USER MOD reduce.3.24.130724 H: found=0, std=0, add=3063, rem=0, adj=84 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 13 GLN : amide:sc= -2.61 K(o=-11,f=-19!) USER MOD Set 1.2: B 16 GLN : amide:sc= -2.5 X(o=-11,f=-12!) USER MOD Set 1.3: C 110 GLN : amide:sc= -4.5 X(o=-11,f=-11!) USER MOD Set 1.4: C 111 GLN : amide:sc= -1.51! K(o=-11!,f=-13) USER MOD Set 2.1: C 83 ASN : amide:sc= -0.142 X(o=-0.14,f=-0.0065) USER MOD Set 2.2: C 87 GLN : amide:sc= -0.0016 K(o=-0.14,f=-1.4!) USER MOD Set 3.1: B 52 GLN :FLIP amide:sc= -8.29! C(o=-16!,f=-15!) USER MOD Set 3.2: C 74 ASN :FLIP amide:sc= -6.99! C(o=-16!,f=-15!) USER MOD Set 4.1: A 24 GLN : amide:sc= -1.71 K(o=-5.2,f=-9.9!) USER MOD Set 4.2: B 24 GLN : amide:sc= -1.64 K(o=-5.2,f=-9.7!) USER MOD Set 4.3: C 24 GLN : amide:sc= -1.89 K(o=-5.2,f=-9.3!) USER MOD Set 5.1: C 22 LYS NZ :NH3+ -138:sc= 0 (180deg=0) USER MOD Set 5.2: C 108 GLN : amide:sc=-0.00942 K(o=-0.0094,f=-1.1) USER MOD Set 6.1: A 2 GLN :FLIP amide:sc= -0.167 X(o=-0.0052,f=0.058) USER MOD Set 6.2: B 2 GLN :FLIP amide:sc= 0.0803 X(o=0.0087,f=0.058) USER MOD Set 6.3: C 2 GLN : amide:sc= 0.144 X(o=0.058,f=0.0087) USER MOD Set 7.1: B 83 ASN : amide:sc= -0.144 X(o=-0.15,f=-0.026) USER MOD Set 7.2: B 87 GLN : amide:sc=-0.00956 K(o=-0.15,f=-1.3) USER MOD Set 8.1: A 37 ASN :FLIP amide:sc= -0.13 F(o=-3,f=-1.8) USER MOD Set 8.2: B 82 ASN :FLIP amide:sc= -1.71! C(o=-3!,f=-1.8!) USER MOD Set 9.1: B 37 ASN :FLIP amide:sc= -0.0776 F(o=-3,f=-1.9) USER MOD Set 9.2: C 82 ASN :FLIP amide:sc= -1.78! C(o=-2.9!,f=-1.9!) USER MOD Set10.1: B 22 LYS NZ :NH3+ -138:sc= 0 (180deg=0) USER MOD Set10.2: B 108 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Set11.1: A 110 GLN : amide:sc= -5.01! C(o=-12!,f=-11!) USER MOD Set11.2: A 111 GLN : amide:sc= -1.53! K(o=-12!,f=-14) USER MOD Set11.3: C 13 GLN : amide:sc= -2.37 K(o=-12,f=-21!) USER MOD Set11.4: C 16 GLN : amide:sc= -2.93! C(o=-12!,f=-12!) USER MOD Set12.1: A 83 ASN : amide:sc= -0.152 X(o=-0.17,f=-0.036) USER MOD Set12.2: A 87 GLN : amide:sc= -0.0205 K(o=-0.17,f=-1.3!) USER MOD Set13.1: A 82 ASN :FLIP amide:sc= -1.85! C(o=-3.6!,f=-1.9!) USER MOD Set13.2: C 37 ASN :FLIP amide:sc= -0.0892 F(o=-3.6,f=-1.9) USER MOD Set14.1: A 74 ASN :FLIP amide:sc= -7.91! C(o=-19!,f=-18!) USER MOD Set14.2: C 52 GLN :FLIP amide:sc= -9.68! C(o=-19!,f=-18!) USER MOD Set15.1: A 52 GLN :FLIP amide:sc= -9.01! C(o=-17!,f=-16!) USER MOD Set15.2: B 74 ASN :FLIP amide:sc= -7.05! C(o=-17!,f=-16!) USER MOD Set16.1: A 35 THR OG1 : rot -116:sc= 1.81 USER MOD Set16.2: B 35 THR OG1 : rot -116:sc= 1.81 USER MOD Set16.3: C 35 THR OG1 : rot -116:sc= 1.83 USER MOD Set17.1: A 22 LYS NZ :NH3+ -138:sc= 0 (180deg=0) USER MOD Set17.2: A 108 GLN : amide:sc= -0.0188 K(o=-0.019,f=-0.99) USER MOD Set18.1: A 13 GLN : amide:sc= -2.4 K(o=-11,f=-20!) USER MOD Set18.2: A 16 GLN : amide:sc= -2.78 K(o=-11,f=-12!) USER MOD Set18.3: B 110 GLN : amide:sc= -4.81 X(o=-11,f=-11!) USER MOD Set18.4: B 111 GLN : amide:sc= -1.41 K(o=-11,f=-14) USER MOD Single : A 1 ALA N :NH3+ 179:sc= -0.172 (180deg=-0.214) USER MOD Single : A 3 SER OG : rot 64:sc= 1.02 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= -0.419 X(o=-0.42,f=-0.16) USER MOD Single : A 14 GLN :FLIP amide:sc= -1.2 F(o=-2.8,f=-1.2) USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 25 GLN :FLIP amide:sc= -1.88 F(o=-6.5!,f=-1.9) USER MOD Single : A 31 THR OG1 : rot -57:sc= 0.793 USER MOD Single : A 36 LYS NZ :NH3+ -162:sc= -0.0494 (180deg=-0.42) USER MOD Single : A 39 GLN : amide:sc= -1.7 X(o=-1.7,f=-2!) USER MOD Single : A 40 THR OG1 : rot -62:sc= 0.64 USER MOD Single : A 43 THR OG1 : rot -28:sc= 0.657 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 TYR OH : rot 134:sc= -0.529 USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 56 ASN : amide:sc= -2.23 K(o=-2.2,f=-10!) USER MOD Single : A 64 GLN :FLIP amide:sc= -5.76! C(o=-12!,f=-5.8!) USER MOD Single : A 67 HIS : no HD1:sc= -0.185 X(o=-0.18,f=-0.018) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 78 THR OG1 : rot 62:sc= 0.784 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 THR OG1 : rot -26:sc= -0.12 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 ASN :FLIP amide:sc= -0.0573 F(o=-0.85,f=-0.057) USER MOD Single : A 101 THR OG1 : rot -17:sc= -0.222 USER MOD Single : A 113 LYS NZ :NH3+ 157:sc= -0.0902 (180deg=-0.527) USER MOD Single : A 114 ASN : amide:sc= -0.818 K(o=-0.82,f=-1.9!) 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=-0.78) USER MOD Single : A 120 LYS NZ :NH3+ 178:sc= -2.01 (180deg=-2.14) USER MOD Single : A 122 ASN : amide:sc= -0.468 X(o=-0.47,f=-0.92) USER MOD Single : A 123 SER OG : rot 180:sc= -0.0773 USER MOD Single : B 1 ALA N :NH3+ 176:sc= -0.112 (180deg=-0.131) USER MOD Single : B 3 SER OG : rot 72:sc= 1.06 USER MOD Single : B 5 THR OG1 : rot 180:sc= 0 USER MOD Single : B 12 GLN : amide:sc= -0.418 X(o=-0.42,f=-0.18) USER MOD Single : B 14 GLN :FLIP amide:sc= -1.3 F(o=-3,f=-1.3) USER MOD Single : B 15 GLN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : B 25 GLN :FLIP amide:sc= -1.95 F(o=-6.5!,f=-1.9) USER MOD Single : B 31 THR OG1 : rot -34:sc= 0.722 USER MOD Single : B 36 LYS NZ :NH3+ -160:sc= -0.0319 (180deg=-0.437) USER MOD Single : B 39 GLN : amide:sc= -1.63 X(o=-1.6,f=-1.8!) USER MOD Single : B 40 THR OG1 : rot -77:sc= 0.795 USER MOD Single : B 43 THR OG1 : rot -37:sc= 0.626 USER MOD Single : B 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 48 TYR OH : rot 130:sc= -0.449 USER MOD Single : B 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 54 GLN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : B 56 ASN : amide:sc= -2.14 K(o=-2.1,f=-10!) USER MOD Single : B 64 GLN :FLIP amide:sc= -5.93! C(o=-12!,f=-5.9!) USER MOD Single : B 67 HIS : no HD1:sc= -0.135 X(o=-0.13,f=-0.021) USER MOD Single : B 68 THR OG1 : rot 180:sc= 0 USER MOD Single : B 69 THR OG1 : rot 180:sc= 0 USER MOD Single : B 76 SER OG : rot 180:sc= 0 USER MOD Single : B 78 THR OG1 : rot 56:sc= 0.746 USER MOD Single : B 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 85 THR OG1 : rot -25:sc= 0.0427 USER MOD Single : B 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 99 ASN :FLIP amide:sc= -0.0682 F(o=-0.85,f=-0.068) USER MOD Single : B 101 THR OG1 : rot -15:sc= -0.12 USER MOD Single : B 113 LYS NZ :NH3+ 158:sc= -0.0864 (180deg=-0.494) USER MOD Single : B 114 ASN : amide:sc= -0.717 K(o=-0.72,f=-2!) 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 K(o=0,f=-0.8) USER MOD Single : B 120 LYS NZ :NH3+ 180:sc= -2.03 (180deg=-2.03) USER MOD Single : B 122 ASN : amide:sc= -0.526 X(o=-0.53,f=-1) USER MOD Single : B 123 SER OG : rot 19:sc= 0.6! USER MOD Single : C 1 ALA N :NH3+ 178:sc= -0.109 (180deg=-0.12) USER MOD Single : C 3 SER OG : rot 69:sc= 0.995 USER MOD Single : C 5 THR OG1 : rot 180:sc= 0 USER MOD Single : C 12 GLN : amide:sc= -0.434 X(o=-0.43,f=-0.19) USER MOD Single : C 14 GLN :FLIP amide:sc= -1.4 F(o=-2.9,f=-1.4) USER MOD Single : C 15 GLN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : C 25 GLN :FLIP amide:sc= -1.82 F(o=-6.5!,f=-1.8) USER MOD Single : C 31 THR OG1 : rot -33:sc= 0.767 USER MOD Single : C 36 LYS NZ :NH3+ -160:sc= -0.0339 (180deg=-0.448) USER MOD Single : C 39 GLN : amide:sc= -1.63 X(o=-1.6,f=-1.9!) USER MOD Single : C 40 THR OG1 : rot -54:sc= 0.744 USER MOD Single : C 43 THR OG1 : rot -29:sc= 0.683 USER MOD Single : C 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 48 TYR OH : rot 130:sc= -0.642 USER MOD Single : C 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 54 GLN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : C 56 ASN : amide:sc= -2.37 K(o=-2.4,f=-10!) USER MOD Single : C 64 GLN :FLIP amide:sc= -5.91! C(o=-13!,f=-5.9!) USER MOD Single : C 67 HIS : no HD1:sc= -0.191 X(o=-0.19,f=-0.0031) USER MOD Single : C 68 THR OG1 : rot 180:sc= 0 USER MOD Single : C 69 THR OG1 : rot 180:sc= 0 USER MOD Single : C 76 SER OG : rot 180:sc= 0 USER MOD Single : C 78 THR OG1 : rot 57:sc= 0.642 USER MOD Single : C 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 85 THR OG1 : rot -26:sc= -0.13 USER MOD Single : C 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 99 ASN :FLIP amide:sc= -0.0746 F(o=-0.85,f=-0.075) USER MOD Single : C 101 THR OG1 : rot -12:sc= -0.0582 USER MOD Single : C 113 LYS NZ :NH3+ 156:sc= -0.0784 (180deg=-0.525) USER MOD Single : C 114 ASN : amide:sc= -0.794 K(o=-0.79,f=-2.1!) 