATOM 2986 C ALA B 57 2.450 39.285 25.572 1.00 1.36 C ATOM 2987 O ALA B 57 2.452 39.260 26.787 1.00 1.50 O ATOM 2988 CB ALA B 57 -0.008 38.867 25.277 1.00 1.33 C ATOM 0 H ALA B 57 2.094 36.783 25.760 1.00 1.13 H new ATOM 0 HA ALA B 57 1.460 38.826 23.711 1.00 1.24 H new ATOM 0 HB1 ALA B 57 -0.185 39.938 25.178 1.00 1.33 H new ATOM 0 HB2 ALA B 57 -0.752 38.321 24.697 1.00 1.33 H new ATOM 0 HB3 ALA B 57 -0.085 38.582 26.326 1.00 1.33 H new ATOM 2994 N TRP B 58 3.358 39.940 24.899 1.00 1.35 N ATOM 2995 CA TRP B 58 4.447 40.694 25.597 1.00 1.48 C ATOM 2996 C TRP B 58 4.198 42.200 25.511 1.00 1.33 C ATOM 2997 O TRP B 58 3.917 42.731 24.455 1.00 1.26 O ATOM 2998 CB TRP B 58 5.781 40.374 24.922 1.00 1.68 C ATOM 2999 CG TRP B 58 6.183 38.975 25.252 1.00 1.88 C ATOM 3000 CD1 TRP B 58 5.923 37.897 24.482 1.00 1.95 C ATOM 3001 CD2 TRP B 58 6.904 38.484 26.418 1.00 2.05 C ATOM 3002 NE1 TRP B 58 6.438 36.771 25.102 1.00 2.17 N ATOM 3003 CE2 TRP B 58 7.054 37.082 26.297 1.00 2.24 C ATOM 3004 CE3 TRP B 58 7.439 39.113 27.557 1.00 2.09 C ATOM 3005 CZ2 TRP B 58 7.710 36.329 27.272 1.00 2.44 C ATOM 3006 CZ3 TRP B 58 8.101 38.359 28.539 1.00 2.29 C ATOM 3007 CH2 TRP B 58 8.236 36.970 28.396 1.00 2.47 C ATOM 0 H TRP B 58 3.394 39.987 23.881 1.00 1.35 H new ATOM 0 HA TRP B 58 4.466 40.398 26.646 1.00 1.48 H new ATOM 0 HB2 TRP B 58 5.692 40.493 23.842 1.00 1.68 H new ATOM 0 HB3 TRP B 58 6.547 41.073 25.258 1.00 1.68 H new ATOM 0 HD1 TRP B 58 5.399 37.911 23.538 1.00 1.95 H new ATOM 0 HE1 TRP B 58 6.370 35.827 24.722 1.00 2.17 H new ATOM 0 HE3 TRP B 58 7.340 40.182 27.677 1.00 2.09 H new ATOM 0 HZ2 TRP B 58 7.810 35.260 27.158 1.00 2.44 H new ATOM 0 HZ3 TRP B 58 8.509 38.851 29.410 1.00 2.29 H new ATOM 0 HH2 TRP B 58 8.747 36.396 29.155 1.00 2.47 H new ATOM 3018 N GLY B 59 4.320 42.894 26.608 1.00 1.34 N ATOM 3019 CA GLY B 59 4.114 44.370 26.585 1.00 1.27 C ATOM 3020 C GLY B 59 2.639 44.677 26.355 1.00 1.16 C ATOM 3021 O GLY B 59 2.275 45.779 25.998 1.00 1.13 O ATOM 0 H GLY B 59 4.554 42.503 27.521 1.00 1.34 H new ATOM 0 HA2 GLY B 59 4.444 44.808 27.527 1.00 1.27 H new ATOM 0 HA3 GLY B 59 4.717 44.819 25.796 1.00 1.27 H new ATOM 3025 N ALA B 60 1.785 43.716 26.553 1.00 1.14 N ATOM 3026 CA ALA B 60 0.338 43.960 26.333 1.00 1.11 C ATOM 3027 C ALA B 60 -0.209 44.821 27.472 1.00 1.02 C ATOM 3028 O ALA B 60 -1.393 44.837 27.730 1.00 1.06 O ATOM 3029 CB ALA B 60 -0.381 42.600 26.305 1.00 1.20 C ATOM 0 H ALA B 60 2.027 42.773 26.857 1.00 1.14 H new ATOM 0 HA ALA B 60 0.176 44.483 25.390 1.00 1.11 H new ATOM 0 HB1 ALA B 60 -1.448 42.756 26.144 1.00 1.20 H new ATOM 0 HB2 ALA B 60 0.023 41.991 25.496 1.00 1.20 H new ATOM 0 HB3 ALA B 60 -0.228 42.088 27.255 1.00 1.20 H new ATOM 3035 N ALA B 61 0.637 45.555 28.143 1.00 0.96 N ATOM 3036 CA ALA B 61 0.139 46.421 29.247 1.00 0.92 C ATOM 3037 C ALA B 61 1.151 47.535 29.538 1.00 1.17 C ATOM 3038 O ALA B 61 2.234 47.277 30.027 1.00 1.25 O ATOM 3039 CB ALA B 61 -0.066 45.564 30.499 1.00 0.72 C ATOM 0 H ALA B 61 1.643 45.592 27.976 1.00 0.96 H new ATOM 0 HA ALA B 61 -0.807 46.877 28.955 1.00 0.92 H new ATOM 0 HB1 ALA B 61 -0.431 46.190 31.313 1.00 0.72 H new ATOM 0 HB2 ALA B 61 -0.795 44.781 30.289 1.00 0.72 H new ATOM 0 HB3 ALA B 61 0.882 45.109 30.788 1.00 0.72 H new ATOM 3045 N PHE B 62 0.800 48.773 29.266 1.00 1.49 N ATOM 3046 CA PHE B 62 1.738 49.911 29.551 1.00 1.80 C ATOM 3047 C PHE B 62 1.213 50.732 30.737 1.00 1.71 C ATOM 3048 O PHE B 62 1.715 51.801 31.028 1.00 1.94 O ATOM 3049 CB PHE B 62 1.864 50.804 28.304 1.00 2.32 C ATOM 3050 CG PHE B 62 2.868 50.202 27.342 1.00 2.70 C ATOM 3051 CD1 PHE B 62 4.223 50.537 27.464 1.00 2.87 C ATOM 3052 CD2 PHE B 62 2.456 49.313 26.342 1.00 2.93 C ATOM 3053 CE1 PHE B 62 5.164 49.987 26.587 1.00 3.24 C ATOM 3054 CE2 PHE B 62 3.401 48.762 25.464 1.00 3.28 C ATOM 3055 CZ PHE B 62 4.753 49.099 25.588 1.00 3.42 C ATOM 0 H PHE B 62 -0.095 49.044 28.859 1.00 1.49 H new ATOM 0 HA PHE B 62 2.721 49.514 29.804 1.00 1.80 H new ATOM 0 HB2 PHE B 62 0.894 50.903 27.817 1.00 2.32 H new ATOM 0 HB3 PHE B 62 2.179 51.806 28.593 1.00 2.32 H new ATOM 0 HD1 PHE B 62 4.542 51.221 28.237 1.00 2.87 H new ATOM 0 HD2 PHE B 62 1.412 49.052 26.247 1.00 2.93 H new ATOM 0 HE1 PHE B 62 6.208 50.248 26.681 1.00 3.24 H new ATOM 0 HE2 PHE B 62 3.084 48.077 24.691 1.00 3.28 H new ATOM 0 HZ PHE B 62 5.480 48.673 24.912 1.00 3.42 H new ATOM 3065 N ARG B 63 0.236 50.220 31.448 1.00 1.43 N ATOM 3066 CA ARG B 63 -0.292 50.940 32.650 1.00 1.41 C ATOM 3067 C ARG B 63 -0.434 49.932 33.788 1.00 1.25 C ATOM 3068 O ARG B 63 -1.200 50.117 34.712 1.00 1.34 O ATOM 3069 CB ARG B 63 -1.660 51.555 32.339 1.00 1.67 C ATOM 3070 CG ARG B 63 -1.487 52.705 31.345 1.00 2.31 C ATOM 3071 CD ARG B 63 -2.847 53.347 31.059 1.00 2.72 C ATOM 3072 NE ARG B 63 -3.362 53.992 32.301 1.00 3.14 N ATOM 3073 CZ ARG B 63 -4.333 54.863 32.230 1.00 3.66 C ATOM 3074 NH1 ARG B 63 -4.842 55.179 31.070 1.00 3.89 N ATOM 3075 NH2 ARG B 63 -4.793 55.416 33.318 1.00 4.35 N ATOM 0 H ARG B 63 -0.220 49.330 31.246 1.00 1.43 H new ATOM 0 HA ARG B 63 0.393 51.740 32.932 1.00 1.41 H new ATOM 0 HB2 ARG B 63 -2.325 50.798 31.924 1.00 1.67 H new ATOM 0 HB3 ARG B 63 -2.124 51.919 33.256 1.00 1.67 H new ATOM 0 HG2 ARG B 63 -0.801 53.449 31.750 1.00 2.31 H new ATOM 0 HG3 ARG B 63 -1.046 52.335 30.419 1.00 2.31 H new ATOM 0 HD2 ARG B 63 -2.752 54.087 30.264 1.00 2.72 H new ATOM 0 HD3 ARG B 63 -3.551 52.592 30.709 1.00 2.72 H new ATOM 0 HE ARG B 63 -2.956 53.753 33.206 1.00 3.14 H new ATOM 0 HH11 ARG B 63 -4.481 54.746 30.220 1.00 3.89 H new ATOM 0 HH12 ARG B 63 -5.600 55.859 31.014 1.00 3.89 H new ATOM 0 HH21 ARG B 63 -4.395 55.168 34.224 1.00 4.35 H new ATOM 0 HH22 ARG B 63 -5.551 56.096 33.263 1.00 4.35 H new ATOM 3089 N GLN B 64 0.322 48.872 33.726 1.00 1.12 N ATOM 3090 CA GLN B 64 0.275 47.831 34.793 1.00 1.12 C ATOM 3091 C GLN B 64 1.659 47.202 34.920 1.00 1.12 C ATOM 3092 O GLN B 64 2.409 47.160 33.968 1.00 1.09 O ATOM 3093 CB GLN B 64 -0.740 46.735 34.435 1.00 1.17 C ATOM 3094 CG GLN B 64 -2.175 47.301 34.442 1.00 1.37 C ATOM 3095 CD GLN B 64 -2.518 47.907 33.077 1.00 1.77 C ATOM 3096 OE1 GLN B 64 -1.573 48.088 32.197 1.00 2.44 O flip ATOM 3097 NE2 GLN B 64 -3.662 48.218 32.809 1.00 1.84 N flip ATOM 0 H GLN B 64 0.980 48.679 32.971 1.00 1.12 H new ATOM 0 HA GLN B 64 -0.027 48.295 35.732 1.00 1.12 H new ATOM 0 HB2 GLN B 64 -0.510 46.326 33.451 1.00 1.17 H new ATOM 0 HB3 GLN B 64 -0.664 45.914 35.148 1.00 1.17 H new ATOM 0 HG2 GLN B 64 -2.884 46.509 34.684 1.00 1.37 H new ATOM 0 HG3 GLN B 64 -2.269 48.061 35.218 1.00 1.37 H new ATOM 0 HE21 GLN B 64 -4.403 48.077 33.496 1.00 1.84 H new ATOM 0 HE22 GLN B 64 -3.881 48.620 31.897 1.00 1.84 H new ATOM 3106 N VAL B 65 2.002 46.701 36.076 1.00 1.28 N ATOM 3107 CA VAL B 65 3.345 46.060 36.246 1.00 1.44 C ATOM 3108 C VAL B 65 3.161 44.540 36.264 1.00 1.49 C ATOM 3109 O VAL B 65 3.508 43.872 37.216 1.00 1.72 O ATOM 3110 CB VAL B 65 3.958 46.513 37.574 1.00 1.71 C ATOM 3111 CG1 VAL B 65 5.448 46.165 37.599 1.00 1.94 C ATOM 3112 CG2 VAL B 65 3.791 48.029 37.722 1.00 1.67 C ATOM 0 H VAL B 65 1.415 46.706 36.910 1.00 1.28 H new ATOM 0 HA VAL B 65 4.004 46.348 35.427 1.00 1.44 H new ATOM 0 HB VAL B 65 3.452 46.005 38.395 1.00 1.71 H new ATOM 0 HG11 VAL B 65 5.881 46.489 38.545 1.00 1.94 H new ATOM 0 HG12 VAL B 65 5.572 45.087 37.493 1.00 1.94 H new ATOM 0 HG13 VAL B 65 5.954 46.671 36.777 1.00 1.94 H new ATOM 0 HG21 VAL B 65 4.227 48.353 38.667 1.00 1.67 H new ATOM 0 HG22 VAL B 65 4.296 48.533 36.898 1.00 1.67 H new ATOM 0 HG23 VAL B 65 2.731 48.282 37.706 1.00 1.67 H new ATOM 3122 N ALA B 66 2.616 43.988 35.208 1.00 1.30 N ATOM 3123 CA ALA B 66 2.410 42.509 35.151 1.00 1.38 C ATOM 3124 C ALA B 66 2.490 42.031 33.698 1.00 1.17 C ATOM 3125 O ALA B 66 2.285 42.790 32.771 1.00 1.01 O ATOM 3126 CB ALA B 66 1.034 42.164 35.720 1.00 1.51 C ATOM 0 H ALA B 66 2.305 44.499 34.382 1.00 1.30 H new ATOM 0 HA ALA B 66 3.185 42.016 35.738 1.00 1.38 H new ATOM 0 HB1 ALA B 66 0.883 41.085 35.679 1.00 1.51 H new ATOM 0 HB2 ALA B 66 0.974 42.499 36.755 1.00 1.51 H new ATOM 0 HB3 ALA B 66 0.262 42.661 35.132 1.00 1.51 H new ATOM 3132 N HIS B 67 2.774 40.768 33.496 1.00 1.22 N ATOM 3133 CA HIS B 67 2.859 40.200 32.111 1.00 1.05 C ATOM 3134 C HIS B 67 1.997 38.940 32.038 1.00 1.10 C ATOM 3135 O HIS B 67 2.071 38.084 32.898 1.00 1.27 O ATOM 3136 CB HIS B 67 4.315 39.856 31.781 1.00 1.10 C ATOM 3137 CG HIS B 67 5.072 41.118 31.461 1.00 1.12 C ATOM 3138 ND1 HIS B 67 6.344 41.366 31.957 1.00 1.35 N ATOM 3139 CD2 HIS B 67 4.748 42.212 30.694 1.00 1.02 C ATOM 3140 CE1 HIS B 67 6.735 42.567 31.487 1.00 1.38 C ATOM 3141 NE2 HIS B 67 5.799 43.120 30.715 1.00 1.19 N ATOM 0 H HIS B 67 2.953 40.096 34.242 1.00 1.22 H new ATOM 0 HA HIS B 67 2.499 40.933 31.389 1.00 1.05 H new ATOM 0 HB2 HIS B 67 4.779 39.346 32.625 1.00 1.10 H new ATOM 0 HB3 HIS B 67 4.355 39.171 30.934 1.00 1.10 H new ATOM 0 HD2 HIS B 67 3.820 42.345 30.158 1.00 1.02 H new ATOM 0 HE1 HIS B 67 7.688 43.025 31.708 1.00 1.38 H new ATOM 0 HE2 HIS B 67 5.845 44.021 30.239 1.00 1.19 H new ATOM 3149 N THR B 68 1.171 38.812 31.025 1.00 1.01 N ATOM 3150 CA THR B 68 0.302 37.598 30.925 1.00 1.12 C ATOM 3151 C THR B 68 0.968 36.571 30.010 1.00 0.99 C ATOM 3152 O THR B 68 1.147 36.797 28.827 1.00 0.86 O ATOM 3153 CB THR B 68 -1.065 37.995 30.350 1.00 1.20 C ATOM 3154 OG1 THR B 68 -1.902 36.848 30.292 1.00 1.39 O ATOM 3155 CG2 THR B 68 -0.901 38.580 28.940 1.00 1.09 C ATOM 0 H THR B 68 1.062 39.490 30.270 1.00 1.01 H new ATOM 0 HA THR B 68 0.164 37.163 31.915 1.00 1.12 H new ATOM 0 HB THR B 68 -1.515 38.750 30.995 1.00 1.20 H new ATOM 0 HG1 THR B 68 -2.776 37.099 29.927 1.00 1.39 H new ATOM 0 HG21 THR B 68 -1.878 38.857 28.545 1.00 1.09 H new ATOM 0 HG22 THR B 68 -0.264 39.463 28.984 1.00 1.09 H new ATOM 0 HG23 THR B 68 -0.444 37.836 28.288 1.00 1.09 H new ATOM 3163 N THR B 69 1.341 35.438 30.560 1.00 1.06 N ATOM 3164 CA THR B 69 2.004 34.371 29.750 1.00 0.95 C ATOM 3165 C THR B 69 1.141 33.113 29.778 1.00 0.99 C ATOM 3166 O THR B 69 0.865 32.562 30.824 1.00 1.16 O ATOM 3167 CB THR B 69 3.378 34.057 30.349 1.00 1.05 C ATOM 3168 OG1 THR B 69 4.009 33.051 29.569 1.00 1.09 O ATOM 3169 CG2 THR B 69 3.222 33.561 31.793 1.00 1.28 C ATOM 0 H THR B 69 1.212 35.208 31.545 1.00 1.06 H new ATOM 0 HA THR B 69 2.125 34.712 28.722 1.00 0.95 H new ATOM 0 HB THR B 69 3.986 34.962 30.348 1.00 1.05 H new ATOM 0 HG1 THR B 69 4.890 32.848 29.948 1.00 1.09 H new ATOM 0 HG21 THR B 69 4.205 33.340 32.210 1.00 1.28 H new ATOM 0 HG22 THR B 69 2.738 34.332 32.392 1.00 1.28 H new ATOM 0 HG23 THR B 69 2.612 32.658 31.804 1.00 1.28 H new ATOM 3177 N VAL B 70 0.712 32.659 28.629 1.00 0.89 N ATOM 3178 CA VAL B 70 -0.139 31.434 28.562 1.00 0.97 C ATOM 3179 C VAL B 70 0.649 30.323 27.853 1.00 0.85 C ATOM 3180 O VAL B 70 0.656 30.252 26.641 1.00 0.80 O ATOM 3181 CB VAL B 70 -1.398 31.747 27.749 1.00 1.07 C ATOM 3182 CG1 VAL B 70 -2.204 30.462 27.549 1.00 1.24 C ATOM 3183 CG2 VAL B 70 -2.249 32.772 28.505 1.00 1.18 C ATOM 0 H VAL B 70 0.917 33.088 27.727 1.00 0.89 H new ATOM 0 HA VAL B 70 -0.415 31.115 29.567 1.00 0.97 H new ATOM 0 HB VAL B 70 -1.116 32.154 26.778 1.00 1.07 H new ATOM 0 HG11 VAL B 70 -3.101 30.682 26.970 1.00 1.24 H new ATOM 0 HG12 VAL B 70 -1.597 29.731 27.014 1.00 1.24 H new ATOM 0 HG13 VAL B 70 -2.489 30.056 28.520 1.00 1.24 H new ATOM 0 HG21 VAL B 70 -3.146 32.996 27.928 1.00 1.18 H new ATOM 0 HG22 VAL B 70 -2.534 32.364 29.475 1.00 1.18 H new ATOM 0 HG23 VAL B 70 -1.673 33.686 28.651 1.00 1.18 H new ATOM 3193 N PRO B 71 1.313 29.460 28.588 1.00 0.84 N ATOM 3194 CA PRO B 71 2.108 28.355 27.989 1.00 0.75 C ATOM 3195 C PRO B 71 1.234 27.143 27.660 1.00 0.74 C ATOM 3196 O PRO B 71 1.414 26.070 28.196 1.00 0.78 O ATOM 3197 CB PRO B 71 3.123 28.031 29.087 1.00 0.84 C ATOM 3198 CG PRO B 71 2.395 28.304 30.368 1.00 0.99 C ATOM 3199 CD PRO B 71 1.387 29.428 30.065 1.00 0.98 C ATOM 0 HA PRO B 71 2.571 28.628 27.041 1.00 0.75 H new ATOM 0 HB2 PRO B 71 3.450 26.993 29.031 1.00 0.84 H new ATOM 0 HB3 PRO B 71 4.015 28.651 28.998 1.00 0.84 H new ATOM 0 HG2 PRO B 71 1.884 27.409 30.722 1.00 0.99 H new ATOM 0 HG3 PRO B 71 3.089 28.606 31.152 1.00 0.99 H new ATOM 0 HD2 PRO B 71 0.413 29.220 30.508 1.00 0.98 H new ATOM 0 HD3 PRO B 71 1.723 30.384 30.468 1.00 0.98 H new ATOM 3207 N TRP B 72 0.296 27.310 26.768 1.00 0.72 N ATOM 3208 CA TRP B 72 -0.583 26.169 26.387 1.00 0.75 C ATOM 3209 C TRP B 72 0.279 25.138 25.652 1.00 0.68 C ATOM 3210 O TRP B 72 1.015 25.502 24.759 1.00 0.60 O ATOM 3211 CB TRP B 72 -1.675 26.669 25.437 1.00 0.78 C ATOM 3212 CG TRP B 72 -2.688 25.587 25.226 1.00 0.84 C ATOM 3213 CD1 TRP B 72 -3.634 25.225 26.121 1.00 0.94 C ATOM 3214 CD2 TRP B 72 -2.871 24.724 24.064 1.00 0.84 C ATOM 3215 NE1 TRP B 72 -4.390 24.198 25.582 1.00 0.99 N ATOM 3216 CE2 TRP B 72 -3.958 23.854 24.317 1.00 0.94 C ATOM 3217 CE3 TRP B 72 -2.209 24.615 22.828 1.00 0.79 C ATOM 3218 CZ2 TRP B 72 -4.370 22.909 23.378 1.00 0.97 C ATOM 3219 CZ3 TRP B 72 -2.622 23.663 21.881 1.00 0.84 C ATOM 3220 CH2 TRP B 72 -3.701 22.813 22.157 1.00 0.92 C ATOM 0 H TRP B 72 0.101 28.188 26.287 1.00 0.72 H new ATOM 0 HA TRP B 72 -1.044 25.730 27.272 1.00 0.75 H new ATOM 0 HB2 TRP B 72 -2.155 27.555 25.852 1.00 0.78 H new ATOM 0 HB3 TRP B 72 -1.236 26.962 24.483 1.00 0.78 H new ATOM 0 HD1 TRP B 72 -3.777 25.665 27.097 1.00 0.94 H new ATOM 0 HE1 TRP B 72 -5.171 23.750 26.061 1.00 0.99 H new ATOM 0 HE3 TRP B 72 -1.378 25.267 22.605 1.00 0.79 H new ATOM 0 HZ2 TRP B 72 -5.202 22.255 23.594 1.00 0.97 H new ATOM 0 HZ3 TRP B 72 -2.105 23.586 20.936 1.00 0.84 H new ATOM 0 HH2 TRP B 72 -4.015 22.084 21.425 1.00 0.92 H new ATOM 3231 N PRO B 73 0.229 23.871 26.008 1.00 0.71 N ATOM 3232 CA PRO B 73 1.071 22.859 25.322 1.00 0.66 C ATOM 3233 C PRO B 73 1.100 23.087 23.810 1.00 0.58 C ATOM 3234 O PRO B 73 0.110 23.439 23.201 1.00 0.61 O ATOM 3235 CB PRO B 73 0.378 21.537 25.669 1.00 0.75 C ATOM 3236 CG PRO B 73 -0.236 21.773 27.015 1.00 0.85 C ATOM 3237 CD PRO B 73 -0.602 23.265 27.066 1.00 0.82 C ATOM 0 HA PRO B 73 2.115 22.892 25.635 1.00 0.66 H new ATOM 0 HB2 PRO B 73 -0.379 21.280 24.928 1.00 0.75 H new ATOM 0 HB3 PRO B 73 1.090 20.712 25.697 1.00 0.75 H new ATOM 0 HG2 PRO B 73 -1.120 21.151 27.154 1.00 0.85 H new ATOM 0 HG3 PRO B 73 0.462 21.516 27.811 1.00 0.85 H new ATOM 0 HD2 PRO B 73 -1.664 23.422 26.879 1.00 0.82 H new ATOM 0 HD3 PRO B 73 -0.383 23.697 28.043 1.00 0.82 H new ATOM 3245 N ASN B 74 2.232 22.877 23.204 1.00 0.52 N ATOM 3246 CA ASN B 74 2.366 23.064 21.729 1.00 0.48 C ATOM 3247 C ASN B 74 3.121 21.865 21.178 1.00 0.50 C ATOM 3248 O ASN B 74 3.114 21.581 19.999 1.00 0.80 O ATOM 3249 CB ASN B 74 3.154 24.343 21.454 1.00 0.47 C ATOM 3250 CG ASN B 74 3.161 24.637 19.952 1.00 0.53 C ATOM 3251 OD1 ASN B 74 2.367 23.969 19.167 1.00 1.17 O flip ATOM 3252 ND2 ASN B 74 3.898 25.485 19.490 1.00 1.26 N flip ATOM 0 H ASN B 74 3.087 22.578 23.674 1.00 0.52 H new ATOM 0 HA ASN B 74 1.387 23.145 21.256 1.00 0.48 H new ATOM 0 HB2 ASN B 74 2.709 25.178 21.995 1.00 0.47 H new ATOM 0 HB3 ASN B 74 4.176 24.236 21.817 1.00 0.47 H new ATOM 0 HD21 ASN B 74 4.521 26.009 20.105 1.00 1.26 H new ATOM 0 HD22 ASN B 74 3.894 25.673 18.487 1.00 1.26 H new ATOM 3259 N ALA B 75 3.782 21.171 22.053 1.00 0.47 N ATOM 3260 CA ALA B 75 4.571 19.982 21.663 1.00 0.47 C ATOM 3261 C ALA B 75 3.674 18.754 21.745 1.00 0.46 C ATOM 3262 O ALA B 75 3.076 18.482 22.768 1.00 0.47 O ATOM 3263 CB ALA B 75 5.747 19.831 22.636 1.00 0.53 C ATOM 0 H ALA B 75 3.808 21.386 23.050 1.00 0.47 H new ATOM 0 HA ALA B 75 4.951 20.090 20.647 1.00 0.47 H new ATOM 0 HB1 ALA B 75 6.338 18.957 22.360 1.00 0.53 H new ATOM 0 HB2 ALA B 75 6.373 20.722 22.591 1.00 0.53 H new ATOM 0 HB3 ALA B 75 5.367 19.706 23.650 1.00 0.53 H new ATOM 3269 N SER B 76 3.568 18.005 20.688 1.00 0.47 N ATOM 3270 CA SER B 76 2.702 16.804 20.746 1.00 0.49 C ATOM 3271 C SER B 76 3.510 15.688 21.385 1.00 0.48 C ATOM 3272 O SER B 76 4.204 14.940 20.723 1.00 0.49 O ATOM 3273 CB SER B 76 2.296 16.394 19.333 1.00 0.54 C ATOM 3274 OG SER B 76 3.427 15.852 18.663 1.00 1.38 O ATOM 0 H SER B 76 4.037 18.170 19.798 1.00 0.47 H new ATOM 0 HA SER B 76 1.800 17.009 21.323 1.00 0.49 H new ATOM 0 HB2 SER B 76 1.493 15.658 19.371 1.00 0.54 H new ATOM 0 HB3 SER B 76 1.913 17.256 18.787 1.00 0.54 H new ATOM 0 HG SER B 76 3.685 15.008 19.088 1.00 1.38 H new ATOM 3280 N LEU B 77 3.434 15.586 22.680 1.00 0.50 N ATOM 3281 CA LEU B 77 4.203 14.540 23.388 1.00 0.53 C ATOM 3282 C LEU B 77 3.508 13.195 23.198 1.00 0.52 C ATOM 3283 O LEU B 77 2.301 13.094 23.260 1.00 0.56 O ATOM 3284 CB LEU B 77 4.263 14.883 24.878 1.00 0.61 C ATOM 3285 CG LEU B 77 4.894 16.270 25.060 1.00 0.65 C ATOM 3286 CD1 LEU B 77 4.883 16.644 26.546 1.00 0.75 C ATOM 3287 CD2 LEU B 77 6.343 16.268 24.533 1.00 0.66 C ATOM 0 H LEU B 77 2.868 16.188 23.278 1.00 0.50 H new ATOM 0 HA LEU B 77 5.215 14.486 22.987 1.00 0.53 H new ATOM 0 HB2 LEU B 77 3.261 14.869 25.306 1.00 0.61 H new ATOM 0 HB3 LEU B 77 4.847 14.133 25.411 1.00 0.61 H new ATOM 0 HG LEU B 77 4.316 17.002 24.496 1.00 0.65 H new ATOM 0 HD11 LEU B 77 5.331 17.629 26.677 1.00 0.75 H new ATOM 0 HD12 LEU B 77 3.855 16.662 26.909 1.00 0.75 H new ATOM 0 HD13 LEU B 77 5.455 15.908 27.111 1.00 0.75 H new ATOM 0 HD21 LEU B 77 6.780 17.257 24.667 1.00 0.66 H new ATOM 0 HD22 LEU B 77 6.930 15.534 25.085 1.00 0.66 H new ATOM 0 HD23 LEU B 77 6.345 16.012 23.474 1.00 0.66 H new ATOM 3299 N THR B 78 4.266 12.163 22.966 1.00 0.51 N ATOM 3300 CA THR B 78 3.666 10.810 22.774 1.00 0.51 C ATOM 3301 C THR B 78 4.556 9.785 23.482 1.00 0.58 C ATOM 3302 O THR B 78 5.421 9.193 22.881 1.00 0.66 O ATOM 3303 CB THR B 78 3.629 10.503 21.270 1.00 0.55 C ATOM 3304 OG1 THR B 78 3.053 9.220 21.073 1.00 0.61 O ATOM 3305 CG2 THR B 78 5.055 10.525 20.680 1.00 0.63 C ATOM 0 H THR B 78 5.283 12.196 22.900 1.00 0.51 H new ATOM 0 HA THR B 78 2.656 10.771 23.183 1.00 0.51 H new ATOM 0 HB THR B 78 3.032 11.262 20.765 1.00 0.55 H new ATOM 0 HG1 THR B 78 2.113 9.320 20.813 1.00 0.61 H new ATOM 0 HG21 THR B 78 5.011 10.305 19.613 1.00 0.63 H new ATOM 0 HG22 THR B 78 5.496 11.511 20.830 1.00 0.63 H new ATOM 0 HG23 THR B 78 5.667 9.774 21.180 1.00 0.63 H new ATOM 3313 N PRO B 79 4.350 9.586 24.759 1.00 0.66 N ATOM 3314 CA PRO B 79 5.143 8.634 25.579 1.00 0.77 C ATOM 3315 C PRO B 79 4.457 7.281 25.811 1.00 0.68 C ATOM 3316 O PRO B 79 5.069 6.235 25.725 1.00 0.70 O ATOM 3317 CB PRO B 79 5.232 9.397 26.897 1.00 0.99 C ATOM 3318 CG PRO B 79 3.896 10.082 27.025 1.00 0.97 C ATOM 3319 CD PRO B 79 3.351 10.268 25.592 1.00 0.75 C ATOM 0 HA PRO B 79 6.088 8.368 25.105 1.00 0.77 H new ATOM 0 HB2 PRO B 79 5.415 8.724 27.734 1.00 0.99 H new ATOM 0 HB3 PRO B 79 6.049 10.119 26.884 1.00 0.99 H new ATOM 0 HG2 PRO B 79 3.210 9.483 27.625 1.00 0.97 H new ATOM 0 HG3 PRO B 79 4.001 11.044 27.527 1.00 0.97 H new ATOM 0 HD2 PRO B 79 2.362 9.825 25.477 1.00 0.75 H new ATOM 0 HD3 PRO B 79 3.261 11.322 25.330 1.00 0.75 H new ATOM 3327 N LYS B 80 3.207 7.300 26.158 1.00 0.66 N ATOM 3328 CA LYS B 80 2.494 6.023 26.453 1.00 0.67 C ATOM 3329 C LYS B 80 2.041 5.288 25.187 1.00 0.64 C ATOM 3330 O LYS B 80 2.126 4.077 25.122 1.00 0.65 O ATOM 3331 CB LYS B 80 1.263 6.313 27.320 1.00 0.79 C ATOM 3332 CG LYS B 80 1.697 6.732 28.728 1.00 1.31 C ATOM 3333 CD LYS B 80 0.453 7.015 29.576 1.00 1.46 C ATOM 3334 CE LYS B 80 0.876 7.418 30.991 1.00 2.32 C ATOM 3335 NZ LYS B 80 1.453 8.791 30.974 1.00 2.97 N ATOM 0 H LYS B 80 2.642 8.144 26.252 1.00 0.66 H new ATOM 0 HA LYS B 80 3.201 5.379 26.975 1.00 0.67 H new ATOM 0 HB2 LYS B 80 0.666 7.103 26.865 1.00 0.79 H new ATOM 0 HB3 LYS B 80 0.630 5.427 27.375 1.00 0.79 H new ATOM 0 HG2 LYS B 80 2.293 5.943 29.187 1.00 1.31 H new ATOM 0 HG3 LYS B 80 2.327 7.620 28.678 1.00 1.31 H new ATOM 0 HD2 LYS B 80 -0.136 7.811 29.121 1.00 1.46 H new ATOM 0 HD3 LYS B 80 -0.183 6.130 29.614 1.00 1.46 H new ATOM 0 HE2 LYS B 80 0.017 7.383 31.661 1.00 2.32 H new ATOM 0 HE3 LYS B 80 1.610 6.710 31.376 1.00 2.32 H new ATOM 0 HZ1 LYS B 80 1.550 9.139 31.949 1.00 2.97 H new ATOM 0 HZ2 LYS B 80 2.388 8.769 30.520 1.00 2.97 H new ATOM 0 HZ3 LYS B 80 0.824 9.425 30.441 1.00 2.97 H new ATOM 3349 N TRP B 81 1.494 5.974 24.210 1.00 0.65 N ATOM 3350 CA TRP B 81 0.964 5.245 23.003 1.00 0.67 C ATOM 3351 C TRP B 81 1.981 5.099 21.855 1.00 0.62 C ATOM 3352 O TRP B 81 2.408 4.005 21.556 1.00 0.64 O ATOM 3353 CB TRP B 81 -0.333 5.918 22.506 1.00 0.73 C ATOM 3354 CG TRP B 81 -0.077 7.251 21.874 1.00 0.69 C ATOM 3355 CD1 TRP B 81 0.157 7.457 20.557 1.00 0.70 C ATOM 3356 CD2 TRP B 81 -0.085 8.567 22.498 1.00 0.68 C ATOM 3357 NE1 TRP B 81 0.341 8.811 20.341 1.00 0.68 N ATOM 3358 CE2 TRP B 81 0.187 9.538 21.505 1.00 0.66 C ATOM 3359 CE3 TRP B 81 -0.288 9.006 23.819 1.00 0.71 C ATOM 3360 CZ2 TRP B 81 0.252 10.898 21.812 1.00 0.66 C ATOM 3361 CZ3 TRP B 81 -0.229 10.374 24.131 1.00 0.72 C ATOM 3362 CH2 TRP B 81 0.041 11.318 23.130 1.00 0.68 C ATOM 0 H TRP B 81 1.391 6.989 24.191 1.00 0.65 H new ATOM 0 HA TRP B 81 0.752 4.227 23.331 1.00 0.67 H new ATOM 0 HB2 TRP B 81 -0.825 5.265 21.785 1.00 0.73 H new ATOM 0 HB3 TRP B 81 -1.019 6.042 23.344 1.00 0.73 H new ATOM 0 HD1 TRP B 81 0.194 6.689 19.798 1.00 0.70 H new ATOM 0 HE1 TRP B 81 0.563 9.222 19.434 1.00 0.68 H new ATOM 0 HE3 TRP B 81 -0.491 8.286 24.598 1.00 0.71 H new ATOM 0 HZ2 TRP B 81 0.464 11.621 21.038 1.00 0.66 H new ATOM 0 HZ3 TRP B 81 -0.392 10.701 25.147 1.00 0.72 H new ATOM 0 HH2 TRP B 81 0.086 12.369 23.376 1.00 0.68 H new ATOM 3373 N ASN B 82 2.326 6.144 21.159 1.00 0.59 N ATOM 3374 CA ASN B 82 3.248 5.962 19.992 1.00 0.59 C ATOM 3375 C ASN B 82 4.657 5.545 20.445 1.00 0.53 C ATOM 3376 O ASN B 82 5.242 4.639 19.885 1.00 0.49 O ATOM 3377 CB ASN B 82 3.308 7.267 19.174 1.00 0.69 C ATOM 3378 CG ASN B 82 3.476 6.956 17.679 1.00 1.07 C ATOM 3379 OD1 ASN B 82 3.168 7.780 16.841 1.00 0.96 O ATOM 3380 ND2 ASN B 82 3.956 5.800 17.308 1.00 1.86 N ATOM 0 H ASN B 82 2.020 7.101 21.337 1.00 0.59 H new ATOM 0 HA ASN B 82 2.857 5.159 19.367 1.00 0.59 H new ATOM 0 HB2 ASN B 82 2.397 7.844 19.331 1.00 0.69 H new ATOM 0 HB3 ASN B 82 4.139 7.882 19.519 1.00 0.69 H new ATOM 