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 K(o=0,f=-0.84) USER MOD Single : C 120 LYS NZ :NH3+ 180:sc= -2.11 (180deg=-2.11) USER MOD Single : C 122 ASN : amide:sc= -0.436 X(o=-0.44,f=-0.9) USER MOD Single : C 123 SER OG : rot 21:sc= 0.374! USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 27.429 -41.777 -8.348 1.00 0.82 N ATOM 2 CA ALA A 1 28.319 -40.701 -8.868 1.00 0.80 C ATOM 3 C ALA A 1 27.542 -39.385 -8.917 1.00 0.71 C ATOM 4 O ALA A 1 28.014 -38.389 -9.429 1.00 0.70 O ATOM 5 CB ALA A 1 28.791 -41.070 -10.276 1.00 0.90 C ATOM 0 H1 ALA A 1 27.948 -42.678 -8.329 1.00 0.82 H new ATOM 0 H2 ALA A 1 27.119 -41.536 -7.385 1.00 0.82 H new ATOM 0 H3 ALA A 1 26.598 -41.869 -8.967 1.00 0.82 H new ATOM 0 HA ALA A 1 29.184 -40.590 -8.214 1.00 0.80 H new ATOM 0 HB1 ALA A 1 29.442 -40.284 -10.659 1.00 0.90 H new ATOM 0 HB2 ALA A 1 29.340 -42.011 -10.241 1.00 0.90 H new ATOM 0 HB3 ALA A 1 27.928 -41.178 -10.933 1.00 0.90 H new ATOM 13 N GLN A 2 26.349 -39.376 -8.387 1.00 0.67 N ATOM 14 CA GLN A 2 25.527 -38.131 -8.400 1.00 0.60 C ATOM 15 C GLN A 2 25.961 -37.211 -7.257 1.00 0.52 C ATOM 16 O GLN A 2 26.316 -37.660 -6.186 1.00 0.52 O ATOM 17 CB GLN A 2 24.053 -38.503 -8.219 1.00 0.62 C ATOM 18 CG GLN A 2 23.542 -39.209 -9.477 1.00 0.72 C ATOM 19 CD GLN A 2 23.437 -38.204 -10.625 1.00 1.27 C ATOM 20 OE1 GLN A 2 24.139 -38.393 -11.708 1.00 2.00 O flip ATOM 21 NE2 GLN A 2 22.705 -37.237 -10.537 1.00 1.87 N flip ATOM 0 H GLN A 2 25.906 -40.181 -7.944 1.00 0.67 H new ATOM 0 HA GLN A 2 25.666 -37.614 -9.349 1.00 0.60 H new ATOM 0 HB2 GLN A 2 23.936 -39.153 -7.352 1.00 0.62 H new ATOM 0 HB3 GLN A 2 23.462 -37.607 -8.028 1.00 0.62 H new ATOM 0 HG2 GLN A 2 24.218 -40.019 -9.751 1.00 0.72 H new ATOM 0 HG3 GLN A 2 22.568 -39.658 -9.284 1.00 0.72 H new ATOM 0 HE21 GLN A 2 22.156 -37.089 -9.690 1.00 1.87 H new ATOM 0 HE22 GLN A 2 22.640 -36.574 -11.310 1.00 1.87 H new ATOM 30 N SER A 3 25.927 -35.921 -7.472 1.00 0.47 N ATOM 31 CA SER A 3 26.330 -34.971 -6.391 1.00 0.41 C ATOM 32 C SER A 3 25.099 -34.606 -5.557 1.00 0.37 C ATOM 33 O SER A 3 24.728 -33.455 -5.450 1.00 0.34 O ATOM 34 CB SER A 3 26.916 -33.704 -7.018 1.00 0.40 C ATOM 35 OG SER A 3 25.857 -32.851 -7.432 1.00 1.37 O ATOM 0 H SER A 3 25.638 -35.485 -8.348 1.00 0.47 H new ATOM 0 HA SER A 3 27.080 -35.438 -5.753 1.00 0.41 H new ATOM 0 HB2 SER A 3 27.553 -33.189 -6.298 1.00 0.40 H new ATOM 0 HB3 SER A 3 27.544 -33.963 -7.871 1.00 0.40 H new ATOM 0 HG SER A 3 25.343 -32.563 -6.649 1.00 1.37 H new ATOM 41 N ARG A 4 24.466 -35.581 -4.961 1.00 0.41 N ATOM 42 CA ARG A 4 23.264 -35.291 -4.131 1.00 0.42 C ATOM 43 C ARG A 4 23.683 -34.469 -2.911 1.00 0.42 C ATOM 44 O ARG A 4 23.003 -33.547 -2.504 1.00 0.43 O ATOM 45 CB ARG A 4 22.642 -36.612 -3.675 1.00 0.51 C ATOM 46 CG ARG A 4 22.016 -37.315 -4.881 1.00 0.90 C ATOM 47 CD ARG A 4 21.393 -38.639 -4.435 1.00 1.03 C ATOM 48 NE ARG A 4 20.875 -39.374 -5.625 1.00 1.97 N ATOM 49 CZ ARG A 4 20.612 -40.649 -5.539 1.00 2.55 C ATOM 50 NH1 ARG A 4 20.816 -41.284 -4.417 1.00 2.53 N ATOM 51 NH2 ARG A 4 20.152 -41.292 -6.577 1.00 3.57 N ATOM 0 H ARG A 4 24.730 -36.565 -5.014 1.00 0.41 H new ATOM 0 HA ARG A 4 22.535 -34.728 -4.713 1.00 0.42 H new ATOM 0 HB2 ARG A 4 23.402 -37.249 -3.222 1.00 0.51 H new ATOM 0 HB3 ARG A 4 21.885 -36.428 -2.913 1.00 0.51 H new ATOM 0 HG2 ARG A 4 21.256 -36.677 -5.333 1.00 0.90 H new ATOM 0 HG3 ARG A 4 22.774 -37.496 -5.643 1.00 0.90 H new ATOM 0 HD2 ARG A 4 22.135 -39.245 -3.915 1.00 1.03 H new ATOM 0 HD3 ARG A 4 20.583 -38.452 -3.729 1.00 1.03 H new ATOM 0 HE ARG A 4 20.727 -38.880 -6.505 1.00 1.97 H new ATOM 0 HH11 ARG A 4 21.181 -40.783 -3.607 1.00 2.53 H new ATOM 0 HH12 ARG A 4 20.610 -42.281 -4.350 1.00 2.53 H new ATOM 0 HH21 ARG A 4 19.998 -40.798 -7.456 1.00 3.57 H new ATOM 0 HH22 ARG A 4 19.946 -42.289 -6.510 1.00 3.57 H new ATOM 65 N THR A 5 24.805 -34.794 -2.329 1.00 0.45 N ATOM 66 CA THR A 5 25.279 -34.032 -1.140 1.00 0.49 C ATOM 67 C THR A 5 25.482 -32.563 -1.522 1.00 0.44 C ATOM 68 O THR A 5 25.090 -31.666 -0.804 1.00 0.46 O ATOM 69 CB THR A 5 26.602 -34.630 -0.647 1.00 0.54 C ATOM 70 OG1 THR A 5 27.020 -33.951 0.528 1.00 0.68 O ATOM 71 CG2 THR A 5 27.674 -34.488 -1.730 1.00 0.57 C ATOM 0 H THR A 5 25.415 -35.556 -2.627 1.00 0.45 H new ATOM 0 HA THR A 5 24.537 -34.095 -0.344 1.00 0.49 H new ATOM 0 HB THR A 5 26.457 -35.687 -0.425 1.00 0.54 H new ATOM 0 HG1 THR A 5 27.865 -34.334 0.844 1.00 0.68 H new ATOM 0 HG21 THR A 5 28.611 -34.915 -1.373 1.00 0.57 H new ATOM 0 HG22 THR A 5 27.355 -35.015 -2.629 1.00 0.57 H new ATOM 0 HG23 THR A 5 27.821 -33.433 -1.961 1.00 0.57 H new ATOM 79 N LEU A 6 26.090 -32.311 -2.650 1.00 0.39 N ATOM 80 CA LEU A 6 26.312 -30.901 -3.078 1.00 0.36 C ATOM 81 C LEU A 6 24.951 -30.212 -3.234 1.00 0.32 C ATOM 82 O LEU A 6 24.752 -29.093 -2.804 1.00 0.33 O ATOM 83 CB LEU A 6 27.065 -30.899 -4.412 1.00 0.35 C ATOM 84 CG LEU A 6 27.316 -29.463 -4.891 1.00 0.35 C ATOM 85 CD1 LEU A 6 28.168 -28.702 -3.857 1.00 0.41 C ATOM 86 CD2 LEU A 6 28.057 -29.510 -6.235 1.00 0.36 C ATOM 0 H LEU A 6 26.442 -33.020 -3.293 1.00 0.39 H new ATOM 0 HA LEU A 6 26.902 -30.364 -2.336 1.00 0.36 H new ATOM 0 HB2 LEU A 6 28.015 -31.421 -4.300 1.00 0.35 H new ATOM 0 HB3 LEU A 6 26.489 -31.442 -5.161 1.00 0.35 H new ATOM 0 HG LEU A 6 26.363 -28.947 -5.009 1.00 0.35 H new ATOM 0 HD11 LEU A 6 28.341 -27.684 -4.206 1.00 0.41 H new ATOM 0 HD12 LEU A 6 27.643 -28.674 -2.902 1.00 0.41 H new ATOM 0 HD13 LEU A 6 29.125 -29.209 -3.730 1.00 0.41 H new ATOM 0 HD21 LEU A 6 28.241 -28.494 -6.585 1.00 0.36 H new ATOM 0 HD22 LEU A 6 29.008 -30.028 -6.108 1.00 0.36 H new ATOM 0 HD23 LEU A 6 27.449 -30.042 -6.967 1.00 0.36 H new ATOM 98 N LEU A 7 24.012 -30.889 -3.838 1.00 0.29 N ATOM 99 CA LEU A 7 22.652 -30.307 -4.019 1.00 0.26 C ATOM 100 C LEU A 7 22.044 -29.995 -2.655 1.00 0.30 C ATOM 101 O LEU A 7 21.384 -28.990 -2.478 1.00 0.29 O ATOM 102 CB LEU A 7 21.760 -31.289 -4.789 1.00 0.27 C ATOM 103 CG LEU A 7 22.191 -31.329 -6.269 1.00 0.24 C ATOM 104 CD1 LEU A 7 21.677 -32.618 -6.924 1.00 0.27 C ATOM 105 CD2 LEU A 7 21.616 -30.119 -7.030 1.00 0.23 C ATOM 0 H LEU A 7 24.131 -31.829 -4.217 1.00 0.29 H new ATOM 0 HA LEU A 7 22.727 -29.383 -4.593 1.00 0.26 H new ATOM 0 HB2 LEU A 7 21.835 -32.284 -4.351 1.00 0.27 H new ATOM 0 HB3 LEU A 7 20.716 -30.985 -4.712 1.00 0.27 H new ATOM 0 HG LEU A 7 23.280 -31.297 -6.312 1.00 0.24 H new ATOM 0 HD11 LEU A 7 21.984 -32.642 -7.970 1.00 0.27 H new ATOM 0 HD12 LEU A 7 22.093 -33.481 -6.404 1.00 0.27 H new ATOM 0 HD13 LEU A 7 20.589 -32.648 -6.864 1.00 0.27 H new ATOM 0 HD21 LEU A 7 21.930 -30.163 -8.073 1.00 0.23 H new ATOM 0 HD22 LEU A 7 20.527 -30.140 -6.977 1.00 0.23 H new ATOM 0 HD23 LEU A 7 21.983 -29.197 -6.579 1.00 0.23 H new ATOM 117 N ALA A 8 22.248 -30.845 -1.689 1.00 0.34 N ATOM 118 CA ALA A 8 21.663 -30.580 -0.349 1.00 0.39 C ATOM 119 C ALA A 8 22.194 -29.238 