0 HD21 ASN B 82 4.072 5.590 16.317 1.00 1.86 H new ATOM 0 HD22 ASN B 82 4.215 5.107 18.010 1.00 1.86 H new ATOM 3387 N ASN B 83 5.216 6.183 21.435 1.00 0.56 N ATOM 3388 CA ASN B 83 6.584 5.780 21.872 1.00 0.57 C ATOM 3389 C ASN B 83 6.572 4.322 22.321 1.00 0.53 C ATOM 3390 O ASN B 83 7.464 3.562 22.004 1.00 0.52 O ATOM 3391 CB ASN B 83 7.063 6.668 23.018 1.00 0.66 C ATOM 3392 CG ASN B 83 8.449 6.213 23.474 1.00 1.22 C ATOM 3393 OD1 ASN B 83 8.668 5.975 24.644 1.00 1.99 O ATOM 3394 ND2 ASN B 83 9.404 6.084 22.594 1.00 1.84 N ATOM 0 H ASN B 83 4.795 6.954 21.954 1.00 0.56 H new ATOM 0 HA ASN B 83 7.268 5.896 21.031 1.00 0.57 H new ATOM 0 HB2 ASN B 83 7.099 7.708 22.695 1.00 0.66 H new ATOM 0 HB3 ASN B 83 6.360 6.616 23.850 1.00 0.66 H new ATOM 0 HD21 ASN B 83 10.333 5.784 22.890 1.00 1.84 H new ATOM 0 HD22 ASN B 83 9.222 6.284 21.610 1.00 1.84 H new ATOM 3401 N GLU B 84 5.571 3.916 23.051 1.00 0.53 N ATOM 3402 CA GLU B 84 5.527 2.498 23.495 1.00 0.52 C ATOM 3403 C GLU B 84 5.504 1.617 22.251 1.00 0.47 C ATOM 3404 O GLU B 84 6.217 0.639 22.152 1.00 0.48 O ATOM 3405 CB GLU B 84 4.270 2.252 24.338 1.00 0.56 C ATOM 3406 CG GLU B 84 4.239 0.797 24.825 1.00 1.26 C ATOM 3407 CD GLU B 84 5.431 0.530 25.748 1.00 1.71 C ATOM 3408 OE1 GLU B 84 6.000 1.488 26.245 1.00 2.23 O ATOM 3409 OE2 GLU B 84 5.754 -0.630 25.941 1.00 2.29 O ATOM 0 H GLU B 84 4.791 4.498 23.356 1.00 0.53 H new ATOM 0 HA GLU B 84 6.399 2.265 24.106 1.00 0.52 H new ATOM 0 HB2 GLU B 84 4.257 2.930 25.191 1.00 0.56 H new ATOM 0 HB3 GLU B 84 3.379 2.465 23.747 1.00 0.56 H new ATOM 0 HG2 GLU B 84 3.307 0.602 25.355 1.00 1.26 H new ATOM 0 HG3 GLU B 84 4.269 0.118 23.972 1.00 1.26 H new ATOM 3416 N THR B 85 4.707 1.976 21.286 1.00 0.44 N ATOM 3417 CA THR B 85 4.658 1.181 20.032 1.00 0.42 C ATOM 3418 C THR B 85 5.973 1.382 19.281 1.00 0.38 C ATOM 3419 O THR B 85 6.506 0.467 18.688 1.00 0.39 O ATOM 3420 CB THR B 85 3.488 1.644 19.159 1.00 0.45 C ATOM 3421 OG1 THR B 85 3.626 3.028 18.875 1.00 0.43 O ATOM 3422 CG2 THR B 85 2.165 1.394 19.891 1.00 0.50 C ATOM 0 H THR B 85 4.088 2.786 21.312 1.00 0.44 H new ATOM 0 HA THR B 85 4.517 0.126 20.269 1.00 0.42 H new ATOM 0 HB THR B 85 3.490 1.082 18.225 1.00 0.45 H new ATOM 0 HG1 THR B 85 4.240 3.435 19.522 1.00 0.43 H new ATOM 0 HG21 THR B 85 1.335 1.725 19.266 1.00 0.50 H new ATOM 0 HG22 THR B 85 2.060 0.329 20.100 1.00 0.50 H new ATOM 0 HG23 THR B 85 2.157 1.950 20.829 1.00 0.50 H new ATOM 3430 N TRP B 86 6.506 2.579 19.299 1.00 0.36 N ATOM 3431 CA TRP B 86 7.787 2.816 18.578 1.00 0.34 C ATOM 3432 C TRP B 86 8.858 1.905 19.165 1.00 0.34 C ATOM 3433 O TRP B 86 9.641 1.314 18.454 1.00 0.33 O ATOM 3434 CB TRP B 86 8.246 4.270 18.724 1.00 0.34 C ATOM 3435 CG TRP B 86 9.336 4.517 17.727 1.00 0.32 C ATOM 3436 CD1 TRP B 86 10.662 4.346 17.943 1.00 0.34 C ATOM 3437 CD2 TRP B 86 9.201 4.955 16.350 1.00 0.29 C ATOM 3438 NE1 TRP B 86 11.345 4.651 16.778 1.00 0.33 N ATOM 3439 CE2 TRP B 86 10.486 5.032 15.768 1.00 0.29 C ATOM 3440 CE3 TRP B 86 8.094 5.288 15.560 1.00 0.28 C ATOM 3441 CZ2 TRP B 86 10.663 5.426 14.441 1.00 0.28 C ATOM 3442 CZ3 TRP B 86 8.270 5.689 14.229 1.00 0.27 C ATOM 3443 CH2 TRP B 86 9.548 5.757 13.670 1.00 0.27 C ATOM 0 H TRP B 86 6.113 3.390 19.776 1.00 0.36 H new ATOM 0 HA TRP B 86 7.631 2.605 17.520 1.00 0.34 H new ATOM 0 HB2 TRP B 86 7.412 4.951 18.553 1.00 0.34 H new ATOM 0 HB3 TRP B 86 8.607 4.455 19.736 1.00 0.34 H new ATOM 0 HD1 TRP B 86 11.112 4.025 18.871 1.00 0.34 H new ATOM 0 HE1 TRP B 86 12.359 4.600 16.679 1.00 0.33 H new ATOM 0 HE3 TRP B 86 7.100 5.236 15.979 1.00 0.28 H new ATOM 0 HZ2 TRP B 86 11.654 5.474 14.015 1.00 0.28 H new ATOM 0 HZ3 TRP B 86 7.409 5.948 13.630 1.00 0.27 H new ATOM 0 HH2 TRP B 86 9.673 6.065 12.643 1.00 0.27 H new ATOM 3454 N GLN B 87 8.902 1.780 20.460 1.00 0.37 N ATOM 3455 CA GLN B 87 9.927 0.891 21.058 1.00 0.39 C ATOM 3456 C GLN B 87 9.698 -0.512 20.517 1.00 0.37 C ATOM 3457 O GLN B 87 10.621 -1.205 20.150 1.00 0.38 O ATOM 3458 CB GLN B 87 9.795 0.899 22.580 1.00 0.43 C ATOM 3459 CG GLN B 87 10.239 2.263 23.104 1.00 0.46 C ATOM 3460 CD GLN B 87 9.975 2.359 24.606 1.00 0.52 C ATOM 3461 OE1 GLN B 87 9.116 1.677 25.127 1.00 1.21 O ATOM 3462 NE2 GLN B 87 10.683 3.187 25.329 1.00 1.03 N ATOM 0 H GLN B 87 8.282 2.248 21.120 1.00 0.37 H new ATOM 0 HA GLN B 87 10.929 1.234 20.802 1.00 0.39 H new ATOM 0 HB2 GLN B 87 8.763 0.700 22.871 1.00 0.43 H new ATOM 0 HB3 GLN B 87 10.407 0.109 23.016 1.00 0.43 H new ATOM 0 HG2 GLN B 87 11.300 2.411 22.903 1.00 0.46 H new ATOM 0 HG3 GLN B 87 9.702 3.055 22.581 1.00 0.46 H new ATOM 0 HE21 GLN B 87 11.404 3.759 24.890 1.00 1.03 H new ATOM 0 HE22 GLN B 87 10.514 3.261 26.332 1.00 1.03 H new ATOM 3471 N GLU B 88 8.467 -0.927 20.431 1.00 0.37 N ATOM 3472 CA GLU B 88 8.193 -2.275 19.877 1.00 0.37 C ATOM 3473 C GLU B 88 8.681 -2.298 18.428 1.00 0.34 C ATOM 3474 O GLU B 88 9.286 -3.247 17.980 1.00 0.34 O ATOM 3475 CB GLU B 88 6.688 -2.545 19.914 1.00 0.39 C ATOM 3476 CG GLU B 88 6.227 -2.693 21.366 1.00 1.17 C ATOM 3477 CD GLU B 88 4.720 -2.959 21.395 1.00 1.41 C ATOM 3478 OE1 GLU B 88 4.103 -2.871 20.348 1.00 1.92 O ATOM 3479 OE2 GLU B 88 4.209 -3.245 22.466 1.00 1.95 O ATOM 0 H GLU B 88 7.646 -0.394 20.718 1.00 0.37 H new ATOM 0 HA GLU B 88 8.704 -3.039 20.463 1.00 0.37 H new ATOM 0 HB2 GLU B 88 6.150 -1.728 19.433 1.00 0.39 H new ATOM 0 HB3 GLU B 88 6.457 -3.452 19.355 1.00 0.39 H new ATOM 0 HG2 GLU B 88 6.762 -3.512 21.847 1.00 1.17 H new ATOM 0 HG3 GLU B 88 6.459 -1.788 21.927 1.00 1.17 H new ATOM 3486 N TRP B 89 8.436 -1.238 17.696 1.00 0.32 N ATOM 3487 CA TRP B 89 8.900 -1.190 16.284 1.00 0.29 C ATOM 3488 C TRP B 89 10.419 -1.325 16.248 1.00 0.29 C ATOM 3489 O TRP B 89 10.965 -2.131 15.522 1.00 0.30 O ATOM 3490 CB TRP B 89 8.475 0.154 15.677 1.00 0.28 C ATOM 3491 CG TRP B 89 9.121 0.365 14.345 1.00 0.25 C ATOM 3492 CD1 TRP B 89 8.735 -0.213 13.191 1.00 0.24 C ATOM 3493 CD2 TRP B 89 10.250 1.227 14.017 1.00 0.24 C ATOM 3494 NE1 TRP B 89 9.565 0.226 12.176 1.00 0.23 N ATOM 3495 CE2 TRP B 89 10.512 1.116 12.633 1.00 0.22 C ATOM 3496 CE3 TRP B 89 11.066 2.082 14.780 1.00 0.26 C ATOM 3497 CZ2 TRP B 89 11.548 1.829 12.022 1.00 0.22 C ATOM 3498 CZ3 TRP B 89 12.108 2.801 14.170 1.00 0.26 C ATOM 3499 CH2 TRP B 89 12.348 2.674 12.795 1.00 0.25 C ATOM 0 H TRP B 89 7.936 -0.409 18.018 1.00 0.32 H new ATOM 0 HA TRP B 89 8.460 -2.006 15.711 1.00 0.29 H new ATOM 0 HB2 TRP B 89 7.391 0.182 15.569 1.00 0.28 H new ATOM 0 HB3 TRP B 89 8.749 0.965 16.351 1.00 0.28 H new ATOM 0 HD1 TRP B 89 7.913 -0.905 13.077 1.00 0.24 H new ATOM 0 HE1 TRP B 89 9.486 -0.074 11.204 1.00 0.23 H new ATOM 0 HE3 TRP B 89 10.891 2.186 15.841 1.00 0.26 H new ATOM 0 HZ2 TRP B 89 11.728 1.727 10.962 1.00 0.22 H new ATOM 0 HZ3 TRP B 89 12.728 3.456 14.765 1.00 0.26 H new ATOM 0 HH2 TRP B 89 13.151 3.229 12.333 1.00 0.25 H new ATOM 3510 N GLU B 90 11.108 -0.548 17.033 1.00 0.31 N ATOM 3511 CA GLU B 90 12.590 -0.641 17.049 1.00 0.33 C ATOM 3512 C GLU B 90 13.001 -2.042 17.511 1.00 0.33 C ATOM 3513 O GLU B 90 13.883 -2.659 16.948 1.00 0.34 O ATOM 3514 CB GLU B 90 13.146 0.415 18.008 1.00 0.37 C ATOM 3515 CG GLU B 90 14.676 0.355 18.023 1.00 0.84 C ATOM 3516 CD GLU B 90 15.219 1.428 18.967 1.00 1.16 C ATOM 3517 OE1 GLU B 90 14.417 2.154 19.533 1.00 1.67 O ATOM 3518 OE2 GLU B 90 16.428 1.510 19.107 1.00 1.82 O ATOM 0 H GLU B 90 10.708 0.147 17.664 1.00 0.31 H new ATOM 0 HA GLU B 90 12.989 -0.464 16.050 1.00 0.33 H new ATOM 0 HB2 GLU B 90 12.816 1.407 17.701 1.00 0.37 H new ATOM 0 HB3 GLU B 90 12.757 0.247 19.012 1.00 0.37 H new ATOM 0 HG2 GLU B 90 15.009 -0.631 18.347 1.00 0.84 H new ATOM 0 HG3 GLU B 90 15.067 0.509 17.017 1.00 0.84 H new ATOM 3525 N ARG B 91 12.365 -2.548 18.536 1.00 0.34 N ATOM 3526 CA ARG B 91 12.721 -3.907 19.032 1.00 0.36 C ATOM 3527 C ARG B 91 12.440 -4.954 17.954 1.00 0.34 C ATOM 3528 O ARG B 91 13.233 -5.846 17.731 1.00 0.34 O ATOM 3529 CB ARG B 91 11.896 -4.232 20.281 1.00 0.40 C ATOM 3530 CG ARG B 91 12.369 -3.396 21.484 1.00 0.44 C ATOM 3531 CD ARG B 91 13.829 -3.728 21.849 1.00 1.07 C ATOM 3532 NE ARG B 91 14.129 -5.152 21.534 1.00 1.67 N ATOM 3533 CZ ARG B 91 15.367 -5.552 21.456 1.00 2.30 C ATOM 3534 NH1 ARG B 91 16.336 -4.714 21.690 1.00 2.62 N ATOM 3535 NH2 ARG B 91 15.635 -6.794 21.153 1.00 3.17 N ATOM 0 H ARG B 91 11.618 -2.079 19.048 1.00 0.34 H new ATOM 0 HA ARG B 91 13.783 -3.924 19.278 1.00 0.36 H new ATOM 0 HB2 ARG B 91 10.842 -4.034 20.087 1.00 0.40 H new ATOM 0 HB3 ARG B 91 11.983 -5.293 20.514 1.00 0.40 H new ATOM 0 HG2 ARG B 91 12.281 -2.335 21.251 1.00 0.44 H new ATOM 0 HG3 ARG B 91 11.724 -3.588 22.341 1.00 0.44 H new ATOM 0 HD2 ARG B 91 14.506 -3.076 21.297 1.00 1.07 H new ATOM 0 HD3 ARG B 91 13.998 -3.540 22.909 1.00 1.07 H new ATOM 0 HE ARG B 91 13.368 -5.813 21.380 1.00 1.67 H new ATOM 0 HH11 ARG B 91 16.126 -3.746 21.934 1.00 2.62 H new ATOM 0 HH12 ARG B 91 17.305 -5.025 21.629 1.00 2.62 H new ATOM 0 HH21 ARG B 91 14.875 -7.451 20.977 1.00 3.17 H new ATOM 0 HH22 ARG B 91 16.604 -7.106 21.092 1.00 3.17 H new ATOM 3549 N LYS B 92 11.329 -4.859 17.271 1.00 0.33 N ATOM 3550 CA LYS B 92 11.044 -5.865 16.210 1.00 0.33 C ATOM 3551 C LYS B 92 12.154 -5.803 15.167 1.00 0.31 C ATOM 3552 O LYS B 92 12.624 -6.814 14.687 1.00 0.32 O ATOM 3553 CB LYS B 92 9.688 -5.573 15.563 1.00 0.34 C ATOM 3554 CG LYS B 92 8.565 -5.963 16.531 1.00 0.68 C ATOM 3555 CD LYS B 92 7.212 -5.670 15.881 1.00 1.09 C ATOM 3556 CE LYS B 92 6.082 -6.063 16.833 1.00 1.41 C ATOM 3557 NZ LYS B 92 4.778 -5.926 16.127 1.00 2.14 N ATOM 0 H LYS B 92 10.618 -4.139 17.400 1.00 0.33 H new ATOM 0 HA LYS B 92 11.007 -6.864 16.645 1.00 0.33 H new ATOM 0 HB2 LYS B 92 9.614 -4.515 15.310 1.00 0.34 H new ATOM 0 HB3 LYS B 92 9.590 -6.131 14.632 1.00 0.34 H new ATOM 0 HG2 LYS B 92 8.638 -7.021 16.784 1.00 0.68 H new ATOM 0 HG3 LYS B 92 8.662 -5.405 17.462 1.00 0.68 H new ATOM 0 HD2 LYS B 92 7.139 -4.611 15.634 1.00 1.09 H new ATOM 0 HD3 LYS B 92 7.120 -6.223 14.946 1.00 1.09 H new ATOM 0 HE2 LYS B 92 6.218 -7.089 17.175 1.00 1.41 H new ATOM 0 HE3 LYS B 92 6.098 -5.427 17.718 1.00 1.41 H new ATOM 0 HZ1 LYS B 92 4.005 -6.192 16.770 1.00 2.14 H new ATOM 0 HZ2 LYS B 92 4.650 -4.940 15.822 1.00 2.14 H new ATOM 0 HZ3 LYS B 92 4.766 -6.550 15.295 1.00 2.14 H new ATOM 3571 N VAL B 93 12.602 -4.627 14.836 1.00 0.29 N ATOM 3572 CA VAL B 93 13.708 -4.511 13.850 1.00 0.28 C ATOM 3573 C VAL B 93 14.940 -5.229 14.402 1.00 0.29 C ATOM 3574 O VAL B 93 15.631 -5.932 13.694 1.00 0.29 O ATOM 3575 CB VAL B 93 14.034 -3.030 13.621 1.00 0.28 C ATOM 3576 CG1 VAL B 93 15.338 -2.894 12.817 1.00 0.29 C ATOM 3577 CG2 VAL B 93 12.883 -2.378 12.848 1.00 0.28 C ATOM 0 H VAL B 93 12.251 -3.743 15.205 1.00 0.29 H new ATOM 0 HA VAL B 93 13.412 -4.963 12.904 1.00 0.28 H new ATOM 0 HB VAL B 93 14.161 -2.535 14.584 1.00 0.28 H new ATOM 0 HG11 VAL B 93 15.560 -1.839 12.660 1.00 0.29 H new ATOM 0 HG12 VAL B 93 16.155 -3.359 13.368 1.00 0.29 H new ATOM 0 HG13 VAL B 93 15.224 -3.388 11.852 1.00 0.29 H new ATOM 0 HG21 VAL B 93 13.107 -1.324 12.681 1.00 0.28 H new ATOM 0 HG22 VAL B 93 12.760 -2.879 11.888 1.00 0.28 H new ATOM 0 HG23 VAL B 93 11.962 -2.466 13.424 1.00 0.28 H new ATOM 3587 N ASP B 94 15.229 -5.045 15.661 1.00 0.30 N ATOM 3588 CA ASP B 94 16.422 -5.707 16.253 1.00 0.32 C ATOM 3589 C ASP B 94 16.287 -7.226 16.156 1.00 0.33 C ATOM 3590 O ASP B 94 17.240 -7.921 15.862 1.00 0.35 O ATOM 3591 CB ASP B 94 16.552 -5.307 17.725 1.00 0.35 C ATOM 3592 CG ASP B 94 16.960 -3.838 17.827 1.00 1.26 C ATOM 3593 OD1 ASP B 94 17.534 -3.335 16.875 1.00 2.03 O ATOM 3594 OD2 ASP B 94 16.703 -3.242 18.860 1.00 1.96 O ATOM 0 H ASP B 94 14.690 -4.465 16.304 1.00 0.30 H new ATOM 0 HA ASP B 94 17.308 -5.391 15.703 1.00 0.32 H new ATOM 0 HB2 ASP B 94 15.605 -5.468 18.240 1.00 0.35 H new ATOM 0 HB3 ASP B 94 17.294 -5.935 18.218 1.00 0.35 H new ATOM 3599 N PHE B 95 15.121 -7.757 16.407 1.00 0.34 N ATOM 3600 CA PHE B 95 14.964 -9.236 16.327 1.00 0.36 C ATOM 3601 C PHE B 95 15.125 -9.693 14.879 1.00 0.34 C ATOM 3602 O PHE B 95 15.819 -10.651 14.597 1.00 0.35 O ATOM 3603 CB PHE B 95 13.580 -9.651 16.842 1.00 0.39 C ATOM 3604 CG PHE B 95 13.542 -9.555 18.352 1.00 0.43 C ATOM 3605 CD1 PHE B 95 14.269 -10.466 19.128 1.00 0.47 C ATOM 3606 CD2 PHE B 95 12.781 -8.558 18.974 1.00 0.43 C ATOM 3607 CE1 PHE B 95 14.234 -10.380 20.526 1.00 0.51 C ATOM 3608 CE2 PHE B 95 12.745 -8.473 20.372 1.00 0.47 C ATOM 3609 CZ PHE B 95 13.472 -9.385 21.147 1.00 0.51 C ATOM 0 H PHE B 95 14.280 -7.238 16.661 1.00 0.34 H new ATOM 0 HA PHE B 95 15.729 -9.704 16.946 1.00 0.36 H new ATOM 0 HB2 PHE B 95 12.813 -9.008 16.409 1.00 0.39 H new ATOM 0 HB3 PHE B 95 13.356 -10.671 16.528 1.00 0.39 H new ATOM 0 HD1 PHE B 95 14.857 -11.235 18.649 1.00 0.47 H new ATOM 0 HD2 PHE B 95 12.221 -7.854 18.376 1.00 0.43 H new ATOM 0 HE1 PHE B 95 14.796 -11.082 21.124 1.00 0.51 H new ATOM 0 HE2 PHE B 95 12.157 -7.705 20.852 1.00 0.47 H new ATOM 0 HZ PHE B 95 13.444 -9.320 22.225 1.00 0.51 H new ATOM 3619 N LEU B 96 14.507 -9.017 13.952 1.00 0.32 N ATOM 3620 CA LEU B 96 14.653 -9.431 12.532 1.00 0.32 C ATOM 3621 C LEU B 96 16.078 -9.126 12.081 1.00 0.31 C ATOM 3622 O LEU B 96 16.699 -9.900 11.380 1.00 0.32 O ATOM 3623 CB LEU B 96 13.659 -8.655 11.663 1.00 0.32 C ATOM 3624 CG LEU B 96 12.219 -8.939 12.122 1.00 0.33 C ATOM 3625 CD1 LEU B 96 11.246 -8.123 11.264 1.00 0.35 C ATOM 3626 CD2 LEU B 96 11.900 -10.437 11.970 1.00 0.36 C ATOM 0 H LEU B 96 13.913 -8.204 14.115 1.00 0.32 H new ATOM 0 HA LEU B 96 14.451 -10.497 12.432 1.00 0.32 H new ATOM 0 HB2 LEU B 96 13.865 -7.587 11.727 1.00 0.32 H new ATOM 0 HB3 LEU B 96 13.778 -8.940 10.618 1.00 0.32 H new ATOM 0 HG LEU B 96 12.116 -8.658 13.170 1.00 0.33 H new ATOM 0 HD11 LEU B 96 10.223 -8.321 11.586 1.00 0.35 H new ATOM 0 HD12 LEU B 96 11.463 -7.061 11.378 1.00 0.35 H new ATOM 0 HD13 LEU B 96 11.358 -8.406 10.217 1.00 0.35 H new ATOM 0 HD21 LEU B 96 10.878 -10.626 12.298 1.00 0.36 H new ATOM 0 HD22 LEU B 96 12.005 -10.727 10.925 1.00 0.36 H new ATOM 0 HD23 LEU B 96 12.591 -11.020 12.580 1.00 0.36 H new ATOM 3638 N GLU B 97 16.607 -8.002 12.490 1.00 0.31 N ATOM 3639 CA GLU B 97 17.995 -7.654 12.093 1.00 0.32 C ATOM 3640 C GLU B 97 18.950 -8.730 12.615 1.00 0.33 C ATOM 3641 O GLU B 97 19.770 -9.248 11.884 1.00 0.35 O ATOM 3642 CB GLU B 97 18.367 -6.288 12.675 1.00 0.34 C ATOM 3643 CG GLU B 97 19.786 -5.917 12.241 1.00 0.95 C ATOM 3644 CD GLU B 97 20.120 -4.507 12.732 1.00 1.23 C ATOM 3645 OE1 GLU B 97 19.194 -3.770 13.032 1.00 1.86 O ATOM 3646 OE2 GLU B 97 21.294 -4.182 12.783 1.00 1.69 O ATOM 0 H GLU B 97 16.137 -7.315 13.079 1.00 0.31 H new ATOM 0 HA GLU B 97 18.069 -7.605 11.007 1.00 0.32 H new ATOM 0 HB2 GLU B 97 17.661 -5.531 12.333 1.00 0.34 H new ATOM 0 HB3 GLU B 97 18.303 -6.315 13.763 1.00 0.34 H new ATOM 0 HG2 GLU B 97 20.500 -6.633 12.647 1.00 0.95 H new ATOM 0 HG3 GLU B 97 19.869 -5.964 11.155 1.00 0.95 H new ATOM 3653 N GLU B 98 18.846 -9.077 13.872 1.00 0.34 N ATOM 3654 CA GLU B 98 19.750 -10.125 14.425 1.00 0.37 C ATOM 3655 C GLU B 98 19.518 -11.436 13.676 1.00 0.36 C ATOM 3656 O GLU B 98 20.447 -12.137 13.327 1.00 0.37 O ATOM 3657 CB GLU B 98 19.456 -10.323 15.917 1.00 0.40 C ATOM 3658 CG GLU B 98 20.452 -11.319 16.523 1.00 1.18 C ATOM 3659 CD GLU B 98 21.860 -10.718 16.495 1.00 1.33 C ATOM 3660 OE1 GLU B 98 21.967 -9.515 16.324 1.00 1.78 O ATOM 3661 OE2 GLU B 98 22.808 -11.471 16.649 1.00 1.85 O ATOM 0 H GLU B 98 18.178 -8.682 14.534 1.00 0.34 H new ATOM 0 HA GLU B 98 20.788 -9.815 14.303 1.00 0.37 H new ATOM 0 HB2 GLU B 98 19.522 -9.368 16.438 1.00 0.40 H new ATOM 0 HB3 GLU B 98 18.438 -10.689 16.050 1.00 0.40 H new ATOM 0 HG2 GLU B 98 20.167 -11.556 17.548 1.00 1.18 H new ATOM 0 HG3 GLU B 98 20.433 -12.254 15.963 1.00 1.18 H new ATOM 3668 N ASN B 99 18.284 -11.775 13.427 1.00 0.35 N ATOM 3669 CA ASN B 99 17.999 -13.042 12.701 1.00 0.35 C ATOM 3670 C ASN B 99 18.638 -12.986 11.313 1.00 0.33 C ATOM 3671 O ASN B 99 19.271 -13.925 10.872 1.00 0.34 O ATOM 3672 CB ASN B 99 16.486 -13.214 12.562 1.00 0.36 C ATOM 3673 CG ASN B 99 15.877 -13.504 13.934 1.00 1.25 C ATOM 3674 OD1 ASN B 99 14.667 -13.093 14.195 1.00 2.16 O flip ATOM 3675 ND2 ASN B 99 16.512 -14.103 14.780 1.00 1.82 N flip ATOM 0 H ASN B 99 17.463 -11.231 13.694 1.00 0.35 H new ATOM 0 HA ASN B 99 18.412 -13.885 13.256 1.00 0.35 H new ATOM 0 HB2 ASN B 99 16.044 -12.312 12.140 1.00 0.36 H new ATOM 0 HB3 ASN B 99 16.264 -14.030 11.874 1.00 0.36 H new ATOM 0 HD21 ASN B 99 17.458 -14.424 14.575 1.00 1.82 H new ATOM 0 HD22 ASN B 99 16.099 -14.284 15.695 1.00 1.82 H new ATOM 3682 N ILE B 100 18.484 -11.885 10.621 1.00 0.31 N ATOM 3683 CA ILE B 100 19.087 -11.775 9.264 1.00 0.30 C ATOM 3684 C ILE B 100 20.604 -11.936 9.369 1.00 0.31 C ATOM 3685 O ILE B 100 21.206 -12.701 8.640 1.00 0.32 O ATOM 3686 CB ILE B 100 18.742 -10.410 8.649 1.00 0.28 C ATOM 3687 CG1 ILE B 100 17.244 -10.378 8.312 1.00 0.29 C ATOM 3688 CG2 ILE B 100 19.564 -10.195 7.366 1.00 0.28 C ATOM 3689 CD1 ILE B 100 16.829 -8.951 7.940 1.00 0.30 C ATOM 0 H ILE B 100 17.969 -11.063 10.938 1.00 0.31 H new ATOM 0 HA ILE B 100 18.686 -12.560 8.623 1.00 0.30 H new ATOM 0 HB ILE B 100 18.978 -9.618 9.360 1.00 0.28 H new ATOM 0 HG12 ILE B 100 17.033 -11.056 7.485 1.00 0.29 H new ATOM 0 HG13 ILE B 100 16.662 -10.726 9.165 1.00 0.29 H new ATOM 0 HG21 ILE B 100 19.316 -9.226 6.933 1.00 0.28 H new ATOM 0 HG22 ILE B 100 20.627 -10.224 7.606 1.00 0.28 H new ATOM 0 HG23 ILE B 100 19.332 -10.983 6.649 1.00 0.28 H new ATOM 0 HD11 ILE B 100 15.766 -8.932 7.701 1.00 0.30 H new ATOM 0 HD12 ILE B 100 17.025 -8.285 8.780 1.00 0.30 H new ATOM 0 HD13 ILE B 100 17.401 -8.620 7.073 1.00 0.30 H new ATOM 3701 N THR B 101 21.231 -11.221 10.267 1.00 0.33 N ATOM 3702 CA THR B 101 22.710 -11.339 10.402 1.00 0.36 C ATOM 3703 C THR B 101 23.075 -12.780 10.750 1.00 0.38 C ATOM 3704 O THR B 101 24.015 -13.336 10.218 1.00 0.40 O ATOM 3705 CB THR B 101 23.206 -10.405 11.511 1.00 0.39 C ATOM 3706 OG1 THR B 101 22.497 -10.671 12.712 1.00 0.40 O ATOM 3707 CG2 THR B 101 22.986 -8.949 11.094 1.00 0.39 C ATOM 0 H THR B 101 20.785 -10.565 10.908 1.00 0.33 H new ATOM 0 HA THR B 101 23.181 -11.060 9.459 1.00 0.36 H new ATOM 0 HB THR B 101 24.270 -10.575 11.676 1.00 0.39 H new ATOM 0 HG1 THR B 101 21.674 -11.161 12.504 1.00 0.40 H new ATOM 0 HG21 THR B 101 23.340 -8.287 11.884 1.00 0.39 H new ATOM 0 HG22 THR B 101 23.538 -8.746 10.176 1.00 0.39 H new ATOM 0 HG23 THR B 101 21.923 -8.776 10.924 1.00 0.39 H new ATOM 3715 N ALA B 102 22.338 -13.396 11.634 1.00 0.38 N ATOM 3716 CA ALA B 102 22.648 -14.805 11.997 1.00 0.41 C ATOM 3717 C ALA B 102 22.534 -15.681 10.751 1.00 0.40 C ATOM 3718 O ALA B 102 23.415 -16.455 10.438 1.00 0.42 O ATOM 3719 CB ALA B 102 21.670 -15.294 13.066 1.00 0.43 C ATOM 0 H ALA B 102 21.539 -12.986 12.117 1.00 0.38 H new ATOM 0 HA ALA B 102 23.662 -14.864 12.393 1.00 0.41 H new ATOM 0 HB1 ALA B 102 21.903 -16.326 13.327 1.00 0.43 H new ATOM 0 HB2 ALA B 102 21.757 -14.667 13.953 1.00 0.43 H new ATOM 0 HB3 ALA B 102 20.652 -15.238 12.681 1.00 0.43 H new ATOM 3725 N LEU B 103 21.451 -15.560 10.035 1.00 0.37 N ATOM 3726 CA LEU B 103 21.273 -16.378 8.804 1.00 0.36 C ATOM 3727 C LEU B 103 22.392 -16.059 7.810 1.00 0.34 C ATOM 3728 O LEU B 103 22.957 -16.942 7.197 1.00 0.36 O ATOM 3729 CB LEU B 103 19.925 -16.044 8.173 1.00 0.34 C ATOM 3730 CG LEU B 103 18.776 -16.569 9.052 1.00 0.35 C ATOM 3731 CD1 LEU B 103 17.441 -16.052 8.503 1.00 0.37 C ATOM 3732 CD2 LEU B 103 18.769 -18.112 9.069 1.00 0.43 C ATOM 0 H LEU B 103 20.680 -14.928 10.250 1.00 0.37 H new ATOM 0 HA LEU B 103 21.309 -17.437 9.060 1.00 0.36 H new ATOM 0 HB2 LEU B 103 19.832 -14.965 8.048 1.00 0.34 H new ATOM 0 HB3 LEU B 103 19.862 -16.486 7.179 1.00 0.34 H new ATOM 0 HG LEU B 103 18.919 -16.212 10.072 1.00 0.35 H new ATOM 0 HD11 LEU B 103 16.625 -16.422 9.123 1.00 0.37 H new ATOM 0 HD12 LEU B 103 17.440 -14.962 8.515 1.00 0.37 H new ATOM 0 HD13 LEU B 103 17.308 -16.404 7.480 1.00 0.37 H new ATOM 0 HD21 LEU B 103 17.950 -18.465 9.695 1.00 0.43 H new ATOM 0 HD22 LEU B 103 18.637 -18.486 8.054 1.00 0.43 H new ATOM 0 HD23 LEU B 103 19.715 -18.476 9.470 1.00 0.43 H new ATOM 3744 N LEU B 104 22.721 -14.804 7.638 1.00 0.33 N ATOM 3745 CA LEU B 104 23.808 -14.464 6.678 1.00 0.33 C ATOM 3746 C LEU B 104 25.099 -15.144 7.125 1.00 0.37 C ATOM 3747 O LEU B 104 25.837 -15.679 6.322 1.00 0.39 O ATOM 3748 CB LEU B 104 24.023 -12.945 6.624 1.00 0.33 C ATOM 3749 CG LEU B 104 22.831 -12.256 5.941 1.00 0.29 C ATOM 3750 CD1 LEU B 104 22.961 -10.738 6.116 1.00 0.31 C ATOM 3751 CD2 LEU B 104 22.800 -12.599 4.436 1.00 0.28 C ATOM 0 H LEU B 104 22.290 -14.012 8.114 1.00 0.33 H new ATOM 0 HA LEU B 104 23.526 -14.812 5.684 1.00 0.33 H new ATOM 0 HB2 LEU B 104 24.147 -12.553 7.634 1.00 0.33 H new ATOM 0 HB3 LEU B 104 24.941 -12.721 6.080 1.00 0.33 H new ATOM 0 HG LEU B 104 21.906 -12.607 6.399 1.00 0.29 H new ATOM 0 HD11 LEU B 104 22.118 -10.243 5.634 1.00 0.31 H new ATOM 0 HD12 LEU B 104 22.966 -10.493 7.178 1.00 0.31 H new ATOM 0 HD13 LEU B 104 23.891 -10.398 5.661 1.00 0.31 H new ATOM 0 HD21 LEU B 104 21.950 -12.103 3.967 1.00 0.28 H new ATOM 0 HD22 LEU B 104 23.723 -12.259 3.966 1.00 0.28 H new ATOM 0 HD23 LEU B 104 22.705 -13.678 4.311 1.00 0.28 H new ATOM 3763 N GLU B 105 25.379 -15.144 8.400 1.00 0.40 N ATOM 3764 CA GLU B 105 26.623 -15.812 8.863 1.00 0.45 C ATOM 3765 C GLU B 105 26.559 -17.286 8.471 1.00 0.46 C ATOM 3766 O GLU B 105 27.500 -17.839 7.939 1.00 0.48 O ATOM 3767 CB GLU B 105 26.751 -15.684 10.383 1.00 0.49 C ATOM 3768 CG GLU B 105 28.063 -16.328 10.842 1.00 0.53 C ATOM 3769 CD GLU B 105 28.202 -16.192 12.360 1.00 1.15 C ATOM 3770 OE1 GLU B 105 27.411 -15.472 12.949 1.00 1.82 O ATOM 3771 OE2 GLU B 105 29.097 -16.814 12.908 1.00 1.84 O ATOM 0 H GLU B 105 24.808 -14.717 9.130 1.00 0.40 H new ATOM 0 HA GLU B 105 27.490 -15.341 8.400 1.00 0.45 H new ATOM 0 HB2 GLU B 105 26.728 -14.634 10.673 1.00 0.49 H new ATOM 0 HB3 GLU B 105 25.906 -16.168 10.872 1.00 0.49 H new ATOM 0 HG2 GLU B 105 28.081 -17.380 10.558 1.00 0.53 H new ATOM 0 HG3 GLU B 105 28.907 -15.849 10.346 1.00 0.53 H new ATOM 3778 N GLU B 106 25.452 -17.924 8.723 1.00 0.45 N ATOM 3779 CA GLU B 106 25.327 -19.360 8.354 1.00 0.47 C ATOM 3780 C GLU B 106 25.332 -19.477 6.832 1.00 0.44 C ATOM 3781 O GLU B 106 25.935 -20.370 6.270 1.00 0.46 O ATOM 3782 CB GLU B 106 24.019 -19.922 8.917 1.00 0.48 C ATOM 3783 CG GLU B 106 24.126 -20.013 10.442 1.00 1.17 C ATOM 3784 CD GLU B 106 22.808 -20.537 11.016 1.00 1.66 C ATOM 3785 OE1 GLU B 106 21.837 -20.579 10.277 1.00 2.27 O ATOM 3786 OE2 GLU B 106 22.788 -20.874 12.188 1.00 2.26 O ATOM 0 H GLU B 106 24.630 -17.515 9.167 1.00 0.45 H new ATOM 0 HA GLU B 106 26.161 -19.927 8.768 1.00 0.47 H new ATOM 0 HB2 GLU B 106 23.183 -19.281 8.637 1.00 0.48 H new ATOM 0 HB3 GLU B 106 23.821 -20.907 8.495 1.00 0.48 H new ATOM 0 HG2 GLU B 106 24.945 -20.676 10.721 1.00 1.17 H new ATOM 0 HG3 GLU B 106 24.353 -19.032 10.860 1.00 1.17 H new ATOM 3793 N ALA B 107 24.671 -18.575 6.157 1.00 0.39 N ATOM 3794 CA ALA B 107 24.653 -18.631 4.671 1.00 0.37 C ATOM 3795 C ALA B 107 26.086 -18.517 4.149 1.00 0.40 C ATOM 3796 O ALA B 107 26.515 -19.286 3.313 1.00 0.41 O ATOM 3797 CB ALA B 107 23.803 -17.485 4.117 1.00 0.34 C ATOM 0 H ALA B 107 24.145 -17.805 6.571 1.00 0.39 H new ATOM 0 HA ALA B 107 24.220 -19.577 4.346 1.00 0.37 H new ATOM 0 HB1 ALA B 107 23.794 -17.532 3.028 1.00 0.34 H new ATOM 0 HB2 ALA B 107 22.784 -17.574 4.492 1.00 0.34 H new ATOM 0 HB3 ALA B 107 24.225 -16.532 4.436 1.00 0.34 H new ATOM 3803 N GLN B 108 26.839 -17.565 4.643 1.00 0.42 N ATOM 3804 CA GLN B 108 28.245 -17.424 4.170 1.00 0.46 C ATOM 3805 C GLN B 108 29.009 -18.707 4.477 1.00 0.50 C ATOM 3806 O GLN B 108 29.691 -19.257 3.635 1.00 0.53 O ATOM 3807 CB GLN B 108 28.916 -16.249 4.882 1.00 0.50 C ATOM 3808 CG GLN B 108 28.308 -14.940 4.383 1.00 0.48 C ATOM 3809 CD GLN B 108 28.973 -13.762 5.096 1.00 0.98 C ATOM 3810 OE1 GLN B 108 30.174 -13.747 5.277 1.00 1.68 O ATOM 3811 NE2 GLN B 108 28.239 -12.776 5.530 1.00 1.58 N ATOM 0 H GLN B 108 26.542 -16.888 5.346 1.00 0.42 H new ATOM 0 HA GLN B 108 28.249 -17.241 3.095 1.00 0.46 H new ATOM 0 HB2 GLN B 108 28.781 -16.338 5.960 1.00 0.50 H new ATOM 0 HB3 GLN B 108 29.989 -16.260 4.693 1.00 0.50 H new ATOM 0 HG2 GLN B 108 28.446 -14.851 3.305 1.00 0.48 H new ATOM 0 HG3 GLN B 108 27.234 -14.932 4.569 1.00 0.48 H new ATOM 0 HE21 GLN B 108 27.230 -12.786 5.379 1.00 1.58 H new ATOM 0 HE22 GLN B 108 28.673 -11.994 6.020 1.00 1.58 H new ATOM 3820 N ILE B 109 28.891 -19.195 5.680 1.00 0.52 N ATOM 3821 CA ILE B 109 29.598 -20.449 6.044 1.00 0.57 C ATOM 3822 C ILE B 109 29.110 -21.571 5.127 1.00 0.56 C ATOM 3823 O ILE B 109 29.892 -22.292 4.538 1.00 0.58 O ATOM 3824 CB ILE B 109 29.298 -20.788 7.506 1.00 0.61 C ATOM 3825 CG1 ILE B 109 29.938 -19.729 8.409 1.00 0.64 C ATOM 3826 CG2 ILE B 109 29.873 -22.165 7.846 1.00 0.67 C ATOM 3827 CD1 ILE B 109 29.429 -19.898 9.841 1.00 0.67 C ATOM 0 H ILE B 109 28.334 -18.778 6.426 1.00 0.52 H new ATOM 0 HA ILE B 109 30.675 -20.329 5.924 1.00 0.57 H new ATOM 0 HB ILE B 109 28.219 -20.802 7.663 1.00 0.61 H new ATOM 0 HG12 ILE B 109 31.024 -19.824 8.385 1.00 0.64 H new ATOM 0 HG13 ILE B 109 29.697 -18.731 8.043 1.00 0.64 H new ATOM 0 HG21 ILE B 109 29.657 -22.402 8.888 1.00 0.67 H new ATOM 0 HG22 ILE B 109 29.420 -22.918 7.201 1.00 0.67 H new ATOM 0 HG23 ILE B 109 30.952 -22.157 7.692 1.00 0.67 H new ATOM 0 HD11 ILE B 109 29.886 -19.143 10.481 1.00 0.67 H new ATOM 0 HD12 ILE B 109 28.345 -19.781 9.858 1.00 0.67 H new ATOM 0 HD13 ILE B 109 29.692 -20.891 10.206 1.00 0.67 H new ATOM 3839 N GLN B 110 27.818 -21.722 4.996 1.00 0.52 N ATOM 3840 CA GLN B 110 27.280 -22.790 4.109 1.00 0.52 C ATOM 3841 C GLN B 110 27.671 -22.489 2.659 1.00 0.48 C ATOM 3842 O GLN B 110 28.016 -23.376 1.904 1.00 0.50 O ATOM 3843 CB GLN B 110 25.752 -22.832 4.230 1.00 0.50 C ATOM 3844 CG GLN B 110 25.195 -23.954 3.350 1.00 1.17 C ATOM 3845 CD GLN B 110 23.678 -24.039 3.531 1.00 1.46 C ATOM 3846 OE1 GLN B 110 23.127 -23.430 4.426 1.00 2.12 O ATOM 3847 NE2 GLN B 110 22.974 -24.767 2.709 1.00 1.93 N ATOM 0 H GLN B 110 27.114 -21.152 5.465 1.00 0.52 H new ATOM 0 HA GLN B 110 27.693 -23.754 4.405 1.00 0.52 H new ATOM 0 HB2 GLN B 110 25.464 -22.995 5.269 1.00 0.50 H new ATOM 0 HB3 GLN B 110 25.327 -21.875 3.928 1.00 0.50 H new ATOM 0 HG2 GLN B 110 25.437 -23.765 2.304 1.00 1.17 H new ATOM 0 HG3 GLN B 110 25.658 -24.904 3.617 1.00 1.17 H new ATOM 0 HE21 GLN B 110 23.436 -25.279 1.957 1.00 1.93 H new ATOM 0 HE22 GLN B 110 21.961 -24.825 2.818 1.00 1.93 H new ATOM 3856 N GLN B 111 27.617 -21.243 2.260 1.00 0.45 N ATOM 3857 CA GLN B 111 27.981 -20.893 0.858 1.00 0.43 C ATOM 3858 C GLN B 111 29.433 -21.296 0.582 1.00 0.49 C ATOM 3859 O GLN B 111 29.736 -21.902 -0.424 1.00 0.49 O ATOM 3860 CB GLN B 111 27.821 -19.383 0.647 1.00 0.42 C ATOM 3861 CG GLN B 111 27.978 -19.046 -0.840 1.00 0.42 C ATOM 3862 CD GLN B 111 26.764 -19.565 -1.611 1.00 0.38 C ATOM 3863 OE1 GLN B 111 25.647 -19.470 -1.141 1.00 0.37 O ATOM 3864 NE2 GLN B 111 26.934 -20.115 -2.784 1.00 0.40 N ATOM 0 H GLN B 111 27.337 -20.456 2.845 1.00 0.45 H new ATOM 0 HA GLN B 111 27.323 -21.428 0.174 1.00 0.43 H new ATOM 0 HB2 GLN B 111 26.842 -19.059 1.001 1.00 0.42 H new ATOM 0 HB3 GLN B 111 28.566 -18.844 1.232 1.00 0.42 H new ATOM 0 HG2 GLN B 111 28.072 -17.968 -0.972 1.00 0.42 H new ATOM 0 HG3 GLN B 111 28.890 -19.496 -1.231 1.00 0.42 H new ATOM 0 HE21 GLN B 111 27.871 -20.195 -3.179 1.00 0.40 H new ATOM 0 HE22 GLN B 111 26.130 -20.464 -3.305 1.00 0.40 H new ATOM 3873 N GLU B 112 30.340 -20.958 1.461 1.00 0.54 N ATOM 3874 CA GLU B 112 31.766 -21.326 1.230 1.00 0.60 C ATOM 3875 C GLU B 112 31.907 -22.850 1.175 1.00 0.62 C ATOM 3876 O GLU B 112 32.639 -23.381 0.365 1.00 0.64 O ATOM 3877 CB GLU B 112 32.636 -20.756 2.363 1.00 0.66 C ATOM 3878 CG GLU B 112 32.921 -19.269 2.112 1.00 1.29 C ATOM 3879 CD GLU B 112 31.606 -18.493 2.007 1.00 1.72 C ATOM 3880 OE1 GLU B 112 30.911 -18.674 1.021 1.00 2.27 O ATOM 3881 OE2 GLU B 112 31.322 -17.724 2.910 1.00 2.25 O ATOM 0 H GLU B 112 30.156 -20.446 2.324 1.00 0.54 H new ATOM 0 HA GLU B 112 32.098 -20.907 0.280 1.00 0.60 H new ATOM 0 HB2 GLU B 112 32.128 -20.881 3.320 1.00 0.66 H new ATOM 0 HB3 GLU B 112 33.574 -21.309 2.425 1.00 0.66 H new ATOM 0 HG2 GLU B 112 33.527 -18.865 2.923 1.00 1.29 H new ATOM 0 HG3 GLU B 112 33.497 -19.151 1.194 1.00 1.29 H new ATOM 3888 N LYS B 113 31.216 -23.563 2.019 1.00 0.62 N ATOM 3889 CA LYS B 113 31.329 -25.050 1.992 1.00 0.65 C ATOM 3890 C LYS B 113 30.776 -25.584 0.670 1.00 0.60 C ATOM 3891 O LYS B 113 31.322 -26.500 0.088 1.00 0.63 O ATOM 3892 CB LYS B 113 30.549 -25.665 3.161 1.00 0.68 C ATOM 3893 CG LYS B 113 31.261 -25.354 4.483 1.00 0.75 C ATOM 3894 CD LYS B 113 30.676 -26.215 5.611 1.00 1.28 C ATOM 3895 CE LYS B 113 29.216 -25.839 5.857 1.00 1.53 C ATOM 3896 NZ LYS B 113 28.764 -26.435 7.146 1.00 2.10 N ATOM 0 H LYS B 113 30.581 -23.185 2.723 1.00 0.62 H new ATOM 0 HA LYS B 113 32.380 -25.324 2.086 1.00 0.65 H new ATOM 0 HB2 LYS B 113 29.534 -25.268 3.182 1.00 0.68 H new ATOM 0 HB3 LYS B 113 30.466 -26.744 3.027 1.00 0.68 H new ATOM 0 HG2 LYS B 113 32.329 -25.547 4.384 1.00 0.75 H new ATOM 0 HG3 LYS B 113 31.149 -24.297 4.726 1.00 0.75 H new ATOM 0 HD2 LYS B 113 30.748 -27.270 5.348 1.00 1.28 H new ATOM 0 HD3 LYS B 113 31.255 -26.074 6.524 1.00 1.28 H new ATOM 0 HE2 LYS B 113 29.108 -24.755 5.887 1.00 1.53 H new ATOM 0 HE3 LYS B 113 28.593 -26.199 5.038 1.00 1.53 H new ATOM 0 HZ1 LYS B 113 27.770 -26.181 7.316 1.00 2.10 H new ATOM 0 HZ2 LYS B 113 28.854 -27.470 7.100 1.00 2.10 H new ATOM 0 HZ3 LYS B 113 29.352 -26.071 7.922 1.00 2.10 H new ATOM 3910 N ASN B 114 29.694 -25.028 0.193 1.00 0.53 N ATOM 3911 CA ASN B 114 29.120 -25.525 -1.086 1.00 0.49 C ATOM 3912 C ASN B 114 30.150 -25.363 -2.203 1.00 0.49 C ATOM 3913 O ASN B 114 30.348 -26.255 -3.004 1.00 0.50 O ATOM 3914 CB ASN B 114 27.864 -24.719 -1.431 1.00 0.44 C ATOM 3915 CG ASN B 114 26.750 -25.057 -0.439 1.00 0.46 C ATOM 3916 OD1 ASN B 114 26.007 -24.188 -0.025 1.00 1.19 O ATOM 3917 ND2 ASN B 114 26.600 -26.289 -0.034 1.00 1.18 N ATOM 0 H ASN B 114 29.188 -24.258 0.631 1.00 0.53 H new ATOM 0 HA ASN B 114 28.858 -26.578 -0.981 1.00 0.49 H new ATOM 0 HB2 ASN B 114 28.084 -23.652 -1.397 1.00 0.44 H new ATOM 0 HB3 ASN B 114 27.541 -24.946 -2.447 1.00 0.44 H new ATOM 0 HD21 ASN B 114 25.860 -26.521 0.629 1.00 1.18 H new ATOM 0 HD22 ASN B 114 27.222 -27.019 -0.380 1.00 1.18 H new ATOM 3924 N MET B 115 30.820 -24.242 -2.262 1.00 0.50 N ATOM 3925 CA MET B 115 31.839 -24.054 -3.329 1.00 0.54 C ATOM 3926 C MET B 115 33.009 -25.005 -3.062 1.00 0.61 C ATOM 3927 O MET B 115 33.555 -25.606 -3.966 1.00 0.63 O ATOM 3928 CB MET B 115 32.332 -22.604 -3.322 1.00 0.57 C ATOM 3929 CG MET B 115 33.327 -22.392 -4.465 1.00 0.72 C ATOM 3930 SD MET B 115 33.887 -20.672 -4.462 1.00 0.94 S ATOM 3931 CE MET B 115 35.103 -20.816 -5.794 1.00 1.46 C ATOM 0 H MET B 115 30.705 -23.456 -1.622 1.00 0.50 H new ATOM 0 HA MET B 115 31.403 -24.271 -4.304 1.00 0.54 H new ATOM 0 HB2 MET B 115 31.488 -21.922 -3.430 1.00 0.57 H new ATOM 0 HB3 MET B 115 32.806 -22.375 -2.367 1.00 0.57 H new ATOM 0 HG2 MET B 115 34.178 -23.063 -4.350 1.00 0.72 H new ATOM 0 HG3 MET B 115 32.858 -22.632 -5.419 1.00 0.72 H new ATOM 0 HE1 MET B 115 35.577 -19.849 -5.960 1.00 1.46 H new ATOM 0 HE2 MET B 115 35.861 -21.549 -5.517 1.00 1.46 H new ATOM 0 HE3 MET B 115 34.605 -21.138 -6.708 1.00 1.46 H new ATOM 3941 N TYR B 116 33.388 -25.152 -1.819 1.00 0.65 N ATOM 3942 CA TYR B 116 34.511 -26.072 -1.476 1.00 0.73 C ATOM 3943 C TYR B 116 34.157 -27.494 -1.921 1.00 0.72 C ATOM 3944 O TYR B 116 34.952 -28.180 -2.532 1.00 0.76 O ATOM 3945 CB TYR B 116 34.744 -26.055 0.038 1.00 0.78 C ATOM 3946 CG TYR B 116 35.892 -26.973 0.387 1.00 0.87 C ATOM 3947 CD1 TYR B 116 35.648 -28.324 0.663 1.00 0.91 C ATOM 3948 CD2 TYR B 116 37.201 -26.476 0.432 1.00 0.95 C ATOM 3949 CE1 TYR B 116 36.714 -29.176 0.985 1.00 1.01 C ATOM 3950 CE2 TYR B 116 38.265 -27.327 0.754 1.00 1.05 C ATOM 3951 CZ TYR B 116 38.021 -28.677 1.030 1.00 1.07 C ATOM 3952 OH TYR B 116 39.068 -29.518 1.346 1.00 1.18 O ATOM 0 H TYR B 116 32.966 -24.672 -1.024 1.00 0.65 H new ATOM 0 HA TYR B 116 35.417 -25.744 -1.986 1.00 0.73 H new ATOM 0 HB2 TYR B 116 34.963 -25.040 0.371 1.00 0.78 H new ATOM 0 HB3 TYR B 116 33.840 -26.373 0.558 1.00 0.78 H new ATOM 0 HD1 TYR B 116 34.640 -28.709 0.628 1.00 0.91 H new ATOM 0 HD2 TYR B 116 37.390 -25.434 0.218 1.00 0.95 H new ATOM 0 HE1 TYR B 116 36.527 -30.218 1.198 1.00 1.01 H new ATOM 0 HE2 TYR B 116 39.273 -26.942 0.789 1.00 1.05 H new ATOM 0 HH TYR B 116 39.908 -29.014 1.332 1.00 1.18 H new ATOM 3962 N GLU B 117 32.972 -27.949 -1.609 1.00 0.68 N ATOM 3963 CA GLU B 117 32.576 -29.332 -2.008 1.00 0.68 C ATOM 3964 C GLU B 117 32.626 -29.462 -3.532 1.00 0.64 C ATOM 3965 O GLU B 117 33.071 -30.459 -4.065 1.00 0.68 O ATOM 3966 CB GLU B 117 31.157 -29.613 -1.511 1.00 0.66 C ATOM 3967 CG GLU B 117 31.161 -29.734 0.016 1.00 0.72 C ATOM 3968 CD GLU B 117 29.736 -29.987 0.512 1.00 0.73 C ATOM 3969 OE1 GLU B 117 28.827 -29.903 -0.295 1.00 1.29 O ATOM 3970 OE2 GLU B 117 29.578 -30.258 1.692 1.00 1.28 O ATOM 0 H GLU B 117 32.263 -27.425 -1.097 1.00 0.68 H new ATOM 0 HA GLU B 117 33.265 -30.052 -1.566 1.00 0.68 H new ATOM 0 HB2 GLU B 117 30.487 -28.811 -1.820 1.00 0.66 H new ATOM 0 HB3 GLU B 117 30.780 -30.533 -1.958 1.00 0.66 H new ATOM 0 HG2 GLU B 117 31.815 -30.549 0.325 1.00 0.72 H new ATOM 0 HG3 GLU B 117 31.556 -28.822 0.463 1.00 0.72 H new ATOM 3977 N LEU B 118 32.186 -28.458 -4.238 1.00 0.58 N ATOM 3978 CA LEU B 118 32.225 -28.521 -5.725 1.00 0.56 C ATOM 3979 C LEU B 118 33.677 -28.695 -6.172 1.00 0.64 C ATOM 3980 O LEU B 118 33.976 -29.459 -7.068 1.00 0.67 O ATOM 3981 CB LEU B 118 31.648 -27.221 -6.296 1.00 0.51 C ATOM 3982 CG LEU B 118 31.693 -27.239 -7.830 1.00 0.52 C ATOM 3983 CD1 LEU B 118 30.855 -28.405 -8.376 1.00 0.53 C ATOM 3984 CD2 LEU B 118 31.130 -25.916 -8.351 1.00 0.53 C ATOM 0 H LEU B 118 31.801 -27.597 -3.849 1.00 0.58 H new ATOM 0 HA LEU B 118 31.633 -29.362 -6.086 1.00 0.56 H new ATOM 0 HB2 LEU B 118 30.619 -27.094 -5.958 1.00 0.51 H new ATOM 0 HB3 LEU B 118 32.215 -26.369 -5.920 1.00 0.51 H new ATOM 0 HG LEU B 118 32.723 -27.368 -8.162 1.00 0.52 H new ATOM 0 HD11 LEU B 118 30.897 -28.404 -9.465 1.00 0.53 H new ATOM 0 HD12 LEU B 118 31.252 -29.347 -7.998 1.00 0.53 H new ATOM 0 HD13 LEU B 118 29.820 -28.292 -8.053 1.00 0.53 H new ATOM 0 HD21 LEU B 118 31.155 -25.914 -9.441 1.00 0.53 H new ATOM 0 HD22 LEU B 118 30.101 -25.800 -8.012 1.00 0.53 H new ATOM 0 HD23 LEU B 118 31.732 -25.090 -7.972 1.00 0.53 H new ATOM 3996 N GLN B 119 34.582 -27.992 -5.546 1.00 0.71 N ATOM 3997 CA GLN B 119 36.018 -28.114 -5.924 1.00 0.81 C ATOM 3998 C GLN B 119 36.493 -29.551 -5.700 1.00 0.86 C ATOM 3999 O GLN B 119 37.239 -30.094 -6.486 1.00 0.92 O ATOM 4000 CB GLN B 119 36.856 -27.158 -5.071 1.00 0.88 C ATOM 4001 CG GLN B 119 36.564 -25.715 -5.488 1.00 0.87 C ATOM 4002 CD GLN B 119 37.329 -24.753 -4.576 1.00 0.95 C ATOM 4003 OE1 GLN B 119 37.548 -25.043 -3.415 1.00 1.29 O ATOM 4004 NE2 GLN B 119 37.752 -23.615 -5.055 1.00 1.45 N ATOM 0 H GLN B 119 34.388 -27.338 -4.788 1.00 0.71 H new ATOM 0 HA GLN B 119 36.135 -27.858 -6.977 1.00 0.81 H new ATOM 0 HB2 GLN B 119 36.624 -27.297 -4.015 1.00 0.88 H new ATOM 0 HB3 GLN B 119 37.917 -27.377 -5.196 1.00 0.88 H new ATOM 0 HG2 GLN B 119 36.858 -25.559 -6.526 1.00 0.87 H new ATOM 0 HG3 GLN B 119 35.494 -25.517 -5.426 1.00 0.87 H new ATOM 0 HE21 GLN B 119 37.569 -23.372 -6.028 1.00 1.45 H new ATOM 0 HE22 GLN B 119 38.266 -22.969 -4.456 1.00 1.45 H new ATOM 4013 N LYS B 120 36.072 -30.171 -4.634 1.00 0.86 N ATOM 4014 CA LYS B 120 36.509 -31.570 -4.365 1.00 0.93 C ATOM 4015 C LYS B 120 36.064 -32.459 -5.522 1.00 0.90 C ATOM 4016 O LYS B 120 36.789 -33.329 -5.962 1.00 0.99 O ATOM 4017 CB LYS B 120 35.879 -32.066 -3.057 1.00 0.95 C ATOM 4018 CG LYS B 120 36.493 -31.324 -1.854 1.00 1.01 C ATOM 4019 CD LYS B 120 37.835 -31.972 -1.437 1.00 1.57 C ATOM 4020 CE LYS B 120 37.599 -33.014 -0.335 1.00 1.89 C ATOM 4021 NZ LYS B 120 36.669 -34.068 -0.832 1.00 2.45 N ATOM 0 H LYS B 120 35.444 -29.770 -3.937 1.00 0.86 H new ATOM 0 HA LYS B 120 37.594 -31.606 -4.271 1.00 0.93 H new ATOM 0 HB2 LYS B 120 34.801 -31.906 -3.081 1.00 0.95 H new ATOM 0 HB3 LYS B 120 36.039 -33.139 -2.952 1.00 0.95 H new ATOM 0 HG2 LYS B 120 36.653 -30.277 -2.110 1.00 1.01 H new ATOM 0 HG3 LYS B 120 35.798 -31.344 -1.015 1.00 1.01 H new ATOM 0 HD2 LYS B 120 38.303 -32.445 -2.301 1.00 1.57 H new ATOM 0 HD3 LYS B 120 38.523 -31.205 -1.081 1.00 1.57 H new ATOM 0 HE2 LYS B 120 38.546 -33.463 -0.036 1.00 1.89 H new ATOM 0 HE3 LYS B 120 37.181 -32.534 0.550 1.00 1.89 H new ATOM 0 HZ1 LYS B 120 36.656 -34.863 -0.162 1.00 2.45 H new ATOM 0 HZ2 LYS B 120 35.711 -33.673 -0.919 1.00 2.45 H new ATOM 0 HZ3 LYS B 120 36.991 -34.404 -1.762 1.00 2.45 H new ATOM 4035 N LEU B 121 34.886 -32.241 -6.027 1.00 0.80 N ATOM 4036 CA LEU B 121 34.411 -33.073 -7.163 1.00 0.78 C ATOM 4037 C LEU B 121 35.388 -32.887 -8.320 1.00 0.86 C ATOM 4038 O LEU B 121 35.819 -33.839 -8.935 1.00 0.95 O ATOM 4039 CB LEU B 121 33.011 -32.618 -7.592 1.00 0.67 C ATOM 4040 CG LEU B 121 32.025 -32.778 -6.426 1.00 0.67 C ATOM 4041 CD1 LEU B 121 30.652 -32.254 -6.858 1.00 0.62 C ATOM 4042 CD2 LEU B 121 31.909 -34.261 -6.028 1.00 0.77 C ATOM 0 H LEU B 121 34.234 -31.526 -5.705 1.00 0.80 H new ATOM 0 HA LEU B 121 34.361 -34.122 -6.870 1.00 0.78 H new ATOM 0 HB2 LEU B 121 33.041 -31.577 -7.913 1.00 0.67 H new ATOM 0 HB3 LEU B 121 32.675 -33.206 -8.446 1.00 0.67 H new ATOM 0 HG LEU B 121 32.386 -32.211 -5.568 1.00 0.67 H new ATOM 0 HD11 LEU B 121 29.945 -32.364 -6.035 1.00 0.62 H new ATOM 0 HD12 LEU B 121 30.733 -31.201 -7.129 1.00 0.62 H new ATOM 0 HD13 LEU B 121 30.299 -32.823 -7.718 1.00 0.62 H new ATOM 0 HD21 LEU B 121 31.207 -34.362 -5.200 1.00 0.77 H new ATOM 0 HD22 LEU B 121 31.551 -34.839 -6.880 1.00 0.77 H new ATOM 0 HD23 LEU B 121 32.887 -34.633 -5.722 1.00 0.77 H new ATOM 4054 N ASN B 122 35.752 -31.663 -8.612 1.00 0.88 N ATOM 4055 CA ASN B 122 36.717 -31.391 -9.722 1.00 1.02 C ATOM 4056 C ASN B 122 37.872 -30.535 -9.192 1.00 1.08 C ATOM 4057 O ASN B 122 38.104 -29.439 -9.660 1.00 1.15 O ATOM 4058 CB ASN B 122 35.999 -30.628 -10.837 1.00 1.10 C ATOM 4059 CG ASN B 122 36.953 -30.422 -12.015 1.00 1.30 C ATOM 4060 OD1 ASN B 122 37.187 -31.414 -12.829 1.00 1.77 O flip ATOM 4061 ND2 ASN B 122 37.486 -29.345 -12.197 1.00 1.70 N flip ATOM 0 H ASN B 122 35.418 -30.832 -8.124 1.00 0.88 H new ATOM 0 HA ASN B 122 37.105 -32.333 -10.109 1.00 1.02 H new ATOM 0 HB2 ASN B 122 35.118 -31.182 -11.162 1.00 1.10 H new ATOM 0 HB3 ASN B 122 35.650 -29.664 -10.466 1.00 1.10 H new ATOM 0 HD21 ASN B 122 37.302 -28.571 -11.559 1.00 1.70 H new ATOM 0 HD22 ASN B 122 38.118 -29.216 -12.987 1.00 1.70 H new ATOM 4068 N SER B 123 38.606 -31.027 -8.224 1.00 1.09 N ATOM 4069 CA SER B 123 39.751 -30.237 -7.680 1.00 1.18 C ATOM 4070 C SER B 123 41.009 -30.564 -8.487 1.00 1.37 C ATOM 4071 O SER B 123 42.050 -30.015 -8.171 1.00 1.92 O ATOM 4072 CB SER B 123 39.983 -30.611 -6.212 1.00 1.16 C ATOM 4073 OG SER B 123 41.354 -30.429 -5.889 1.00 1.84 O ATOM 4074 OXT SER B 123 40.910 -31.362 -9.406 1.00 1.65 O ATOM 0 H SER B 123 38.462 -31.938 -7.789 1.00 1.09 H new ATOM 0 HA SER B 123 39.528 -29.173 -7.751 1.00 1.18 H new ATOM 0 HB2 SER B 123 39.361 -29.993 -5.565 1.00 1.16 H new ATOM 0 HB3 SER B 123 39.692 -31.647 -6.039 1.00 1.16 H new ATOM 0 HG SER B 123 41.745 -29.759 -6.488 1.00 1.84 H new TER 4080 SER B 123 ATOM 4081 N ALA C 1 21.107 -40.582 -15.434 1.00 0.82 N ATOM 4082 CA ALA C 1 20.831 -40.656 -13.972 1.00 0.80 C ATOM 4083 C ALA C 1 21.009 -39.269 -13.350 1.00 0.71 C ATOM 4084 O ALA C 1 20.981 -39.108 -12.145 1.00 0.70 O ATOM 4085 CB ALA C 1 21.806 -41.639 -13.322 1.00 0.90 C ATOM 0 H1 ALA C 1 21.070 -41.537 -15.843 1.00 0.82 H new ATOM 0 H2 ALA C 1 20.393 -39.981 -15.892 1.00 0.82 H new ATOM 0 H3 ALA C 1 22.052 -40.176 -15.589 1.00 0.82 H new ATOM 0 HA ALA C 1 19.809 -40.997 -13.809 1.00 0.80 H new ATOM 0 HB1 ALA C 1 21.607 -41.695 -12.252 1.00 0.90 H new ATOM 0 HB2 ALA C 1 21.679 -42.626 -13.767 1.00 0.90 H new ATOM 0 HB3 ALA C 1 22.828 -41.297 -13.483 1.00 0.90 H new ATOM 4093 N GLN C 2 21.198 -38.267 -14.167 1.00 0.67 N ATOM 4094 CA GLN C 2 21.385 -36.888 -13.636 1.00 0.60 C ATOM 4095 C GLN C 2 20.033 -36.317 -13.201 1.00 0.52 C ATOM 4096 O GLN C 2 19.009 -36.599 -13.788 1.00 0.52 O ATOM 4097 CB GLN C 2 21.981 -35.998 -14.728 1.00 0.62 C ATOM 4098 CG GLN C 2 23.419 -36.437 -15.029 1.00 0.72 C ATOM 4099 CD GLN C 2 23.401 -37.716 -15.873 1.00 1.27 C ATOM 4100 OE1 GLN C 2 22.602 -37.849 -16.778 1.00 2.01 O ATOM 4101 NE2 GLN C 2 24.254 -38.669 -15.614 1.00 1.88 N ATOM 0 H GLN C 2 21.231 -38.346 -15.183 1.00 0.67 H new ATOM 0 HA GLN C 2 22.059 -36.920 -12.780 1.00 0.60 H new ATOM 0 HB2 GLN C 2 21.375 -36.061 -15.632 1.00 0.62 H new ATOM 0 HB3 GLN C 2 21.969 -34.956 -14.408 1.00 0.62 H new ATOM 0 HG2 GLN C 2 23.947 -35.646 -15.561 1.00 0.72 H new ATOM 0 HG3 GLN C 2 23.959 -36.611 -14.098 1.00 0.72 H new ATOM 0 HE21 GLN C 2 24.926 -38.559 -14.854 1.00 1.88 H new ATOM 0 HE22 GLN C 2 24.249 -39.523 -16.171 1.00 1.88 H new ATOM 4110 N SER C 3 20.023 -35.511 -12.173 1.00 0.47 N ATOM 4111 CA SER C 3 18.741 -34.918 -11.699 1.00 0.41 C ATOM 4112 C SER C 3 18.479 -33.621 -12.463 1.00 0.37 C ATOM 4113 O SER C 3 18.403 -32.552 -11.892 1.00 0.34 O ATOM 4114 CB SER C 3 18.845 -34.618 -10.205 1.00 0.40 C ATOM 4115 OG SER C 3 19.598 -33.425 -10.016 1.00 1.37 O ATOM 0 H SER C 3 20.849 -35.238 -11.641 1.00 0.47 H new ATOM 0 HA SER C 3 17.923 -35.617 -11.872 1.00 0.41 H new ATOM 0 HB2 SER C 3 17.850 -34.506 -9.775 1.00 0.40 H new ATOM 0 HB3 SER C 3 19.324 -35.450 -9.688 1.00 0.40 H new ATOM 0 HG SER C 3 19.134 -32.674 -10.442 1.00 1.37 H new ATOM 4121 N ARG C 4 18.332 -33.713 -13.754 1.00 0.41 N ATOM 4122 CA ARG C 4 18.066 -32.491 -14.562 1.00 0.42 C ATOM 4123 C ARG C 4 16.741 -31.867 -14.117 1.00 0.42 C ATOM 4124 O ARG C 4 16.617 -30.664 -14.017 1.00 0.43 O ATOM 4125 CB ARG C 4 18.003 -32.865 -16.045 1.00 0.51 C ATOM 4126 CG ARG C 4 19.405 -33.244 -16.531 1.00 0.90 C ATOM 4127 CD ARG C 4 19.353 -33.641 -18.007 1.00 1.03 C ATOM 4128 NE ARG C 4 18.488 -34.845 -18.158 1.00 1.97 N ATOM 4129 CZ ARG C 4 18.085 -35.229 -19.341 1.00 2.55 C ATOM 4130 NH1 ARG C 4 18.456 -34.576 -20.407 1.00 2.53 N ATOM 4131 NH2 ARG C 4 17.312 -36.274 -19.455 1.00 3.56 N ATOM 0 H ARG C 4 18.385 -34.582 -14.285 1.00 0.41 H new ATOM 0 HA ARG C 4 18.867 -31.767 -14.413 1.00 0.42 H new ATOM 0 HB2 ARG C 4 17.317 -33.699 -16.193 1.00 0.51 H new ATOM 0 HB3 ARG C 4 17.618 -32.028 -16.627 1.00 0.51 H new ATOM 0 HG2 ARG C 4 20.086 -32.404 -16.395 1.00 0.90 H new ATOM 0 HG3 ARG C 4 19.795 -34.070 -15.936 1.00 0.90 H new ATOM 0 HD2 ARG C 4 18.960 -32.818 -18.604 1.00 1.03 H new ATOM 0 HD3 ARG C 4 20.357 -33.851 -18.376 1.00 1.03 H new ATOM 0 HE ARG C 4 18.208 -35.374 -17.332 1.00 1.97 H new ATOM 0 HH11 ARG C 4 19.064 -33.761 -20.320 1.00 2.53 H new ATOM 0 HH12 ARG C 4 18.139 -34.880 -21.327 1.00 2.53 H new ATOM 0 HH21 ARG C 4 17.024 -36.789 -18.623 1.00 3.56 H new ATOM 0 HH22 ARG C 4 16.996 -36.576 -20.376 1.00 3.56 H new ATOM 4145 N THR C 5 15.749 -32.673 -13.843 1.00 0.45 N ATOM 4146 CA THR C 5 14.441 -32.109 -13.399 1.00 0.49 C ATOM 4147 C THR C 5 14.642 -31.330 -12.097 1.00 0.44 C ATOM 4148 O THR C 5 14.135 -30.238 -11.932 1.00 0.46 O ATOM 4149 CB THR C 5 13.437 -33.247 -13.180 1.00 0.54 C ATOM 4150 OG1 THR C 5 12.140 -32.701 -12.988 1.00 0.68 O ATOM 4151 CG2 THR C 5 13.836 -34.065 -11.949 1.00 0.56 C ATOM 0 H THR C 5 15.787 -33.690 -13.907 1.00 0.45 H new ATOM 0 HA THR C 5 14.053 -31.437 -14.164 1.00 0.49 H new ATOM 0 HB THR C 5 13.435 -33.897 -14.055 1.00 0.54 H new ATOM 0 HG1 THR C 5 11.497 -33.427 -12.849 1.00 0.68 H new ATOM 0 HG21 THR C 5 13.118 -34.872 -11.800 1.00 0.56 H new ATOM 0 HG22 THR C 5 14.830 -34.487 -12.099 1.00 0.56 H new ATOM 0 HG23 THR C 5 13.845 -33.420 -11.071 1.00 0.56 H new ATOM 4159 N LEU C 6 15.386 -31.876 -11.170 1.00 0.39 N ATOM 4160 CA LEU C 6 15.621 -31.147 -9.891 1.00 0.37 C ATOM 4161 C LEU C 6 16.311 -29.821 -10.204 1.00 0.32 C ATOM 4162 O LEU C 6 15.971 -28.785 -9.668 1.00 0.33 O ATOM 4163 CB LEU C 6 16.510 -31.993 -8.970 1.00 0.35 C ATOM 4164 CG LEU C 6 16.761 -31.254 -7.646 1.00 0.35 C ATOM 4165 CD1 LEU C 6 15.433 -31.007 -6.908 1.00 0.41 C ATOM 4166 CD2 LEU C 6 17.692 -32.101 -6.771 1.00 0.37 C ATOM 0 H LEU C 6 15.837 -32.788 -11.243 1.00 0.39 H new ATOM 0 HA LEU C 6 14.672 -30.960 -9.388 1.00 0.37 H new ATOM 0 HB2 LEU C 6 16.033 -32.953 -8.774 1.00 0.35 H new ATOM 0 HB3 LEU C 6 17.459 -32.204 -9.463 1.00 0.35 H new ATOM 0 HG LEU C 6 17.224 -30.289 -7.855 1.00 0.35 H new ATOM 0 HD11 LEU C 6 15.629 -30.483 -5.973 1.00 0.41 H new ATOM 0 HD12 LEU C 6 14.777 -30.401 -7.533 1.00 0.41 H new ATOM 0 HD13 LEU C 6 14.952 -31.962 -6.695 1.00 0.41 H new ATOM 0 HD21 LEU C 6 17.876 -31.584 -5.829 1.00 0.37 H new ATOM 0 HD22 LEU C 6 17.225 -33.066 -6.571 1.00 0.37 H new ATOM 0 HD23 LEU C 6 18.638 -32.256 -7.290 1.00 0.37 H new ATOM 4178 N LEU C 7 17.280 -29.853 -11.076 1.00 0.29 N ATOM 4179 CA LEU C 7 18.006 -28.608 -11.445 1.00 0.27 C ATOM 4180 C LEU C 7 17.030 -27.595 -12.036 1.00 0.30 C ATOM 4181 O LEU C 7 17.115 -26.414 -11.764 1.00 0.29 O ATOM 4182 CB LEU C 7 19.116 -28.935 -12.445 1.00 0.27 C ATOM 4183 CG LEU C 7 20.256 -29.682 -11.721 1.00 0.24 C ATOM 4184 CD1 LEU C 7 21.112 -30.447 -12.744 1.00 0.27 C ATOM 4185 CD2 LEU C 7 21.153 -28.686 -10.958 1.00 0.23 C ATOM 0 H LEU C 7 17.602 -30.696 -11.552 1.00 0.29 H new ATOM 0 HA LEU C 7 18.458 -28.173 -10.553 1.00 0.27 H new ATOM 0 HB2 LEU C 7 18.721 -29.549 -13.255 1.00 0.27 H new ATOM 0 HB3 LEU C 7 19.496 -28.018 -12.896 1.00 0.27 H new ATOM 0 HG LEU C 7 19.813 -30.382 -11.013 1.00 0.24 H new ATOM 0 HD11 LEU C 7 21.915 -30.972 -12.226 1.00 0.27 H new ATOM 0 HD12 LEU C 7 20.489 -31.168 -13.273 1.00 0.27 H new ATOM 0 HD13 LEU C 7 21.540 -29.744 -13.459 1.00 0.27 H new ATOM 0 HD21 LEU C 7 21.952 -29.229 -10.453 1.00 0.23 H new ATOM 0 HD22 LEU C 7 21.586 -27.974 -11.661 1.00 0.23 H new ATOM 0 HD23 LEU C 7 20.556 -28.150 -10.220 1.00 0.23 H new ATOM 4197 N ALA C 8 16.099 -28.034 -12.839 1.00 0.35 N ATOM 4198 CA ALA C 8 15.135 -27.065 -13.426 1.00 0.39 C ATOM 4199 C ALA C 8 14.394 -26.384 -12.278 1.00 0.38 C ATOM 4200 O ALA C 8 14.166 -25.194 -12.297 1.00 0.39 O ATOM 4201 CB ALA C 8 14.123 -27.805 -14.308 1.00 0.45 C ATOM 0 H ALA C 8 15.966 -29.008 -13.110 1.00 0.35 H new ATOM 0 HA ALA C 8 15.665 -26.332 -14.034 1.00 0.39 H new ATOM 0 HB1 ALA C 8 13.420 -27.089 -14.734 1.00 0.45 H new ATOM 0 HB2 ALA C 8 14.649 -28.320 -15.112 1.00 0.45 H new ATOM 0 HB3 ALA C 8 13.579 -28.533 -13.706 1.00 0.45 H new ATOM 4207 N GLY C 9 14.046 -27.125 -11.263 1.00 0.38 N ATOM 4208 CA GLY C 9 13.347 -26.502 -10.103 1.00 0.39 C ATOM 4209 C GLY C 9 14.319 -25.561 -9.384 1.00 0.34 C ATOM 4210 O GLY C 9 13.990 -24.436 -9.065 1.00 0.34 O ATOM 0 H GLY C 9 14.214 -28.128 -11.186 1.00 0.38 H new ATOM 0 HA2 GLY C 9 12.471 -25.950 -10.443 1.00 0.39 H new ATOM 0 HA3 GLY C 9 12.993 -27.273 -9.418 1.00 0.39 H new ATOM 4214 N ILE C 10 15.521 -26.013 -9.130 1.00 0.30 N ATOM 4215 CA ILE C 10 16.517 -25.146 -8.438 1.00 0.27 C ATOM 4216 C ILE C 10 16.764 -23.888 -9.275 1.00 0.25 C ATOM 4217 O ILE C 10 16.758 -22.785 -8.770 1.00 0.25 O ATOM 4218 CB ILE C 10 17.829 -25.913 -8.263 1.00 0.25 C ATOM 4219 CG1 ILE C 10 17.622 -27.050 -7.261 1.00 0.28 C ATOM 4220 CG2 ILE C 10 18.915 -24.971 -7.736 1.00 0.26 C ATOM 4221 CD1 ILE C 10 18.810 -28.011 -7.325 1.00 0.26 C ATOM 0 H ILE C 10 15.854 -26.946 -9.373 1.00 0.30 H new ATOM 0 HA ILE C 10 16.134 -24.860 -7.458 1.00 0.27 H new ATOM 0 HB ILE C 10 18.138 -26.319 -9.226 1.00 0.25 H new ATOM 0 HG12 ILE C 10 17.521 -26.647 -6.253 1.00 0.28 H new ATOM 0 HG13 ILE C 10 16.698 -27.582 -7.485 1.00 0.28 H new ATOM 0 HG21 ILE C 10 19.847 -25.523 -7.613 1.00 0.26 H new ATOM 0 HG22 ILE C 10 19.066 -24.157 -8.445 1.00 0.26 H new ATOM 0 HG23 ILE C 10 18.606 -24.562 -6.774 1.00 0.26 H new ATOM 0 HD11 ILE C 10 18.662 -28.821 -6.611 1.00 0.26 H new ATOM 0 HD12 ILE C 10 18.890 -28.424 -8.331 1.00 0.26 H new ATOM 0 HD13 ILE C 10 19.726 -27.474 -7.079 1.00 0.26 H new ATOM 4233 N VAL C 11 16.984 -24.041 -10.556 1.00 0.26 N ATOM 4234 CA VAL C 11 17.228 -22.838 -11.403 1.00 0.27 C ATOM 4235 C VAL C 11 15.997 -21.932 -11.319 1.00 0.28 C ATOM 4236 O VAL C 11 16.101 -20.749 -11.057 1.00 0.28 O ATOM 4237 CB VAL C 11 17.458 -23.262 -12.860 1.00 0.30 C ATOM 4238 CG1 VAL C 11 17.482 -22.019 -13.758 1.00 0.35 C ATOM 4239 CG2 VAL C 11 18.794 -24.004 -12.974 1.00 0.29 C ATOM 0 H VAL C 11 17.005 -24.935 -11.046 1.00 0.26 H new ATOM 0 HA VAL C 11 18.112 -22.307 -11.050 1.00 0.27 H new ATOM 0 HB VAL C 11 16.650 -23.922 -13.177 1.00 0.30 H new ATOM 0 HG11 VAL C 11 17.645 -22.321 -14.793 1.00 0.35 H new ATOM 0 HG12 VAL C 11 16.530 -21.495 -13.679 1.00 0.35 H new ATOM 0 HG13 VAL C 11 18.288 -21.357 -13.442 1.00 0.35 H new ATOM 0 HG21 VAL C 11 18.956 -24.305 -14.009 1.00 0.29 H new ATOM 0 HG22 VAL C 11 19.603 -23.347 -12.656 1.00 0.29 H new ATOM 0 HG23 VAL C 11 18.774 -24.889 -12.338 1.00 0.29 H new ATOM 4249 N GLN C 12 14.828 -22.482 -11.519 1.00 0.32 N ATOM 4250 CA GLN C 12 13.586 -21.662 -11.429 1.00 0.34 C ATOM 4251 C GLN C 12 13.465 -21.089 -10.015 1.00 0.32 C ATOM 4252 O GLN C 12 13.075 -19.954 -9.825 1.00 0.33 O ATOM 4253 CB GLN C 12 12.366 -22.527 -11.747 1.00 0.39 C ATOM 4254 CG GLN C 12 12.365 -22.877 -13.234 1.00 1.18 C ATOM 4255 CD GLN C 12 11.148 -23.748 -13.555 1.00 1.63 C ATOM 4256 OE1 GLN C 12 10.460 -24.268 -12.578 1.00 1.99 O flip ATOM 4257 NE2 GLN C 12 10.825 -23.963 -14.706 1.00 2.40 N flip ATOM 0 H GLN C 12 14.681 -23.466 -11.741 1.00 0.32 H new ATOM 0 HA GLN C 12 13.634 -20.846 -12.150 1.00 0.34 H new ATOM 0 HB2 GLN C 12 12.386 -23.437 -11.148 1.00 0.39 H new ATOM 0 HB3 GLN C 12 11.451 -21.994 -11.487 1.00 0.39 H new ATOM 0 HG2 GLN C 12 12.341 -21.966 -13.832 1.00 1.18 H new ATOM 0 HG3 GLN C 12 13.282 -23.406 -13.494 1.00 1.18 H new ATOM 0 HE21 GLN C 12 11.363 -23.556 -15.471 1.00 2.40 H new ATOM 0 HE22 GLN C 12 10.016 -24.550 -14.907 1.00 2.40 H new ATOM 4266 N GLN C 13 13.794 -21.871 -9.019 1.00 0.30 N ATOM 4267 CA GLN C 13 13.692 -21.371 -7.621 1.00 0.29 C ATOM 4268 C GLN C 13 14.605 -20.154 -7.478 1.00 0.25 C ATOM 4269 O GLN C 13 14.240 -19.162 -6.880 1.00 0.25 O ATOM 4270 CB GLN C 13 14.140 -22.479 -6.658 1.00 0.29 C ATOM 4271 CG GLN C 13 13.987 -22.020 -5.201 1.00 0.30 C ATOM 4272 CD GLN C 13 12.501 -21.896 -4.858 1.00 0.38 C ATOM 4273 OE1 GLN C 13 11.655 -22.391 -5.577 1.00 0.84 O ATOM 4274 NE2 GLN C 13 12.146 -21.267 -3.770 1.00 0.64 N ATOM 0 H GLN C 13 14.127 -22.830 -9.116 1.00 0.30 H new ATOM 0 HA GLN C 13 12.665 -21.091 -7.387 1.00 0.29 H new ATOM 0 HB2 GLN C 13 13.546 -23.377 -6.827 1.00 0.29 H new ATOM 0 HB3 GLN C 13 15.179 -22.742 -6.855 1.00 0.29 H new ATOM 0 HG2 GLN C 13 14.467 -22.734 -4.531 1.00 0.30 H new ATOM 0 HG3 GLN C 13 14.486 -21.062 -5.056 1.00 0.30 H new ATOM 0 HE21 GLN C 13 12.856 -20.852 -3.166 1.00 0.64 H new ATOM 0 HE22 GLN C 13 11.159 -21.191 -3.524 1.00 0.64 H new ATOM 4283 N GLN C 14 15.780 -20.206 -8.040 1.00 0.22 N ATOM 4284 CA GLN C 14 16.685 -19.033 -7.943 1.00 0.20 C ATOM 4285 C GLN C 14 16.032 -17.845 -8.653 1.00 0.22 C ATOM 4286 O GLN C 14 16.074 -16.725 -8.180 1.00 0.21 O ATOM 4287 CB GLN C 14 18.023 -19.354 -8.613 1.00 0.20 C ATOM 4288 CG GLN C 14 18.787 -20.378 -7.774 1.00 0.18 C ATOM 4289 CD GLN C 14 20.122 -20.695 -8.450 1.00 0.19 C ATOM 4290 OE1 GLN C 14 20.154 -21.323 -9.487 1.00 0.28 O ATOM 4291 NE2 GLN C 14 21.234 -20.284 -7.900 1.00 0.23 N ATOM 0 H GLN C 14 16.149 -21.004 -8.558 1.00 0.22 H new ATOM 0 HA GLN C 14 16.861 -18.791 -6.895 1.00 0.20 H new ATOM 0 HB2 GLN C 14 17.854 -19.745 -9.616 1.00 0.20 H new ATOM 0 HB3 GLN C 14 18.614 -18.445 -8.721 1.00 0.20 H new ATOM 0 HG2 GLN C 14 18.959 -19.987 -6.771 1.00 0.18 H new ATOM 0 HG3 GLN C 14 18.197 -21.288 -7.665 1.00 0.18 H new ATOM 0 HE21 GLN C 14 21.207 -19.756 -7.028 1.00 0.23 H new ATOM 0 HE22 GLN C 14 22.129 -20.491 -8.343 1.00 0.23 H new ATOM 4300 N GLN C 15 15.421 -18.079 -9.785 1.00 0.26 N ATOM 4301 CA GLN C 15 14.764 -16.956 -10.507 1.00 0.29 C ATOM 4302 C GLN C 15 13.679 -16.348 -9.616 1.00 0.28 C ATOM 4303 O GLN C 15 13.567 -15.146 -9.496 1.00 0.29 O ATOM 4304 CB GLN C 15 14.149 -17.460 -11.813 1.00 0.34 C ATOM 4305 CG GLN C 15 13.590 -16.272 -12.595 1.00 0.38 C ATOM 4306 CD GLN C 15 12.998 -16.755 -13.921 1.00 0.44 C ATOM 4307 OE1 GLN C 15 13.243 -17.970 -14.328 1.00 0.82 O flip ATOM 4308 NE2 GLN C 15 12.311 -16.015 -14.597 1.00 0.81 N flip ATOM 0 H GLN C 15 15.350 -18.991 -10.235 1.00 0.26 H new ATOM 0 HA GLN C 15 15.507 -16.194 -10.744 1.00 0.29 H new ATOM 0 HB2 GLN C 15 14.901 -17.980 -12.406 1.00 0.34 H new ATOM 0 HB3 GLN C 15 13.356 -18.178 -11.603 1.00 0.34 H new ATOM 0 HG2 GLN C 15 12.824 -15.766 -12.007 1.00 0.38 H new ATOM 0 HG3 GLN C 15 14.380 -15.545 -12.783 1.00 0.38 H new ATOM 0 HE21 GLN C 15 12.119 -15.065 -14.279 1.00 0.81 H new ATOM 0 HE22 GLN C 15 11.926 -16.344 -15.482 1.00 0.81 H new ATOM 4317 N GLN C 16 12.883 -17.167 -8.980 1.00 0.28 N ATOM 4318 CA GLN C 16 11.824 -16.609 -8.094 1.00 0.29 C ATOM 4319 C GLN C 16 12.480 -15.796 -6.982 1.00 0.25 C ATOM 4320 O GLN C 16 12.014 -14.735 -6.617 1.00 0.26 O ATOM 4321 CB GLN C 16 10.990 -17.741 -7.482 1.00 0.31 C ATOM 4322 CG GLN C 16 10.121 -18.384 -8.564 1.00 0.36 C ATOM 4323 CD GLN C 16 9.286 -19.509 -7.951 1.00 0.40 C ATOM 4324 OE1 GLN C 16 9.590 -19.960 -6.764 1.00 0.93 O flip ATOM 4325 NE2 GLN C 16 8.345 -19.980 -8.558 1.00 0.87 N flip ATOM 0 H GLN C 16 12.920 -18.185 -9.035 1.00 0.28 H new ATOM 0 HA GLN C 16 11.165 -15.969 -8.682 1.00 0.29 H new ATOM 0 HB2 GLN C 16 11.646 -18.489 -7.037 1.00 0.31 H new ATOM 0 HB3 GLN C 16 10.362 -17.351 -6.681 1.00 0.31 H new ATOM 0 HG2 GLN C 16 9.468 -17.635 -9.012 1.00 0.36 H new ATOM 0 HG3 GLN C 16 10.749 -18.778 -9.363 1.00 0.36 H new ATOM 0 HE21 GLN C 16 8.108 -19.627 -9.485 1.00 0.87 H new ATOM 0 HE22 GLN C 16 7.792 -20.728 -8.140 1.00 0.87 H new ATOM 4334 N LEU C 17 13.571 -16.277 -6.445 1.00 0.22 N ATOM 4335 CA LEU C 17 14.259 -15.516 -5.369 1.00 0.19 C ATOM 4336 C LEU C 17 14.775 -14.202 -5.949 1.00 0.18 C ATOM 4337 O LEU C 17 14.667 -13.158 -5.337 1.00 0.18 O ATOM 4338 CB LEU C 17 15.432 -16.341 -4.825 1.00 0.16 C ATOM 4339 CG LEU C 17 14.905 -17.548 -4.035 1.00 0.18 C ATOM 4340 CD1 LEU C 17 16.076 -18.475 -3.697 1.00 0.18 C ATOM 4341 CD2 LEU C 17 14.210 -17.086 -2.735 1.00 0.20 C ATOM 0 H LEU C 17 14.011 -17.160 -6.706 1.00 0.22 H new ATOM 0 HA LEU C 17 13.564 -15.311 -4.555 1.00 0.19 H new ATOM 0 HB2 LEU C 17 16.060 -16.681 -5.648 1.00 0.16 H new ATOM 0 HB3 LEU C 17 16.057 -15.720 -4.183 1.00 0.16 H new ATOM 0 HG LEU C 17 14.174 -18.081 -4.644 1.00 0.18 H new ATOM 0 HD11 LEU C 17 15.709 -19.335 -3.136 1.00 0.18 H new ATOM 0 HD12 LEU C 17 16.547 -18.817 -4.619 1.00 0.18 H new ATOM 0 HD13 LEU C 17 16.807 -17.934 -3.096 1.00 0.18 H new ATOM 0 HD21 LEU C 17 13.844 -17.956 -2.190 1.00 0.20 H new ATOM 0 HD22 LEU C 17 14.923 -16.542 -2.115 1.00 0.20 H new ATOM 0 HD23 LEU C 17 13.373 -16.433 -2.982 1.00 0.20 H new ATOM 4353 N LEU C 18 15.316 -14.241 -7.137 1.00 0.19 N ATOM 4354 CA LEU C 18 15.816 -12.986 -7.767 1.00 0.20 C ATOM 4355 C LEU C 18 14.649 -12.015 -7.924 1.00 0.22 C ATOM 4356 O LEU C 18 14.776 -10.830 -7.687 1.00 0.23 O ATOM 4357 CB LEU C 18 16.412 -13.301 -9.146 1.00 0.22 C ATOM 4358 CG LEU C 18 16.934 -12.016 -9.814 1.00 0.25 C ATOM 4359 CD1 LEU C 18 18.032 -11.368 -8.953 1.00 0.26 C ATOM 4360 CD2 LEU C 18 17.501 -12.369 -11.196 1.00 0.29 C ATOM 0 H LEU C 18 15.433 -15.086 -7.697 1.00 0.19 H new ATOM 0 HA LEU C 18 16.588 -12.540 -7.140 1.00 0.20 H new ATOM 0 HB2 LEU C 18 17.225 -14.020 -9.042 1.00 0.22 H new ATOM 0 HB3 LEU C 18 15.655 -13.765 -9.778 1.00 0.22 H new ATOM 0 HG LEU C 18 16.113 -11.306 -9.917 1.00 0.25 H new ATOM 0 HD11 LEU C 18 18.389 -10.461 -9.441 1.00 0.26 H new ATOM 0 HD12 LEU C 18 17.625 -11.117 -7.973 1.00 0.26 H new ATOM 0 HD13 LEU C 18 18.861 -12.066 -8.834 1.00 0.26 H new ATOM 0 HD21 LEU C 18 17.874 -11.465 -11.678 1.00 0.29 H new ATOM 0 HD22 LEU C 18 18.317 -13.083 -11.083 1.00 0.29 H new ATOM 0 HD23 LEU C 18 16.716 -12.810 -11.810 1.00 0.29 H new ATOM 4372 N ASP C 19 13.509 -12.508 -8.330 1.00 0.25 N ATOM 4373 CA ASP C 19 12.339 -11.609 -8.513 1.00 0.28 C ATOM 4374 C ASP C 19 12.005 -10.941 -7.177 1.00 0.27 C ATOM 4375 O ASP C 19 11.861 -9.737 -7.101 1.00 0.28 O ATOM 4376 CB ASP C 19 11.140 -12.428 -9.005 1.00 0.32 C ATOM 4377 CG ASP C 19 9.928 -11.514 -9.211 1.00 0.36 C ATOM 4378 OD1 ASP C 19 9.905 -10.443 -8.628 1.00 1.13 O ATOM 4379 OD2 ASP C 19 9.038 -11.905 -9.949 1.00 1.12 O ATOM 0 H ASP C 19 13.340 -13.491 -8.541 1.00 0.25 H new ATOM 0 HA ASP C 19 12.572 -10.841 -9.251 1.00 0.28 H new ATOM 0 HB2 ASP C 19 11.391 -12.929 -9.940 1.00 0.32 H new ATOM 0 HB3 ASP C 19 10.900 -13.206 -8.281 1.00 0.32 H new ATOM 4384 N VAL C 20 11.889 -11.700 -6.120 1.00 0.25 N ATOM 4385 CA VAL C 20 11.572 -11.079 -4.804 1.00 0.24 C ATOM 4386 C VAL C 20 12.669 -10.090 -4.440 1.00 0.21 C ATOM 4387 O VAL C 20 12.406 -8.990 -4.003 1.00 0.23 O ATOM 4388 CB VAL C 20 11.487 -12.154 -3.716 1.00 0.24 C ATOM 4389 CG1 VAL C 20 11.235 -11.476 -2.365 1.00 0.24 C ATOM 4390 CG2 VAL C 20 10.341 -13.120 -4.035 1.00 0.30 C ATOM 0 H VAL C 20 11.999 -12.714 -6.111 1.00 0.25 H new ATOM 0 HA VAL C 20 10.612 -10.567 -4.876 1.00 0.24 H new ATOM 0 HB VAL C 20 12.421 -12.714 -3.676 1.00 0.24 H new ATOM 0 HG11 VAL C 20 11.173 -12.234 -1.584 1.00 0.24 H new ATOM 0 HG12 VAL C 20 12.054 -10.792 -2.143 1.00 0.24 H new ATOM 0 HG13 VAL C 20 10.299 -10.920 -2.406 1.00 0.24 H new ATOM 0 HG21 VAL C 20 10.283 -13.884 -3.260 1.00 0.30 H new ATOM 0 HG22 VAL C 20 9.401 -12.569 -4.074 1.00 0.30 H new ATOM 0 HG23 VAL C 20 10.523 -13.595 -4.999 1.00 0.30 H new ATOM 4400 N VAL C 21 13.899 -10.472 -4.615 1.00 0.18 N ATOM 4401 CA VAL C 21 15.008 -9.550 -4.279 1.00 0.18 C ATOM 4402 C VAL C 21 14.857 -8.297 -5.138 1.00 0.22 C ATOM 4403 O VAL C 21 14.978 -7.187 -4.660 1.00 0.21 O ATOM 4404 CB VAL C 21 16.346 -10.240 -4.568 1.00 0.17 C ATOM 4405 CG1 VAL C 21 17.490 -9.243 -4.399 1.00 0.21 C ATOM 4406 CG2 VAL C 21 16.541 -11.405 -3.589 1.00 0.15 C ATOM 0 H VAL C 21 14.182 -11.383 -4.976 1.00 0.18 H new ATOM 0 HA VAL C 21 14.981 -9.278 -3.224 1.00 0.18 H new ATOM 0 HB VAL C 21 16.342 -10.615 -5.591 1.00 0.17 H new ATOM 0 HG11 VAL C 21 18.438 -9.739 -4.606 1.00 0.21 H new ATOM 0 HG12 VAL C 21 17.355 -8.414 -5.093 1.00 0.21 H new ATOM 0 HG13 VAL C 21 17.494 -8.864 -3.377 1.00 0.21 H new ATOM 0 HG21 VAL C 21 17.492 -11.897 -3.793 1.00 0.15 H new ATOM 0 HG22 VAL C 21 16.541 -11.026 -2.567 1.00 0.15 H new ATOM 0 HG23 VAL C 21 15.729 -12.122 -3.710 1.00 0.15 H new ATOM 4416 N LYS C 22 14.569 -8.470 -6.402 1.00 0.28 N ATOM 4417 CA LYS C 22 14.376 -7.291 -7.288 1.00 0.33 C ATOM 4418 C LYS C 22 13.200 -6.469 -6.756 1.00 0.32 C ATOM 4419 O LYS C 22 13.252 -5.257 -6.690 1.00 0.33 O ATOM 4420 CB LYS C 22 14.067 -7.769 -8.709 1.00 0.39 C ATOM 4421 CG LYS C 22 13.976 -6.566 -9.649 1.00 0.46 C ATOM 4422 CD LYS C 22 13.667 -7.053 -11.067 1.00 0.75 C ATOM 4423 CE LYS C 22 13.574 -5.856 -12.016 1.00 1.12 C ATOM 4424 NZ LYS C 22 14.917 -5.221 -12.155 1.00 1.91 N ATOM 0 H LYS C 22 14.460 -9.377 -6.856 1.00 0.28 H new ATOM 0 HA LYS C 22 15.279 -6.681 -7.304 1.00 0.33 H new ATOM 0 HB2 LYS C 22 14.845 -8.452 -9.051 1.00 0.39 H new ATOM 0 HB3 LYS C 22 13.129 -8.324 -8.721 1.00 0.39 H new ATOM 0 HG2 LYS C 22 13.198 -5.883 -9.309 1.00 0.46 H new ATOM 0 HG3 LYS C 22 14.914 -6.011 -9.639 1.00 0.46 H new ATOM 0 HD2 LYS C 22 14.446 -7.737 -11.404 1.00 0.75 H new ATOM 0 HD3 LYS C 22 12.729 -7.609 -11.075 1.00 0.75 H new ATOM 0 HE2 LYS C 22 13.211 -6.180 -12.991 1.00 1.12 H new ATOM 0 HE3 LYS C 22 12.856 -5.131 -11.633 1.00 1.12 H new ATOM 0 HZ1 LYS C 22 14.921 -4.595 -12.986 1.00 1.91 H new ATOM 0 HZ2 LYS C 22 15.128 -4.665 -11.302 1.00 1.91 H new ATOM 0 HZ3 LYS C 22 15.640 -5.959 -12.274 1.00 1.91 H new ATOM 4438 N ARG C 23 12.138 -7.129 -6.368 1.00 0.33 N ATOM 4439 CA ARG C 23 10.951 -6.401 -5.827 1.00 0.34 C ATOM 4440 C ARG C 23 11.370 -5.632 -4.577 1.00 0.29 C ATOM 4441 O ARG C 23 10.957 -4.510 -4.355 1.00 0.29 O ATOM 4442 CB ARG C 23 9.860 -7.410 -5.438 1.00 0.39 C ATOM 4443 CG ARG C 23 9.257 -8.075 -6.685 1.00 0.59 C ATOM 4444 CD ARG C 23 8.222 -7.159 -7.349 1.00 0.93 C ATOM 4445 NE ARG C 23 7.494 -7.934 -8.396 1.00 0.81 N ATOM 4446 CZ ARG C 23 6.397 -7.461 -8.922 1.00 1.05 C ATOM 4447 NH1 ARG C 23 5.934 -6.301 -8.541 1.00 1.68 N ATOM 4448 NH2 ARG C 23 5.757 -8.151 -9.827 1.00 1.08 N ATOM 0 H ARG C 23 12.042 -8.144 -6.403 1.00 0.33 H new ATOM 0 HA ARG C 23 10.568 -5.718 -6.585 1.00 0.34 H new ATOM 0 HB2 ARG C 23 10.281 -8.172 -4.782 1.00 0.39 H new ATOM 0 HB3 ARG C 23 9.075 -6.904 -4.876 1.00 0.39 H new ATOM 0 HG2 ARG C 23 10.049 -8.310 -7.396 1.00 0.59 H new ATOM 0 HG3 ARG C 23 8.788 -9.019 -6.407 1.00 0.59 H new ATOM 0 HD2 ARG C 23 7.521 -6.780 -6.605 1.00 0.93 H new ATOM 0 HD3 ARG C 23 8.714 -6.294 -7.794 1.00 0.93 H new ATOM 0 HE ARG C 23 7.855 -8.837 -8.702 1.00 0.81 H new ATOM 0 HH11 ARG C 23 6.430 -5.762 -7.831 1.00 1.68 H new ATOM 0 HH12 ARG C 23 5.077 -5.934 -8.954 1.00 1.68 H new ATOM 0 HH21 ARG C 23 6.114 -9.059 -10.123 1.00 1.08 H new ATOM 0 HH22 ARG C 23 4.900 -7.782 -10.238 1.00 1.08 H new ATOM 4462 N GLN C 24 12.192 -6.234 -3.758 1.00 0.24 N ATOM 4463 CA GLN C 24 12.651 -5.549 -2.519 1.00 0.19 C ATOM 4464 C GLN C 24 13.386 -4.266 -2.890 1.00 0.19 C ATOM 4465 O GLN C 24 13.236 -3.246 -2.249 1.00 0.19 O ATOM 4466 CB GLN C 24 13.579 -6.473 -1.725 1.00 0.16 C ATOM 4467 CG GLN C 24 12.755 -7.594 -1.084 1.00 0.17 C ATOM 4468 CD GLN C 24 13.687 -8.595 -0.396 1.00 0.17 C ATOM 4469 OE1 GLN C 24 14.826 -8.752 -0.789 1.00 0.19 O ATOM 4470 NE2 GLN C 24 13.248 -9.280 0.626 1.00 0.18 N ATOM 0 H GLN C 24 12.565 -7.173 -3.896 1.00 0.24 H new ATOM 0 HA GLN C 24 11.787 -5.303 -1.901 1.00 0.19 H new ATOM 0 HB2 GLN C 24 14.339 -6.896 -2.382 1.00 0.16 H new ATOM 0 HB3 GLN C 24 14.103 -5.906 -0.955 1.00 0.16 H new ATOM 0 HG2 GLN C 24 12.057 -7.176 -0.359 1.00 0.17 H new ATOM 0 HG3 GLN C 24 12.160 -8.100 -1.844 1.00 0.17 H new ATOM 0 HE21 GLN C 24 12.292 -9.148 0.956 1.00 0.18 H new ATOM 0 HE22 GLN C 24 13.861 -9.947 1.094 1.00 0.18 H new ATOM 4479 N GLN C 25 14.179 -4.305 -3.922 1.00 0.21 N ATOM 4480 CA GLN C 25 14.919 -3.083 -4.327 1.00 0.23 C ATOM 4481 C GLN C 25 13.909 -1.981 -4.653 1.00 0.25 C ATOM 4482 O GLN C 25 14.011 -0.872 -4.170 1.00 0.25 O ATOM 4483 CB GLN C 25 15.766 -3.398 -5.564 1.00 0.28 C ATOM 4484 CG GLN C 25 16.465 -2.129 -6.071 1.00 0.32 C ATOM 4485 CD GLN C 25 17.292 -1.505 -4.948 1.00 0.34 C ATOM 4486 OE1 GLN C 25 17.851 -2.277 -4.055 1.00 1.06 O flip ATOM 4487 NE2 GLN C 25 17.426 -0.301 -4.877 1.00 1.13 N flip ATOM 0 H GLN C 25 14.346 -5.128 -4.500 1.00 0.21 H new ATOM 0 HA GLN C 25 15.572 -2.750 -3.520 1.00 0.23 H new ATOM 0 HB2 GLN C 25 16.509 -4.157 -5.320 1.00 0.28 H new ATOM 0 HB3 GLN C 25 15.134 -3.811 -6.350 1.00 0.28 H new ATOM 0 HG2 GLN C 25 17.109 -2.371 -6.917 1.00 0.32 H new ATOM 0 HG3 GLN C 25 15.724 -1.414 -6.429 1.00 0.32 H new ATOM 0 HE21 GLN C 25 16.990 0.303 -5.574 1.00 1.13 H new ATOM 0 HE22 GLN C 25 17.975 0.107 -4.120 1.00 1.13 H new ATOM 4496 N GLU C 26 12.924 -2.278 -5.455 1.00 0.27 N ATOM 4497 CA GLU C 26 11.906 -1.239 -5.781 1.00 0.29 C ATOM 4498 C GLU C 26 11.189 -0.812 -4.497 1.00 0.26 C ATOM 4499 O GLU C 26 10.968 0.355 -4.256 1.00 0.26 O ATOM 4500 CB GLU C 26 10.891 -1.806 -6.773 1.00 0.34 C ATOM 4501 CG GLU C 26 11.563 -1.993 -8.134 1.00 0.54 C ATOM 4502 CD GLU C 26 10.562 -2.599 -9.117 1.00 1.19 C ATOM 4503 OE1 GLU C 26 9.454 -2.897 -8.700 1.00 1.94 O ATOM 4504 OE2 GLU C 26 10.919 -2.748 -10.274 1.00 1.85 O ATOM 0 H GLU C 26 12.780 -3.187 -5.896 1.00 0.27 H new ATOM 0 HA GLU C 26 12.398 -0.375 -6.228 1.00 0.29 H new ATOM 0 HB2 GLU C 26 10.505 -2.759 -6.411 1.00 0.34 H new ATOM 0 HB3 GLU C 26 10.039 -1.132 -6.865 1.00 0.34 H new ATOM 0 HG2 GLU C 26 11.922 -1.035 -8.509 1.00 0.54 H new ATOM 0 HG3 GLU C 26 12.432 -2.643 -8.036 1.00 0.54 H new ATOM 4511 N LEU C 27 10.840 -1.754 -3.662 1.00 0.24 N ATOM 4512 CA LEU C 27 10.152 -1.415 -2.382 1.00 0.22 C ATOM 4513 C LEU C 27 11.113 -0.631 -1.491 1.00 0.19 C ATOM 4514 O LEU C 27 10.738 0.316 -0.830 1.00 0.20 O ATOM 4515 CB LEU C 27 9.696 -2.706 -1.692 1.00 0.22 C ATOM 4516 CG LEU C 27 9.170 -2.414 -0.280 1.00 0.22 C ATOM 4517 CD1 LEU C 27 8.083 -1.338 -0.330 1.00 0.25 C ATOM 4518 CD2 LEU C 27 8.580 -3.704 0.304 1.00 0.23 C ATOM 0 H LEU C 27 11.003 -2.750 -3.812 1.00 0.24 H new ATOM 0 HA LEU C 27 9.274 -0.799 -2.577 1.00 0.22 H new ATOM 0 HB2 LEU C 27 8.915 -3.184 -2.284 1.00 0.22 H new ATOM 0 HB3 LEU C 27 10.528 -3.408 -1.637 1.00 0.22 H new ATOM 0 HG LEU C 27 9.990 -2.057 0.343 1.00 0.22 H new ATOM 0 HD11 LEU C 27 7.719 -1.141 0.678 1.00 0.25 H new ATOM 0 HD12 LEU C 27 8.497 -0.422 -0.752 1.00 0.25 H new ATOM 0 HD13 LEU C 27 7.258 -1.683 -0.952 1.00 0.25 H new ATOM 0 HD21 LEU C 27 8.203 -3.510 1.308 1.00 0.23 H new ATOM 0 HD22 LEU C 27 7.764 -4.050 -0.330 1.00 0.23 H new ATOM 0 HD23 LEU C 27 9.354 -4.470 0.349 1.00 0.23 H new ATOM 4530 N LEU C 28 12.356 -1.020 -1.471 1.00 0.18 N ATOM 4531 CA LEU C 28 13.343 -0.297 -0.630 1.00 0.18 C ATOM 4532 C LEU C 28 13.404 1.159 -1.082 1.00 0.20 C ATOM 4533 O LEU C 28 13.478 2.064 -0.277 1.00 0.20 O ATOM 4534 CB LEU C 28 14.719 -0.949 -0.807 1.00 0.18 C ATOM 4535 CG LEU C 28 14.804 -2.254 0.010 1.00 0.18 C ATOM 4536 CD1 LEU C 28 15.916 -3.156 -0.559 1.00 0.21 C ATOM 4537 CD2 LEU C 28 15.122 -1.934 1.483 1.00 0.21 C ATOM 0 H LEU C 28 12.729 -1.807 -2.001 1.00 0.18 H new ATOM 0 HA LEU C 28 13.050 -0.342 0.419 1.00 0.18 H new ATOM 0 HB2 LEU C 28 14.895 -1.160 -1.862 1.00 0.18 H new ATOM 0 HB3 LEU C 28 15.499 -0.259 -0.485 1.00 0.18 H new ATOM 0 HG LEU C 28 13.845 -2.769 -0.053 1.00 0.18 H new ATOM 0 HD11 LEU C 28 15.971 -4.076 0.022 1.00 0.21 H new ATOM 0 HD12 LEU C 28 15.693 -3.396 -1.599 1.00 0.21 H new ATOM 0 HD13 LEU C 28 16.871 -2.634 -0.504 1.00 0.21 H new ATOM 0 HD21 LEU C 28 15.180 -2.862 2.052 1.00 0.21 H new ATOM 0 HD22 LEU C 28 16.076 -1.410 1.544 1.00 0.21 H new ATOM 0 HD23 LEU C 28 14.335 -1.303 1.896 1.00 0.21 