0.157 1.00 0.38 C ATOM 120 O ALA A 8 21.459 -28.427 0.676 1.00 0.38 O ATOM 121 CB ALA A 8 22.074 -31.697 0.618 1.00 0.45 C ATOM 0 H ALA A 8 22.790 -31.705 -1.769 1.00 0.34 H new ATOM 0 HA ALA A 8 20.575 -30.548 -0.413 1.00 0.39 H new ATOM 0 HB1 ALA A 8 21.645 -31.503 1.601 1.00 0.45 H new ATOM 0 HB2 ALA A 8 21.709 -32.654 0.245 1.00 0.45 H new ATOM 0 HB3 ALA A 8 23.161 -31.729 0.696 1.00 0.45 H new ATOM 127 N GLY A 9 23.462 -28.984 -0.016 1.00 0.38 N ATOM 128 CA GLY A 9 24.015 -27.678 0.435 1.00 0.38 C ATOM 129 C GLY A 9 23.343 -26.563 -0.367 1.00 0.34 C ATOM 130 O GLY A 9 22.874 -25.583 0.177 1.00 0.34 O ATOM 0 H GLY A 9 24.134 -29.619 -0.447 1.00 0.38 H new ATOM 0 HA2 GLY A 9 23.836 -27.539 1.501 1.00 0.38 H new ATOM 0 HA3 GLY A 9 25.095 -27.653 0.288 1.00 0.38 H new ATOM 134 N ILE A 10 23.287 -26.718 -1.663 1.00 0.30 N ATOM 135 CA ILE A 10 22.637 -25.685 -2.519 1.00 0.27 C ATOM 136 C ILE A 10 21.173 -25.533 -2.105 1.00 0.25 C ATOM 137 O ILE A 10 20.683 -24.437 -1.914 1.00 0.25 O ATOM 138 CB ILE A 10 22.723 -26.118 -3.984 1.00 0.24 C ATOM 139 CG1 ILE A 10 24.185 -26.076 -4.431 1.00 0.28 C ATOM 140 CG2 ILE A 10 21.895 -25.167 -4.854 1.00 0.25 C ATOM 141 CD1 ILE A 10 24.326 -26.745 -5.799 1.00 0.26 C ATOM 0 H ILE A 10 23.666 -27.520 -2.167 1.00 0.30 H new ATOM 0 HA ILE A 10 23.145 -24.728 -2.396 1.00 0.27 H new ATOM 0 HB ILE A 10 22.333 -27.130 -4.090 1.00 0.24 H new ATOM 0 HG12 ILE A 10 24.530 -25.043 -4.483 1.00 0.28 H new ATOM 0 HG13 ILE A 10 24.813 -26.585 -3.700 1.00 0.28 H new ATOM 0 HG21 ILE A 10 21.959 -25.479 -5.896 1.00 0.25 H new ATOM 0 HG22 ILE A 10 20.854 -25.192 -4.531 1.00 0.25 H new ATOM 0 HG23 ILE A 10 22.282 -24.153 -4.754 1.00 0.25 H new ATOM 0 HD11 ILE A 10 25.369 -26.713 -6.114 1.00 0.26 H new ATOM 0 HD12 ILE A 10 23.999 -27.783 -5.732 1.00 0.26 H new ATOM 0 HD13 ILE A 10 23.711 -26.217 -6.527 1.00 0.26 H new ATOM 153 N VAL A 11 20.468 -26.624 -1.959 1.00 0.25 N ATOM 154 CA VAL A 11 19.037 -26.526 -1.552 1.00 0.27 C ATOM 155 C VAL A 11 18.971 -25.830 -0.191 1.00 0.28 C ATOM 156 O VAL A 11 18.207 -24.906 0.010 1.00 0.28 O ATOM 157 CB VAL A 11 18.437 -27.934 -1.449 1.00 0.30 C ATOM 158 CG1 VAL A 11 17.049 -27.869 -0.803 1.00 0.35 C ATOM 159 CG2 VAL A 11 18.324 -28.536 -2.852 1.00 0.29 C ATOM 0 H VAL A 11 20.818 -27.571 -2.103 1.00 0.25 H new ATOM 0 HA VAL A 11 18.471 -25.956 -2.289 1.00 0.27 H new ATOM 0 HB VAL A 11 19.084 -28.557 -0.831 1.00 0.30 H new ATOM 0 HG11 VAL A 11 16.632 -28.874 -0.735 1.00 0.35 H new ATOM 0 HG12 VAL A 11 17.132 -27.442 0.196 1.00 0.35 H new ATOM 0 HG13 VAL A 11 16.394 -27.245 -1.411 1.00 0.35 H new ATOM 0 HG21 VAL A 11 17.898 -29.537 -2.785 1.00 0.29 H new ATOM 0 HG22 VAL A 11 17.679 -27.908 -3.467 1.00 0.29 H new ATOM 0 HG23 VAL A 11 19.314 -28.592 -3.305 1.00 0.29 H new ATOM 169 N GLN A 12 19.785 -26.257 0.736 1.00 0.31 N ATOM 170 CA GLN A 12 19.800 -25.612 2.081 1.00 0.34 C ATOM 171 C GLN A 12 20.161 -24.135 1.928 1.00 0.31 C ATOM 172 O GLN A 12 19.608 -23.278 2.589 1.00 0.32 O ATOM 173 CB GLN A 12 20.832 -26.308 2.971 1.00 0.39 C ATOM 174 CG GLN A 12 20.327 -27.703 3.345 1.00 1.19 C ATOM 175 CD GLN A 12 19.175 -27.579 4.342 1.00 1.63 C ATOM 176 OE1 GLN A 12 18.120 -28.148 4.142 1.00 1.99 O ATOM 177 NE2 GLN A 12 19.333 -26.858 5.419 1.00 2.40 N ATOM 0 H GLN A 12 20.443 -27.028 0.620 1.00 0.31 H new ATOM 0 HA GLN A 12 18.815 -25.699 2.540 1.00 0.34 H new ATOM 0 HB2 GLN A 12 21.786 -26.383 2.449 1.00 0.39 H new ATOM 0 HB3 GLN A 12 21.007 -25.720 3.872 1.00 0.39 H new ATOM 0 HG2 GLN A 12 19.994 -28.232 2.452 1.00 1.19 H new ATOM 0 HG3 GLN A 12 21.136 -28.290 3.780 1.00 1.19 H new ATOM 0 HE21 GLN A 12 20.218 -26.380 5.588 1.00 2.40 H new ATOM 0 HE22 GLN A 12 18.571 -26.773 6.092 1.00 2.40 H new ATOM 186 N GLN A 13 21.091 -23.828 1.062 1.00 0.29 N ATOM 187 CA GLN A 13 21.488 -22.406 0.872 1.00 0.28 C ATOM 188 C GLN A 13 20.265 -21.607 0.419 1.00 0.24 C ATOM 189 O GLN A 13 20.014 -20.517 0.893 1.00 0.25 O ATOM 190 CB GLN A 13 22.581 -22.326 -0.198 1.00 0.28 C ATOM 191 CG GLN A 13 23.123 -20.897 -0.288 1.00 0.30 C ATOM 192 CD GLN A 13 23.889 -20.558 0.993 1.00 0.38 C ATOM 193 OE1 GLN A 13 24.165 -21.427 1.796 1.00 0.84 O ATOM 194 NE2 GLN A 13 24.257 -19.326 1.211 1.00 0.63 N ATOM 0 H GLN A 13 21.591 -24.501 0.480 1.00 0.29 H new ATOM 0 HA GLN A 13 21.868 -21.995 1.807 1.00 0.28 H new ATOM 0 HB2 GLN A 13 23.390 -23.016 0.044 1.00 0.28 H new ATOM 0 HB3 GLN A 13 22.179 -22.633 -1.164 1.00 0.28 H new ATOM 0 HG2 GLN A 13 23.779 -20.800 -1.153 1.00 0.30 H new ATOM 0 HG3 GLN A 13 22.302 -20.194 -0.430 1.00 0.30 H new ATOM 0 HE21 GLN A 13 24.025 -18.597 0.536 1.00 0.63 H new ATOM 0 HE22 GLN A 13 24.777 -19.091 2.056 1.00 0.63 H new ATOM 203 N GLN A 14 19.492 -22.146 -0.485 1.00 0.22 N ATOM 204 CA GLN A 14 18.278 -21.419 -0.950 1.00 0.20 C ATOM 205 C GLN A 14 17.327 -21.220 0.230 1.00 0.22 C ATOM 206 O GLN A 14 16.718 -20.179 0.378 1.00 0.21 O ATOM 207 CB GLN A 14 17.575 -22.223 -2.046 1.00 0.20 C ATOM 208 CG GLN A 14 18.427 -22.206 -3.316 1.00 0.18 C ATOM 209 CD GLN A 14 17.724 -23.007 -4.412 1.00 0.19 C ATOM 210 OE1 GLN A 14 17.479 -22.440 -5.561 1.00 0.29 O flip ATOM 211 NE2 GLN A 14 17.391 -24.160 -4.219 1.00 0.23 N flip ATOM 0 H GLN A 14 19.649 -23.055 -0.920 1.00 0.22 H new ATOM 0 HA GLN A 14 18.570 -20.450 -1.354 1.00 0.20 H new ATOM 0 HB2 GLN A 14 17.417 -23.249 -1.715 1.00 0.20 H new ATOM 0 HB3 GLN A 14 16.592 -21.799 -2.249 1.00 0.20 H new ATOM 0 HG2 GLN A 14 18.586 -21.179 -3.646 1.00 0.18 H new ATOM 0 HG3 GLN A 14 19.410 -22.632 -3.113 1.00 0.18 H new ATOM 0 HE21 GLN A 14 17.583 -24.603 -3.320 1.00 0.23 H new ATOM 0 HE22 GLN A 14 16.920 -24.685 -4.956 1.00 0.23 H new ATOM 220 N GLN A 15 17.193 -22.209 1.073 1.00 0.26 N ATOM 221 CA GLN A 15 16.279 -22.066 2.241 1.00 0.29 C ATOM 222 C GLN A 15 16.747 -20.894 3.104 1.00 0.28 C ATOM 223 O GLN A 15 15.966 -20.049 3.496 1.00 0.29 O ATOM 224 CB GLN A 15 16.296 -23.360 3.065 1.00 0.34 C ATOM 225 CG GLN A 15 15.357 -23.224 4.269 1.00 0.38 C ATOM 226 CD GLN A 15 15.335 -24.539 5.051 1.00 0.44 C ATOM 227 OE1 GLN A 15 16.370 -25.107 5.340 1.00 0.81 O ATOM 228 NE2 GLN A 15 14.188 -25.053 5.405 1.00 0.81 N ATOM 0 H GLN A 15 17.675 -23.105 1.003 1.00 0.26 H new ATOM 0 HA GLN A 15 15.263 -21.877 1.894 1.00 0.29 H new ATOM 0 HB2 GLN A 15 15.986 -24.201 2.444 1.00 0.34 H new ATOM 0 HB3 GLN A 15 17.310 -23.571 3.405 1.00 0.34 H new ATOM 0 HG2 GLN A 15 15.691 -22.411 4.914 1.00 0.38 H new ATOM 0 HG3 GLN A 15 14.351 -22.972 3.933 1.00 0.38 H new ATOM 0 HE21 GLN A 15 13.319 -24.577 5.163 1.00 0.81 H new ATOM 0 HE22 GLN A 15 14.161 -25.931 5.924 1.00 0.81 H new ATOM 237 N GLN A 16 18.015 -20.832 3.405 1.00 0.28 N ATOM 238 CA GLN A 16 18.518 -19.708 4.239 1.00 0.29 C ATOM 239 C GLN A 16 18.241 -18.388 3.520 1.00 0.25 C ATOM 240 O GLN A 16 17.800 -17.426 4.115 1.00 0.25 O ATOM 241 CB GLN A 16 20.021 -19.874 4.466 1.00 0.31 C ATOM 242 CG GLN A 16 20.257 -21.066 5.396 1.00 0.36 C ATOM 243 CD GLN A 16 21.758 -21.251 5.620 1.00 0.39 C ATOM 244 OE1 GLN A 16 22.219 -22.354 5.837 1.00 0.92 O ATOM 245 NE2 GLN A 16 22.547 -20.214 5.567 1.00 0.87 N ATOM 0 H GLN A 16 18.720 -21.508 3.111 1.00 0.28 H new ATOM 0 HA GLN A 16 18.011 -19.707 5.204 1.00 0.29 H new ATOM 0 HB2 GLN A 16 20.530 -20.032 3.515 1.00 0.31 H new ATOM 0 HB3 GLN A 16 20.438 -18.967 4.904 1.00 0.31 H new ATOM 0 HG2 GLN A 16 19.754 -20.902 6.349 1.00 0.36 H new ATOM 0 HG3 GLN A 16 19.830 -21.970 4.961 1.00 0.36 H new ATOM 0 HE21 GLN A 16 22.160 -19.288 5.385 1.00 0.87 H new ATOM 0 HE22 GLN A 16 23.551 -20.329 5.708 1.00 0.87 H new ATOM 254 N LEU A 17 18.484 -18.335 2.236 1.00 0.22 N ATOM 255 CA LEU A 17 18.217 -17.077 1.489 1.00 0.19 C ATOM 256 C LEU A 17 16.723 -16.765 1.572 1.00 0.18 C ATOM 257 O LEU A 17 16.323 -15.645 1.816 1.00 0.18 O ATOM 258 CB LEU A 17 18.627 -17.250 0.021 1.00 0.16 C ATOM 259 CG LEU A 17 20.158 -17.356 -0.090 1.00 0.18 C ATOM 260 CD1 LEU A 17 20.531 -17.768 -1.517 1.00 0.18 C ATOM 261 CD2 LEU A 17 20.823 -16.004 0.240 1.00 0.20 C ATOM 0 H LEU A 17 18.853 -19.105 1.678 1.00 0.22 H new ATOM 0 HA LEU A 17 18.792 -16.259 1.923 1.00 0.19 H new ATOM 0 HB2 LEU A 17 18.162 -18.145 -0.392 1.00 0.16 H new ATOM 0 HB3 LEU A 17 18.269 -16.405 -0.567 1.00 0.16 H new ATOM 0 HG LEU A 17 20.511 -18.102 0.622 1.00 0.18 H new ATOM 0 HD11 LEU A 17 21.615 -17.845 -1.602 1.00 0.18 H new ATOM 0 HD12 LEU A 17 20.080 -18.733 -1.747 1.00 0.18 H new ATOM 0 HD13 LEU A 17 20.164 -17.020 -2.219 1.00 0.18 H new ATOM 0 HD21 LEU A 17 21.905 -16.101 0.156 1.00 0.20 H new ATOM 0 HD22 LEU A 17 20.471 -15.245 -0.459 1.00 0.20 H new ATOM 0 HD23 LEU A 17 20.563 -15.709 1.257 1.00 0.20 H new ATOM 273 N LEU A 18 15.893 -17.757 1.385 1.00 0.19 N ATOM 274 CA LEU A 18 14.425 -17.524 1.472 1.00 0.20 C ATOM 275 C LEU A 18 14.081 -17.012 2.870 1.00 0.22 C ATOM 276 O LEU A 18 13.310 -16.087 3.030 1.00 0.22 O ATOM 277 CB LEU A 18 13.679 -18.836 1.195 1.00 0.22 C ATOM 278 CG LEU A 18 12.158 -18.622 1.280 1.00 0.25 C ATOM 279 CD1 LEU A 18 11.700 -17.589 0.239 1.00 0.26 C ATOM 280 CD2 LEU A 18 11.456 -19.961 1.021 1.00 0.29 C ATOM 0 H LEU A 18 16.169 -18.716 1.176 1.00 0.19 H new ATOM 0 HA LEU A 18 14.124 -16.783 0.731 1.00 0.20 H new ATOM 0 HB2 LEU A 18 13.944 -19.210 0.206 1.00 0.22 H new ATOM 0 HB3 LEU A 18 13.986 -19.594 1.915 1.00 0.22 H new ATOM 0 HG LEU A 18 11.902 -18.248 2.271 1.00 0.25 H new ATOM 0 HD11 LEU A 18 10.621 -17.451 0.314 1.00 0.26 H new ATOM 0 HD12 LEU A 18 12.201 -16.639 0.424 1.00 0.26 H new ATOM 0 HD13 LEU A 18 11.952 -17.944 -0.761 1.00 0.26 H new ATOM 0 HD21 LEU A 18 10.376 -19.823 1.079 1.00 0.29 H new ATOM 0 HD22 LEU A 18 11.723 -20.326 0.029 1.00 0.29 H new ATOM 0 HD23 LEU A 18 11.769 -20.687 1.771 1.00 0.29 H new ATOM 292 N ASP A 19 14.643 -17.610 3.889 1.00 0.25 N ATOM 293 CA ASP A 19 14.335 -17.152 5.271 1.00 0.28 C ATOM 294 C ASP A 19 14.747 -15.687 5.410 1.00 0.26 C ATOM 295 O ASP A 19 13.978 -14.860 5.853 1.00 0.27 O ATOM 296 CB ASP A 19 15.115 -18.004 6.279 1.00 0.32 C ATOM 297 CG ASP A 19 14.799 -17.548 7.709 1.00 0.36 C ATOM 298 OD1 ASP A 19 14.380 -16.415 7.875 1.00 1.12 O ATOM 299 OD2 ASP A 19 14.977 -18.346 8.616 1.00 1.13 O ATOM 0 H ASP A 19 15.297 -18.390 3.822 1.00 0.25 H new ATOM 0 HA ASP A 19 13.268 -17.255 5.466 1.00 0.28 H new ATOM 0 HB2 ASP A 19 14.854 -19.055 6.158 1.00 0.32 H new ATOM 0 HB3 ASP A 19 16.185 -17.918 6.089 1.00 0.32 H new ATOM 304 N VAL A 20 15.948 -15.350 5.025 1.00 0.25 N ATOM 305 CA VAL A 20 16.380 -13.930 5.135 1.00 0.24 C ATOM 306 C VAL A 20 15.452 -13.052 4.292 1.00 0.21 C ATOM 307 O VAL A 20 15.021 -12.003 4.724 1.00 0.22 O ATOM 308 CB VAL A 20 17.828 -13.781 4.652 1.00 0.24 C ATOM 309 CG1 VAL A 20 18.183 -12.293 4.532 1.00 0.24 C ATOM 310 CG2 VAL A 20 18.765 -14.442 5.665 1.00 0.30 C ATOM 0 H VAL A 20 16.643 -15.991 4.642 1.00 0.25 H new ATOM 0 HA VAL A 20 16.327 -13.616 6.177 1.00 0.24 H new ATOM 0 HB VAL A 20 17.937 -14.258 3.678 1.00 0.24 H new ATOM 0 HG11 VAL A 20 19.212 -12.191 4.189 1.00 0.24 H new ATOM 0 HG12 VAL A 20 17.513 -11.816 3.817 1.00 0.24 H new ATOM 0 HG13 VAL A 20 18.076 -11.814 5.505 1.00 0.24 H new ATOM 0 HG21 VAL A 20 19.796 -14.340 5.327 1.00 0.30 H new ATOM 0 HG22 VAL A 20 18.651 -13.959 6.635 1.00 0.30 H new ATOM 0 HG23 VAL A 20 18.516 -15.499 5.755 1.00 0.30 H new ATOM 320 N VAL A 21 15.138 -13.465 3.095 1.00 0.18 N ATOM 321 CA VAL A 21 14.241 -12.637 2.246 1.00 0.17 C ATOM 322 C VAL A 21 12.901 -12.473 2.969 1.00 0.22 C ATOM 323 O VAL A 21 12.354 -11.390 3.041 1.00 0.21 O ATOM 324 CB VAL A 21 14.043 -13.321 0.888 1.00 0.17 C ATOM 325 CG1 VAL A 21 12.961 -12.596 0.087 1.00 0.20 C ATOM 326 CG2 VAL A 21 15.358 -13.273 0.103 1.00 0.14 C ATOM 0 H VAL A 21 15.462 -14.335 2.672 1.00 0.18 H new ATOM 0 HA VAL A 21 14.681 -11.655 2.073 1.00 0.17 H new ATOM 0 HB VAL A 21 13.739 -14.355 1.052 1.00 0.17 H new ATOM 0 HG11 VAL A 21 12.828 -13.090 -0.876 1.00 0.20 H new ATOM 0 HG12 VAL A 21 12.022 -12.620 0.640 1.00 0.20 H new ATOM 0 HG13 VAL A 21 13.260 -11.560 -0.075 1.00 0.20 H new ATOM 0 HG21 VAL A 21 15.223 -13.758 -0.864 1.00 0.14 H new ATOM 0 HG22 VAL A 21 15.653 -12.235 -0.050 1.00 0.14 H new ATOM 0 HG23 VAL A 21 16.136 -13.792 0.664 1.00 0.14 H new ATOM 336 N LYS A 22 12.377 -13.535 3.528 1.00 0.27 N ATOM 337 CA LYS A 22 11.089 -13.422 4.271 1.00 0.32 C ATOM 338 C LYS A 22 11.278 -12.433 5.422 1.00 0.32 C ATOM 339 O LYS A 22 10.439 -11.592 5.679 1.00 0.33 O ATOM 340 CB LYS A 22 10.695 -14.790 4.834 1.00 0.39 C ATOM 341 CG LYS A 22 9.312 -14.702 5.488 1.00 0.46 C ATOM 342 CD LYS A 22 8.927 -16.073 6.049 1.00 0.75 C ATOM 343 CE LYS A 22 7.554 -15.990 6.721 1.00 1.12 C ATOM 344 NZ LYS A 22 7.086 -17.362 7.072 1.00 1.91 N ATOM 0 H LYS A 22 12.784 -14.470 3.501 1.00 0.27 H new ATOM 0 HA LYS A 22 10.303 -13.074 3.601 1.00 0.32 H new ATOM 0 HB2 LYS A 22 10.684 -15.533 4.036 1.00 0.39 H new ATOM 0 HB3 LYS A 22 11.433 -15.119 5.565 1.00 0.39 H new ATOM 0 HG2 LYS A 22 9.322 -13.960 6.286 1.00 0.46 H new ATOM 0 HG3 LYS A 22 8.572 -14.375 4.757 1.00 0.46 H new ATOM 0 HD2 LYS A 22 8.906 -16.811 5.248 1.00 0.75 H new ATOM 0 HD3 LYS A 22 9.675 -16.405 6.769 1.00 0.75 H new ATOM 0 HE2 LYS A 22 7.614 -15.374 7.618 1.00 1.12 H new ATOM 0 HE3 LYS A 22 6.839 -15.511 6.052 1.00 1.12 H new ATOM 0 HZ1 LYS A 22 6.075 -17.452 6.846 1.00 1.91 H new ATOM 0 HZ2 LYS A 22 7.627 -18.063 6.527 1.00 1.91 H new ATOM 0 HZ3 LYS A 22 7.230 -17.528 8.089 1.00 1.91 H new ATOM 358 N ARG A 23 12.387 -12.527 6.112 1.00 0.33 N ATOM 359 CA ARG A 23 12.645 -11.590 7.241 1.00 0.34 C ATOM 360 C ARG A 23 12.738 -10.166 6.695 1.00 0.29 C ATOM 361 O ARG A 23 12.236 -9.232 7.287 1.00 0.29 O ATOM 362 CB ARG A 23 13.960 -11.967 7.932 1.00 0.38 C ATOM 363 CG ARG A 23 13.779 -13.287 8.684 1.00 0.59 C ATOM 364 CD ARG A 23 15.091 -13.665 9.375 1.00 0.93 C ATOM 365 NE ARG A 23 15.018 -15.083 9.863 1.00 0.81 N ATOM 366 CZ ARG A 23 14.083 -15.479 10.686 1.00 1.05 C ATOM 367 NH1 ARG A 23 13.293 -14.612 11.258 1.00 1.68 N ATOM 368 NH2 ARG A 23 13.976 -16.746 10.981 1.00 1.08 N ATOM 0 H ARG A 23 13.123 -13.212 5.940 1.00 0.33 H new ATOM 0 HA ARG A 23 11.832 -11.652 7.965 1.00 0.34 H new ATOM 0 HB2 ARG A 23 14.757 -12.062 7.194 1.00 0.38 H new ATOM 0 HB3 ARG A 23 14.259 -11.180 8.624 1.00 0.38 H new ATOM 0 HG2 ARG A 23 12.982 -13.191 9.421 1.00 0.59 H new ATOM 0 HG3 ARG A 23 13.480 -14.074 7.992 1.00 0.59 H new ATOM 0 HD2 ARG A 23 15.924 -13.552 8.681 1.00 0.93 H new ATOM 0 HD3 ARG A 23 15.279 -12.992 10.211 1.00 0.93 H new ATOM 0 HE ARG A 23 15.716 -15.755 9.544 1.00 0.81 H new ATOM 0 HH11 ARG A 23 13.403 -13.617 11.064 1.00 1.68 H new ATOM 0 HH12 ARG A 23 12.566 -14.930 11.899 1.00 1.68 H new ATOM 0 HH21 ARG A 23 14.620 -17.422 10.570 1.00 1.08 H new ATOM 0 HH22 ARG A 23 13.248 -17.061 11.623 1.00 1.08 H new ATOM 382 N GLN A 24 13.362 -9.993 5.561 1.00 0.24 N ATOM 383 CA GLN A 24 13.460 -8.628 4.984 1.00 0.19 C ATOM 384 C GLN A 24 12.049 -8.093 4.733 1.00 0.19 C ATOM 385 O GLN A 24 11.759 -6.941 4.979 1.00 0.18 O ATOM 386 CB GLN A 24 14.253 -8.664 3.674 1.00 0.16 C ATOM 387 CG GLN A 24 15.732 -8.921 3.985 1.00 0.17 C ATOM 388 CD GLN A 24 16.520 -9.076 2.681 1.00 0.16 C ATOM 389 OE1 GLN A 24 16.017 -9.611 1.714 1.00 0.18 O ATOM 390 NE2 GLN A 24 17.744 -8.625 2.617 1.00 0.18 N ATOM 0 H GLN A 24 13.804 -10.733 5.015 1.00 0.24 H new ATOM 