H new ATOM 4549 N ARG C 29 13.359 1.400 -2.362 1.00 0.22 N ATOM 4550 CA ARG C 29 13.397 2.804 -2.840 1.00 0.24 C ATOM 4551 C ARG C 29 12.168 3.548 -2.318 1.00 0.24 C ATOM 4552 O ARG C 29 12.252 4.689 -1.911 1.00 0.24 O ATOM 4553 CB ARG C 29 13.400 2.824 -4.369 1.00 0.28 C ATOM 4554 CG ARG C 29 14.744 2.300 -4.879 1.00 0.29 C ATOM 4555 CD ARG C 29 14.748 2.321 -6.408 1.00 0.33 C ATOM 4556 NE ARG C 29 16.032 1.761 -6.912 1.00 0.38 N ATOM 4557 CZ ARG C 29 16.132 1.386 -8.158 1.00 0.88 C ATOM 4558 NH1 ARG C 29 15.112 1.518 -8.958 1.00 1.82 N ATOM 4559 NH2 ARG C 29 17.251 0.880 -8.600 1.00 0.86 N ATOM 0 H ARG C 29 13.298 0.689 -3.091 1.00 0.22 H new ATOM 0 HA ARG C 29 14.300 3.291 -2.473 1.00 0.24 H new ATOM 0 HB2 ARG C 29 12.587 2.208 -4.754 1.00 0.28 H new ATOM 0 HB3 ARG C 29 13.231 3.838 -4.731 1.00 0.28 H new ATOM 0 HG2 ARG C 29 15.557 2.915 -4.493 1.00 0.29 H new ATOM 0 HG3 ARG C 29 14.913 1.286 -4.517 1.00 0.29 H new ATOM 0 HD2 ARG C 29 13.910 1.739 -6.792 1.00 0.33 H new ATOM 0 HD3 ARG C 29 14.619 3.342 -6.768 1.00 0.33 H new ATOM 0 HE ARG C 29 16.832 1.671 -6.285 1.00 0.38 H new ATOM 0 HH11 ARG C 29 14.239 1.913 -8.610 1.00 1.82 H new ATOM 0 HH12 ARG C 29 15.187 1.226 -9.932 1.00 1.82 H new ATOM 0 HH21 ARG C 29 18.048 0.778 -7.971 1.00 0.86 H new ATOM 0 HH22 ARG C 29 17.329 0.587 -9.574 1.00 0.86 H new ATOM 4573 N LEU C 30 11.026 2.908 -2.314 1.00 0.23 N ATOM 4574 CA LEU C 30 9.804 3.595 -1.805 1.00 0.23 C ATOM 4575 C LEU C 30 10.018 3.964 -0.337 1.00 0.21 C ATOM 4576 O LEU C 30 9.704 5.058 0.089 1.00 0.22 O ATOM 4577 CB LEU C 30 8.592 2.664 -1.901 1.00 0.24 C ATOM 4578 CG LEU C 30 8.341 2.248 -3.354 1.00 0.27 C ATOM 4579 CD1 LEU C 30 7.170 1.264 -3.394 1.00 0.29 C ATOM 4580 CD2 LEU C 30 8.010 3.476 -4.217 1.00 0.34 C ATOM 0 H LEU C 30 10.889 1.950 -2.638 1.00 0.23 H new ATOM 0 HA LEU C 30 9.623 4.487 -2.405 1.00 0.23 H new ATOM 0 HB2 LEU C 30 8.758 1.778 -1.288 1.00 0.24 H new ATOM 0 HB3 LEU C 30 7.710 3.166 -1.504 1.00 0.24 H new ATOM 0 HG LEU C 30 9.240 1.777 -3.751 1.00 0.27 H new ATOM 0 HD11 LEU C 30 6.984 0.962 -4.425 1.00 0.29 H new ATOM 0 HD12 LEU C 30 7.413 0.385 -2.797 1.00 0.29 H new ATOM 0 HD13 LEU C 30 6.278 1.743 -2.989 1.00 0.29 H new ATOM 0 HD21 LEU C 30 7.835 3.161 -5.246 1.00 0.34 H new ATOM 0 HD22 LEU C 30 7.115 3.963 -3.829 1.00 0.34 H new ATOM 0 HD23 LEU C 30 8.845 4.176 -4.189 1.00 0.34 H new ATOM 4592 N THR C 31 10.551 3.063 0.447 1.00 0.19 N ATOM 4593 CA THR C 31 10.771 3.384 1.883 1.00 0.18 C ATOM 4594 C THR C 31 11.703 4.584 1.978 1.00 0.18 C ATOM 4595 O THR C 31 11.509 5.482 2.774 1.00 0.18 O ATOM 4596 CB THR C 31 11.401 2.186 2.590 1.00 0.17 C ATOM 4597 OG1 THR C 31 12.622 1.853 1.946 1.00 0.18 O ATOM 4598 CG2 THR C 31 10.446 0.994 2.530 1.00 0.19 C ATOM 0 H THR C 31 10.840 2.129 0.156 1.00 0.19 H new ATOM 0 HA THR C 31 9.819 3.614 2.361 1.00 0.18 H new ATOM 0 HB THR C 31 11.595 2.437 3.633 1.00 0.17 H new ATOM 0 HG1 THR C 31 12.546 2.034 0.986 1.00 0.18 H new ATOM 0 HG21 THR C 31 10.898 0.140 3.035 1.00 0.19 H new ATOM 0 HG22 THR C 31 9.509 1.253 3.023 1.00 0.19 H new ATOM 0 HG23 THR C 31 10.249 0.737 1.489 1.00 0.19 H new ATOM 4606 N VAL C 32 12.704 4.619 1.152 1.00 0.18 N ATOM 4607 CA VAL C 32 13.635 5.771 1.174 1.00 0.19 C ATOM 4608 C VAL C 32 12.858 7.020 0.746 1.00 0.20 C ATOM 4609 O VAL C 32 13.041 8.092 1.286 1.00 0.21 O ATOM 4610 CB VAL C 32 14.789 5.503 0.201 1.00 0.22 C ATOM 4611 CG1 VAL C 32 15.625 6.773 0.025 1.00 0.23 C ATOM 4612 CG2 VAL C 32 15.670 4.383 0.756 1.00 0.22 C ATOM 0 H VAL C 32 12.917 3.899 0.462 1.00 0.18 H new ATOM 0 HA VAL C 32 14.047 5.918 2.172 1.00 0.19 H new ATOM 0 HB VAL C 32 14.384 5.205 -0.766 1.00 0.22 H new ATOM 0 HG11 VAL C 32 16.444 6.577 -0.667 1.00 0.23 H new ATOM 0 HG12 VAL C 32 14.997 7.570 -0.373 1.00 0.23 H new ATOM 0 HG13 VAL C 32 16.031 7.078 0.990 1.00 0.23 H new ATOM 0 HG21 VAL C 32 16.491 4.190 0.066 1.00 0.22 H new ATOM 0 HG22 VAL C 32 16.072 4.682 1.724 1.00 0.22 H new ATOM 0 HG23 VAL C 32 15.075 3.477 0.874 1.00 0.22 H new ATOM 4622 N TRP C 33 11.997 6.885 -0.231 1.00 0.21 N ATOM 4623 CA TRP C 33 11.216 8.060 -0.712 1.00 0.23 C ATOM 4624 C TRP C 33 10.359 8.644 0.417 1.00 0.23 C ATOM 4625 O TRP C 33 10.377 9.835 0.656 1.00 0.23 O ATOM 4626 CB TRP C 33 10.307 7.630 -1.863 1.00 0.25 C ATOM 4627 CG TRP C 33 9.526 8.808 -2.340 1.00 0.27 C ATOM 4628 CD1 TRP C 33 9.929 9.665 -3.304 1.00 0.32 C ATOM 4629 CD2 TRP C 33 8.222 9.278 -1.894 1.00 0.27 C ATOM 4630 NE1 TRP C 33 8.954 10.629 -3.482 1.00 0.34 N ATOM 4631 CE2 TRP C 33 7.881 10.433 -2.636 1.00 0.31 C ATOM 4632 CE3 TRP C 33 7.310 8.816 -0.928 1.00 0.26 C ATOM 4633 CZ2 TRP C 33 6.677 11.109 -2.428 1.00 0.32 C ATOM 4634 CZ3 TRP C 33 6.099 9.493 -0.716 1.00 0.29 C ATOM 4635 CH2 TRP C 33 5.782 10.635 -1.464 1.00 0.31 C ATOM 0 H TRP C 33 11.802 6.009 -0.716 1.00 0.21 H new ATOM 0 HA TRP C 33 11.915 8.824 -1.052 1.00 0.23 H new ATOM 0 HB2 TRP C 33 10.903 7.220 -2.678 1.00 0.25 H new ATOM 0 HB3 TRP C 33 9.632 6.841 -1.533 1.00 0.25 H new ATOM 0 HD1 TRP C 33 10.861 9.606 -3.847 1.00 0.32 H new ATOM 0 HE1 TRP C 33 9.020 11.392 -4.156 1.00 0.34 H new ATOM 0 HE3 TRP C 33 7.543 7.936 -0.347 1.00 0.26 H new ATOM 0 HZ2 TRP C 33 6.439 11.990 -3.006 1.00 0.32 H new ATOM 0 HZ3 TRP C 33 5.406 9.131 0.029 1.00 0.29 H new ATOM 0 HH2 TRP C 33 4.847 11.149 -1.296 1.00 0.31 H new ATOM 4646 N GLY C 34 9.603 7.832 1.115 1.00 0.22 N ATOM 4647 CA GLY C 34 8.764 8.381 2.209 1.00 0.23 C ATOM 4648 C GLY C 34 9.673 9.001 3.264 1.00 0.22 C ATOM 4649 O GLY C 34 9.437 10.091 3.740 1.00 0.23 O ATOM 0 H GLY C 34 9.535 6.824 0.972 1.00 0.22 H new ATOM 0 HA2 GLY C 34 8.076 9.130 1.817 1.00 0.23 H new ATOM 0 HA3 GLY C 34 8.157 7.591 2.651 1.00 0.23 H new ATOM 4653 N THR C 35 10.719 8.312 3.628 1.00 0.22 N ATOM 4654 CA THR C 35 11.650 8.861 4.650 1.00 0.24 C ATOM 4655 C THR C 35 12.241 10.185 4.159 1.00 0.24 C ATOM 4656 O THR C 35 12.220 11.185 4.856 1.00 0.24 O ATOM 4657 CB THR C 35 12.773 7.844 4.883 1.00 0.27 C ATOM 4658 OG1 THR C 35 12.234 6.684 5.500 1.00 0.30 O ATOM 4659 CG2 THR C 35 13.854 8.452 5.776 1.00 0.30 C ATOM 0 H THR C 35 10.968 7.393 3.262 1.00 0.22 H new ATOM 0 HA THR C 35 11.114 9.043 5.581 1.00 0.24 H new ATOM 0 HB THR C 35 13.220 7.574 3.926 1.00 0.27 H new ATOM 0 HG1 THR C 35 11.898 6.073 4.811 1.00 0.30 H new ATOM 0 HG21 THR C 35 14.647 7.722 5.936 1.00 0.30 H new ATOM 0 HG22 THR C 35 14.268 9.338 5.294 1.00 0.30 H new ATOM 0 HG23 THR C 35 13.419 8.731 6.736 1.00 0.30 H new ATOM 4667 N LYS C 36 12.755 10.213 2.961 1.00 0.25 N ATOM 4668 CA LYS C 36 13.329 11.480 2.439 1.00 0.28 C ATOM 4669 C LYS C 36 12.204 12.507 2.284 1.00 0.28 C ATOM 4670 O LYS C 36 12.363 13.673 2.585 1.00 0.30 O ATOM 4671 CB LYS C 36 14.001 11.231 1.086 1.00 0.32 C ATOM 4672 CG LYS C 36 14.888 12.431 0.744 1.00 0.47 C ATOM 4673 CD LYS C 36 15.404 12.309 -0.695 1.00 0.77 C ATOM 4674 CE LYS C 36 16.282 11.057 -0.839 1.00 1.44 C ATOM 4675 NZ LYS C 36 15.418 9.871 -1.088 1.00 2.00 N ATOM 0 H LYS C 36 12.802 9.417 2.325 1.00 0.25 H new ATOM 0 HA LYS C 36 14.078 11.858 3.135 1.00 0.28 H new ATOM 0 HB2 LYS C 36 14.598 10.320 1.124 1.00 0.32 H new ATOM 0 HB3 LYS C 36 13.247 11.087 0.312 1.00 0.32 H new ATOM 0 HG2 LYS C 36 14.323 13.356 0.859 1.00 0.47 H new ATOM 0 HG3 LYS C 36 15.728 12.482 1.437 1.00 0.47 H new ATOM 0 HD2 LYS C 36 14.564 12.254 -1.387 1.00 0.77 H new ATOM 0 HD3 LYS C 36 15.978 13.197 -0.960 1.00 0.77 H new ATOM 0 HE2 LYS C 36 16.986 11.186 -1.661 1.00 1.44 H new ATOM 0 HE3 LYS C 36 16.872 10.907 0.065 1.00 1.44 H new ATOM 0 HZ1 LYS C 36 15.305 9.332 -0.206 1.00 2.00 H new ATOM 0 HZ2 LYS C 36 14.485 10.185 -1.423 1.00 2.00 H new ATOM 0 HZ3 LYS C 36 15.859 9.265 -1.809 1.00 2.00 H new ATOM 4689 N ASN C 37 11.063 12.074 1.820 1.00 0.27 N ATOM 4690 CA ASN C 37 9.914 13.008 1.644 1.00 0.30 C ATOM 4691 C ASN C 37 9.551 13.627 3.000 1.00 0.29 C ATOM 4692 O ASN C 37 9.256 14.798 3.098 1.00 0.33 O ATOM 4693 CB ASN C 37 8.719 12.248 1.076 1.00 0.32 C ATOM 4694 CG ASN C 37 7.545 13.209 0.878 1.00 0.37 C ATOM 4695 OD1 ASN C 37 6.422 12.997 1.508 1.00 0.74 O flip ATOM 4696 ND2 ASN C 37 7.653 14.167 0.135 1.00 0.48 N flip ATOM 0 H ASN C 37 10.876 11.107 1.554 1.00 0.27 H new ATOM 0 HA ASN C 37 10.189 13.802 0.950 1.00 0.30 H new ATOM 0 HB2 ASN C 37 8.988 11.786 0.126 1.00 0.32 H new ATOM 0 HB3 ASN C 37 8.433 11.443 1.753 1.00 0.32 H new ATOM 0 HD21 ASN C 37 8.530 14.334 -0.358 1.00 0.48 H new ATOM 0 HD22 ASN C 37 6.866 14.803 0.005 1.00 0.48 H new ATOM 4703 N LEU C 38 9.578 12.856 4.056 1.00 0.26 N ATOM 4704 CA LEU C 38 9.245 13.427 5.396 1.00 0.27 C ATOM 4705 C LEU C 38 10.230 14.547 5.703 1.00 0.26 C ATOM 4706 O LEU C 38 9.870 15.566 6.255 1.00 0.28 O ATOM 4707 CB LEU C 38 9.343 12.345 6.475 1.00 0.26 C ATOM 4708 CG LEU C 38 8.152 11.381 6.366 1.00 0.30 C ATOM 4709 CD1 LEU C 38 8.413 10.162 7.255 1.00 0.34 C ATOM 4710 CD2 LEU C 38 6.846 12.076 6.814 1.00 0.35 C ATOM 0 H LEU C 38 9.814 11.864 4.050 1.00 0.26 H new ATOM 0 HA LEU C 38 8.226 13.813 5.386 1.00 0.27 H new ATOM 0 HB2 LEU C 38 10.277 11.795 6.365 1.00 0.26 H new ATOM 0 HB3 LEU C 38 9.359 12.806 7.463 1.00 0.26 H new ATOM 0 HG LEU C 38 8.041 11.071 5.327 1.00 0.30 H new ATOM 0 HD11 LEU C 38 7.572 9.473 7.183 1.00 0.34 H new ATOM 0 HD12 LEU C 38 9.323 9.660 6.926 1.00 0.34 H new ATOM 0 HD13 LEU C 38 8.530 10.485 8.290 1.00 0.34 H new ATOM 0 HD21 LEU C 38 6.014 11.377 6.729 1.00 0.35 H new ATOM 0 HD22 LEU C 38 6.943 12.400 7.850 1.00 0.35 H new ATOM 0 HD23 LEU C 38 6.658 12.942 6.179 1.00 0.35 H new ATOM 4722 N GLN C 39 11.469 14.379 5.339 1.00 0.25 N ATOM 4723 CA GLN C 39 12.453 15.455 5.607 1.00 0.29 C ATOM 4724 C GLN C 39 11.981 16.712 4.880 1.00 0.33 C ATOM 4725 O GLN C 39 12.048 17.801 5.409 1.00 0.35 O ATOM 4726 CB GLN C 39 13.821 15.038 5.073 1.00 0.31 C ATOM 4727 CG GLN C 39 14.873 16.066 5.486 1.00 0.39 C ATOM 4728 CD GLN C 39 16.249 15.599 5.016 1.00 0.44 C ATOM 4729 OE1 GLN C 39 16.407 15.165 3.891 1.00 0.84 O ATOM 4730 NE2 GLN C 39 17.262 15.668 5.836 1.00 0.97 N ATOM 0 H GLN C 39 11.838 13.551 4.872 1.00 0.25 H new ATOM 0 HA GLN C 39 12.535 15.642 6.678 1.00 0.29 H new ATOM 0 HB2 GLN C 39 14.088 14.055 5.460 1.00 0.31 H new ATOM 0 HB3 GLN C 39 13.788 14.955 3.987 1.00 0.31 H new ATOM 0 HG2 GLN C 39 14.638 17.038 5.051 1.00 0.39 H new ATOM 0 HG3 GLN C 39 14.869 16.192 6.569 1.00 0.39 H new ATOM 0 HE21 GLN C 39 17.130 16.032 6.780 1.00 0.97 H new ATOM 0 HE22 GLN C 39 18.185 15.358 5.533 1.00 0.97 H new ATOM 4739 N THR C 40 11.476 16.577 3.680 1.00 0.36 N ATOM 4740 CA THR C 40 10.982 17.787 2.972 1.00 0.42 C ATOM 4741 C THR C 40 9.865 18.408 3.815 1.00 0.41 C ATOM 4742 O THR C 40 9.789 19.609 3.960 1.00 0.43 O ATOM 4743 CB THR C 40 10.434 17.419 1.587 1.00 0.47 C ATOM 4744 OG1 THR C 40 9.217 16.702 1.727 1.00 0.46 O ATOM 4745 CG2 THR C 40 11.454 16.560 0.840 1.00 0.49 C ATOM 0 H THR C 40 11.387 15.698 3.171 1.00 0.36 H new ATOM 0 HA THR C 40 11.802 18.492 2.837 1.00 0.42 H new ATOM 0 HB THR C 40 10.250 18.332 1.021 1.00 0.47 H new ATOM 0 HG1 THR C 40 9.394 15.838 2.154 1.00 0.46 H new ATOM 0 HG21 THR C 40 11.061 16.301 -0.143 1.00 0.49 H new ATOM 0 HG22 THR C 40 12.383 17.117 0.724 1.00 0.49 H new ATOM 0 HG23 THR C 40 11.646 15.648 1.406 1.00 0.49 H new ATOM 4753 N ARG C 41 9.007 17.602 4.400 1.00 0.39 N ATOM 4754 CA ARG C 41 7.928 18.183 5.250 1.00 0.39 C ATOM 4755 C ARG C 41 8.573 18.943 6.404 1.00 0.35 C ATOM 4756 O ARG C 41 8.130 20.009 6.787 1.00 0.37 O ATOM 4757 CB ARG C 41 7.032 17.086 5.840 1.00 0.43 C ATOM 4758 CG ARG C 41 6.177 16.436 4.750 1.00 0.55 C ATOM 4759 CD ARG C 41 5.098 15.574 5.422 1.00 0.66 C ATOM 4760 NE ARG C 41 4.536 14.579 4.451 1.00 0.89 N ATOM 4761 CZ ARG C 41 4.019 14.948 3.314 1.00 1.04 C ATOM 4762 NH1 ARG C 41 3.873 16.210 3.028 1.00 1.22 N ATOM 4763 NH2 ARG C 41 3.598 14.044 2.476 1.00 1.32 N ATOM 0 H ARG C 41 9.010 16.585 4.325 1.00 0.39 H new ATOM 0 HA ARG C 41 7.318 18.840 4.630 1.00 0.39 H new ATOM 0 HB2 ARG C 41 7.648 16.329 6.325 1.00 0.43 H new ATOM 0 HB3 ARG C 41 6.387 17.512 6.609 1.00 0.43 H new ATOM 0 HG2 ARG C 41 5.715 17.201 4.125 1.00 0.55 H new ATOM 0 HG3 ARG C 41 6.798 15.823 4.097 1.00 0.55 H new ATOM 0 HD2 ARG C 41 5.523 15.053 6.280 1.00 0.66 H new ATOM 0 HD3 ARG C 41 4.299 16.212 5.801 1.00 0.66 H new ATOM 0 HE ARG C 41 4.559 13.587 4.687 1.00 0.89 H new ATOM 0 HH11 ARG C 41 4.165 16.922 3.698 1.00 1.22 H new ATOM 0 HH12 ARG C 41 3.467 16.487 2.134 1.00 1.22 H new ATOM 0 HH21 ARG C 41 3.674 13.055 2.712 1.00 1.32 H new ATOM 0 HH22 ARG C 41 3.192 14.325 1.584 1.00 1.32 H new ATOM 4777 N VAL C 42 9.622 18.402 6.967 1.00 0.33 N ATOM 4778 CA VAL C 42 10.293 19.100 8.091 1.00 0.35 C ATOM 4779 C VAL C 42 10.771 20.463 7.592 1.00 0.37 C ATOM 4780 O VAL C 42 10.588 21.466 8.247 1.00 0.40 O ATOM 4781 CB VAL C 42 11.482 18.267 8.588 1.00 0.37 C ATOM 4782 CG1 VAL C 42 12.315 19.088 9.576 1.00 0.43 C ATOM 4783 CG2 VAL C 42 10.962 17.007 9.286 1.00 0.37 C ATOM 0 H VAL C 42 10.038 17.511 6.695 1.00 0.33 H new ATOM 0 HA VAL C 42 9.599 19.233 8.921 1.00 0.35 H new ATOM 0 HB VAL C 42 12.105 17.987 7.739 1.00 0.37 H new ATOM 0 HG11 VAL C 42 13.158 18.491 9.925 1.00 0.43 H new ATOM 0 HG12 VAL C 42 12.686 19.985 9.081 1.00 0.43 H new ATOM 0 HG13 VAL C 42 11.695 19.373 10.426 1.00 0.43 H new ATOM 0 HG21 VAL C 42 11.805 16.413 9.640 1.00 0.37 H new ATOM 0 HG22 VAL C 42 10.337 17.292 10.133 1.00 0.37 H new ATOM 0 HG23 VAL C 42 10.373 16.418 8.583 1.00 0.37 H new ATOM 4793 N THR C 43 11.371 20.515 6.430 1.00 0.39 N ATOM 4794 CA THR C 43 11.838 21.836 5.914 1.00 0.45 C ATOM 4795 C THR C 43 10.637 22.776 5.764 1.00 0.44 C ATOM 4796 O THR C 43 10.713 23.948 6.082 1.00 0.47 O ATOM 4797 CB THR C 43 12.516 21.650 4.553 1.00 0.50 C ATOM 4798 OG1 THR C 43 11.589 21.090 3.634 1.00 0.50 O ATOM 4799 CG2 THR C 43 13.718 20.718 4.702 1.00 0.51 C ATOM 0 H THR C 43 11.555 19.714 5.825 1.00 0.39 H new ATOM 0 HA THR C 43 12.553 22.266 6.615 1.00 0.45 H new ATOM 0 HB THR C 43 12.854 22.617 4.182 1.00 0.50 H new ATOM 0 HG1 THR C 43 11.058 20.400 4.084 1.00 0.50 H new ATOM 0 HG21 THR C 43 14.199 20.587 3.733 1.00 0.51 H new ATOM 0 HG22 THR C 43 14.430 21.152 5.405 1.00 0.51 H new ATOM 0 HG23 THR C 43 13.384 19.750 5.075 1.00 0.51 H new ATOM 4807 N ALA C 44 9.525 22.272 5.293 1.00 0.41 N ATOM 4808 CA ALA C 44 8.322 23.143 5.137 1.00 0.43 C ATOM 4809 C ALA C 44 7.827 23.562 6.522 1.00 0.39 C ATOM 4810 O ALA C 44 7.492 24.706 6.758 1.00 0.39 O ATOM 4811 CB ALA C 44 7.221 22.367 4.412 1.00 0.45 C ATOM 0 H ALA C 44 9.398 21.300 5.011 1.00 0.41 H new ATOM 0 HA ALA C 44 8.580 24.028 4.556 1.00 0.43 H new ATOM 0 HB1 ALA C 44 6.343 23.002 4.298 1.00 0.45 H new ATOM 0 HB2 ALA C 44 7.578 22.062 3.428 1.00 0.45 H new ATOM 0 HB3 ALA C 44 6.956 21.483 4.992 1.00 0.45 H new ATOM 4817 N ILE C 45 7.811 22.640 7.442 1.00 0.35 N ATOM 4818 CA ILE C 45 7.378 22.951 8.830 1.00 0.32 C ATOM 4819 C ILE C 45 8.294 24.024 9.417 1.00 0.32 C ATOM 4820 O ILE C 45 7.857 24.911 10.122 1.00 0.31 O ATOM 4821 CB ILE C 45 7.411 21.676 9.681 1.00 0.31 C ATOM 4822 CG1 ILE C 45 6.282 20.742 9.220 1.00 0.32 C ATOM 4823 CG2 ILE C 45 7.218 22.029 11.160 1.00 0.30 C ATOM 4824 CD1 ILE C 45 6.496 19.334 9.786 1.00 0.33 C ATOM 0 H ILE C 45 8.084 21.669 7.288 1.00 0.35 H new ATOM 0 HA ILE C 45 6.356 23.330 8.824 1.00 0.32 H new ATOM 0 HB ILE C 45 8.374 21.181 9.561 1.00 0.31 H new ATOM 0 HG12 ILE C 45 5.319 21.132 9.550 1.00 0.32 H new ATOM 0 HG13 ILE C 45 6.254 20.704 8.131 1.00 0.32 H new ATOM 0 HG21 ILE C 45 7.243 21.118 11.758 1.00 0.30 H new ATOM 0 HG22 ILE C 45 8.018 22.696 11.482 1.00 0.30 H new ATOM 0 HG23 ILE C 45 6.256 22.524 11.293 1.00 0.30 H new ATOM 0 HD11 ILE C 45 5.689 18.681 9.452 1.00 0.33 H new ATOM 0 HD12 ILE C 45 7.450 18.941 9.434 1.00 0.33 H new ATOM 0 HD13 ILE C 45 6.501 19.377 10.875 1.00 0.33 H new ATOM 4836 N GLU C 46 9.565 23.938 9.138 1.00 0.35 N ATOM 4837 CA GLU C 46 10.518 24.943 9.683 1.00 0.36 C ATOM 4838 C GLU C 46 10.117 26.321 9.184 1.00 0.38 C ATOM 4839 O GLU C 46 10.137 27.290 9.916 1.00 0.38 O ATOM 4840 CB GLU C 46 11.927 24.612 9.182 1.00 0.44 C ATOM 4841 CG GLU C 46 12.446 23.345 9.874 1.00 1.20 C ATOM 4842 CD GLU C 46 12.935 23.680 11.287 1.00 1.67 C ATOM 4843 OE1 GLU C 46 14.071 24.110 11.415 1.00 2.17 O ATOM 4844 OE2 GLU C 46 12.171 23.487 12.217 1.00 2.26 O ATOM 0 H GLU C 46 9.985 23.214 8.555 1.00 0.35 H new ATOM 0 HA GLU C 46 10.501 24.926 10.773 1.00 0.36 H new ATOM 0 HB2 GLU C 46 11.913 24.466 8.102 1.00 0.44 H new ATOM 0 HB3 GLU C 46 12.599 25.447 9.382 1.00 0.44 H new ATOM 0 HG2 GLU C 46 11.654 22.597 9.922 1.00 1.20 H new ATOM 0 HG3 GLU C 46 13.259 22.911 9.293 1.00 1.20 H new ATOM 4851 N LYS C 47 9.731 26.416 7.948 1.00 0.41 N ATOM 4852 CA LYS C 47 9.308 27.730 7.410 1.00 0.43 C ATOM 4853 C LYS C 47 8.113 28.241 8.225 1.00 0.41 C ATOM 4854 O LYS C 47 8.093 29.365 8.688 1.00 0.42 O ATOM 4855 CB LYS C 47 8.914 27.554 5.945 1.00 0.48 C ATOM 4856 CG LYS C 47 8.475 28.891 5.366 1.00 1.21 C ATOM 4857 CD LYS C 47 8.131 28.719 3.886 1.00 1.54 C ATOM 4858 CE LYS C 47 7.375 29.954 3.394 1.00 2.30 C ATOM 4859 NZ LYS C 47 8.135 31.181 3.767 1.00 2.87 N ATOM 0 H LYS C 47 9.690 25.640 7.287 1.00 0.41 H new ATOM 0 HA LYS C 47 10.120 28.453 7.480 1.00 0.43 H new ATOM 0 HB2 LYS C 47 9.757 27.160 5.377 1.00 0.48 H new ATOM 0 HB3 LYS C 47 8.106 26.828 5.861 1.00 0.48 H new ATOM 0 HG2 LYS C 47 7.609 29.268 5.910 1.00 1.21 H new ATOM 0 HG3 LYS C 47 9.270 29.628 5.482 1.00 1.21 H new ATOM 0 HD2 LYS C 47 9.042 28.580 3.303 1.00 1.54 H new ATOM 0 HD3 LYS C 47 7.523 27.826 3.744 1.00 1.54 H new ATOM 0 HE2 LYS C 47 7.245 29.908 2.313 1.00 2.30 H new ATOM 0 HE3 LYS C 47 6.378 29.983 3.834 1.00 2.30 H new ATOM 0 HZ1 LYS C 47 7.830 31.974 3.167 1.00 2.87 H new ATOM 0 HZ2 LYS C 47 7.954 31.412 4.765 1.00 2.87 H new ATOM 0 HZ3 LYS C 47 9.152 31.015 3.629 1.00 2.87 H new ATOM 4873 N TYR C 48 7.117 27.419 8.406 1.00 0.38 N ATOM 4874 CA TYR C 48 5.927 27.851 9.194 1.00 0.36 C ATOM 4875 C TYR C 48 6.354 28.195 10.626 1.00 0.32 C ATOM 4876 O TYR C 48 5.890 29.157 11.204 1.00 0.32 O ATOM 4877 CB TYR C 48 4.878 26.734 9.200 1.00 0.37 C ATOM 4878 CG TYR C 48 4.111 26.751 7.892 1.00 0.40 C ATOM 4879 CD1 TYR C 48 3.091 27.688 7.685 1.00 0.45 C ATOM 4880 CD2 TYR C 48 4.428 25.833 6.885 1.00 0.41 C ATOM 4881 CE1 TYR C 48 2.389 27.704 6.473 1.00 0.50 C ATOM 4882 CE2 TYR C 48 3.727 25.848 5.672 1.00 0.46 C ATOM 4883 CZ TYR C 48 2.707 26.783 5.467 1.00 0.50 C ATOM 4884 OH TYR C 48 2.018 26.800 4.274 1.00 0.56 O ATOM 0 H TYR C 48 7.075 26.467 8.043 1.00 0.38 H new ATOM 0 HA TYR C 48 5.489 28.738 8.737 1.00 0.36 H new ATOM 0 HB2 TYR C 48 5.362 25.767 9.337 1.00 0.37 H new ATOM 0 HB3 TYR C 48 4.193 26.869 10.037 1.00 0.37 H new ATOM 0 HD1 TYR C 48 2.846 28.399 8.460 1.00 0.45 H new ATOM 0 HD2 TYR C 48 5.215 25.111 7.043 1.00 0.41 H new ATOM 0 HE1 TYR C 48 1.602 28.427 6.314 1.00 0.50 H new ATOM 0 HE2 TYR C 48 3.974 25.138 4.896 1.00 0.46 H new ATOM 0 HH TYR C 48 2.364 26.097 3.686 1.00 0.56 H new ATOM 4894 N LEU C 49 7.242 27.429 11.202 1.00 0.30 N ATOM 4895 CA LEU C 49 7.694 27.728 12.594 1.00 0.29 C ATOM 4896 C LEU C 49 8.323 29.124 12.625 1.00 0.32 C ATOM 4897 O LEU C 49 8.118 29.885 13.551 1.00 0.32 O ATOM 4898 CB LEU C 49 8.718 26.678 13.068 1.00 0.29 C ATOM 4899 CG LEU C 49 8.030 25.330 13.368 1.00 0.25 C ATOM 4900 CD1 LEU C 49 9.100 24.256 13.590 1.00 0.27 C ATOM 4901 CD2 LEU C 49 7.166 25.441 14.637 1.00 0.25 C ATOM 0 H LEU C 49 7.673 26.611 10.771 1.00 0.30 H new ATOM 0 HA LEU C 49 6.836 27.695 13.265 1.00 0.29 H new ATOM 0 HB2 LEU C 49 9.481 26.538 12.303 1.00 0.29 H new ATOM 0 HB3 LEU C 49 9.226 27.038 13.963 1.00 0.29 H new ATOM 0 HG LEU C 49 7.395 25.063 12.523 1.00 0.25 H new ATOM 0 HD11 LEU C 49 8.619 23.301 13.802 1.00 0.27 H new ATOM 0 HD12 LEU C 49 9.713 24.162 12.693 1.00 0.27 H new ATOM 0 HD13 LEU C 49 9.731 24.540 14.432 1.00 0.27 H new ATOM 0 HD21 LEU C 49 6.687 24.482 14.836 1.00 0.25 H new ATOM 0 HD22 LEU C 49 7.796 25.714 15.483 1.00 0.25 H new ATOM 0 HD23 LEU C 49 6.402 26.205 14.492 1.00 0.25 H new ATOM 4913 N LYS C 50 9.071 29.473 11.619 1.00 0.35 N ATOM 4914 CA LYS C 50 9.709 30.820 11.593 1.00 0.39 C ATOM 4915 C LYS C 50 8.606 31.885 11.650 1.00 0.39 C ATOM 4916 O LYS C 50 8.734 32.892 12.320 1.00 0.41 O ATOM 4917 CB LYS C 50 10.515 30.972 10.295 1.00 0.44 C ATOM 4918 CG LYS C 50 11.194 32.351 10.221 1.00 1.03 C ATOM 4919 CD LYS C 50 12.278 32.470 11.302 1.00 1.21 C ATOM 4920 CE LYS C 50 13.242 33.602 10.934 1.00 1.58 C ATOM 4921 NZ LYS C 50 14.216 33.808 12.042 1.00 2.18 N ATOM 0 H LYS C 50 9.270 28.884 10.811 1.00 0.35 H new ATOM 0 HA LYS C 50 10.379 30.939 12.445 1.00 0.39 H new ATOM 0 HB2 LYS C 50 11.270 30.188 10.239 1.00 0.44 H new ATOM 0 HB3 LYS C 50 9.856 30.842 9.437 1.00 0.44 H new ATOM 0 HG2 LYS C 50 11.637 32.493 9.235 1.00 1.03 H new ATOM 0 HG3 LYS C 50 10.451 33.137 10.353 1.00 1.03 H new ATOM 0 HD2 LYS C 50 11.820 32.668 12.271 1.00 1.21 H new ATOM 0 HD3 LYS C 50 12.822 31.530 11.392 1.00 1.21 H new ATOM 0 HE2 LYS C 50 13.770 33.358 10.012 1.00 1.58 H new ATOM 0 HE3 LYS C 50 12.686 34.521 10.749 1.00 1.58 H new ATOM 0 HZ1 LYS C 50 14.870 34.577 11.791 1.00 2.18 H new ATOM 0 HZ2 LYS C 50 13.704 34.059 12.912 1.00 2.18 H new ATOM 0 HZ3 LYS C 50 14.755 32.932 12.198 1.00 2.18 H new ATOM 4935 N ASP C 51 7.524 31.669 10.962 1.00 0.38 N ATOM 4936 CA ASP C 51 6.424 32.672 10.988 1.00 0.40 C ATOM 4937 C ASP C 51 5.943 32.827 12.433 1.00 0.38 C ATOM 4938 O ASP C 51 5.654 33.914 12.890 1.00 0.40 O ATOM 4939 CB ASP C 51 5.261 32.189 10.119 1.00 0.42 C ATOM 4940 CG ASP C 51 4.143 33.236 10.136 1.00 1.29 C ATOM 4941 OD1 ASP C 51 3.598 33.474 11.201 1.00 1.96 O ATOM 4942 OD2 ASP C 51 3.853 33.781 9.083 1.00 2.07 O ATOM 0 H ASP C 51 7.352 30.846 10.385 1.00 0.38 H new ATOM 0 HA ASP C 51 6.784 33.626 10.603 1.00 0.40 H new ATOM 0 HB2 ASP C 51 5.601 32.021 9.097 1.00 0.42 H new ATOM 0 HB3 ASP C 51 4.887 31.235 10.491 1.00 0.42 H new ATOM 4947 N GLN C 52 5.857 31.747 13.155 1.00 0.36 N ATOM 4948 CA GLN C 52 5.399 31.827 14.574 1.00 0.37 C ATOM 4949 C GLN C 52 6.353 32.727 15.376 1.00 0.38 C ATOM 4950 O GLN C 52 5.923 33.504 16.207 1.00 0.40 O ATOM 4951 CB GLN C 52 5.353 30.404 15.171 1.00 0.42 C ATOM 4952 CG GLN C 52 3.925 29.843 15.091 1.00 1.31 C ATOM 4953 CD GLN C 52 3.370 30.030 13.676 1.00 2.37 C ATOM 4954 OE1 GLN C 52 4.178 29.940 12.656 1.00 3.28 O flip ATOM 4955 NE2 GLN C 52 2.190 30.262 13.499 1.00 2.59 N flip ATOM 0 H GLN C 52 6.084 30.809 12.826 1.00 0.36 H new ATOM 0 HA GLN C 52 4.400 32.261 14.621 1.00 0.37 H new ATOM 0 HB2 GLN C 52 6.039 29.752 14.630 1.00 0.42 H new ATOM 0 HB3 GLN C 52 5.686 30.426 16.209 1.00 0.42 H new ATOM 0 HG2 GLN C 52 3.925 28.785 15.354 1.00 1.31 H new ATOM 0 HG3 GLN C 52 3.285 30.351 15.812 1.00 1.31 H new ATOM 0 HE21 GLN C 52 1.559 30.332 14.297 1.00 2.59 H new ATOM 0 HE22 GLN C 52 1.831 30.386 12.552 1.00 2.59 H new ATOM 4964 N ALA C 53 7.635 32.641 15.144 1.00 0.39 N ATOM 4965 CA ALA C 53 8.578 33.502 15.905 1.00 0.45 C ATOM 4966 C ALA C 53 8.205 34.961 15.650 1.00 0.47 C ATOM 4967 O ALA C 53 8.238 35.789 16.538 1.00 0.53 O ATOM 4968 CB ALA C 53 10.008 33.251 15.422 1.00 0.50 C ATOM 0 H ALA C 53 8.066 32.015 14.464 1.00 0.39 H new ATOM 0 HA ALA C 53 8.518 33.275 16.969 1.00 0.45 H new ATOM 0 HB1 ALA C 53 10.697 33.883 15.981 1.00 0.50 H new ATOM 0 HB2 ALA C 53 10.267 32.204 15.580 1.00 0.50 H new ATOM 0 HB3 ALA C 53 10.080 33.487 14.360 1.00 0.50 H new ATOM 4974 N GLN C 54 7.842 35.279 14.437 1.00 0.45 N ATOM 4975 CA GLN C 54 7.454 36.679 14.114 1.00 0.50 C ATOM 4976 C GLN C 54 6.260 37.080 14.988 1.00 0.55 C ATOM 4977 O GLN C 54 6.175 38.194 15.465 1.00 0.62 O ATOM 4978 CB GLN C 54 7.084 36.781 12.628 1.00 0.51 C ATOM 4979 CG GLN C 54 6.708 38.224 12.280 1.00 0.58 C ATOM 4980 CD GLN C 54 6.361 38.319 10.793 1.00 0.62 C ATOM 4981 OE1 GLN C 54 6.781 37.390 9.977 1.00 0.97 O flip ATOM 4982 NE2 GLN C 54 5.703 39.248 10.367 1.00 1.03 N flip ATOM 0 H GLN C 54 7.798 34.626 13.654 1.00 0.45 H new ATOM 0 HA GLN C 54 8.288 37.352 14.313 1.00 0.50 H new ATOM 0 HB2 GLN C 54 7.923 36.457 12.013 1.00 0.51 H new ATOM 0 HB3 GLN C 54 6.250 36.115 12.406 1.00 0.51 H new ATOM 0 HG2 GLN C 54 5.859 38.545 12.883 1.00 0.58 H new ATOM 0 HG3 GLN C 54 7.536 38.893 12.514 1.00 0.58 H new ATOM 0 HE21 GLN C 54 5.374 39.974 11.003 1.00 1.03 H new ATOM 0 HE22 GLN C 54 5.479 39.301 9.373 1.00 1.03 H new ATOM 4991 N LEU C 55 5.333 36.182 15.200 1.00 0.54 N ATOM 4992 CA LEU C 55 4.147 36.516 16.042 1.00 0.62 C ATOM 4993 C LEU C 55 4.569 36.583 17.512 1.00 0.65 C ATOM 4994 O LEU C 55 4.974 35.596 18.096 1.00 0.59 O ATOM 4995 CB LEU C 55 3.088 35.425 15.874 1.00 0.60 C ATOM 4996 CG LEU C 55 2.740 35.271 14.390 1.00 0.63 C ATOM 4997 CD1 LEU C 55 1.700 34.158 14.228 1.00 0.65 C ATOM 4998 CD2 LEU C 55 2.172 36.594 13.843 1.00 0.78 C ATOM 0 H LEU C 55 5.346 35.233 14.827 1.00 0.54 H new ATOM 0 HA LEU C 55 3.739 37.479 15.734 1.00 0.62 H new ATOM 0 HB2 LEU C 55 3.459 34.480 16.271 1.00 0.60 H new ATOM 0 HB3 LEU C 55 2.194 35.681 16.443 1.00 0.60 H new ATOM 0 HG LEU C 55 3.641 35.015 13.832 1.00 0.63 H new ATOM 0 HD11 LEU C 55 1.449 34.045 13.173 1.00 0.65 H new ATOM 0 HD12 LEU C 55 2.108 33.221 14.606 1.00 0.65 H new ATOM 0 HD13 LEU C 55 0.801 34.415 14.789 1.00 0.65 H new ATOM 0 HD21 LEU C 55 1.927 36.476 12.787 1.00 0.78 H new ATOM 0 HD22 LEU C 55 1.272 36.860 14.397 1.00 0.78 H new ATOM 0 HD23 LEU C 55 2.915 37.384 13.957 1.00 0.78 H new ATOM 5010 N ASN C 56 4.476 37.745 18.114 1.00 0.78 N ATOM 5011 CA ASN C 56 4.865 37.899 19.553 1.00 0.85 C ATOM 5012 C ASN C 56 3.790 38.696 20.297 1.00 0.97 C ATOM 5013 O ASN C 56 3.124 38.189 21.180 1.00 0.92 O ATOM 5014 CB ASN C 56 6.201 38.636 19.628 1.00 0.92 C ATOM 5015 CG ASN C 56 7.278 37.779 18.964 1.00 0.85 C ATOM 5016 OD1 ASN C 56 7.761 38.141 17.806 1.00 1.37 O flip ATOM 5017 ND2 ASN C 56 7.677 36.763 19.498 1.00 1.36 N flip ATOM 0 H ASN C 56 4.145 38.600 17.667 1.00 0.78 H new ATOM 0 HA ASN C 56 4.960 36.917 20.017 1.00 0.85 H new ATOM 0 HB2 ASN C 56 6.127 39.602 19.128 1.00 0.92 H new ATOM 0 HB3 ASN C 56 6.464 38.834 20.667 1.00 0.92 H new ATOM 0 HD21 ASN C 56 7.300 36.480 20.403 1.00 1.36 H new ATOM 0 HD22 ASN C 56 8.389 36.193 19.042 1.00 1.36 H new ATOM 5024 N ALA C 57 3.620 39.941 19.943 1.00 1.13 N ATOM 5025 CA ALA C 57 2.591 40.788 20.618 1.00 1.24 C ATOM 5026 C ALA C 57 2.131 41.880 19.647 1.00 1.36 C ATOM 5027 O ALA C 57 2.865 42.790 19.323 1.00 1.50 O ATOM 5028 CB ALA C 57 3.197 41.421 21.875 1.00 1.33 C ATOM 0 H ALA C 57 4.152 40.412 19.211 1.00 1.13 H new ATOM 0 HA ALA C 57 1.735 40.178 20.908 1.00 1.24 H new ATOM 0 HB1 ALA C 57 2.447 42.039 22.369 1.00 1.33 H new ATOM 0 HB2 ALA C 57 3.525 40.636 22.556 1.00 1.33 H new ATOM 0 HB3 ALA C 57 4.050 42.039 21.596 1.00 1.33 H new ATOM 5034 N TRP C 58 0.918 41.774 19.170 1.00 1.35 N ATOM 5035 CA TRP C 58 0.377 42.775 18.197 1.00 1.48 C ATOM 5036 C TRP C 58 -0.641 43.692 18.877 1.00 1.33 C ATOM 5037 O TRP C 58 -1.533 43.241 19.566 1.00 1.26 O ATOM 5038 CB TRP C 58 -0.315 42.033 17.055 1.00 1.68 C ATOM 5039 CG TRP C 58 0.711 41.370 16.198 1.00 1.88 C ATOM 5040 CD1 TRP C 58 1.119 40.090 16.331 1.00 1.95 C ATOM 5041 CD2 TRP C 58 1.464 41.927 15.082 1.00 2.05 C ATOM 5042 NE1 TRP C 58 2.077 39.823 15.371 1.00 2.16 N ATOM 5043 CE2 TRP C 58 2.323 40.924 14.575 1.00 2.23 C ATOM 5044 CE3 TRP C 58 1.485 43.191 14.467 1.00 2.08 C ATOM 5045 CZ2 TRP C 58 3.174 41.168 13.496 1.00 2.44 C ATOM 5046 CZ3 TRP C 58 2.338 43.440 13.380 1.00 2.29 C ATOM 5047 CH2 TRP C 58 3.181 42.431 12.896 1.00 2.47 C ATOM 0 H TRP C 58 0.269 41.027 19.416 1.00 1.35 H new ATOM 0 HA TRP C 58 1.202 43.379 17.819 1.00 1.48 H new ATOM 0 HB2 TRP C 58 -1.005 41.290 17.455 1.00 1.68 H new ATOM 0 HB3 TRP C 58 -0.906 42.729 16.460 1.00 1.68 H new ATOM 0 HD1 TRP C 58 0.756 39.389 17.068 1.00 1.95 H new ATOM 0 HE1 TRP C 58 2.545 38.923 15.264 1.00 2.16 H new ATOM 0 HE3 TRP C 58 0.840 43.976 14.833 1.00 2.08 H new ATOM 0 HZ2 TRP C 58 3.822 40.387 13.127 1.00 2.44 H new ATOM 0 HZ3 TRP C 58 2.344 44.414 12.914 1.00 2.29 H new ATOM 0 HH2 TRP C 58 3.836 42.629 12.060 1.00 2.47 H new ATOM 5058 N GLY C 59 -0.528 44.974 18.667 1.00 1.33 N ATOM 5059 CA GLY C 59 -1.505 45.917 19.283 1.00 1.27 C ATOM 5060 C GLY C 59 -1.287 45.969 20.790 1.00 1.16 C ATOM 5061 O GLY C 59 -2.136 46.423 21.530 1.00 1.13 O ATOM 0 H GLY C 59 0.197 45.410 18.097 1.00 1.33 H new ATOM 0 HA2 GLY C 59 -1.385 46.912 18.854 1.00 1.27 H new ATOM 0 HA3 GLY C 59 -2.523 45.596 19.064 1.00 1.27 H new ATOM 5065 N ALA C 60 -0.160 45.510 21.253 1.00 1.14 N ATOM 5066 CA ALA C 60 0.101 45.525 22.713 1.00 1.11 C ATOM 5067 C ALA C 60 0.372 46.960 23.166 1.00 1.02 C ATOM 5068 O ALA C 60 0.978 47.187 24.191 1.00 1.05 O ATOM 5069 CB ALA C 60 1.326 44.639 22.994 1.00 1.19 C ATOM 0 H ALA C 60 0.591 45.125 20.681 1.00 1.14 H new ATOM 0 HA ALA C 60 -0.762 45.144 23.259 1.00 1.11 H new ATOM 0 HB1 ALA C 60 1.535 44.636 24.064 1.00 1.19 H new ATOM 0 HB2 ALA C 60 1.123 43.621 22.661 1.00 1.19 H new ATOM 0 HB3 ALA C 60 2.189 45.031 22.456 1.00 1.19 H new ATOM 5075 N ALA C 61 -0.085 47.932 22.421 1.00 0.96 N ATOM 5076 CA ALA C 61 0.145 49.345 22.834 1.00 0.92 C ATOM 5077 C ALA C 61 -0.866 50.264 22.143 1.00 1.17 C ATOM 5078 O ALA C 61 -0.818 50.450 20.943 1.00 1.25 O ATOM 5079 CB ALA C 61 1.568 49.752 22.445 1.00 0.72 C ATOM 0 H ALA C 61 -0.603 47.809 21.551 1.00 0.96 H new ATOM 0 HA ALA C 61 0.019 49.435 23.913 1.00 0.92 H new ATOM 0 HB1 ALA C 61 1.745 50.785 22.744 1.00 0.72 H new ATOM 0 HB2 ALA C 61 2.283 49.101 22.948 1.00 0.72 H new ATOM 0 HB3 ALA C 61 1.691 49.660 21.366 1.00 0.72 H new ATOM 5085 N PHE C 62 -1.771 50.860 22.889 1.00 1.49 N ATOM 5086 CA PHE C 62 -2.774 51.792 22.272 1.00 1.80 C ATOM 5087 C PHE C 62 -2.458 53.238 22.672 1.00 1.70 C ATOM 5088 O PHE C 62 -3.240 54.136 22.432 1.00 1.94 O ATOM 5089 CB PHE C 62 -4.190 51.411 22.742 1.00 2.32 C ATOM 5090 CG PHE C 62 -4.720 50.268 21.902 1.00 2.69 C ATOM 5091 CD1 PHE C 62 -5.421 50.553 20.723 1.00 2.87 C ATOM 5092 CD2 PHE C 62 -4.512 48.938 22.287 1.00 2.93 C ATOM 5093 CE1 PHE C 62 -5.916 49.511 19.930 1.00 3.24 C ATOM 5094 CE2 PHE C 62 -5.008 47.895 21.491 1.00 3.28 C ATOM 5095 CZ PHE C 62 -5.709 48.181 20.314 1.00 3.42 C ATOM 0 H PHE C 62 -1.858 50.741 23.898 1.00 1.49 H new ATOM 0 HA PHE C 62 -2.723 51.709 21.186 1.00 1.80 H new ATOM 0 HB2 PHE C 62 -4.169 51.122 23.793 1.00 2.32 H new ATOM 0 HB3 PHE C 62 -4.854 52.272 22.661 1.00 2.32 H new ATOM 0 HD1 PHE C 62 -5.580 51.579 20.425 1.00 2.87 H new ATOM 0 HD2 PHE C 62 -3.971 48.716 23.195 1.00 2.93 H new ATOM 0 HE1 PHE C 62 -6.457 49.733 19.022 1.00 3.24 H new ATOM 0 HE2 PHE C 62 -4.849 46.869 21.787 1.00 3.28 H new ATOM 0 HZ PHE C 62 -6.090 47.376 19.703 1.00 3.42 H new ATOM 5105 N ARG C 63 -1.297 53.476 23.237 1.00 1.42 N ATOM 5106 CA ARG C 63 -0.902 54.874 23.607 1.00 1.41 C ATOM 5107 C ARG C 63 0.539 55.100 23.149 1.00 1.25 C ATOM 5108 O ARG C 63 1.251 55.939 23.663 1.00 1.34 O ATOM 5109 CB ARG C 63 -0.990 55.066 25.125 1.00 1.66 C ATOM 5110 CG ARG C 63 -2.457 55.036 25.564 1.00 2.30 C ATOM 5111 CD ARG C 63 -2.548 55.263 27.075 1.00 2.72 C ATOM 5112 NE ARG C 63 -2.084 56.639 27.398 1.00 3.14 N ATOM 5113 CZ ARG C 63 -2.361 57.164 28.558 1.00 3.66 C ATOM 5114 NH1 ARG C 63 -3.062 56.489 29.428 1.00 3.89 N ATOM 5115 NH2 ARG C 63 -1.939 58.364 28.848 1.00 4.35 N ATOM 0 H ARG C 63 -0.604 52.761 23.458 1.00 1.42 H new ATOM 0 HA ARG C 63 -1.573 55.586 23.127 1.00 1.41 H new ATOM 0 HB2 ARG C 63 -0.432 54.280 25.634 1.00 1.66 H new ATOM 0 HB3 ARG C 63 -0.535 56.015 25.408 1.00 1.66 H new ATOM 0 HG2 ARG C 63 -3.020 55.806 25.036 1.00 2.30 H new ATOM 0 HG3 ARG C 63 -2.905 54.077 25.303 1.00 2.30 H new ATOM 0 HD2 ARG C 63 -3.575 55.125 27.413 1.00 2.72 H new ATOM 0 HD3 ARG C 63 -1.938 54.529 27.601 1.00 2.72 H new ATOM 0 HE ARG C 63 -1.549 57.171 26.712 1.00 3.14 H new ATOM 0 HH11 ARG C 63 -3.392 55.551 29.200 1.00 3.89 H new ATOM 0 HH12 ARG C 63 -3.279 56.899 30.336 1.00 3.89 H new ATOM 0 HH21 ARG C 63 -1.392 58.891 28.167 1.00 4.35 H new ATOM 0 HH22 ARG C 63 -2.156 58.775 29.756 1.00 4.35 H new ATOM 5129 N GLN C 64 0.961 54.351 22.167 1.00 1.12 N ATOM 5130 CA GLN C 64 2.346 54.494 21.632 1.00 1.12 C ATOM 5131 C GLN C 64 2.327 54.153 20.144 1.00 1.12 C ATOM 5132 O GLN C 64 1.506 53.379 19.694 1.00 1.09 O ATOM 5133 CB GLN C 64 3.303 53.533 22.352 1.00 1.17 C ATOM 5134 CG GLN C 64 3.462 53.933 23.833 1.00 1.37 C ATOM 5135 CD GLN C 64 2.360 53.289 24.680 1.00 1.77 C ATOM 5136 OE1 GLN C 64 1.353 52.706 24.090 1.00 2.43 O flip ATOM 5137 NE2 GLN C 64 2.420 53.314 25.895 1.00 1.84 N flip ATOM 0 H GLN C 64 0.398 53.636 21.706 1.00 1.12 H new ATOM 0 HA GLN C 64 2.690 55.516 21.791 1.00 1.12 H new ATOM 0 HB2 GLN C 64 2.923 52.514 22.284 1.00 1.17 H new ATOM 0 HB3 GLN C 64 4.276 53.544 21.860 1.00 1.17 H new ATOM 0 HG2 GLN C 64 4.440 53.620 24.198 1.00 1.37 H new ATOM 0 HG3 GLN C 64 3.418 55.018 23.930 1.00 1.37 H new ATOM 0 HE21 GLN C 64 3.207 53.769 26.357 1.00 1.84 H new ATOM 0 HE22 GLN C 64 1.684 52.879 26.451 1.00 1.84 H new ATOM 5146 N VAL C 65 3.231 54.704 19.378 1.00 1.28 N ATOM 5147 CA VAL C 65 3.271 54.391 17.916 1.00 1.44 C ATOM 5148 C VAL C 65 4.434 53.429 17.652 1.00 1.49 C ATOM 5149 O VAL C 65 5.336 53.722 16.894 1.00 1.72 O ATOM 5150 CB VAL C 65 3.491 55.689 17.129 1.00 1.71 C ATOM 5151 CG1 VAL C 65 3.171 55.450 15.652 1.00 1.93 C ATOM 5152 CG2 VAL C 65 2.569 56.783 17.680 1.00 1.67 C ATOM 0 H VAL C 65 3.945 55.358 19.700 1.00 1.28 H new ATOM 0 HA VAL C 65 2.333 53.933 17.603 1.00 1.44 H new ATOM 0 HB VAL C 65 4.530 56.004 17.230 1.00 1.71 H new ATOM 0 HG11 VAL C 65 3.327 56.372 15.092 1.00 1.93 H new ATOM 0 HG12 VAL C 65 3.825 54.672 15.259 1.00 1.93 H new ATOM 0 HG13 VAL C 65 2.132 55.136 15.551 1.00 1.93 H new ATOM 0 HG21 VAL C 65 2.725 57.706 17.121 1.00 1.67 H new ATOM 0 HG22 VAL C 65 1.530 56.468 17.579 1.00 1.67 H new ATOM 0 HG23 VAL C 65 2.795 56.954 18.732 1.00 1.67 H new ATOM 5162 N ALA C 66 4.412 52.274 18.275 1.00 1.30 N ATOM 5163 CA ALA C 66 5.507 51.281 18.064 1.00 1.38 C ATOM 5164 C ALA C 66 4.957 49.860 18.237 1.00 1.17 C ATOM 5165 O ALA C 66 3.954 49.648 18.888 1.00 1.01 O ATOM 5166 CB ALA C 66 6.619 51.522 19.088 1.00 1.51 C ATOM 0 H ALA C 66 3.680 51.978 18.921 1.00 1.30 H new ATOM 0 HA ALA C 66 5.906 51.395 17.056 1.00 1.38 H new ATOM 0 HB1 ALA C 66 7.419 50.797 18.934 1.00 1.51 H new ATOM 0 HB2 ALA C 66 7.015 52.530 18.965 1.00 1.51 H new ATOM 0 HB3 ALA C 66 6.217 51.410 20.095 1.00 1.51 H new ATOM 5172 N HIS C 67 5.623 48.887 17.670 1.00 1.22 N ATOM 5173 CA HIS C 67 5.174 47.460 17.794 1.00 1.06 C ATOM 5174 C HIS C 67 6.357 46.608 18.253 1.00 1.10 C ATOM 5175 O HIS C 67 7.443 46.709 17.718 1.00 1.27 O ATOM 5176 CB HIS C 67 4.662 46.956 16.439 1.00 1.11 C ATOM 5177 CG HIS C 67 3.283 47.508 16.184 1.00 1.12 C ATOM 5178 ND1 HIS C 67 2.904 48.015 14.949 1.00 1.35 N ATOM 5179 CD2 HIS C 67 2.179 47.632 16.994 1.00 1.02 C ATOM 5180 CE1 HIS C 67 1.622 48.416 15.050 1.00 1.38 C ATOM 5181 NE2 HIS C 67 1.137 48.203 16.276 1.00 1.19 N ATOM 0 H HIS C 67 6.471 49.019 17.118 1.00 1.22 H new ATOM 0 HA HIS C 67 4.366 47.389 18.522 1.00 1.06 H new ATOM 0 HB2 HIS C 67 5.341 47.265 15.644 1.00 1.11 H new ATOM 0 HB3 HIS C 67 4.636 45.866 16.431 1.00 1.11 H new ATOM 0 HD2 HIS C 67 2.130 47.331 18.030 1.00 1.02 H new ATOM 0 HE1 HIS C 67 1.057 48.855 14.241 1.00 1.38 H new ATOM 0 HE2 HIS C 67 0.198 48.415 16.614 1.00 1.19 H new ATOM 5189 N THR C 68 6.168 45.771 19.247 1.00 1.01 N ATOM 5190 CA THR C 68 7.301 44.926 19.734 1.00 1.12 C ATOM 5191 C THR C 68 7.228 43.552 19.070 1.00 0.99 C ATOM 5192 O THR C 68 6.299 42.796 19.277 1.00 0.86 O ATOM 5193 CB THR C 68 7.207 44.768 21.258 1.00 1.21 C ATOM 5194 OG1 THR C 68 8.307 43.997 21.720 1.00 1.39 O ATOM 5195 CG2 THR C 68 5.895 44.068 21.642 1.00 1.09 C ATOM 0 H THR C 68 5.284 45.638 19.738 1.00 1.01 H new ATOM 0 HA THR C 68 8.248 45.403 19.480 1.00 1.12 H new ATOM 0 HB THR C 68 7.228 45.756 21.718 1.00 1.21 H new ATOM 0 HG1 THR C 68 8.250 43.896 22.693 1.00 1.39 H new ATOM 0 HG21 THR C 68 5.842 43.963 22.726 1.00 1.09 H new ATOM 0 HG22 THR C 68 5.050 44.662 21.294 1.00 1.09 H new ATOM 0 HG23 THR C 68 5.860 43.082 21.180 1.00 1.09 H new ATOM 5203 N THR C 69 8.211 43.235 18.263 1.00 1.06 N ATOM 5204 CA THR C 69 8.236 41.917 17.561 1.00 0.95 C ATOM 5205 C THR C 69 9.481 41.146 17.987 1.00 1.00 C ATOM 5206 O THR C 69 10.593 41.597 17.806 1.00 1.16 O ATOM 5207 CB THR C 69 8.272 42.147 16.045 1.00 1.05 C ATOM 5208 OG1 THR C 69 8.268 40.891 15.382 1.00 1.09 O ATOM 5209 CG2 THR C 69 9.537 42.925 15.659 1.00 1.28 C ATOM 0 H THR C 69 9.005 43.842 18.060 1.00 1.06 H new ATOM 0 HA THR C 69 7.344 41.346 17.820 1.00 0.95 H new ATOM 0 HB THR C 69 7.397 42.725 15.749 1.00 1.05 H new ATOM 0 HG1 THR C 69 8.289 41.033 14.413 1.00 1.09 H new ATOM 0 HG21 THR C 69 9.552 43.083 14.581 1.00 1.28 H new ATOM 0 HG22 THR C 69 9.540 43.889 16.167 1.00 1.28 H new ATOM 0 HG23 THR C 69 10.418 42.356 15.955 1.00 1.28 H new ATOM 5217 N VAL C 70 9.299 39.984 18.555 1.00 0.89 N ATOM 5218 CA VAL C 70 10.461 39.158 19.003 1.00 0.98 C ATOM 5219 C VAL C 70 10.520 37.885 18.149 1.00 0.85 C ATOM 5220 O VAL C 70 9.840 36.919 18.435 1.00 0.80 O ATOM 5221 CB VAL C 70 10.255 38.760 20.466 1.00 1.08 C ATOM 5222 CG1 VAL C 70 11.364 37.795 20.899 1.00 1.24 C ATOM 5223 CG2 VAL C 70 10.298 40.015 21.342 1.00 1.18 C ATOM 0 H VAL C 70 8.385 39.566 18.730 1.00 0.89 H new ATOM 0 HA VAL C 70 11.385 39.726 18.898 1.00 0.98 H new ATOM 0 HB VAL C 70 9.288 38.269 20.577 1.00 1.08 H new ATOM 0 HG11 VAL C 70 11.215 37.513 21.941 1.00 1.24 H new ATOM 0 HG12 VAL C 70 11.334 36.902 20.274 1.00 1.24 H new ATOM 0 HG13 VAL C 70 12.333 38.282 20.790 1.00 1.24 H new ATOM 0 HG21 VAL C 70 10.152 39.736 22.385 1.00 1.18 H new ATOM 0 HG22 VAL C 70 11.266 40.504 21.230 1.00 1.18 H new ATOM 0 HG23 VAL C 70 9.507 40.700 21.035 1.00 1.18 H new ATOM 5233 N PRO C 71 11.320 37.870 17.106 1.00 0.84 N ATOM 5234 CA PRO C 71 11.444 36.685 16.218 1.00 0.75 C ATOM 5235 C PRO C 71 12.442 35.665 16.770 1.00 0.74 C ATOM 5236 O PRO C 71 13.453 35.376 16.160 1.00 0.78 O ATOM 5237 CB PRO C 71 11.939 37.293 14.903 1.00 0.84 C ATOM 5238 CG PRO C 71 12.779 38.462 15.318 1.00 0.99 C ATOM 5239 CD PRO C 71 12.197 38.970 16.651 1.00 0.99 C ATOM 0 HA PRO C 71 10.510 36.132 16.114 1.00 0.75 H new ATOM 0 HB2 PRO C 71 12.520 36.572 14.327 1.00 0.84 H new ATOM 0 HB3 PRO C 71 11.106 37.607 14.274 1.00 0.84 H new ATOM 0 HG2 PRO C 71 13.822 38.167 15.438 1.00 0.99 H new ATOM 0 HG3 PRO C 71 12.754 39.245 14.561 1.00 0.99 H new ATOM 0 HD2 PRO C 71 12.984 39.178 17.376 1.00 0.99 H new ATOM 0 HD3 PRO C 71 11.637 39.895 16.514 1.00 0.99 H new ATOM 5247 N TRP C 72 12.155 35.111 17.916 1.00 0.72 N ATOM 5248 CA TRP C 72 13.077 34.103 18.507 1.00 0.75 C ATOM 5249 C TRP C 72 13.045 32.861 17.615 1.00 0.67 C ATOM 5250 O TRP C 72 11.978 32.396 17.274 1.00 0.60 O ATOM 5251 CB TRP C 72 12.581 33.722 19.903 1.00 0.78 C ATOM 5252 CG TRP C 72 13.617 32.882 20.587 1.00 0.84 C ATOM 5253 CD1 TRP C 72 14.771 33.351 21.118 1.00 0.94 C ATOM 5254 CD2 TRP C 72 13.612 31.443 20.824 1.00 0.84 C ATOM 5255 NE1 TRP C 72 15.474 32.293 21.664 1.00 0.99 N ATOM 5256 CE2 TRP C 72 14.802 31.097 21.508 1.00 0.93 C ATOM 5257 CE3 TRP C 72 12.702 30.416 20.516 1.00 0.79 C ATOM 5258 CZ2 TRP C 72 15.078 29.780 21.871 1.00 0.97 C ATOM 5259 CZ3 TRP C 72 12.979 29.088 20.880 1.00 0.84 C ATOM 5260 CH2 TRP C 72 14.164 28.770 21.557 1.00 0.92 C ATOM 0 H TRP C 72 11.322 35.313 18.468 1.00 0.72 H new ATOM 0 HA TRP C 72 14.088 34.505 18.578 1.00 0.75 H new ATOM 0 HB2 TRP C 72 12.381 34.620 20.488 1.00 0.78 H new ATOM 0 HB3 TRP C 72 11.642 33.173 19.830 1.00 0.78 H new ATOM 0 HD1 TRP C 72 15.090 34.383 21.115 1.00 0.94 H new ATOM 0 HE1 TRP C 72 16.379 32.385 22.126 1.00 0.99 H new ATOM 0 HE3 TRP C 72 11.785 30.650 19.996 1.00 0.79 H new ATOM 0 HZ2 TRP C 72 15.993 29.541 22.392 1.00 0.97 H new ATOM 0 HZ3 TRP C 72 12.274 28.307 20.637 1.00 0.84 H new ATOM 0 HH2 TRP C 72 14.371 27.747 21.835 1.00 0.92 H new ATOM 5271 N PRO C 73 14.174 32.318 17.213 1.00 0.71 N ATOM 5272 CA PRO C 73 14.164 31.122 16.334 1.00 0.65 C ATOM 5273 C PRO C 73 13.099 30.113 16.770 1.00 0.58 C ATOM 5274 O PRO C 73 12.870 29.897 17.945 1.00 0.61 O ATOM 5275 CB PRO C 73 15.576 30.549 16.509 1.00 0.74 C ATOM 5276 CG PRO C 73 16.438 31.742 16.789 1.00 0.84 C ATOM 5277 CD PRO C 73 15.549 32.753 17.530 1.00 0.82 C ATOM 0 HA PRO C 73 13.922 31.359 15.298 1.00 0.65 H new ATOM 0 HB2 PRO C 73 15.614 29.832 17.329 1.00 0.74 H new ATOM 0 HB3 PRO C 73 15.905 30.025 15.612 1.00 0.74 H new ATOM 0 HG2 PRO C 73 17.300 31.465 17.396 1.00 0.84 H new ATOM 0 HG3 PRO C 73 16.824 32.169 15.863 1.00 0.84 H new ATOM 0 HD2 PRO C 73 15.735 32.737 18.604 1.00 0.82 H new ATOM 0 HD3 PRO C 73 15.734 33.772 17.190 1.00 0.82 H new ATOM 5285 N ASN C 74 12.455 29.491 15.827 1.00 0.52 N ATOM 5286 CA ASN C 74 11.401 28.482 16.145 1.00 0.48 C ATOM 5287 C ASN C 74 11.634 27.273 15.254 1.00 0.50 C ATOM 5288 O ASN C 74 11.148 26.184 15.492 1.00 0.80 O ATOM 5289 CB ASN C 74 10.029 29.085 15.850 1.00 0.47 C ATOM 5290 CG ASN C 74 8.927 28.129 16.314 1.00 0.53 C ATOM 5291 OD1 ASN C 74 9.238 27.112 17.067 1.00 1.17 O flip ATOM 5292 ND2 ASN C 74 7.771 28.312 15.986 1.00 1.26 N flip ATOM 0 H ASN C 74 12.614 29.639 14.830 1.00 0.52 H new ATOM 0 HA ASN C 74 11.442 28.191 17.195 1.00 0.48 H new ATOM 0 HB2 ASN C 74 9.927 30.044 16.358 1.00 0.47 H new ATOM 0 HB3 ASN C 74 9.929 29.277 14.782 1.00 0.47 H new ATOM 0 HD21 ASN C 74 7.528 29.108 15.397 1.00 1.26 H new ATOM 0 HD22 ASN C 74 7.044 27.669 16.300 1.00 1.26 H new ATOM 5299 N ALA C 75 12.383 27.482 14.214 1.00 0.47 N ATOM 5300 CA ALA C 75 12.688 26.401 13.254 1.00 0.47 C ATOM 5301 C ALA C 75 13.952 25.687 13.711 1.00 0.46 C ATOM 5302 O ALA C 75 14.981 26.303 13.915 1.00 0.47 O ATOM 5303 CB ALA C 75 12.913 27.022 11.872 1.00 0.53 C ATOM 0 H ALA C 75 12.806 28.382 13.986 1.00 0.47 H new ATOM 0 HA ALA C 75 11.865 25.688 13.203 1.00 0.47 H new ATOM 0 HB1 ALA C 75 13.139 26.235 11.152 1.00 0.53 H new ATOM 0 HB2 ALA C 75 12.013 27.551 11.560 1.00 0.53 H new ATOM 0 HB3 ALA C 75 13.747 27.722 11.919 1.00 0.53 H new ATOM 5309 N SER C 76 13.901 24.398 13.878 1.00 0.47 N ATOM 5310 CA SER C 76 15.123 23.686 14.321 1.00 0.48 C ATOM 5311 C SER C 76 15.982 23.437 13.090 1.00 0.48 C ATOM 5312 O SER C 76 15.857 22.435 12.414 1.00 0.49 O ATOM 5313 CB SER C 76 14.738 22.350 14.951 1.00 0.54 C ATOM 5314 OG SER C 76 14.293 21.466 13.931 1.00 1.38 O ATOM 0 H SER C 76 13.078 23.815 13.729 1.00 0.47 H new ATOM 0 HA SER C 76 15.666 24.278 15.058 1.00 0.48 H new ATOM 0 HB2 SER C 76 15.593 21.921 15.474 1.00 0.54 H new ATOM 0 HB3 SER C 76 13.952 22.496 15.691 1.00 0.54 H new ATOM 0 HG SER C 76 15.040 21.253 13.334 1.00 1.38 H new ATOM 5320 N LEU C 77 16.846 24.361 12.790 1.00 0.50 N ATOM 5321 CA LEU C 77 17.713 24.213 11.598 1.00 0.53 C ATOM 5322 C LEU C 77 18.821 23.214 11.910 1.00 0.52 C ATOM 5323 O LEU C 77 19.399 23.225 12.976 1.00 0.55 O ATOM 5324 CB LEU C 77 18.325 25.570 11.252 1.00 0.62 C ATOM 5325 CG LEU C 77 17.205 26.595 11.025 1.00 0.65 C ATOM 5326 CD1 LEU C 77 17.826 27.966 10.744 1.00 0.75 C ATOM 5327 CD2 LEU C 77 16.323 26.166 9.837 1.00 0.66 C ATOM 0 H LEU C 77 16.988 25.218 13.325 1.00 0.50 H new ATOM 0 HA LEU C 77 17.127 23.854 10.752 1.00 0.53 H new ATOM 0 HB2 LEU C 77 18.978 25.902 12.059 1.00 0.62 H new ATOM 0 HB3 LEU C 77 18.941 25.485 10.357 1.00 0.62 H new ATOM 0 HG LEU C 77 16.582 26.651 11.918 1.00 0.65 H new ATOM 0 HD11 LEU C 77 17.034 28.698 10.582 1.00 0.75 H new ATOM 0 HD12 LEU C 77 18.434 28.272 11.596 1.00 0.75 H new ATOM 0 HD13 LEU C 77 18.452 27.906 9.854 1.00 0.75 H new ATOM 0 HD21 LEU C 77 15.533 26.901 9.687 1.00 0.66 H new ATOM 0 HD22 LEU C 77 16.933 26.100 8.936 1.00 0.66 H new ATOM 0 HD23 LEU C 77 15.878 25.193 10.047 1.00 0.66 H new ATOM 5339 N THR C 78 19.124 22.357 10.981 1.00 0.51 N ATOM 5340 CA THR C 78 20.201 21.347 11.199 1.00 0.51 C ATOM 5341 C THR C 78 20.997 21.211 9.899 1.00 0.57 C ATOM 5342 O THR C 78 20.722 20.356 9.090 1.00 0.66 O ATOM 5343 CB THR C 78 19.547 20.001 11.545 1.00 0.55 C ATOM 5344 OG1 THR C 78 20.563 19.034 11.761 1.00 0.61 O ATOM 5345 CG2 THR C 78 18.626 19.532 10.396 1.00 0.64 C ATOM 0 H THR C 78 18.669 22.309 10.069 1.00 0.51 H new ATOM 0 HA THR C 78 