0 HA GLN A 24 13.981 -7.972 5.682 1.00 0.19 H new ATOM 0 HB2 GLN A 24 13.865 -9.447 3.022 1.00 0.16 H new ATOM 0 HB3 GLN A 24 14.140 -7.720 3.141 1.00 0.16 H new ATOM 0 HG2 GLN A 24 16.138 -8.096 4.570 1.00 0.17 H new ATOM 0 HG3 GLN A 24 15.834 -9.821 4.591 1.00 0.17 H new ATOM 0 HE21 GLN A 24 18.165 -8.176 3.430 1.00 0.18 H new ATOM 0 HE22 GLN A 24 18.279 -8.722 1.754 1.00 0.18 H new ATOM 399 N GLN A 25 11.161 -8.928 4.260 1.00 0.21 N ATOM 400 CA GLN A 25 9.767 -8.462 4.012 1.00 0.23 C ATOM 401 C GLN A 25 9.157 -7.969 5.324 1.00 0.25 C ATOM 402 O GLN A 25 8.612 -6.886 5.396 1.00 0.25 O ATOM 403 CB GLN A 25 8.935 -9.621 3.447 1.00 0.28 C ATOM 404 CG GLN A 25 7.483 -9.178 3.222 1.00 0.32 C ATOM 405 CD GLN A 25 7.441 -7.992 2.255 1.00 0.34 C ATOM 406 OE1 GLN A 25 7.139 -8.196 1.004 1.00 1.06 O flip ATOM 407 NE2 GLN A 25 7.679 -6.866 2.646 1.00 1.13 N flip ATOM 0 H GLN A 25 11.340 -9.907 4.036 1.00 0.21 H new ATOM 0 HA GLN A 25 9.774 -7.644 3.292 1.00 0.23 H new ATOM 0 HB2 GLN A 25 9.367 -9.963 2.507 1.00 0.28 H new ATOM 0 HB3 GLN A 25 8.962 -10.466 4.136 1.00 0.28 H new ATOM 0 HG2 GLN A 25 6.900 -10.006 2.820 1.00 0.32 H new ATOM 0 HG3 GLN A 25 7.028 -8.899 4.172 1.00 0.32 H new ATOM 0 HE21 GLN A 25 7.915 -6.705 3.625 1.00 1.13 H new ATOM 0 HE22 GLN A 25 7.642 -6.082 1.995 1.00 1.13 H new ATOM 416 N GLU A 26 9.246 -8.750 6.366 1.00 0.27 N ATOM 417 CA GLU A 26 8.670 -8.310 7.667 1.00 0.29 C ATOM 418 C GLU A 26 9.403 -7.054 8.134 1.00 0.26 C ATOM 419 O GLU A 26 8.806 -6.108 8.610 1.00 0.26 O ATOM 420 CB GLU A 26 8.854 -9.419 8.702 1.00 0.34 C ATOM 421 CG GLU A 26 7.950 -10.598 8.342 1.00 0.54 C ATOM 422 CD GLU A 26 8.128 -11.713 9.373 1.00 1.19 C ATOM 423 OE1 GLU A 26 8.995 -11.576 10.221 1.00 1.85 O ATOM 424 OE2 GLU A 26 7.398 -12.687 9.296 1.00 1.94 O ATOM 0 H GLU A 26 9.690 -9.668 6.373 1.00 0.27 H new ATOM 0 HA GLU A 26 7.608 -8.096 7.549 1.00 0.29 H new ATOM 0 HB2 GLU A 26 9.896 -9.739 8.728 1.00 0.34 H new ATOM 0 HB3 GLU A 26 8.609 -9.048 9.697 1.00 0.34 H new ATOM 0 HG2 GLU A 26 6.909 -10.276 8.315 1.00 0.54 H new ATOM 0 HG3 GLU A 26 8.195 -10.967 7.346 1.00 0.54 H new ATOM 431 N LEU A 27 10.698 -7.037 7.980 1.00 0.24 N ATOM 432 CA LEU A 27 11.494 -5.848 8.389 1.00 0.22 C ATOM 433 C LEU A 27 11.099 -4.661 7.515 1.00 0.19 C ATOM 434 O LEU A 27 10.977 -3.544 7.977 1.00 0.19 O ATOM 435 CB LEU A 27 12.982 -6.159 8.225 1.00 0.22 C ATOM 436 CG LEU A 27 13.831 -4.906 8.475 1.00 0.22 C ATOM 437 CD1 LEU A 27 13.461 -4.275 9.822 1.00 0.25 C ATOM 438 CD2 LEU A 27 15.315 -5.299 8.488 1.00 0.23 C ATOM 0 H LEU A 27 11.243 -7.803 7.585 1.00 0.24 H new ATOM 0 HA LEU A 27 11.298 -5.603 9.433 1.00 0.22 H new ATOM 0 HB2 LEU A 27 13.273 -6.946 8.921 1.00 0.22 H new ATOM 0 HB3 LEU A 27 13.171 -6.537 7.220 1.00 0.22 H new ATOM 0 HG LEU A 27 13.643 -4.182 7.682 1.00 0.22 H new ATOM 0 HD11 LEU A 27 14.071 -3.387 9.987 1.00 0.25 H new ATOM 0 HD12 LEU A 27 12.407 -3.996 9.816 1.00 0.25 H new ATOM 0 HD13 LEU A 27 13.642 -4.993 10.622 1.00 0.25 H new ATOM 0 HD21 LEU A 27 15.925 -4.413 8.665 1.00 0.23 H new ATOM 0 HD22 LEU A 27 15.492 -6.026 9.281 1.00 0.23 H new ATOM 0 HD23 LEU A 27 15.584 -5.738 7.527 1.00 0.23 H new ATOM 450 N LEU A 28 10.895 -4.900 6.251 1.00 0.18 N ATOM 451 CA LEU A 28 10.501 -3.794 5.341 1.00 0.18 C ATOM 452 C LEU A 28 9.187 -3.198 5.837 1.00 0.20 C ATOM 453 O LEU A 28 8.998 -1.999 5.833 1.00 0.20 O ATOM 454 CB LEU A 28 10.327 -4.355 3.921 1.00 0.18 C ATOM 455 CG LEU A 28 11.708 -4.561 3.263 1.00 0.18 C ATOM 456 CD1 LEU A 28 11.603 -5.584 2.117 1.00 0.21 C ATOM 457 CD2 LEU A 28 12.223 -3.228 2.693 1.00 0.22 C ATOM 0 H LEU A 28 10.985 -5.815 5.809 1.00 0.18 H new ATOM 0 HA LEU A 28 11.266 -3.018 5.326 1.00 0.18 H new ATOM 0 HB2 LEU A 28 9.788 -5.302 3.958 1.00 0.18 H new ATOM 0 HB3 LEU A 28 9.728 -3.670 3.321 1.00 0.18 H new ATOM 0 HG LEU A 28 12.399 -4.930 4.021 1.00 0.18 H new ATOM 0 HD11 LEU A 28 12.583 -5.721 1.661 1.00 0.21 H new ATOM 0 HD12 LEU A 28 11.250 -6.537 2.511 1.00 0.21 H new ATOM 0 HD13 LEU A 28 10.901 -5.219 1.367 1.00 0.21 H new ATOM 0 HD21 LEU A 28 13.198 -3.382 2.231 1.00 0.22 H new ATOM 0 HD22 LEU A 28 11.522 -2.857 1.946 1.00 0.22 H new ATOM 0 HD23 LEU A 28 12.315 -2.499 3.498 1.00 0.22 H new ATOM 469 N ARG A 29 8.281 -4.023 6.280 1.00 0.22 N ATOM 470 CA ARG A 29 6.992 -3.491 6.791 1.00 0.24 C ATOM 471 C ARG A 29 7.258 -2.578 7.994 1.00 0.24 C ATOM 472 O ARG A 29 6.635 -1.546 8.149 1.00 0.24 O ATOM 473 CB ARG A 29 6.096 -4.651 7.231 1.00 0.27 C ATOM 474 CG ARG A 29 5.624 -5.429 6.001 1.00 0.29 C ATOM 475 CD ARG A 29 4.709 -6.571 6.445 1.00 0.33 C ATOM 476 NE ARG A 29 4.410 -7.452 5.282 1.00 0.38 N ATOM 477 CZ ARG A 29 3.907 -8.639 5.478 1.00 0.88 C ATOM 478 NH1 ARG A 29 3.652 -9.045 6.693 1.00 1.83 N ATOM 479 NH2 ARG A 29 3.653 -9.417 4.463 1.00 0.86 N ATOM 0 H ARG A 29 8.378 -5.038 6.310 1.00 0.22 H new ATOM 0 HA ARG A 29 6.497 -2.926 6.001 1.00 0.24 H new ATOM 0 HB2 ARG A 29 6.643 -5.311 7.904 1.00 0.27 H new ATOM 0 HB3 ARG A 29 5.238 -4.271 7.785 1.00 0.27 H new ATOM 0 HG2 ARG A 29 5.092 -4.766 5.319 1.00 0.29 H new ATOM 0 HG3 ARG A 29 6.481 -5.825 5.456 1.00 0.29 H new ATOM 0 HD2 ARG A 29 5.188 -7.147 7.237 1.00 0.33 H new ATOM 0 HD3 ARG A 29 3.783 -6.170 6.858 1.00 0.33 H new ATOM 0 HE ARG A 29 4.598 -7.127 4.334 1.00 0.38 H new ATOM 0 HH11 ARG A 29 3.846 -8.434 7.486 1.00 1.83 H new ATOM 0 HH12 ARG A 29 3.259 -9.973 6.849 1.00 1.83 H new ATOM 0 HH21 ARG A 29 3.848 -9.097 3.514 1.00 0.86 H new ATOM 0 HH22 ARG A 29 3.260 -10.345 4.618 1.00 0.86 H new ATOM 493 N LEU A 30 8.177 -2.951 8.850 1.00 0.23 N ATOM 494 CA LEU A 30 8.468 -2.099 10.043 1.00 0.23 C ATOM 495 C LEU A 30 8.948 -0.717 9.591 1.00 0.21 C ATOM 496 O LEU A 30 8.576 0.291 10.157 1.00 0.22 O ATOM 497 CB LEU A 30 9.573 -2.740 10.895 1.00 0.24 C ATOM 498 CG LEU A 30 9.150 -4.132 11.386 1.00 0.27 C ATOM 499 CD1 LEU A 30 10.287 -4.738 12.214 1.00 0.29 C ATOM 500 CD2 LEU A 30 7.880 -4.029 12.249 1.00 0.33 C ATOM 0 H LEU A 30 8.734 -3.802 8.775 1.00 0.23 H new ATOM 0 HA LEU A 30 7.554 -2.006 10.630 1.00 0.23 H new ATOM 0 HB2 LEU A 30 10.489 -2.820 10.309 1.00 0.24 H new ATOM 0 HB3 LEU A 30 9.795 -2.101 11.749 1.00 0.24 H new ATOM 0 HG LEU A 30 8.938 -4.768 10.526 1.00 0.27 H new ATOM 0 HD11 LEU A 30 9.994 -5.727 12.566 1.00 0.29 H new ATOM 0 HD12 LEU A 30 11.181 -4.823 11.597 1.00 0.29 H new ATOM 0 HD13 LEU A 30 10.497 -4.096 13.069 1.00 0.29 H new ATOM 0 HD21 LEU A 30 7.591 -5.023 12.591 1.00 0.33 H new ATOM 0 HD22 LEU A 30 8.077 -3.392 13.111 1.00 0.33 H new ATOM 0 HD23 LEU A 30 7.072 -3.599 11.657 1.00 0.33 H new ATOM 512 N THR A 31 9.777 -0.659 8.581 1.00 0.19 N ATOM 513 CA THR A 31 10.276 0.668 8.117 1.00 0.17 C ATOM 514 C THR A 31 9.109 1.491 7.579 1.00 0.17 C ATOM 515 O THR A 31 9.014 2.680 7.811 1.00 0.17 O ATOM 516 CB THR A 31 11.308 0.471 7.005 1.00 0.17 C ATOM 517 OG1 THR A 31 10.712 -0.240 5.929 1.00 0.18 O ATOM 518 CG2 THR A 31 12.505 -0.315 7.540 1.00 0.19 C ATOM 0 H THR A 31 10.127 -1.465 8.062 1.00 0.19 H new ATOM 0 HA THR A 31 10.739 1.190 8.954 1.00 0.17 H new ATOM 0 HB THR A 31 11.650 1.445 6.654 1.00 0.17 H new ATOM 0 HG1 THR A 31 10.355 -1.091 6.257 1.00 0.18 H new ATOM 0 HG21 THR A 31 13.236 -0.452 6.743 1.00 0.19 H new ATOM 0 HG22 THR A 31 12.963 0.235 8.362 1.00 0.19 H new ATOM 0 HG23 THR A 31 12.171 -1.289 7.897 1.00 0.19 H new ATOM 526 N VAL A 32 8.215 0.865 6.871 1.00 0.18 N ATOM 527 CA VAL A 32 7.048 1.603 6.325 1.00 0.19 C ATOM 528 C VAL A 32 6.210 2.115 7.498 1.00 0.20 C ATOM 529 O VAL A 32 5.714 3.224 7.492 1.00 0.20 O ATOM 530 CB VAL A 32 6.215 0.644 5.470 1.00 0.21 C ATOM 531 CG1 VAL A 32 4.931 1.337 5.008 1.00 0.23 C ATOM 532 