20.862 21.651 12.011 1.00 0.51 H new ATOM 0 HB THR C 78 18.945 20.121 12.446 1.00 0.55 H new ATOM 0 HG1 THR C 78 20.702 18.916 12.724 1.00 0.61 H new ATOM 0 HG21 THR C 78 18.172 18.577 10.660 1.00 0.64 H new ATOM 0 HG22 THR C 78 17.843 20.273 10.232 1.00 0.64 H new ATOM 0 HG23 THR C 78 19.212 19.415 9.484 1.00 0.64 H new ATOM 5353 N PRO C 79 21.972 22.059 9.695 1.00 0.65 N ATOM 5354 CA PRO C 79 22.820 22.055 8.477 1.00 0.77 C ATOM 5355 C PRO C 79 24.182 21.373 8.666 1.00 0.67 C ATOM 5356 O PRO C 79 24.634 20.618 7.830 1.00 0.70 O ATOM 5357 CB PRO C 79 23.021 23.551 8.262 1.00 0.98 C ATOM 5358 CG PRO C 79 23.137 24.117 9.654 1.00 0.96 C ATOM 5359 CD PRO C 79 22.371 23.155 10.589 1.00 0.75 C ATOM 0 HA PRO C 79 22.362 21.503 7.656 1.00 0.77 H new ATOM 0 HB2 PRO C 79 23.918 23.751 7.676 1.00 0.98 H new ATOM 0 HB3 PRO C 79 22.182 23.991 7.723 1.00 0.98 H new ATOM 0 HG2 PRO C 79 24.182 24.197 9.953 1.00 0.96 H new ATOM 0 HG3 PRO C 79 22.714 25.121 9.700 1.00 0.96 H new ATOM 0 HD2 PRO C 79 23.001 22.800 11.404 1.00 0.75 H new ATOM 0 HD3 PRO C 79 21.506 23.639 11.043 1.00 0.75 H new ATOM 5367 N LYS C 80 24.859 21.675 9.733 1.00 0.66 N ATOM 5368 CA LYS C 80 26.214 21.089 9.948 1.00 0.66 C ATOM 5369 C LYS C 80 26.166 19.654 10.493 1.00 0.63 C ATOM 5370 O LYS C 80 26.957 18.823 10.091 1.00 0.65 O ATOM 5371 CB LYS C 80 27.001 21.962 10.933 1.00 0.79 C ATOM 5372 CG LYS C 80 27.374 23.296 10.279 1.00 1.30 C ATOM 5373 CD LYS C 80 28.159 24.149 11.280 1.00 1.45 C ATOM 5374 CE LYS C 80 28.539 25.482 10.632 1.00 2.31 C ATOM 5375 NZ LYS C 80 27.326 26.335 10.485 1.00 2.95 N ATOM 0 H LYS C 80 24.536 22.303 10.469 1.00 0.66 H new ATOM 0 HA LYS C 80 26.701 21.057 8.973 1.00 0.66 H new ATOM 0 HB2 LYS C 80 26.404 22.142 11.827 1.00 0.79 H new ATOM 0 HB3 LYS C 80 27.903 21.440 11.251 1.00 0.79 H new ATOM 0 HG2 LYS C 80 27.973 23.121 9.385 1.00 1.30 H new ATOM 0 HG3 LYS C 80 26.474 23.823 9.962 1.00 1.30 H new ATOM 0 HD2 LYS C 80 27.559 24.325 12.172 1.00 1.45 H new ATOM 0 HD3 LYS C 80 29.057 23.619 11.599 1.00 1.45 H new ATOM 0 HE2 LYS C 80 29.283 25.994 11.242 1.00 2.31 H new ATOM 0 HE3 LYS C 80 28.992 25.307 9.656 1.00 2.31 H new ATOM 0 HZ1 LYS C 80 27.611 27.304 10.238 1.00 2.95 H new ATOM 0 HZ2 LYS C 80 26.720 25.950 9.733 1.00 2.95 H new ATOM 0 HZ3 LYS C 80 26.799 26.347 11.382 1.00 2.95 H new ATOM 5389 N TRP C 81 25.314 19.363 11.450 1.00 0.65 N ATOM 5390 CA TRP C 81 25.323 17.980 12.052 1.00 0.67 C ATOM 5391 C TRP C 81 24.357 16.986 11.378 1.00 0.62 C ATOM 5392 O TRP C 81 24.792 16.041 10.756 1.00 0.63 O ATOM 5393 CB TRP C 81 25.056 18.061 13.568 1.00 0.72 C ATOM 5394 CG TRP C 81 23.641 18.432 13.881 1.00 0.68 C ATOM 5395 CD1 TRP C 81 22.630 17.553 14.076 1.00 0.69 C ATOM 5396 CD2 TRP C 81 23.077 19.756 14.094 1.00 0.67 C ATOM 5397 NE1 TRP C 81 21.472 18.257 14.350 1.00 0.68 N ATOM 5398 CE2 TRP C 81 21.698 19.620 14.386 1.00 0.65 C ATOM 5399 CE3 TRP C 81 23.620 21.053 14.051 1.00 0.70 C ATOM 5400 CZ2 TRP C 81 20.888 20.730 14.629 1.00 0.65 C ATOM 5401 CZ3 TRP C 81 22.809 22.171 14.300 1.00 0.71 C ATOM 5402 CH2 TRP C 81 21.448 22.012 14.588 1.00 0.67 C ATOM 0 H TRP C 81 24.624 20.006 11.837 1.00 0.65 H new ATOM 0 HA TRP C 81 26.320 17.579 11.870 1.00 0.67 H new ATOM 0 HB2 TRP C 81 25.286 17.099 14.026 1.00 0.72 H new ATOM 0 HB3 TRP C 81 25.728 18.795 14.013 1.00 0.72 H new ATOM 0 HD1 TRP C 81 22.714 16.477 14.026 1.00 0.69 H new ATOM 0 HE1 TRP C 81 20.562 17.823 14.506 1.00 0.68 H new ATOM 0 HE3 TRP C 81 24.667 21.189 13.825 1.00 0.70 H new ATOM 0 HZ2 TRP C 81 19.838 20.601 14.847 1.00 0.65 H new ATOM 0 HZ3 TRP C 81 23.238 23.162 14.269 1.00 0.71 H new ATOM 0 HH2 TRP C 81 20.831 22.878 14.778 1.00 0.67 H new ATOM 5413 N ASN C 82 23.072 17.124 11.543 1.00 0.59 N ATOM 5414 CA ASN C 82 22.152 16.100 10.955 1.00 0.59 C ATOM 5415 C ASN C 82 22.172 16.142 9.420 1.00 0.53 C ATOM 5416 O ASN C 82 22.260 15.117 8.775 1.00 0.49 O ATOM 5417 CB ASN C 82 20.721 16.319 11.486 1.00 0.70 C ATOM 5418 CG ASN C 82 19.997 14.972 11.650 1.00 1.07 C ATOM 5419 OD1 ASN C 82 19.036 14.876 12.387 1.00 0.96 O ATOM 5420 ND2 ASN C 82 20.416 13.930 10.982 1.00 1.86 N ATOM 0 H ASN C 82 22.620 17.886 12.049 1.00 0.59 H new ATOM 0 HA ASN C 82 22.500 15.113 11.259 1.00 0.59 H new ATOM 0 HB2 ASN C 82 20.757 16.838 12.444 1.00 0.70 H new ATOM 0 HB3 ASN C 82 20.165 16.956 10.799 1.00 0.70 H new ATOM 0 HD21 ASN C 82 19.936 13.035 11.079 1.00 1.86 H new ATOM 0 HD22 ASN C 82 21.223 14.011 10.363 1.00 1.86 H new ATOM 5427 N ASN C 83 22.087 17.299 8.822 1.00 0.56 N ATOM 5428 CA ASN C 83 22.102 17.347 7.330 1.00 0.57 C ATOM 5429 C ASN C 83 23.408 16.748 6.807 1.00 0.52 C ATOM 5430 O ASN C 83 23.414 15.997 5.852 1.00 0.51 O ATOM 5431 CB ASN C 83 21.962 18.787 6.839 1.00 0.66 C ATOM 5432 CG ASN C 83 22.028 18.816 5.312 1.00 1.22 C ATOM 5433 OD1 ASN C 83 22.804 19.554 4.741 1.00 1.99 O ATOM 5434 ND2 ASN C 83 21.233 18.045 4.622 1.00 1.83 N ATOM 0 H ASN C 83 22.009 18.201 9.292 1.00 0.56 H new ATOM 0 HA ASN C 83 21.260 16.766 6.954 1.00 0.57 H new ATOM 0 HB2 ASN C 83 21.016 19.208 7.180 1.00 0.66 H new ATOM 0 HB3 ASN C 83 22.756 19.404 7.259 1.00 0.66 H new ATOM 0 HD21 ASN C 83 21.264 18.063 3.603 1.00 1.83 H new ATOM 0 HD22 ASN C 83 20.581 17.425 5.102 1.00 1.83 H new ATOM 5441 N GLU C 84 24.514 17.058 7.427 1.00 0.52 N ATOM 5442 CA GLU C 84 25.797 16.478 6.947 1.00 0.52 C ATOM 5443 C GLU C 84 25.689 14.960 7.041 1.00 0.47 C ATOM 5444 O GLU C 84 26.040 14.241 6.128 1.00 0.47 O ATOM 5445 CB GLU C 84 26.956 16.980 7.816 1.00 0.55 C ATOM 5446 CG GLU C 84 28.285 16.415 7.300 1.00 1.26 C ATOM 5447 CD GLU C 84 28.555 16.942 5.888 1.00 1.70 C ATOM 5448 OE1 GLU C 84 27.946 17.933 5.523 1.00 2.23 O ATOM 5449 OE2 GLU C 84 29.365 16.345 5.197 1.00 2.29 O ATOM 0 H GLU C 84 24.584 17.679 8.233 1.00 0.52 H new ATOM 0 HA GLU C 84 25.989 16.779 5.917 1.00 0.52 H new ATOM 0 HB2 GLU C 84 26.985 18.070 7.802 1.00 0.55 H new ATOM 0 HB3 GLU C 84 26.801 16.678 8.852 1.00 0.55 H new ATOM 0 HG2 GLU C 84 29.097 16.702 7.968 1.00 1.26 H new ATOM 0 HG3 GLU C 84 28.250 15.326 7.292 1.00 1.26 H new ATOM 5456 N THR C 85 25.176 14.472 8.134 1.00 0.44 N ATOM 5457 CA THR C 85 25.015 13.006 8.283 1.00 0.42 C ATOM 5458 C THR C 85 23.926 12.541 7.318 1.00 0.38 C ATOM 5459 O THR C 85 24.024 11.489 6.714 1.00 0.38 O ATOM 5460 CB THR C 85 24.617 12.664 9.722 1.00 0.44 C ATOM 5461 OG1 THR C 85 23.423 13.354 10.059 1.00 0.43 O ATOM 5462 CG2 THR C 85 25.741 13.071 10.678 1.00 0.49 C ATOM 0 H THR C 85 24.862 15.028 8.930 1.00 0.44 H new ATOM 0 HA THR C 85 25.956 12.504 8.057 1.00 0.42 H new ATOM 0 HB THR C 85 24.448 11.590 9.807 1.00 0.44 H new ATOM 0 HG1 THR C 85 23.267 14.074 9.412 1.00 0.43 H new ATOM 0 HG21 THR C 85 25.455 12.826 11.701 1.00 0.49 H new ATOM 0 HG22 THR C 85 26.653 12.533 10.418 1.00 0.49 H new ATOM 0 HG23 THR C 85 25.917 14.144 10.597 1.00 0.49 H new ATOM 5470 N TRP C 86 22.881 13.317 7.166 1.00 0.36 N ATOM 5471 CA TRP C 86 21.797 12.896 6.242 1.00 0.33 C ATOM 5472 C TRP C 86 22.376 12.744 4.840 1.00 0.34 C ATOM 5473 O TRP C 86 22.075 11.805 4.132 1.00 0.33 O ATOM 5474 CB TRP C 86 20.676 13.940 6.196 1.00 0.34 C ATOM 5475 CG TRP C 86 19.489 13.316 5.526 1.00 0.32 C ATOM 5476 CD1 TRP C 86 19.225 13.343 4.198 1.00 0.34 C ATOM 5477 CD2 TRP C 86 18.421 12.548 6.140 1.00 0.29 C ATOM 5478 NE1 TRP C 86 18.057 12.635 3.963 1.00 0.33 N ATOM 5479 CE2 TRP C 86 17.524 12.126 5.131 1.00 0.29 C ATOM 5480 CE3 TRP C 86 18.149 12.183 7.465 1.00 0.28 C ATOM 5481 CZ2 TRP C 86 16.394 11.362 5.432 1.00 0.28 C ATOM 5482 CZ3 TRP C 86 17.013 11.421 7.769 1.00 0.26 C ATOM 5483 CH2 TRP C 86 16.139 11.009 6.755 1.00 0.27 C ATOM 0 H TRP C 86 22.737 14.210 7.637 1.00 0.36 H new ATOM 0 HA TRP C 86 21.384 11.952 6.599 1.00 0.33 H new ATOM 0 HB2 TRP C 86 20.417 14.266 7.203 1.00 0.34 H new ATOM 0 HB3 TRP C 86 21.001 14.825 5.648 1.00 0.34 H new ATOM 0 HD1 TRP C 86 19.825 13.835 3.447 1.00 0.34 H new ATOM 0 HE1 TRP C 86 17.642 12.506 3.040 1.00 0.33 H new ATOM 0 HE3 TRP C 86 18.818 12.490 8.255 1.00 0.28 H new ATOM 0 HZ2 TRP C 86 15.724 11.048 4.646 1.00 0.28 H new ATOM 0 HZ3 TRP C 86 16.810 11.149 8.794 1.00 0.26 H new ATOM 0 HH2 TRP C 86 15.268 10.418 6.999 1.00 0.27 H new ATOM 5494 N GLN C 87 23.209 13.651 4.425 1.00 0.37 N ATOM 5495 CA GLN C 87 23.795 13.520 3.071 1.00 0.39 C ATOM 5496 C GLN C 87 24.562 12.206 3.022 1.00 0.37 C ATOM 5497 O GLN C 87 24.479 11.463 2.069 1.00 0.38 O ATOM 5498 CB GLN C 87 24.735 14.694 2.797 1.00 0.42 C ATOM 5499 CG GLN C 87 23.901 15.967 2.640 1.00 0.46 C ATOM 5500 CD GLN C 87 24.822 17.180 2.499 1.00 0.53 C ATOM 5501 OE1 GLN C 87 25.951 17.158 2.945 1.00 1.21 O ATOM 5502 NE2 GLN C 87 24.381 18.246 1.889 1.00 1.03 N ATOM 0 H GLN C 87 23.506 14.468 4.959 1.00 0.37 H new ATOM 0 HA GLN C 87 23.013 13.527 2.311 1.00 0.39 H new ATOM 0 HB2 GLN C 87 25.446 14.807 3.615 1.00 0.42 H new ATOM 0 HB3 GLN C 87 25.316 14.509 1.893 1.00 0.42 H new ATOM 0 HG2 GLN C 87 23.257 15.885 1.764 1.00 0.46 H new ATOM 0 HG3 GLN C 87 23.249 16.093 3.504 1.00 0.46 H new ATOM 0 HE21 GLN C 87 23.432 18.264 1.515 1.00 1.03 H new ATOM 0 HE22 GLN C 87 24.985 19.062 1.787 1.00 1.03 H new ATOM 5511 N GLU C 88 25.283 11.890 4.064 1.00 0.37 N ATOM 5512 CA GLU C 88 26.017 10.603 4.075 1.00 0.37 C ATOM 5513 C GLU C 88 24.992 9.472 4.002 1.00 0.34 C ATOM 5514 O GLU C 88 25.163 8.508 3.289 1.00 0.34 O ATOM 5515 CB GLU C 88 26.815 10.480 5.372 1.00 0.39 C ATOM 5516 CG GLU C 88 27.966 11.486 5.371 1.00 1.18 C ATOM 5517 CD GLU C 88 28.745 11.361 6.679 1.00 1.42 C ATOM 5518 OE1 GLU C 88 28.312 10.602 7.530 1.00 1.92 O ATOM 5519 OE2 GLU C 88 29.763 12.019 6.806 1.00 1.96 O ATOM 0 H GLU C 88 25.392 12.465 4.899 1.00 0.37 H new ATOM 0 HA GLU C 88 26.703 10.552 3.229 1.00 0.37 H new ATOM 0 HB2 GLU C 88 26.164 10.659 6.228 1.00 0.39 H new ATOM 0 HB3 GLU C 88 27.205 9.467 5.475 1.00 0.39 H new ATOM 0 HG2 GLU C 88 28.625 11.302 4.523 1.00 1.18 H new ATOM 0 HG3 GLU C 88 27.579 12.499 5.260 1.00 1.18 H new ATOM 5526 N TRP C 89 23.907 9.599 4.719 1.00 0.32 N ATOM 5527 CA TRP C 89 22.857 8.542 4.678 1.00 0.29 C ATOM 5528 C TRP C 89 22.343 8.400 3.248 1.00 0.30 C ATOM 5529 O TRP C 89 22.277 7.315 2.705 1.00 0.30 O ATOM 5530 CB TRP C 89 21.716 8.953 5.613 1.00 0.28 C ATOM 5531 CG TRP C 89 20.533 8.060 5.430 1.00 0.25 C ATOM 5532 CD1 TRP C 89 20.410 6.810 5.924 1.00 0.25 C ATOM 5533 CD2 TRP C 89 19.292 8.345 4.724 1.00 0.24 C ATOM 5534 NE1 TRP C 89 19.180 6.304 5.554 1.00 0.23 N ATOM 5535 CE2 TRP C 89 18.452 7.214 4.815 1.00 0.23 C ATOM 5536 CE3 TRP C 89 18.819 9.465 4.015 1.00 0.26 C ATOM 5537 CZ2 TRP C 89 17.188 7.189 4.228 1.00 0.23 C ATOM 5538 CZ3 TRP C 89 17.545 9.446 3.422 1.00 0.27 C ATOM 5539 CH2 TRP C 89 16.732 8.308 3.530 1.00 0.25 C ATOM 0 H TRP C 89 23.703 10.389 5.331 1.00 0.32 H new ATOM 0 HA TRP C 89 23.265 7.585 5.002 1.00 0.29 H new ATOM 0 HB2 TRP C 89 22.054 8.909 6.648 1.00 0.28 H new ATOM 0 HB3 TRP C 89 21.431 9.986 5.415 1.00 0.28 H new ATOM 0 HD1 TRP C 89 21.152 6.291 6.512 1.00 0.25 H new ATOM 0 HE1 TRP C 89 18.849 5.370 5.797 1.00 0.23 H new ATOM 0 HE3 TRP C 89 19.439 10.345 3.926 1.00 0.26 H new ATOM 0 HZ2 TRP C 89 16.566 6.310 4.313 1.00 0.23 H new ATOM 0 HZ3 TRP C 89 17.191 10.311 2.881 1.00 0.27 H new ATOM 0 HH2 TRP C 89 15.753 8.298 3.073 1.00 0.25 H new ATOM 5550 N GLU C 90 21.985 9.488 2.630 1.00 0.31 N ATOM 5551 CA GLU C 90 21.487 9.412 1.234 1.00 0.33 C ATOM 5552 C GLU C 90 22.594 8.851 0.340 1.00 0.33 C ATOM 5553 O GLU C 90 22.357 8.010 -0.503 1.00 0.34 O ATOM 5554 CB GLU C 90 21.089 10.812 0.764 1.00 0.37 C ATOM 5555 CG GLU C 90 20.550 10.748 -0.668 1.00 0.85 C ATOM 5556 CD GLU C 90 20.116 12.147 -1.107 1.00 1.16 C ATOM 5557 OE1 GLU C 90 20.261 13.065 -0.315 1.00 1.67 O ATOM 5558 OE2 GLU C 90 19.655 12.280 -2.228 1.00 1.82 O ATOM 0 H GLU C 90 22.016 10.425 3.032 1.00 0.31 H new ATOM 0 HA GLU C 90 20.616 8.758 1.181 1.00 0.33 H new ATOM 0 HB2 GLU C 90 20.331 11.226 1.429 1.00 0.37 H new ATOM 0 HB3 GLU C 90 21.950 11.478 0.808 1.00 0.37 H new ATOM 0 HG2 GLU C 90 21.317 10.365 -1.341 1.00 0.85 H new ATOM 0 HG3 GLU C 90 19.707 10.060 -0.721 1.00 0.85 H new ATOM 5565 N ARG C 91 23.804 9.315 0.517 1.00 0.34 N ATOM 5566 CA ARG C 91 24.930 8.811 -0.324 1.00 0.36 C ATOM 5567 C ARG C 91 25.147 7.317 -0.080 1.00 0.34 C ATOM 5568 O ARG C 91 25.344 6.559 -1.009 1.00 0.34 O ATOM 5569 CB ARG C 91 26.217 9.571 0.019 1.00 0.40 C ATOM 5570 CG ARG C 91 26.157 11.018 -0.503 1.00 0.44 C ATOM 5571 CD ARG C 91 26.043 11.050 -2.040 1.00 1.07 C ATOM 5572 NE ARG C 91 26.734 9.872 -2.634 1.00 1.67 N ATOM 5573 CZ ARG C 91 26.490 9.531 -3.867 1.00 2.30 C ATOM 5574 NH1 ARG C 91 25.657 10.232 -4.584 1.00 2.61 N ATOM 5575 NH2 ARG C 91 27.078 8.489 -4.386 1.00 3.18 N ATOM 0 H ARG C 91 24.061 10.021 1.207 1.00 0.34 H new ATOM 0 HA ARG C 91 24.679 8.970 -1.373 1.00 0.36 H new ATOM 0 HB2 ARG C 91 26.364 9.576 1.099 1.00 0.40 H new ATOM 0 HB3 ARG C 91 27.074 9.058 -0.417 1.00 0.40 H new ATOM 0 HG2 ARG C 91 25.303 11.532 -0.061 1.00 0.44 H new ATOM 0 HG3 ARG C 91 27.051 11.558 -0.190 1.00 0.44 H new ATOM 0 HD2 ARG C 91 24.993 11.051 -2.334 1.00 1.07 H new ATOM 0 HD3 ARG C 91 26.482 11.970 -2.425 1.00 1.07 H new ATOM 0 HE ARG C 91 27.397 9.333 -2.076 1.00 1.67 H new ATOM 0 HH11 ARG C 91 25.197 11.047 -4.179 1.00 2.61 H new ATOM 0 HH12 ARG C 91 25.466 9.965 -5.550 1.00 2.61 H new ATOM 0 HH21 ARG C 91 27.730 7.940 -3.826 1.00 3.18 H new ATOM 0 HH22 ARG C 91 26.886 8.223 -5.352 1.00 3.18 H new ATOM 5589 N LYS C 92 25.102 6.877 1.150 1.00 0.33 N ATOM 5590 CA LYS C 92 25.301 5.424 1.406 1.00 0.33 C ATOM 5591 C LYS C 92 24.216 4.642 0.672 1.00 0.31 C ATOM 5592 O LYS C 92 24.472 3.612 0.081 1.00 0.32 O ATOM 5593 CB LYS C 92 25.237 5.143 2.908 1.00 0.34 C ATOM 5594 CG LYS C 92 26.517 5.656 3.577 1.00 0.68 C ATOM 5595 CD LYS C 92 26.445 5.372 5.077 1.00 1.08 C ATOM 5596 CE LYS C 92 27.721 5.866 5.761 1.00 1.41 C ATOM 5597 NZ LYS C 92 27.706 5.458 7.194 1.00 2.13 N ATOM 0 H LYS C 92 24.938 7.453 1.976 1.00 0.33 H new ATOM 0 HA LYS C 92 26.281 5.115 1.042 1.00 0.33 H new ATOM 0 HB2 LYS C 92 24.365 5.631 3.344 1.00 0.34 H new ATOM 0 HB3 LYS C 92 25.125 4.073 3.085 1.00 0.34 H new ATOM 0 HG2 LYS C 92 27.390 5.168 3.143 1.00 0.68 H new ATOM 0 HG3 LYS C 92 26.630 6.726 3.402 1.00 0.68 H new ATOM 0 HD2 LYS C 92 25.575 5.867 5.509 1.00 1.08 H new ATOM 0 HD3 LYS C 92 26.321 4.303 5.248 1.00 1.08 H new ATOM 0 HE2 LYS C 92 28.597 5.451 5.263 1.00 1.41 H new ATOM 0 HE3 LYS C 92 27.793 6.951 5.681 1.00 1.41 H new ATOM 0 HZ1 LYS C 92 28.573 5.794 7.660 1.00 2.13 H new ATOM 0 HZ2 LYS C 92 26.877 5.874 7.665 1.00 2.13 H new ATOM 0 HZ3 LYS C 92 27.657 4.421 7.259 1.00 2.13 H new ATOM 5611 N VAL C 93 23.013 5.140 0.677 1.00 0.29 N ATOM 5612 CA VAL C 93 21.922 4.442 -0.050 1.00 0.28 C ATOM 5613 C VAL C 93 22.277 4.376 -1.537 1.00 0.29 C ATOM 5614 O VAL C 93 22.095 3.364 -2.184 1.00 0.29 O ATOM 5615 CB VAL C 93 20.610 5.215 0.134 1.00 0.28 C ATOM 5616 CG1 VAL C 93 19.540 4.663 -0.818 1.00 0.30 C ATOM 5617 CG2 VAL C 93 20.136 5.061 1.581 1.00 0.28 C ATOM 0 H VAL C 93 22.739 6.000 1.153 1.00 0.29 H new ATOM 0 HA VAL C 93 21.801 3.432 0.343 1.00 0.28 H new ATOM 0 HB VAL C 93 20.776 6.269 -0.090 1.00 0.28 H new ATOM 0 HG11 VAL C 93 18.611 5.217 -0.682 1.00 0.30 H new ATOM 0 HG12 VAL C 93 19.879 4.771 -1.848 1.00 0.30 H new ATOM 0 HG13 VAL C 93 19.369 3.609 -0.601 1.00 0.30 H new ATOM 0 HG21 VAL C 93 19.203 5.608 1.719 1.00 0.28 H new ATOM 0 HG22 VAL C 93 19.973 4.006 1.800 1.00 0.28 H new ATOM 0 HG23 VAL C 93 20.893 5.459 2.256 1.00 0.28 H new ATOM 5627 N ASP C 94 22.773 5.457 -2.083 1.00 0.30 N ATOM 5628 CA ASP C 94 23.134 5.462 -3.529 1.00 0.32 C ATOM 5629 C ASP C 94 24.207 4.409 -3.812 1.00 0.33 C ATOM 5630 O ASP C 94 24.157 3.721 -4.813 1.00 0.35 O ATOM 5631 CB ASP C 94 23.665 6.843 -3.917 1.00 0.35 C ATOM 5632 CG ASP C 94 22.523 7.862 -3.901 1.00 1.27 C ATOM 5633 OD1 ASP C 94 21.385 7.449 -4.055 1.00 2.04 O ATOM 5634 OD2 ASP C 94 22.806 9.039 -3.746 1.00 1.96 O ATOM 0 H ASP C 94 22.943 6.334 -1.590 1.00 0.30 H new ATOM 0 HA ASP C 94 22.245 5.229 -4.115 1.00 0.32 H new ATOM 0 HB2 ASP C 94 24.448 7.150 -3.223 1.00 0.35 H new ATOM 0 HB3 ASP C 94 24.116 6.804 -4.909 1.00 0.35 H new ATOM 5639 N PHE C 95 25.180 4.274 -2.950 1.00 0.33 N ATOM 5640 CA PHE C 95 26.239 3.260 -3.206 1.00 0.35 C ATOM 5641 C PHE C 95 25.648 1.856 -3.106 1.00 0.34 C ATOM 5642 O PHE C 95 25.895 1.011 -3.945 1.00 0.34 O ATOM 5643 CB PHE C 95 27.371 3.412 -2.183 1.00 0.39 C ATOM 5644 CG PHE C 95 28.204 4.630 -2.516 1.00 0.42 C ATOM 5645 CD1 PHE C 95 29.029 4.624 -3.647 1.00 0.46 C ATOM 5646 CD2 PHE C 95 28.158 5.760 -1.694 1.00 0.42 C ATOM 5647 CE1 PHE C 95 29.806 5.747 -3.955 1.00 0.51 C ATOM 5648 CE2 PHE C 95 28.934 6.884 -2.000 1.00 0.46 C ATOM 5649 CZ PHE C 95 29.758 6.878 -3.130 1.00 0.51 C ATOM 0 H PHE C 95 25.285 4.815 -2.092 1.00 0.33 H new ATOM 0 HA PHE C 95 26.638 3.414 -4.208 1.00 0.35 H new ATOM 0 HB2 PHE C 95 26.956 3.507 -1.180 1.00 0.39 H new ATOM 0 HB3 PHE C 95 27.998 2.520 -2.185 1.00 0.39 H new ATOM 0 HD1 PHE C 95 29.066 3.752 -4.283 1.00 0.46 H new ATOM 0 HD2 PHE C 95 27.522 5.766 -0.821 1.00 0.42 H new ATOM 0 HE1 PHE C 95 30.442 5.741 -4.828 1.00 0.51 H new ATOM 0 HE2 PHE C 95 28.896 7.756 -1.364 1.00 0.46 H new ATOM 0 HZ PHE C 95 30.357 7.745 -3.366 1.00 0.51 H new ATOM 5659 N LEU C 96 24.862 1.595 -2.098 1.00 0.32 N ATOM 5660 CA LEU C 96 24.261 0.242 -1.980 1.00 0.32 C ATOM 5661 C LEU C 96 23.227 0.074 -3.090 1.00 0.31 C ATOM 5662 O LEU C 96 23.118 -0.972 -3.700 1.00 0.32 O ATOM 5663 CB LEU C 96 23.582 0.097 -0.617 1.00 0.32 C ATOM 5664 CG LEU C 96 24.611 0.287 0.507 1.00 0.33 C ATOM 5665 CD1 LEU C 96 23.906 0.187 1.863 1.00 0.35 C ATOM 5666 CD2 LEU C 96 25.701 -0.797 0.418 1.00 0.36 C ATOM 0 H LEU C 96 24.613 2.254 -1.360 1.00 0.32 H new ATOM 0 HA LEU C 96 25.035 -0.520 -2.071 1.00 0.32 H new ATOM 0 HB2 LEU C 96 22.784 0.833 -0.519 1.00 0.32 H new ATOM 0 HB3 LEU C 96 23.119 -0.887 -0.535 1.00 0.32 H new ATOM 0 HG LEU C 96 25.075 1.268 0.402 1.00 0.33 H new ATOM 0 HD11 LEU C 96 24.634 0.322 2.663 1.00 0.35 H new ATOM 0 HD12 LEU C 96 23.142 0.961 1.934 1.00 0.35 H new ATOM 0 HD13 LEU C 96 23.439 -0.793 1.959 1.00 0.35 H new ATOM 0 HD21 LEU C 96 26.425 -0.652 1.220 1.00 0.36 H new ATOM 0 HD22 LEU C 96 25.244 -1.782 0.516 1.00 0.36 H new ATOM 0 HD23 LEU C 96 26.207 -0.726 -0.545 1.00 0.36 H new ATOM 5678 N GLU C 97 22.470 1.101 -3.365 1.00 0.31 N ATOM 5679 CA GLU C 97 21.454 0.998 -4.443 1.00 0.32 C ATOM 5680 C GLU C 97 22.157 0.685 -5.765 1.00 0.33 C ATOM 5681 O GLU C 97 21.779 -0.223 -6.477 1.00 0.36 O ATOM 5682 CB GLU C 97 20.684 2.319 -4.555 1.00 0.34 C ATOM 5683 CG GLU C 97 19.620 2.207 -5.647 1.00 0.95 C ATOM 5684 CD GLU C 97 18.793 3.493 -5.692 1.00 1.22 C ATOM 5685 OE1 GLU C 97 18.807 4.216 -4.710 1.00 1.86 O ATOM 5686 OE2 GLU C 97 18.151 3.727 -6.703 1.00 1.69 O ATOM 0 H GLU C 97 22.513 2.003 -2.890 1.00 0.31 H new ATOM 0 HA GLU C 97 20.749 0.200 -4.211 1.00 0.32 H new ATOM 0 HB2 GLU C 97 20.215 2.559 -3.601 1.00 0.34 H new ATOM 0 HB3 GLU C 97 21.371 3.133 -4.786 1.00 0.34 H new ATOM 0 HG2 GLU C 97 20.093 2.033 -6.613 1.00 0.95 H new ATOM 0 HG3 GLU C 97 18.972 1.353 -5.451 1.00 0.95 H new ATOM 5693 N GLU C 98 23.184 1.423 -6.100 1.00 0.34 N ATOM 5694 CA GLU C 98 23.903 1.150 -7.376 1.00 0.37 C ATOM 5695 C GLU C 98 24.481 -0.265 -7.334 1.00 0.36 C ATOM 5696 O GLU C 98 24.420 -1.000 -8.300 1.00 0.37 O ATOM 5697 CB GLU C 98 25.035 2.169 -7.558 1.00 0.40 C ATOM 5698 CG GLU C 98 25.718 1.962 -8.918 1.00 1.19 C ATOM 5699 CD GLU C 98 24.735 2.293 -10.045 1.00 1.33 C ATOM 5700 OE1 GLU C 98 23.742 2.946 -9.768 1.00 1.77 O ATOM 5701 OE2 GLU C 98 24.994 1.888 -11.166 1.00 1.86 O ATOM 0 H GLU C 98 23.552 2.198 -5.548 1.00 0.34 H new ATOM 0 HA GLU C 98 23.210 1.235 -8.213 1.00 0.37 H new ATOM 0 HB2 GLU C 98 24.637 3.182 -7.493 1.00 0.40 H new ATOM 0 HB3 GLU C 98 25.765 2.061 -6.756 1.00 0.40 H new ATOM 0 HG2 GLU C 98 26.600 2.598 -8.993 1.00 1.19 H new ATOM 0 HG3 GLU C 98 26.059 0.931 -9.011 1.00 1.19 H new ATOM 5708 N ASN C 99 25.047 -0.653 -6.223 1.00 0.35 N ATOM 5709 CA ASN C 99 25.630 -2.017 -6.123 1.00 0.35 C ATOM 5710 C ASN C 99 24.525 -3.054 -6.330 1.00 0.33 C ATOM 5711 O ASN C 99 24.686 -4.012 -7.061 1.00 0.35 O ATOM 5712 CB ASN C 99 26.254 -2.203 -4.739 1.00 0.37 C ATOM 5713 CG ASN C 99 27.510 -1.338 -4.622 1.00 1.25 C ATOM 5714 OD1 ASN C 99 27.844 -0.851 -3.457 1.00 2.16 O flip ATOM 5715 ND2 ASN C 99 28.187 -1.088 -5.598 1.00 1.83 N flip ATOM 0 H ASN C 99 25.130 -0.083 -5.382 1.00 0.35 H new ATOM 0 HA ASN C 99 26.398 -2.145 -6.886 1.00 0.35 H new ATOM 0 HB2 ASN C 99 25.537 -1.927 -3.966 1.00 0.37 H new ATOM 0 HB3 ASN C 99 26.506 -3.252 -4.581 1.00 0.37 H new ATOM 0 HD21 ASN C 99 27.928 -1.467 -6.509 1.00 1.83 H new ATOM 0 HD22 ASN C 99 29.015 -0.499 -5.507 1.00 1.83 H new ATOM 5722 N ILE C 100 23.401 -2.872 -5.690 1.00 0.31 N ATOM 5723 CA ILE C 100 22.288 -3.845 -5.857 1.00 0.30 C ATOM 5724 C ILE C 100 21.874 -3.899 -7.329 1.00 0.31 C ATOM 5725 O ILE C 100 21.753 -4.958 -7.909 1.00 0.33 O ATOM 5726 CB ILE C 100 21.094 -3.431 -4.984 1.00 0.29 C ATOM 5727 CG1 ILE C 100 21.456 -3.641 -3.506 1.00 0.29 C ATOM 5728 CG2 ILE C 100 19.868 -4.289 -5.338 1.00 0.29 C ATOM 5729 CD1 ILE C 100 20.387 -3.001 -2.616 1.00 0.30 C ATOM 0 H ILE C 100 23.208 -2.093 -5.061 1.00 0.31 H new ATOM 0 HA ILE C 100 22.622 -4.834 -5.544 1.00 0.30 H new ATOM 0 HB ILE C 100 20.859 -2.382 -5.162 1.00 0.29 H new ATOM 0 HG12 ILE C 100 21.534 -4.706 -3.289 1.00 0.29 H new ATOM 0 HG13 ILE C 100 22.430 -3.201 -3.294 1.00 0.29 H new ATOM 0 HG21 ILE C 100 19.024 -3.991 -4.716 1.00 0.29 H new ATOM 0 HG22 ILE C 100 19.614 -4.145 -6.388 1.00 0.29 H new ATOM 0 HG23 ILE C 100 20.096 -5.340 -5.161 1.00 0.29 H new ATOM 0 HD11 ILE C 100 20.647 -3.152 -1.568 1.00 0.30 H new ATOM 0 HD12 ILE C 100 20.331 -1.933 -2.825 1.00 0.30 H new ATOM 0 HD13 ILE C 100 19.420 -3.462 -2.820 1.00 0.30 H new ATOM 5741 N THR C 101 21.654 -2.766 -7.940 1.00 0.33 N ATOM 5742 CA THR C 101 21.244 -2.774 -9.372 1.00 0.36 C ATOM 5743 C THR C 101 22.333 -3.445 -10.207 1.00 0.38 C ATOM 5744 O THR C 101 22.054 -4.237 -11.085 1.00 0.40 O ATOM 5745 CB THR C 101 21.039 -1.338 -9.861 1.00 0.39 C ATOM 5746 OG1 THR C 101 22.211 -0.576 -9.607 1.00 0.40 O ATOM 5747 CG2 THR C 101 19.851 -0.708 -9.134 1.00 0.39 C ATOM 0 H THR C 101 21.740 -1.843 -7.513 1.00 0.33 H new ATOM 0 HA THR C 101 20.310 -3.326 -9.476 1.00 0.36 H new ATOM 0 HB THR C 101 20.839 -1.349 -10.932 1.00 0.39 H new ATOM 0 HG1 THR C 101 22.757 -1.031 -8.933 1.00 0.40 H new ATOM 0 HG21 THR C 101 19.710 0.314 -9.486 1.00 0.39 H new ATOM 0 HG22 THR C 101 18.951 -1.289 -9.336 1.00 0.39 H new ATOM 0 HG23 THR C 101 20.044 -0.699 -8.061 1.00 0.39 H new ATOM 5755 N ALA C 102 23.573 -3.145 -9.942 1.00 0.38 N ATOM 5756 CA ALA C 102 24.663 -3.786 -10.725 1.00 0.42 C ATOM 5757 C ALA C 102 24.591 -5.301 -10.539 1.00 0.40 C ATOM 5758 O ALA C 102 24.614 -6.056 -11.490 1.00 0.42 O ATOM 5759 CB ALA C 102 26.020 -3.266 -10.244 1.00 0.44 C ATOM 0 H ALA C 102 23.877 -2.489 -9.223 1.00 0.38 H new ATOM 0 HA ALA C 102 24.546 -3.544 -11.781 1.00 0.42 H new ATOM 0 HB1 ALA C 102 26.816 -3.738 -10.820 1.00 0.44 H new ATOM 0 HB2 ALA C 102 26.065 -2.186 -10.381 1.00 0.44 H new ATOM 0 HB3 ALA C 102 26.147 -3.503 -9.188 1.00 0.44 H new ATOM 5765 N LEU C 103 24.505 -5.750 -9.315 1.00 0.37 N ATOM 5766 CA LEU C 103 24.431 -7.214 -9.060 1.00 0.36 C ATOM 5767 C LEU C 103 23.186 -7.795 -9.738 1.00 0.34 C ATOM 5768 O LEU C 103 23.237 -8.845 -10.347 1.00 0.36 O ATOM 5769 CB LEU C 103 24.342 -7.457 -7.555 1.00 0.34 C ATOM 5770 CG LEU C 103 25.676 -7.109 -6.874 1.00 0.36 C ATOM 5771 CD1 LEU C 103 25.498 -7.178 -5.354 1.00 0.38 C ATOM 5772 CD2 LEU C 103 26.783 -8.092 -7.312 1.00 0.43 C ATOM 0 H LEU C 103 24.483 -5.163 -8.481 1.00 0.37 H new ATOM 0 HA LEU C 103 25.321 -7.697 -9.463 1.00 0.36 H new ATOM 0 HB2 LEU C 103 23.541 -6.852 -7.130 1.00 0.34 H new ATOM 0 HB3 LEU C 103 24.090 -8.500 -7.363 1.00 0.34 H new ATOM 0 HG LEU C 103 25.972 -6.102 -7.169 1.00 0.36 H new ATOM 0 HD11 LEU C 103 26.441 -6.932 -4.866 1.00 0.38 H new ATOM 0 HD12 LEU C 103 24.733 -6.466 -5.045 1.00 0.38 H new ATOM 0 HD13 LEU C 103 25.193 -8.185 -5.069 1.00 0.38 H new ATOM 0 HD21 LEU C 103 27.719 -7.829 -6.819 1.00 0.43 H new ATOM 0 HD22 LEU C 103 26.499 -9.107 -7.034 1.00 0.43 H new ATOM 0 HD23 LEU C 103 26.913 -8.035 -8.393 1.00 0.43 H new ATOM 5784 N LEU C 104 22.067 -7.120 -9.647 1.00 0.33 N ATOM 5785 CA LEU C 104 20.838 -7.651 -10.300 1.00 0.33 C ATOM 5786 C LEU C 104 21.084 -7.776 -11.798 1.00 0.37 C ATOM 5787 O LEU C 104 20.698 -8.747 -12.416 1.00 0.39 O ATOM 5788 CB LEU C 104 19.648 -6.712 -10.048 1.00 0.33 C ATOM 5789 CG LEU C 104 19.221 -6.773 -8.573 1.00 0.29 C ATOM 5790 CD1 LEU C 104 18.202 -5.660 -8.305 1.00 0.31 C ATOM 5791 CD2 LEU C 104 18.588 -8.144 -8.247 1.00 0.27 C ATOM 0 H LEU C 104 21.954 -6.234 -9.154 1.00 0.33 H new ATOM 0 HA LEU C 104 20.604 -8.629 -9.879 1.00 0.33 H new ATOM 0 HB2 LEU C 104 19.920 -5.690 -10.312 1.00 0.33 H new ATOM 0 HB3 LEU C 104 18.812 -6.995 -10.687 1.00 0.33 H new ATOM 0 HG LEU C 104 20.099 -6.639 -7.941 1.00 0.29 H new ATOM 0 HD11 LEU C 104 17.892 -5.694 -7.261 1.00 0.31 H new ATOM 0 HD12 LEU C 104 18.656 -4.692 -8.517 1.00 0.31 H new ATOM 0 HD13 LEU C 104 17.332 -5.801 -8.946 1.00 0.31 H new ATOM 0 HD21 LEU C 104 18.292 -8.168 -7.198 1.00 0.27 H new ATOM 0 HD22 LEU C 104 17.711 -8.298 -8.875 1.00 0.27 H new ATOM 0 HD23 LEU C 104 19.314 -8.934 -8.437 1.00 0.27 H new ATOM 5803 N GLU C 105 21.729 -6.813 -12.394 1.00 0.40 N ATOM 5804 CA GLU C 105 21.995 -6.918 -13.852 1.00 0.45 C ATOM 5805 C GLU C 105 22.831 -8.168 -14.105 1.00 0.46 C ATOM 5806 O GLU C 105 22.544 -8.954 -14.983 1.00 0.48 O ATOM 5807 CB GLU C 105 22.754 -5.681 -14.337 1.00 0.49 C ATOM 5808 CG GLU C 105 22.977 -5.780 -15.850 1.00 0.53 C ATOM 5809 CD GLU C 105 23.716 -4.536 -16.342 1.00 1.15 C ATOM 5810 OE1 GLU C 105 23.849 -3.604 -15.566 1.00 1.83 O ATOM 5811 OE2 GLU C 105 24.136 -4.536 -17.487 1.00 1.85 O ATOM 0 H GLU C 105 22.079 -5.969 -11.941 1.00 0.40 H new ATOM 0 HA GLU C 105 21.052 -6.983 -14.395 1.00 0.45 H new ATOM 0 HB2 GLU C 105 22.190 -4.779 -14.100 1.00 0.49 H new ATOM 0 HB3 GLU C 105 23.711 -5.603 -13.822 1.00 0.49 H new ATOM 0 HG2 GLU C 105 23.554 -6.675 -16.085 1.00 0.53 H new ATOM 0 HG3 GLU C 105 22.020 -5.874 -16.363 1.00 0.53 H new ATOM 5818 N GLU C 106 23.864 -8.361 -13.331 1.00 0.45 N ATOM 5819 CA GLU C 106 24.710 -9.564 -13.520 1.00 0.47 C ATOM 5820 C GLU C 106 23.897 -10.805 -13.155 1.00 0.44 C ATOM 5821 O GLU C 106 23.966 -11.822 -13.815 1.00 0.46 O ATOM 5822 CB GLU C 106 25.939 -9.466 -12.613 1.00 0.49 C ATOM 5823 CG GLU C 106 26.866 -8.363 -13.133 1.00 1.17 C ATOM 5824 CD GLU C 106 28.079 -8.228 -12.210 1.00 1.66 C ATOM 5825 OE1 GLU C 106 28.029 -8.763 -11.116 1.00 2.27 O ATOM 5826 OE2 GLU C 106 29.030 -7.575 -12.609 1.00 2.25 O ATOM 0 H GLU C 106 24.155 -7.737 -12.579 1.00 0.45 H new ATOM 0 HA GLU C 106 25.035 -9.632 -14.558 1.00 0.47 H new ATOM 0 HB2 GLU C 106 25.633 -9.248 -11.590 1.00 0.49 H new ATOM 0 HB3 GLU C 106 26.466 -10.420 -12.592 1.00 0.49 H new ATOM 0 HG2 GLU C 106 27.193 -8.597 -14.146 1.00 1.17 H new ATOM 0 HG3 GLU C 106 26.328 -7.416 -13.183 1.00 1.17 H new ATOM 5833 N ALA C 107 23.113 -10.724 -12.111 1.00 0.40 N ATOM 5834 CA ALA C 107 22.285 -11.894 -11.717 1.00 0.37 C ATOM 5835 C ALA C 107 21.344 -12.249 -12.869 1.00 0.40 C ATOM 5836 O ALA C 107 21.232 -13.394 -13.260 1.00 0.41 O ATOM 5837 CB ALA C 107 21.471 -11.556 -10.466 1.00 0.34 C ATOM 0 H ALA C 107 23.013 -9.900 -11.518 1.00 0.40 H new ATOM 0 HA ALA C 107 22.931 -12.744 -11.497 1.00 0.37 H new ATOM 0 HB1 ALA C 107 20.866 -12.417 -10.182 1.00 0.34 H new ATOM 0 HB2 ALA C 107 22.147 -11.302 -9.650 1.00 0.34 H new ATOM 0 HB3 ALA C 107 20.819 -10.708 -10.674 1.00 0.34 H new ATOM 5843 N GLN C 108 20.667 -11.275 -13.425 1.00 0.42 N ATOM 5844 CA GLN C 108 19.745 -11.575 -14.560 1.00 0.46 C ATOM 5845 C GLN C 108 20.545 -12.184 -15.707 1.00 0.50 C ATOM 5846 O GLN C 108 20.177 -13.196 -16.265 1.00 0.53 O ATOM 5847 CB GLN C 108 19.078 -10.284 -15.035 1.00 0.49 C ATOM 5848 CG GLN C 108 18.092 -9.804 -13.975 1.00 0.47 C ATOM 5849 CD GLN C 108 17.428 -8.513 -14.445 1.00 0.98 C ATOM 5850 OE1 GLN C 108 17.068 -8.385 -15.600 1.00 1.68 O ATOM 5851 NE2 GLN C 108 17.264 -7.537 -13.596 1.00 1.58 N ATOM 0 H GLN C 108 20.713 -10.295 -13.145 1.00 0.42 H new ATOM 0 HA GLN C 108 18.978 -12.277 -14.232 1.00 0.46 H new ATOM 0 HB2 GLN C 108 19.832 -9.519 -15.219 1.00 0.49 H new ATOM 0 HB3 GLN C 108 18.560 -10.455 -15.979 1.00 0.49 H new ATOM 0 HG2 GLN C 108 17.337 -10.569 -13.793 1.00 0.47 H new ATOM 0 HG3 GLN C 108 18.610 -9.636 -13.031 1.00 0.47 H new ATOM 0 HE21 GLN C 108 17.567 -7.647 -12.628 1.00 1.58 H new ATOM 0 HE22 GLN C 108 16.833 -6.664 -13.900 1.00 1.58 H new ATOM 5860 N ILE C 109 21.643 -11.577 -16.057 1.00 0.52 N ATOM 5861 CA ILE C 109 22.476 -12.124 -17.160 1.00 0.57 C ATOM 5862 C ILE C 109 22.923 -13.536 -16.783 1.00 0.56 C ATOM 5863 O ILE C 109 22.788 -14.466 -17.550 1.00 0.58 O ATOM 5864 CB ILE C 109 23.694 -11.220 -17.368 1.00 0.61 C ATOM 5865 CG1 ILE C 109 23.224 -9.861 -17.901 1.00 0.64 C ATOM 5866 CG2 ILE C 109 24.650 -11.863 -18.375 1.00 0.67 C ATOM 5867 CD1 ILE C 109 24.383 -8.863 -17.869 1.00 0.67 C ATOM 0 H ILE C 109 22.000 -10.724 -15.626 1.00 0.52 H new ATOM 0 HA ILE C 109 21.903 -12.162 -18.086 1.00 0.57 H new ATOM 0 HB ILE C 109 24.214 -11.084 -16.420 1.00 0.61 H new ATOM 0 HG12 ILE C 109 22.853 -9.968 -18.920 1.00 0.64 H new ATOM 0 HG13 ILE C 109 22.396 -9.490 -17.297 1.00 0.64 H new ATOM 0 HG21 ILE C 109 25.515 -11.216 -18.520 1.00 0.67 H new ATOM 0 HG22 ILE C 109 24.980 -12.831 -17.997 1.00 0.67 H new ATOM 0 HG23 ILE C 109 24.137 -12.001 -19.327 1.00 0.67 H new ATOM 0 HD11 ILE C 109 24.044 -7.899 -18.249 1.00 0.67 H new ATOM 0 HD12 ILE C 109 24.734 -8.746 -16.844 1.00 0.67 H new ATOM 0 HD13 ILE C 109 25.198 -9.232 -18.492 1.00 0.67 H new ATOM 5879 N GLN C 110 23.446 -13.706 -15.596 1.00 0.53 N ATOM 5880 CA GLN C 110 23.890 -15.061 -15.167 1.00 0.52 C ATOM 5881 C GLN C 110 22.671 -15.982 -15.059 1.00 0.48 C ATOM 5882 O GLN C 110 22.723 -17.137 -15.425 1.00 0.50 O ATOM 5883 CB GLN C 110 24.583 -14.965 -13.802 1.00 0.50 C ATOM 5884 CG GLN C 110 25.068 -16.353 -13.371 1.00 1.18 C ATOM 5885 CD GLN C 110 25.828 -16.238 -12.047 1.00 1.46 C ATOM 5886 OE1 GLN C 110 26.148 -15.152 -11.610 1.00 2.12 O ATOM 5887 NE2 GLN C 110 26.131 -17.321 -11.385 1.00 1.93 N ATOM 0 H GLN C 110 23.584 -12.965 -14.908 1.00 0.53 H new ATOM 0 HA GLN C 110 24.589 -15.465 -15.899 1.00 0.52 H new ATOM 0 HB2 GLN C 110 25.426 -14.276 -13.859 1.00 0.50 H new ATOM 0 HB3 GLN C 110 23.893 -14.564 -13.060 1.00 0.50 H new ATOM 0 HG2 GLN C 110 24.220 -17.028 -13.258 1.00 1.18 H new ATOM 0 HG3 GLN C 110 25.715 -16.779 -14.138 1.00 1.18 H new ATOM 0 HE21 GLN C 110 25.863 -18.234 -11.751 1.00 1.93 H new ATOM 0 HE22 GLN C 110 26.636 -17.254 -10.501 1.00 1.93 H new ATOM 5896 N GLN C 111 21.576 -15.483 -14.555 1.00 0.45 N ATOM 5897 CA GLN C 111 20.359 -16.335 -14.422 1.00 0.43 C ATOM 5898 C GLN C 111 19.924 -16.837 -15.801 1.00 0.49 C ATOM 5899 O GLN C 111 19.647 -18.005 -15.986 1.00 0.49 O ATOM 5900 CB GLN C 111 19.224 -15.520 -13.790 1.00 0.42 C ATOM 5901 CG GLN C 111 18.055 -16.448 -13.440 1.00 0.42 C ATOM 5902 CD GLN C 111 18.440 -17.330 -12.252 1.00 0.37 C ATOM 5903 OE1 GLN C 111 19.068 -16.870 -11.319 1.00 0.37 O ATOM 5904 NE2 GLN C 111 18.084 -18.586 -12.245 1.00 0.40 N ATOM 0 H GLN C 111 21.471 -14.522 -14.229 1.00 0.45 H new ATOM 0 HA GLN C 111 20.589 -17.189 -13.785 1.00 0.43 H new ATOM 0 HB2 GLN C 111 19.582 -15.015 -12.893 1.00 0.42 H new ATOM 0 HB3 GLN C 111 18.892 -14.745 -14.481 1.00 0.42 H new ATOM 0 HG2 GLN C 111 17.170 -15.860 -13.198 1.00 0.42 H new ATOM 0 HG3 GLN C 111 17.800 -17.068 -14.299 1.00 0.42 H new ATOM 0 HE21 GLN C 111 17.557 -18.971 -13.029 1.00 0.40 H new ATOM 0 HE22 GLN C 111 18.333 -19.182 -11.456 1.00 0.40 H new ATOM 5913 N GLU C 112 19.847 -15.963 -16.771 1.00 0.54 N ATOM 5914 CA GLU C 112 19.417 -16.404 -18.129 1.00 0.60 C ATOM 5915 C GLU C 112 20.406 -17.435 -18.680 1.00 0.62 C ATOM 5916 O GLU C 112 20.018 -18.407 -19.297 1.00 0.65 O ATOM 5917 CB GLU C 112 19.342 -15.190 -19.069 1.00 0.66 C ATOM 5918 CG GLU C 112 18.032 -14.423 -18.842 1.00 1.29 C ATOM 5919 CD GLU C 112 17.928 -13.973 -17.384 1.00 1.72 C ATOM 5920 OE1 GLU C 112 17.739 -14.827 -16.534 1.00 2.27 O ATOM 5921 OE2 GLU C 112 18.032 -12.781 -17.144 1.00 2.25 O ATOM 0 H GLU C 112 20.062 -14.970 -16.682 1.00 0.54 H new ATOM 0 HA GLU C 112 18.431 -16.863 -18.061 1.00 0.60 H new ATOM 0 HB2 GLU C 112 20.193 -14.531 -18.893 1.00 0.66 H new ATOM 0 HB3 GLU C 112 19.404 -15.520 -20.106 1.00 0.66 H new ATOM 0 HG2 GLU C 112 17.991 -13.556 -19.501 1.00 1.29 H new ATOM 0 HG3 GLU C 112 17.182 -15.057 -19.096 1.00 1.29 H new ATOM 5928 N LYS C 113 21.678 -17.239 -18.469 1.00 0.62 N ATOM 5929 CA LYS C 113 22.669 -18.222 -18.988 1.00 0.65 C ATOM 5930 C LYS C 113 22.483 -19.565 -18.282 1.00 0.60 C ATOM 5931 O LYS C 113 22.580 -20.611 -18.889 1.00 0.63 O ATOM 5932 CB LYS C 113 24.097 -17.716 -18.754 1.00 0.68 C ATOM 5933 CG LYS C 113 24.382 -16.517 -19.668 1.00 0.75 C ATOM 5934 CD LYS C 113 25.886 -16.206 -19.670 1.00 1.27 C ATOM 5935 CE LYS C 113 26.332 -15.742 -18.284 1.00 1.53 C ATOM 5936 NZ LYS C 113 27.688 -15.134 -18.378 1.00 2.10 N ATOM 0 H LYS C 113 22.072 -16.446 -17.963 1.00 0.62 H new ATOM 0 HA LYS C 113 22.508 -18.346 -20.059 1.00 0.65 H new ATOM 0 HB2 LYS C 113 24.223 -17.427 -17.711 1.00 0.68 H new ATOM 0 HB3 LYS C 113 24.812 -18.514 -18.953 1.00 0.68 H new ATOM 0 HG2 LYS C 113 24.045 -16.734 -20.682 1.00 0.75 H new ATOM 0 HG3 LYS C 113 23.822 -15.647 -19.325 1.00 0.75 H new ATOM 0 HD2 LYS C 113 26.448 -17.093 -19.962 1.00 1.27 H new ATOM 0 HD3 LYS C 113 26.104 -15.433 -20.407 1.00 1.27 H new ATOM 0 HE2 LYS C 113 25.623 -15.016 -17.886 1.00 1.53 H new ATOM 0 HE3 LYS C 113 26.347 -16.585 -17.593 1.00 1.53 H new ATOM 0 HZ1 LYS C 113 27.993 -14.818 -17.435 1.00 2.10 H new ATOM 0 HZ2 LYS C 113 28.360 -15.840 -18.741 1.00 2.10 H new ATOM 0 HZ3 LYS C 113 27.659 -14.319 -19.024 1.00 2.10 H new ATOM 5950 N ASN C 114 22.227 -19.551 -17.002 1.00 0.53 N ATOM 5951 CA ASN C 114 22.054 -20.840 -16.278 1.00 0.49 C ATOM 5952 C ASN C 114 20.881 -21.612 -16.884 1.00 0.49 C ATOM 5953 O ASN C 114 20.964 -22.803 -17.108 1.00 0.51 O ATOM 5954 CB ASN C 114 21.775 -20.561 -14.801 1.00 0.44 C ATOM 5955 CG ASN C 114 23.033 -19.990 -14.144 1.00 0.46 C ATOM 5956 OD1 ASN C 114 22.950 -19.100 -13.322 1.00 1.19 O ATOM 5957 ND2 ASN C 114 24.202 -20.467 -14.472 1.00 1.18 N ATOM 0 H ASN C 114 22.131 -18.711 -16.432 1.00 0.53 H new ATOM 0 HA ASN C 114 22.964 -21.434 -16.369 1.00 0.49 H new ATOM 0 HB2 ASN C 114 20.949 -19.857 -14.703 1.00 0.44 H new ATOM 0 HB3 ASN C 114 21.473 -21.479 -14.297 1.00 0.44 H new ATOM 0 HD21 ASN C 114 25.046 -20.092 -14.038 1.00 1.18 H new ATOM 0 HD22 ASN C 114 24.272 -21.215 -15.162 1.00 1.18 H new ATOM 5964 N MET C 115 19.793 -20.946 -17.171 1.00 0.50 N ATOM 5965 CA MET C 115 18.637 -21.660 -17.780 1.00 0.54 C ATOM 5966 C MET C 115 19.016 -22.088 -19.201 1.00 0.61 C ATOM 5967 O MET C 115 18.692 -23.175 -19.642 1.00 0.63 O ATOM 5968 CB MET C 115 17.418 -20.730 -17.822 1.00 0.57 C ATOM 5969 CG MET C 115 16.212 -21.496 -18.374 1.00 0.72 C ATOM 5970 SD MET C 115 14.768 -20.402 -18.408 1.00 0.94 S ATOM 5971 CE MET C 115 13.629 -21.541 -19.231 1.00 1.46 C ATOM 0 H MET C 115 19.657 -19.948 -17.011 1.00 0.50 H new ATOM 0 HA MET C 115 18.387 -22.539 -17.185 1.00 0.54 H new ATOM 0 HB2 MET C 115 17.198 -20.355 -16.822 1.00 0.57 H new ATOM 0 HB3 MET C 115 17.630 -19.863 -18.448 1.00 0.57 H new ATOM 0 HG2 MET C 115 16.428 -21.862 -19.378 1.00 0.72 H new ATOM 0 HG3 MET C 115 16.006 -22.368 -17.754 1.00 0.72 H new ATOM 0 HE1 MET C 115 12.659 -21.059 -19.355 1.00 1.46 H new ATOM 0 HE2 MET C 115 14.028 -21.811 -20.209 1.00 1.46 H new ATOM 0 HE3 MET C 115 13.513 -22.440 -18.626 1.00 1.46 H new ATOM 5981 N TYR C 116 19.707 -21.239 -19.913 1.00 0.65 N ATOM 5982 CA TYR C 116 20.127 -21.587 -21.301 1.00 0.73 C ATOM 5983 C TYR C 116 21.007 -22.838 -21.268 1.00 0.72 C ATOM 5984 O TYR C 116 20.823 -23.761 -22.035 1.00 0.76 O ATOM 5985 CB TYR C 116 20.916 -20.423 -21.905 1.00 0.78 C ATOM 5986 CG TYR C 116 21.335 -20.770 -23.314 1.00 0.87 C ATOM 5987 CD1 TYR C 116 22.553 -21.419 -23.545 1.00 0.91 C ATOM 5988 CD2 TYR C 116 20.499 -20.444 -24.391 1.00 0.95 C ATOM 5989 CE1 TYR C 116 22.936 -21.740 -24.854 1.00 1.01 C ATOM 5990 CE2 TYR C 116 20.885 -20.764 -25.697 1.00 1.05 C ATOM 5991 CZ TYR C 116 22.104 -21.412 -25.929 1.00 1.07 C ATOM 5992 OH TYR C 116 22.484 -21.728 -27.218 1.00 1.18 O ATOM 0 H TYR C 116 20.000 -20.316 -19.592 1.00 0.65 H new ATOM 0 HA TYR C 116 19.244 -21.779 -21.910 1.00 0.73 H new ATOM 0 HB2 TYR C 116 20.305 -19.520 -21.909 1.00 0.78 H new ATOM 0 HB3 TYR C 116 21.795 -20.211 -21.296 1.00 0.78 H new ATOM 0 HD1 TYR C 116 23.197 -21.672 -22.716 1.00 0.91 H new ATOM 0 HD2 TYR C 116 19.557 -19.946 -24.213 1.00 0.95 H new ATOM 0 HE1 TYR C 116 23.876 -22.242 -25.033 1.00 1.01 H new ATOM 0 HE2 TYR C 116 20.242 -20.511 -26.527 1.00 1.05 H new ATOM 0 HH TYR C 116 21.792 -21.431 -27.845 1.00 1.18 H new ATOM 6002 N GLU C 117 21.973 -22.870 -20.385 1.00 0.68 N ATOM 6003 CA GLU C 117 22.872 -24.057 -20.305 1.00 0.68 C ATOM 6004 C GLU C 117 22.049 -25.306 -19.987 1.00 0.65 C ATOM 6005 O GLU C 117 22.272 -26.362 -20.542 1.00 0.69 O ATOM 6006 CB GLU C 117 23.911 -23.831 -19.204 1.00 0.66 C ATOM 6007 CG GLU C 117 24.895 -22.744 -19.645 1.00 0.73 C ATOM 6008 CD GLU C 117 25.915 -22.493 -18.531 1.00 0.73 C ATOM 6009 OE1 GLU C 117 25.729 -23.030 -17.450 1.00 1.29 O ATOM 6010 OE2 GLU C 117 26.859 -21.761 -18.777 1.00 1.28 O ATOM 0 H GLU C 117 22.176 -22.126 -19.718 1.00 0.68 H new ATOM 0 HA GLU C 117 23.378 -24.196 -21.261 1.00 0.68 H new ATOM 0 HB2 GLU C 117 23.417 -23.535 -18.278 1.00 0.66 H new ATOM 0 HB3 GLU C 117 24.446 -24.758 -18.998 1.00 0.66 H new ATOM 0 HG2 GLU C 117 25.406 -23.050 -20.558 1.00 0.73 H new ATOM 0 HG3 GLU C 117 24.358 -21.824 -19.874 1.00 0.73 H new ATOM 6017 N LEU C 118 21.088 -25.189 -19.112 1.00 0.58 N ATOM 6018 CA LEU C 118 20.239 -26.365 -18.774 1.00 0.56 C ATOM 6019 C LEU C 118 19.536 -26.847 -20.043 1.00 0.65 C ATOM 6020 O LEU C 118 19.430 -28.030 -20.298 1.00 0.67 O ATOM 6021 CB LEU C 118 19.205 -25.953 -17.722 1.00 0.51 C ATOM 6022 CG LEU C 118 18.302 -27.139 -17.357 1.00 0.52 C ATOM 6023 CD1 LEU C 118 19.136 -28.292 -16.774 1.00 0.54 C ATOM 6024 CD2 LEU C 118 17.271 -26.674 -16.325 1.00 0.53 C ATOM 0 H LEU C 118 20.854 -24.329 -18.616 1.00 0.58 H new ATOM 0 HA LEU C 118 20.852 -27.172 -18.372 1.00 0.56 H new ATOM 0 HB2 LEU C 118 19.713 -25.587 -16.829 1.00 0.51 H new ATOM 0 HB3 LEU C 118 18.599 -25.131 -18.103 1.00 0.51 H new ATOM 0 HG LEU C 118 17.799 -27.499 -18.254 1.00 0.52 H new ATOM 0 HD11 LEU C 118 18.479 -29.124 -16.521 1.00 0.54 H new ATOM 0 HD12 LEU C 118 19.869 -28.619 -17.511 1.00 0.54 H new ATOM 0 HD13 LEU C 118 19.651 -27.951 -15.876 1.00 0.54 H new ATOM 0 HD21 LEU C 118 16.623 -27.508 -16.057 1.00 0.53 H new ATOM 0 HD22 LEU C 118 17.785 -26.313 -15.434 1.00 0.53 H new ATOM 0 HD23 LEU C 118 16.670 -25.869 -16.748 1.00 0.53 H new ATOM 6036 N GLN C 119 19.057 -25.935 -20.844 1.00 0.71 N ATOM 6037 CA GLN C 119 18.366 -26.331 -22.102 1.00 0.82 C ATOM 6038 C GLN C 119 19.330 -27.095 -23.008 1.00 0.87 C ATOM 6039 O GLN C 119 18.963 -28.062 -23.637 1.00 0.92 O ATOM 6040 CB GLN C 119 17.863 -25.082 -22.828 1.00 0.88 C ATOM 6041 CG GLN C 119 16.706 -24.466 -22.040 1.00 0.87 C ATOM 6042 CD GLN C 119 16.268 -23.164 -22.712 1.00 0.95 C ATOM 6043 OE1 GLN C 119 17.072 -22.471 -23.304 1.00 1.29 O ATOM 6044 NE2 GLN C 119 15.018 -22.799 -22.648 1.00 1.46 N ATOM 0 H GLN C 119 19.115 -24.930 -20.680 1.00 0.71 H new ATOM 0 HA GLN C 119 17.521 -26.974 -21.856 1.00 0.82 H new ATOM 0 HB2 GLN C 119 18.672 -24.359 -22.933 1.00 0.88 H new ATOM 0 HB3 GLN C 119 17.535 -25.341 -23.835 1.00 0.88 H new ATOM 0 HG2 GLN C 119 15.870 -25.164 -21.995 1.00 0.87 H new ATOM 0 HG3 GLN C 119 17.014 -24.272 -21.013 1.00 0.87 H new ATOM 0 HE21 GLN C 119 14.342 -23.379 -22.152 1.00 1.46 H new ATOM 0 HE22 GLN C 119 14.716 -21.933 -23.094 1.00 1.46 H new ATOM 6053 N LYS C 120 20.561 -26.673 -23.080 1.00 0.86 N ATOM 6054 CA LYS C 120 21.540 -27.380 -23.955 1.00 0.93 C ATOM 6055 C LYS C 120 21.666 -28.826 -23.488 1.00 0.91 C ATOM 6056 O LYS C 120 21.742 -29.741 -24.286 1.00 0.99 O ATOM 6057 CB LYS C 120 22.908 -26.688 -23.861 1.00 0.95 C ATOM 6058 CG LYS C 120 22.856 -25.301 -24.530 1.00 1.02 C ATOM 6059 CD LYS C 120 23.053 -25.421 -26.061 1.00 1.58 C ATOM 6060 CE LYS C 120 24.536 -25.249 -26.421 1.00 1.89 C ATOM 6061 NZ LYS C 120 25.337 -26.310 -25.750 1.00 2.45 N ATOM 0 H LYS C 120 20.932 -25.870 -22.572 1.00 0.86 H new ATOM 0 HA LYS C 120 21.197 -27.354 -24.989 1.00 0.93 H new ATOM 0 HB2 LYS C 120 23.199 -26.584 -22.816 1.00 0.95 H new ATOM 0 HB3 LYS C 120 23.668 -27.303 -24.343 1.00 0.95 H new ATOM 0 HG2 LYS C 120 21.898 -24.826 -24.318 1.00 1.02 H new ATOM 0 HG3 LYS C 120 23.630 -24.660 -24.108 1.00 1.02 H new ATOM 0 HD2 LYS C 120 22.698 -26.392 -26.405 1.00 1.58 H new ATOM 0 HD3 LYS C 120 22.457 -24.665 -26.572 1.00 1.58 H new ATOM 0 HE2 LYS C 120 24.668 -25.308 -27.501 1.00 1.89 H new ATOM 0 HE3 LYS C 120 24.885 -24.264 -26.110 1.00 1.89 H new ATOM 0 HZ1 LYS C 120 26.312 -26.289 -26.111 1.00 2.45 H new ATOM 0 HZ2 LYS C 120 25.344 -26.143 -24.724 1.00 2.45 H new ATOM 0 HZ3 LYS C 120 24.915 -27.240 -25.946 1.00 2.45 H new ATOM 6075 N LEU C 121 21.672 -29.048 -22.206 1.00 0.80 N ATOM 6076 CA LEU C 121 21.779 -30.444 -21.709 1.00 0.79 C ATOM 6077 C LEU C 121 20.583 -31.233 -22.241 1.00 0.87 C ATOM 6078 O LEU C 121 20.726 -32.336 -22.728 1.00 0.96 O ATOM 6079 CB LEU C 121 21.753 -30.450 -20.179 1.00 0.68 C ATOM 6080 CG LEU C 121 22.927 -29.631 -19.627 1.00 0.67 C ATOM 6081 CD1 LEU C 121 22.837 -29.596 -18.099 1.00 0.62 C ATOM 6082 CD2 LEU C 121 24.261 -30.273 -20.049 1.00 0.77 C ATOM 0 H LEU C 121 21.608 -28.329 -21.485 1.00 0.80 H new ATOM 0 HA LEU C 121 22.712 -30.893 -22.049 1.00 0.79 H new ATOM 0 HB2 LEU C 121 20.811 -30.035 -19.822 1.00 0.68 H new ATOM 0 HB3 LEU C 121 21.810 -31.474 -19.811 1.00 0.68 H new ATOM 0 HG LEU C 121 22.881 -28.617 -20.025 1.00 0.67 H new ATOM 0 HD11 LEU C 121 23.668 -29.016 -17.699 1.00 0.62 H new ATOM 0 HD12 LEU C 121 21.895 -29.135 -17.800 1.00 0.62 H new ATOM 0 HD13 LEU C 121 22.883 -30.613 -17.708 1.00 0.62 H new ATOM 0 HD21 LEU C 121 25.089 -29.685 -19.653 1.00 0.77 H new ATOM 0 HD22 LEU C 121 24.316 -31.288 -19.657 1.00 0.77 H new ATOM 0 HD23 LEU C 121 24.323 -30.301 -21.137 1.00 0.77 H new ATOM 6094 N ASN C 122 19.405 -30.663 -22.168 1.00 0.88 N ATOM 6095 CA ASN C 122 18.185 -31.363 -22.682 1.00 1.03 C ATOM 6096 C ASN C 122 17.436 -30.432 -23.641 1.00 1.08 C ATOM 6097 O ASN C 122 16.288 -30.101 -23.423 1.00 1.15 O ATOM 6098 CB ASN C 122 17.268 -31.709 -21.506 1.00 1.11 C ATOM 6099 CG ASN C 122 16.063 -32.503 -22.014 1.00 1.31 C ATOM 6100 OD1 ASN C 122 16.203 -33.771 -22.299 1.00 1.78 O flip ATOM 6101 ND2 ASN C 122 14.981 -31.965 -22.149 1.00 1.70 N flip ATOM 0 H ASN C 122 19.235 -29.738 -21.773 1.00 0.88 H new ATOM 0 HA ASN C 122 18.478 -32.274 -23.203 1.00 1.03 H new ATOM 0 HB2 ASN C 122 17.814 -32.292 -20.764 1.00 1.11 H new ATOM 0 HB3 ASN C 122 16.934 -30.797 -21.011 1.00 1.11 H new ATOM 0 HD21 ASN C 122 14.872 -30.976 -21.926 1.00 1.70 H new ATOM 0 HD22 ASN C 122 14.182 -32.503 -22.485 1.00 1.70 H new ATOM 6108 N SER C 123 18.070 -30.015 -24.707 1.00 1.09 N ATOM 6109 CA SER C 123 17.385 -29.113 -25.682 1.00 1.18 C ATOM 6110 C SER C 123 16.664 -29.966 -26.726 1.00 1.37 C ATOM 6111 O SER C 123 16.078 -29.392 -27.629 1.00 1.92 O ATOM 6112 CB SER C 123 18.420 -28.227 -26.382 1.00 1.16 C ATOM 6113 OG SER C 123 17.947 -27.891 -27.681 1.00 1.84 O ATOM 6114 OXT SER C 123 16.711 -31.179 -26.605 1.00 1.66 O ATOM 0 H SER C 123 19.031 -30.260 -24.944 1.00 1.09 H new ATOM 0 HA SER C 123 16.669 -28.483 -25.155 1.00 1.18 H new ATOM 0 HB2 SER C 123 18.594 -27.322 -25.800 1.00 1.16 H new ATOM 0 HB3 SER C 123 19.374 -28.749 -26.453 1.00 1.16 H new ATOM 0 HG SER C 123 16.971 -27.971 -27.704 1.00 1.84 H new TER 6120 SER C 123