CG2 VAL A 32 7.032 0.201 4.251 1.00 0.22 C ATOM 0 H VAL A 32 8.243 -0.130 6.646 1.00 0.18 H new ATOM 0 HA VAL A 32 7.374 2.443 5.711 1.00 0.19 H new ATOM 0 HB VAL A 32 5.952 -0.230 6.066 1.00 0.21 H new ATOM 0 HG11 VAL A 32 4.344 0.648 4.400 1.00 0.23 H new ATOM 0 HG12 VAL A 32 4.348 1.641 5.878 1.00 0.23 H new ATOM 0 HG13 VAL A 32 5.185 2.217 4.416 1.00 0.23 H new ATOM 0 HG21 VAL A 32 6.438 -0.482 3.643 1.00 0.22 H new ATOM 0 HG22 VAL A 32 7.302 1.074 3.657 1.00 0.22 H new ATOM 0 HG23 VAL A 32 7.938 -0.305 4.585 1.00 0.22 H new ATOM 542 N TRP A 33 6.062 1.301 8.507 1.00 0.21 N ATOM 543 CA TRP A 33 5.269 1.708 9.698 1.00 0.23 C ATOM 544 C TRP A 33 5.886 2.954 10.340 1.00 0.22 C ATOM 545 O TRP A 33 5.200 3.917 10.623 1.00 0.23 O ATOM 546 CB TRP A 33 5.261 0.558 10.705 1.00 0.25 C ATOM 547 CG TRP A 33 4.481 0.954 11.915 1.00 0.27 C ATOM 548 CD1 TRP A 33 3.136 0.880 12.034 1.00 0.32 C ATOM 549 CD2 TRP A 33 4.976 1.480 13.180 1.00 0.27 C ATOM 550 NE1 TRP A 33 2.773 1.326 13.292 1.00 0.33 N ATOM 551 CE2 TRP A 33 3.874 1.707 14.036 1.00 0.31 C ATOM 552 CE3 TRP A 33 6.264 1.779 13.661 1.00 0.26 C ATOM 553 CZ2 TRP A 33 4.043 2.213 15.326 1.00 0.32 C ATOM 554 CZ3 TRP A 33 6.438 2.288 14.957 1.00 0.28 C ATOM 555 CH2 TRP A 33 5.329 2.505 15.788 1.00 0.31 C ATOM 0 H TRP A 33 6.461 0.363 8.556 1.00 0.21 H new ATOM 0 HA TRP A 33 4.249 1.941 9.394 1.00 0.23 H new ATOM 0 HB2 TRP A 33 4.822 -0.331 10.253 1.00 0.25 H new ATOM 0 HB3 TRP A 33 6.282 0.301 10.987 1.00 0.25 H new ATOM 0 HD1 TRP A 33 2.456 0.530 11.271 1.00 0.32 H new ATOM 0 HE1 TRP A 33 1.811 1.369 13.629 1.00 0.33 H new ATOM 0 HE3 TRP A 33 7.124 1.616 13.029 1.00 0.26 H new ATOM 0 HZ2 TRP A 33 3.186 2.378 15.962 1.00 0.32 H new ATOM 0 HZ3 TRP A 33 7.431 2.514 15.317 1.00 0.28 H new ATOM 0 HH2 TRP A 33 5.469 2.898 16.784 1.00 0.31 H new ATOM 566 N GLY A 34 7.171 2.948 10.588 1.00 0.22 N ATOM 567 CA GLY A 34 7.802 4.132 11.218 1.00 0.23 C ATOM 568 C GLY A 34 7.626 5.353 10.318 1.00 0.22 C ATOM 569 O GLY A 34 7.148 6.382 10.741 1.00 0.23 O ATOM 0 H GLY A 34 7.803 2.175 10.380 1.00 0.22 H new ATOM 0 HA2 GLY A 34 7.352 4.320 12.193 1.00 0.23 H new ATOM 0 HA3 GLY A 34 8.862 3.943 11.387 1.00 0.23 H new ATOM 573 N THR A 35 8.010 5.247 9.078 1.00 0.22 N ATOM 574 CA THR A 35 7.875 6.406 8.153 1.00 0.24 C ATOM 575 C THR A 35 6.405 6.819 8.039 1.00 0.23 C ATOM 576 O THR A 35 6.063 7.980 8.170 1.00 0.24 O ATOM 577 CB THR A 35 8.403 6.000 6.773 1.00 0.27 C ATOM 578 OG1 THR A 35 9.770 5.626 6.883 1.00 0.30 O ATOM 579 CG2 THR A 35 8.278 7.174 5.803 1.00 0.30 C ATOM 0 H THR A 35 8.412 4.406 8.664 1.00 0.22 H new ATOM 0 HA THR A 35 8.447 7.250 8.539 1.00 0.24 H new ATOM 0 HB THR A 35 7.819 5.159 6.398 1.00 0.27 H new ATOM 0 HG1 THR A 35 10.322 6.246 6.361 1.00 0.30 H new ATOM 0 HG21 THR A 35 8.655 6.879 4.824 1.00 0.30 H new ATOM 0 HG22 THR A 35 7.231 7.464 5.716 1.00 0.30 H new ATOM 0 HG23 THR A 35 8.859 8.018 6.176 1.00 0.30 H new ATOM 587 N LYS A 36 5.532 5.885 7.793 1.00 0.25 N ATOM 588 CA LYS A 36 4.091 6.237 7.665 1.00 0.28 C ATOM 589 C LYS A 36 3.576 6.794 8.995 1.00 0.28 C ATOM 590 O LYS A 36 2.814 7.741 9.029 1.00 0.30 O ATOM 591 CB LYS A 36 3.300 4.987 7.287 1.00 0.32 C ATOM 592 CG LYS A 36 1.893 5.395 6.857 1.00 0.46 C ATOM 593 CD LYS A 36 1.101 4.152 6.448 1.00 0.77 C ATOM 594 CE LYS A 36 -0.314 4.558 6.031 1.00 1.44 C ATOM 595 NZ LYS A 36 -1.050 5.084 7.216 1.00 2.00 N ATOM 0 H LYS A 36 5.752 4.896 7.675 1.00 0.25 H new ATOM 0 HA LYS A 36 3.967 6.994 6.891 1.00 0.28 H new ATOM 0 HB2 LYS A 36 3.801 4.456 6.478 1.00 0.32 H new ATOM 0 HB3 LYS A 36 3.250 4.303 8.134 1.00 0.32 H new ATOM 0 HG2 LYS A 36 1.387 5.909 7.674 1.00 0.46 H new ATOM 0 HG3 LYS A 36 1.945 6.096 6.024 1.00 0.46 H new ATOM 0 HD2 LYS A 36 1.602 3.644 5.624 1.00 0.77 H new ATOM 0 HD3 LYS A 36 1.058 3.447 7.278 1.00 0.77 H new ATOM 0 HE2 LYS A 36 -0.271 5.317 5.250 1.00 1.44 H new ATOM 0 HE3 LYS A 36 -0.842 3.701 5.613 1.00 1.44 H new ATOM 0 HZ1 LYS A 36 -2.072 5.073 7.023 1.00 2.00 H new ATOM 0 HZ2 LYS A 36 -0.847 4.487 8.043 1.00 2.00 H new ATOM 0 HZ3 LYS A 36 -0.745 6.059 7.409 1.00 2.00 H new ATOM 609 N ASN A 37 3.991 6.220 10.091 1.00 0.27 N ATOM 610 CA ASN A 37 3.532 6.720 11.418 1.00 0.30 C ATOM 611 C ASN A 37 3.960 8.178 11.581 1.00 0.29 C ATOM 612 O ASN A 37 3.226 9.002 12.091 1.00 0.32 O ATOM 613 CB ASN A 37 4.148 5.877 12.530 1.00 0.32 C ATOM 614 CG ASN A 37 3.647 6.384 13.883 1.00 0.37 C ATOM 615 OD1 ASN A 37 4.503 6.634 14.832 1.00 0.74 O flip ATOM 616 ND2 ASN A 37 2.459 6.556 14.075 1.00 0.47 N flip ATOM 0 H ASN A 37 4.629 5.425 10.125 1.00 0.27 H new ATOM 0 HA ASN A 37 2.446 6.648 11.478 1.00 0.30 H new ATOM 0 HB2 ASN A 37 3.879 4.829 12.399 1.00 0.32 H new ATOM 0 HB3 ASN A 37 5.236 5.935 12.487 1.00 0.32 H new ATOM 0 HD21 ASN A 37 1.789 6.360 13.332 1.00 0.47 H new ATOM 0 HD22 ASN A 37 2.133 6.896 14.979 1.00 0.47 H new ATOM 623 N LEU A 38 5.147 8.505 11.147 1.00 0.26 N ATOM 624 CA LEU A 38 5.629 9.908 11.270 1.00 0.27 C ATOM 625 C LEU A 38 4.689 10.830 10.504 1.00 0.26 C ATOM 626 O LEU A 38 4.392 11.921 10.942 1.00 0.28 O ATOM 627 CB LEU A 38 7.042 10.037 10.698 1.00 0.26 C ATOM 628 CG LEU A 38 8.061 9.353 11.619 1.00 0.30 C ATOM 629 CD1 LEU A 38 9.425 9.354 10.926 1.00 0.33 C ATOM 630 CD2 LEU A 38 8.162 10.103 12.965 1.00 0.35 C ATOM 0 H LEU A 38 5.805 7.858 10.712 1.00 0.26 H new ATOM 0 HA LEU A 38 5.648 10.186 12.324 1.00 0.27 H new ATOM 0 HB2 LEU A 38 7.081 9.587 9.706 1.00 0.26 H new ATOM 0 HB3 LEU A 38 7.298 11.090 10.581 1.00 0.26 H new ATOM 0 HG LEU A 38 7.740 8.331 11.818 1.00 0.30 H new ATOM 0 HD11 LEU A 38 10.160 8.871 11.569 1.00 0.33 H new ATOM 0 HD12 LEU A 38 9.355 8.811 9.983 1.00 0.33 H new ATOM 0 HD13 LEU A 38 9.733 10.381 10.731 1.00 0.33 H new ATOM 0 HD21 LEU A 38 8.889 9.604 13.606 1.00 0.35 H new ATOM 0 HD22 LEU A 38 8.480 11.130 12.786 1.00 0.35 H new ATOM 0 HD23 LEU A 38 7.188 10.105 13.454 1.00 0.35 H new ATOM 642 N GLN A 39 4.220 10.415 9.361 1.00 0.25 N ATOM 643 CA GLN A 39 3.314 11.305 8.590 1.00 0.29 C ATOM 644 C GLN A 39 2.083 11.604 9.447 1.00 0.33 C ATOM 645 O GLN A 39 1.607 12.721 9.485 1.00 0.35 O ATOM 646 CB GLN A 39 2.869 10.597 7.309 1.00 0.32 C ATOM 647 CG GLN A 39 2.007 11.545 6.471 1.00 0.40 C ATOM 648 CD GLN A 39 1.558 10.834 5.193 1.00 0.45 C ATOM 649 OE1 GLN A 39 1.136 9.696 5.235 1.00 0.85 O ATOM 650 NE2 GLN A 39 1.629 11.461 4.051 1.00 0.97 N ATOM 0 H GLN A 39 4.422 9.511 8.933 1.00 0.25 H new ATOM 0 HA GLN A 39 3.832 12.229 8.332 1.00 0.29 H new ATOM 0 HB2 GLN A 39 3.740 10.279 6.736 1.00 0.32 H new ATOM 0 HB3 GLN A 39 2.304 9.698 7.556 1.00 0.32 H new ATOM 0 HG2 GLN A 39 1.138 11.866 7.045 1.00 0.40 H new ATOM 0 HG3 GLN A 39 2.573 12.442 6.221 1.00 0.40 H new ATOM 0 HE21 GLN A 39 1.983 12.417 4.015 1.00 0.97 H new ATOM 0 HE22 GLN A 39 1.330 10.995 3.194 1.00 0.97 H new ATOM 659 N THR A 40 1.575 10.632 10.158 1.00 0.36 N ATOM 660 CA THR A 40 0.394 10.908 11.022 1.00 0.42 C ATOM 661 C THR A 40 0.788 11.981 12.039 1.00 0.41 C ATOM 662 O THR A 40 0.046 12.906 12.299 1.00 0.43 O ATOM 663 CB THR A 40 -0.034 9.629 11.747 1.00 0.47 C ATOM 664 OG1 THR A 40 0.955 9.268 12.700 1.00 0.46 O ATOM 665 CG2 THR A 40 -0.205 8.502 10.728 1.00 0.49 C ATOM 0 H THR A 40 1.922 9.673 10.178 1.00 0.36 H new ATOM 0 HA THR A 40 -0.443 11.255 10.416 1.00 0.42 H new ATOM 0 HB THR A 40 -0.980 9.800 12.260 1.00 0.47 H new ATOM 0 HG1 THR A 40 1.800 9.082 12.240 1.00 0.46 H new ATOM 0 HG21 THR A 40 -0.510 7.590 11.242 1.00 0.49 H new ATOM 0 HG22 THR A 40 -0.968 8.781 10.001 1.00 0.49 H new ATOM 0 HG23 THR A 40 0.740 8.330 10.214 1.00 0.49 H new ATOM 673 N ARG A 41 1.971 11.886 12.588 1.00 0.39 N ATOM 674 CA ARG A 41 2.423 12.926 13.553 1.00 0.39 C ATOM 675 C ARG A 41 2.545 14.251 12.815 1.00 0.36 C ATOM 676 O ARG A 41 2.191 15.291 13.328 1.00 0.37 O ATOM 677 CB ARG A 41 3.772 12.557 14.175 1.00 0.43 C ATOM 678 CG ARG A 41 3.582 11.383 15.134 1.00 0.55 C ATOM 679 CD ARG A 41 4.867 11.161 15.933 1.00 0.66 C ATOM 680 NE ARG A 41 4.622 10.118 16.976 1.00 0.89 N ATOM 681 CZ ARG A 41 3.718 10.283 17.901 1.00 1.04 C ATOM 682 NH1 ARG A 41 3.151 11.444 18.078 1.00 1.22 N ATOM 683 NH2 ARG A 41 3.424 9.295 18.690 1.00 1.32 N ATOM 0 H ARG A 41 2.639 11.136 12.410 1.00 0.39 H new ATOM 0 HA ARG A 41 1.693 13.002 14.359 1.00 0.39 H new ATOM 0 HB2 ARG A 41 4.485 12.292 13.394 1.00 0.43 H new ATOM 0 HB3 ARG A 41 4.186 13.413 14.708 1.00 0.43 H new ATOM 0 HG2 ARG A 41 2.751 11.584 15.810 1.00 0.55 H new ATOM 0 HG3 ARG A 41 3.328 10.482 14.576 1.00 0.55 H new ATOM 0 HD2 ARG A 41 5.673 10.847 15.269 1.00 0.66 H new ATOM 0 HD3 ARG A 41 5.184 12.093 16.401 1.00 0.66 H new ATOM 0 HE ARG A 41 5.173 9.260 16.964 1.00 0.89 H new ATOM 0 HH11 ARG A 41 3.414 12.235 17.490 1.00 1.22 H new ATOM 0 HH12 ARG A 41 2.445 11.561 18.805 1.00 1.22 H new ATOM 0 HH21 ARG A 41 3.899 8.399 18.584 1.00 1.32 H new ATOM 0 HH22 ARG A 41 2.718 9.415 19.416 1.00 1.32 H new ATOM 697 N VAL A 42 3.042 14.225 11.608 1.00 0.33 N ATOM 698 CA VAL A 42 3.176 15.495 10.858 1.00 0.35 C ATOM 699 C VAL A 42 1.785 16.109 10.707 1.00 0.38 C ATOM 700 O VAL A 42 1.598 17.281 10.942 1.00 0.40 O ATOM 701 CB VAL A 42 3.787 15.226 9.477 1.00 0.37 C ATOM 702 CG1 VAL A 42 3.691 16.488 8.614 1.00 0.43 C ATOM 703 CG2 VAL A 42 5.262 14.847 9.639 1.00 0.38 C ATOM 0 H VAL A 42 3.356 13.387 11.118 1.00 0.33 H new ATOM 0 HA VAL A 42 3.831 16.181 11.394 1.00 0.35 H new ATOM 0 HB VAL A 42 3.243 14.412 8.998 1.00 0.37 H new ATOM 0 HG11 VAL A 42 4.126 16.293 7.634 1.00 0.43 H new ATOM 0 HG12 VAL A 42 2.645 16.770 8.497 1.00 0.43 H new ATOM 0 HG13 VAL A 42 4.234 17.301 9.096 1.00 0.43 H new ATOM 0 HG21 VAL A 42 5.698 14.655 8.659 1.00 0.38 H new ATOM 0 HG22 VAL A 42 5.797 15.665 10.121 1.00 0.38 H new ATOM 0 HG23 VAL A 42 5.342 13.950 10.253 1.00 0.38 H new ATOM 713 N THR A 43 0.799 15.328 10.358 1.00 0.39 N ATOM 714 CA THR A 43 -0.572 15.904 10.234 1.00 0.45 C ATOM 715 C THR A 43 -0.981 16.478 11.589 1.00 0.44 C ATOM 716 O THR A 43 -1.572 17.536 11.674 1.00 0.47 O ATOM 717 CB THR A 43 -1.564 14.811 9.821 1.00 0.50 C ATOM 718 OG1 THR A 43 -1.562 13.775 10.794 1.00 0.50 O ATOM 719 CG2 THR A 43 -1.171 14.240 8.457 1.00 0.51 C ATOM 0 H THR A 43 0.879 14.331 10.156 1.00 0.39 H new ATOM 0 HA THR A 43 -0.576 16.687 9.476 1.00 0.45 H new ATOM 0 HB THR A 43 -2.563 15.240 9.752 1.00 0.50 H new ATOM 0 HG1 THR A 43 -0.684 13.736 11.229 1.00 0.50 H new ATOM 0 HG21 THR A 43 -1.880 13.464 8.170 1.00 0.51 H new ATOM 0 HG22 THR A 43 -1.183 15.036 7.712 1.00 0.51 H new ATOM 0 HG23 THR A 43 -0.170 13.813 8.516 1.00 0.51 H new ATOM 727 N ALA A 44 -0.653 15.796 12.651 1.00 0.42 N ATOM 728 CA ALA A 44 -1.004 16.313 14.004 1.00 0.43 C ATOM 729 C ALA A 44 -0.207 17.596 14.253 1.00 0.39 C ATOM 730 O ALA A 44 -0.715 18.569 14.775 1.00 0.39 O ATOM 731 CB ALA A 44 -0.650 15.262 15.063 1.00 0.45 C ATOM 0 H ALA A 44 -0.158 14.904 12.641 1.00 0.42 H new ATOM 0 HA ALA A 44 -2.072 16.523 14.063 1.00 0.43 H new ATOM 0 HB1 ALA A 44 -0.907 15.641 16.052 1.00 0.45 H new ATOM 0 HB2 ALA A 44 -1.209 14.347 14.869 1.00 0.45 H new ATOM 0 HB3 ALA A 44 0.418 15.050 15.022 1.00 0.45 H new ATOM 737 N ILE A 45 1.036 17.608 13.849 1.00 0.35 N ATOM 738 CA ILE A 45 1.884 18.824 14.016 1.00 0.32 C ATOM 739 C ILE A 45 1.297 19.974 13.195 1.00 0.32 C ATOM 740 O ILE A 45 1.289 21.111 13.624 1.00 0.31 O ATOM 741 CB ILE A 45 3.317 18.530 13.559 1.00 0.31 C ATOM 742 CG1 ILE A 45 3.983 17.581 14.563 1.00 0.32 C ATOM 743 CG2 ILE A 45 4.122 19.829 13.473 1.00 0.30 C ATOM 744 CD1 ILE A 45 5.310 17.058 14.000 1.00 0.33 C ATOM 0 H ILE A 45 1.504 16.818 13.406 1.00 0.35 H new ATOM 0 HA ILE A 45 1.903 19.108 15.068 1.00 0.32 H new ATOM 0 HB ILE A 45 3.289 18.066 12.573 1.00 0.31 H new ATOM 0 HG12 ILE A 45 4.159 18.102 15.504 1.00 0.32 H new ATOM 0 HG13 ILE A 45 3.318 16.745 14.781 1.00 0.32 H new ATOM 0 HG21 ILE A 45 5.138 19.606 13.147 1.00 0.30 H new ATOM 0 HG22 ILE A 45 3.651 20.502 12.757 1.00 0.30 H new ATOM 0 HG23 ILE A 45 4.151 20.305 14.453 1.00 0.30 H new ATOM 0 HD11 ILE A 45 5.772 16.386 14.723 1.00 0.33 H new ATOM 0 HD12 ILE A 45 5.124 16.519 13.071 1.00 0.33 H new ATOM 0 HD13 ILE A 45 5.979 17.897 13.806 1.00 0.33 H new ATOM 756 N GLU A 46 0.816 19.696 12.012 1.00 0.35 N ATOM 757 CA GLU A 46 0.252 20.789 11.174 1.00 0.37 C ATOM 758 C GLU A 46 -0.906 21.421 11.927 1.00 0.38 C ATOM 759 O GLU A 46 -1.066 22.625 11.950 1.00 0.38 O ATOM 760 CB GLU A 46 -0.272 20.214 9.853 1.00 0.44 C ATOM 761 CG GLU A 46 0.896 19.765 8.973 1.00 1.20 C ATOM 762 CD GLU A 46 0.354 19.195 7.661 1.00 1.67 C ATOM 763 OE1 GLU A 46 -0.847 18.996 7.574 1.00 2.17 O ATOM 764 OE2 GLU A 46 1.149 18.961 6.766 1.00 2.26 O ATOM 0 H GLU A 46 0.790 18.766 11.594 1.00 0.35 H new ATOM 0 HA GLU A 46 1.025 21.528 10.964 1.00 0.37 H new ATOM 0 HB2 GLU A 46 -0.933 19.370 10.052 1.00 0.44 H new ATOM 0 HB3 GLU A 46 -0.863 20.965 9.330 1.00 0.44 H new ATOM 0 HG2 GLU A 46 1.558 20.607 8.771 1.00 1.20 H new ATOM 0 HG3 GLU A 46 1.488 19.012 9.492 1.00 1.20 H new ATOM 771 N LYS A 47 -1.700 20.618 12.560 1.00 0.41 N ATOM 772 CA LYS A 47 -2.837 21.163 13.336 1.00 0.44 C ATOM 773 C LYS A 47 -2.316 22.099 14.432 1.00 0.41 C ATOM 774 O LYS A 47 -2.810 23.194 14.612 1.00 0.42 O ATOM 775 CB LYS A 47 -3.613 19.992 13.949 1.00 0.48 C ATOM 776 CG LYS A 47 -4.737 20.497 14.858 1.00 1.21 C ATOM 777 CD LYS A 47 -5.714 21.372 14.062 1.00 1.55 C ATOM 778 CE LYS A 47 -7.029 21.506 14.833 1.00 2.31 C ATOM 779 NZ LYS A 47 -7.900 22.510 14.157 1.00 2.88 N ATOM 0 H LYS A 47 -1.611 19.602 12.574 1.00 0.41 H new ATOM 0 HA LYS A 47 -3.498 21.736 12.686 1.00 0.44 H new ATOM 0 HB2 LYS A 47 -4.032 19.373 13.156 1.00 0.48 H new ATOM 0 HB3 LYS A 47 -2.934 19.360 14.521 1.00 0.48 H new ATOM 0 HG2 LYS A 47 -5.268 19.651 15.294 1.00 1.21 H new ATOM 0 HG3 LYS A 47 -4.316 21.070 15.684 1.00 1.21 H new ATOM 0 HD2 LYS A 47 -5.279 22.357 13.891 1.00 1.55 H new ATOM 0 HD3 LYS A 47 -5.898 20.930 13.083 1.00 1.55 H new ATOM 0 HE2 LYS A 47 -7.536 20.542 14.880 1.00 2.31 H new ATOM 0 HE3 LYS A 47 -6.831 21.813 15.860 1.00 2.31 H new ATOM 0 HZ1 LYS A 47 -8.794 22.602 14.680 1.00 2.88 H new ATOM 0 HZ2 LYS A 47 -7.416 23.430 14.134 1.00 2.88 H new ATOM 0 HZ3 LYS A 47 -8.098 22.199 13.185 1.00 2.88 H new ATOM 793 N TYR A 48 -1.330 21.670 15.173 1.00 0.38 N ATOM 794 CA TYR A 48 -0.791 22.530 16.265 1.00 0.36 C ATOM 795 C TYR A 48 -0.220 23.828 15.686 1.00 0.33 C ATOM 796 O TYR A 48 -0.393 24.891 16.245 1.00 0.33 O ATOM 797 CB TYR A 48 0.309 21.767 17.015 1.00 0.37 C ATOM 798 CG TYR A 48 -0.325 20.772 17.963 1.00 0.41 C ATOM 799 CD1 TYR A 48 -1.017 21.235 19.085 1.00 0.45 C ATOM 800 CD2 TYR A 48 -0.230 19.397 17.716 1.00 0.41 C ATOM 801 CE1 TYR A 48 -1.611 20.327 19.967 1.00 0.51 C ATOM 802 CE2 TYR A 48 -0.826 18.486 18.598 1.00 0.46 C ATOM 803 CZ TYR A 48 -1.516 18.952 19.724 1.00 0.51 C ATOM 804 OH TYR A 48 -2.106 18.058 20.593 1.00 0.57 O ATOM 0 H TYR A 48 -0.875 20.763 15.070 1.00 0.38 H new ATOM 0 HA TYR A 48 -1.598 22.781 16.954 1.00 0.36 H new ATOM 0 HB2 TYR A 48 0.956 21.249 16.306 1.00 0.37 H new ATOM 0 HB3 TYR A 48 0.937 22.464 17.569 1.00 0.37 H new ATOM 0 HD1 TYR A 48 -1.093 22.296 19.271 1.00 0.45 H new ATOM 0 HD2 TYR A 48 0.302 19.039 16.847 1.00 0.41 H new ATOM 0 HE1 TYR A 48 -2.143 20.687 20.835 1.00 0.51 H new ATOM 0 HE2 TYR A 48 -0.753 17.425 18.410 1.00 0.46 H new ATOM 0 HH TYR A 48 -2.599 17.383 20.082 1.00 0.57 H new ATOM 814 N LEU A 49 0.457 23.758 14.575 1.00 0.31 N ATOM 815 CA LEU A 49 1.028 24.998 13.980 1.00 0.29 C ATOM 816 C LEU A 49 -0.116 25.974 13.664 1.00 0.32 C ATOM 817 O LEU A 49 -0.010 27.168 13.883 1.00 0.32 O ATOM 818 CB LEU A 49 1.795 24.635 12.697 1.00 0.29 C ATOM 819 CG LEU A 49 3.073 23.843 13.038 1.00 0.25 C ATOM 820 CD1 LEU A 49 3.676 23.281 11.746 1.00 0.28 C ATOM 821 CD2 LEU A 49 4.115 24.757 13.712 1.00 0.25 C ATOM 0 H LEU A 49 0.639 22.900 14.055 1.00 0.31 H new ATOM 0 HA LEU A 49 1.716 25.472 14.680 1.00 0.29 H new ATOM 0 HB2 LEU A 49 1.158 24.043 12.040 1.00 0.29 H new ATOM 0 HB3 LEU A 49 2.057 25.543 12.154 1.00 0.29 H new ATOM 0 HG LEU A 49 2.811 23.036 13.722 1.00 0.25 H new ATOM 0 HD11 LEU A 49 4.580 22.720 11.981 1.00 0.28 H new ATOM 0 HD12 LEU A 49 2.954 22.621 11.264 1.00 0.28 H new ATOM 0 HD13 LEU A 49 3.923 24.102 11.073 1.00 0.28 H new ATOM 0 HD21 LEU A 49 5.009 24.179 13.945 1.00 0.25 H new ATOM 0 HD22 LEU A 49 4.375 25.572 13.037 1.00 0.25 H new ATOM 0 HD23 LEU A 49 3.698 25.167 14.632 1.00 0.25 H new ATOM 833 N LYS A 50 -1.219 25.472 13.172 1.00 0.35 N ATOM 834 CA LYS A 50 -2.382 26.357 12.857 1.00 0.39 C ATOM 835 C LYS A 50 -2.844 27.064 14.136 1.00 0.39 C ATOM 836 O LYS A 50 -3.190 28.235 14.134 1.00 0.41 O ATOM 837 CB LYS A 50 -3.522 25.515 12.272 1.00 0.44 C ATOM 838 CG LYS A 50 -4.645 26.433 11.779 1.00 1.03 C ATOM 839 CD LYS A 50 -5.774 25.586 11.184 1.00 1.21 C ATOM 840 CE LYS A 50 -6.875 26.503 10.643 1.00 1.58 C ATOM 841 NZ LYS A 50 -7.773 25.722 9.746 1.00 2.18 N ATOM 0 H LYS A 50 -1.366 24.482 12.974 1.00 0.35 H new ATOM 0 HA LYS A 50 -2.087 27.108 12.124 1.00 0.39 H new ATOM 0 HB2 LYS A 50 -3.150 24.905 11.448 1.00 0.44 H new ATOM 0 HB3 LYS A 50 -3.905 24.830 13.028 1.00 0.44 H new ATOM 0 HG2 LYS A 50 -5.025 27.036 12.604 1.00 1.03 H new ATOM 0 HG3 LYS A 50 -4.261 27.124 11.029 1.00 1.03 H new ATOM 0 HD2 LYS A 50 -5.386 24.956 10.384 1.00 1.21 H new ATOM 0 HD3 LYS A 50 -6.182 24.920 11.945 1.00 1.21 H new ATOM 0 HE2 LYS A 50 -7.447 26.929 11.468 1.00 1.58 H new ATOM 0 HE3 LYS A 50 -6.434 27.337 10.097 1.00 1.58 H new ATOM 0 HZ1 LYS A 50 -8.521 26.343 9.378 1.00 2.18 H new ATOM 0 HZ2 LYS A 50 -7.222 25.336 8.953 1.00 2.18 H new ATOM 0 HZ3 LYS A 50 -8.204 24.941 10.281 1.00 2.18 H new ATOM 855 N ASP A 51 -2.852 26.361 15.233 1.00 0.38 N ATOM 856 CA ASP A 51 -3.290 26.975 16.515 1.00 0.40 C ATOM 857 C ASP A 51 -2.373 28.158 16.828 1.00 0.38 C ATOM 858 O ASP A 51 -2.813 29.193 17.288 1.00 0.40 O ATOM 859 CB ASP A 51 -3.190 25.941 17.637 1.00 0.42 C ATOM 860 CG ASP A 51 -4.263 24.869 17.442 1.00 1.29 C ATOM 861 OD1 ASP A 51 -5.264 25.167 16.813 1.00 2.07 O ATOM 862 OD2 ASP A 51 -4.064 23.766 17.923 1.00 1.96 O ATOM 0 H ASP A 51 -2.572 25.382 15.296 1.00 0.38 H new ATOM 0 HA ASP A 51 -4.323 27.314 16.433 1.00 0.40 H new ATOM 0 HB2 ASP A 51 -2.200 25.484 17.637 1.00 0.42 H new ATOM 0 HB3 ASP A 51 -3.317 26.426 18.605 1.00 0.42 H new ATOM 867 N GLN A 52 -1.103 28.015 16.576 1.00 0.36 N ATOM 868 CA GLN A 52 -0.159 29.134 16.855 1.00 0.38 C ATOM 869 C GLN A 52 -0.581 30.356 16.027 1.00 0.38 C ATOM 870 O GLN A 52 -0.546 31.475 16.499 1.00 0.40 O ATOM 871 CB GLN A 52 1.273 28.689 16.476 1.00 0.42 C ATOM 872 CG GLN A 52 2.044 28.247 17.727 1.00 1.31 C ATOM 873 CD GLN A 52 1.203 27.250 18.528 1.00 2.37 C ATOM 874 OE1 GLN A 52 0.392 26.447 17.897 1.00 3.28 O flip ATOM 875 NE2 GLN A 52 1.284 27.202 19.739 1.00 2.59 N flip ATOM 0 H GLN A 52 -0.677 27.173 16.189 1.00 0.36 H new ATOM 0 HA GLN A 52 -0.178 29.398 17.912 1.00 0.38 H new ATOM 0 HB2 GLN A 52 1.228 27.869 15.760 1.00 0.42 H new ATOM 0 HB3 GLN A 52 1.799 29.510 15.988 1.00 0.42 H new ATOM 0 HG2 GLN A 52 2.991 27.790 17.439 1.00 1.31 H new ATOM 0 HG3 GLN A 52 2.283 29.114 18.344 1.00 1.31 H new ATOM 0 HE21 GLN A 52 1.918 27.830 20.233 1.00 2.59 H new ATOM 0 HE22 GLN A 52 0.718 26.534 20.262 1.00 2.59 H new ATOM 884 N ALA A 53 -0.989 30.156 14.805 1.00 0.39 N ATOM 885 CA ALA A 53 -1.420 31.309 13.969 1.00 0.45 C ATOM 886 C ALA A 53 -2.551 32.051 14.678 1.00 0.47 C ATOM 887 O ALA A 53 -2.663 33.258 14.595 1.00 0.53 O ATOM 888 CB ALA A 53 -1.932 30.801 12.629 1.00 0.49 C ATOM 0 H ALA A 53 -1.042 29.245 14.350 1.00 0.39 H new ATOM 0 HA ALA A 53 -0.574 31.978 13.813 1.00 0.45 H new ATOM 0 HB1 ALA A 53 -2.248 31.645 12.016 1.00 0.49 H new ATOM 0 HB2 ALA A 53 -1.137 30.259 12.117 1.00 0.49 H new ATOM 0 HB3 ALA A 53 -2.779 30.134 12.792 1.00 0.49 H new ATOM 894 N GLN A 54 -3.398 31.338 15.364 1.00 0.45 N ATOM 895 CA GLN A 54 -4.530 32.007 16.062 1.00 0.50 C ATOM 896 C GLN A 54 -3.979 33.021 17.072 1.00 0.55 C ATOM 897 O GLN A 54 -4.508 34.105 17.221 1.00 0.62 O ATOM 898 CB GLN A 54 -5.375 30.957 16.787 1.00 0.51 C ATOM 899 CG GLN A 54 -6.597 31.626 17.421 1.00 0.58 C ATOM 900 CD GLN A 54 -7.440 30.570 18.138 1.00 0.62 C ATOM 901 OE1 GLN A 54 -6.929 29.805 18.931 1.00 0.97 O ATOM 902 NE2 GLN A 54 -8.717 30.492 17.885 1.00 1.03 N ATOM 0 H GLN A 54 -3.356 30.325 15.472 1.00 0.45 H new ATOM 0 HA GLN A 54 -5.153 32.527 15.334 1.00 0.50 H new ATOM 0 HB2 GLN A 54 -5.694 30.185 16.086 1.00 0.51 H new ATOM 0 HB3 GLN A 54 -4.779 30.464 17.555 1.00 0.51 H new ATOM 0 HG2 GLN A 54 -6.280 32.394 18.126 1.00 0.58 H new ATOM 0 HG3 GLN A 54 -7.192 32.123 16.655 1.00 0.58 H new ATOM 0 HE21 GLN A 54 -9.145 31.135 17.219 1.00 1.03 H new ATOM 0 HE22 GLN A 54 -9.288 29.788 18.353 1.00 1.03 H new ATOM 911 N LEU A 55 -2.922 32.690 17.763 1.00 0.54 N ATOM 912 CA LEU A 55 -2.352 33.655 18.747 1.00 0.62 C ATOM 913 C LEU A 55 -1.637 34.779 17.990 1.00 0.66 C ATOM 914 O LEU A 55 -0.652 34.554 17.316 1.00 0.60 O ATOM 915 CB LEU A 55 -1.347 32.930 19.653 1.00 0.60 C ATOM 916 CG LEU A 55 -2.053 31.796 20.410 1.00 0.63 C ATOM 917 CD1 LEU A 55 -1.021 31.024 21.240 1.00 0.65 C ATOM 918 CD2 LEU A 55 -3.138 32.377 21.337 1.00 0.78 C ATOM 0 H LEU A 55 -2.431 31.799 17.690 1.00 0.54 H new ATOM 0 HA LEU A 55 -3.153 34.073 19.357 1.00 0.62 H new ATOM 0 HB2 LEU A 55 -0.530 32.527 19.055 1.00 0.60 H new ATOM 0 HB3 LEU A 55 -0.908 33.633 20.360 1.00 0.60 H new ATOM 0 HG LEU A 55 -2.525 31.122 19.695 1.00 0.63 H new ATOM 0 HD11 LEU A 55 -1.518 30.218 21.779 1.00 0.65 H new ATOM 0 HD12 LEU A 55 -0.262 30.605 20.579 1.00 0.65 H new ATOM 0 HD13 LEU A 55 -0.548 31.700 21.953 1.00 0.65 H new ATOM 0 HD21 LEU A 55 -3.634 31.566 21.870 1.00 0.78 H new ATOM 0 HD22 LEU A 55 -2.678 33.055 22.055 1.00 0.78 H new ATOM 0 HD23 LEU A 55 -3.871 32.922 20.742 1.00 0.78 H new ATOM 930 N ASN A 56 -2.130 35.992 18.097 1.00 0.78 N ATOM 931 CA ASN A 56 -1.489 37.146 17.384 1.00 0.86 C ATOM 932 C ASN A 56 -1.334 38.322 18.351 1.00 0.97 C ATOM 933 O ASN A 56 -0.243 38.668 18.758 1.00 0.92 O ATOM 934 CB ASN A 56 -2.380 37.566 16.214 1.00 0.92 C ATOM 935 CG ASN A 56 -2.660 36.352 15.328 1.00 0.85 C ATOM 936 OD1 ASN A 56 -3.790 35.924 15.203 1.00 1.37 O ATOM 937 ND2 ASN A 56 -1.670 35.775 14.703 1.00 1.36 N ATOM 0 H ASN A 56 -2.952 36.233 18.650 1.00 0.78 H new ATOM 0 HA ASN A 56 -0.507 36.850 17.014 1.00 0.86 H new ATOM 0 HB2 ASN A 56 -3.316 37.982 16.586 1.00 0.92 H new ATOM 0 HB3 ASN A 56 -1.892 38.349 15.634 1.00 0.92 H new ATOM 0 HD21 ASN A 56 -1.845 34.964 14.109 1.00 1.36 H new ATOM 0 HD22 ASN A 56 -0.721 36.135 14.808 1.00 1.36 H new ATOM 944 N ALA A 57 -2.426 38.934 18.727 1.00 1.13 N ATOM 945 CA ALA A 57 -2.365 40.086 19.676 1.00 1.24 C ATOM 946 C ALA A 57 -3.630 40.074 20.540 1.00 1.36 C ATOM 947 O ALA A 57 -4.627 40.691 20.220 1.00 1.50 O ATOM 948 CB ALA A 57 -2.282 41.395 18.879 1.00 1.33 C ATOM 0 H ALA A 57 -3.364 38.684 18.415 1.00 1.13 H new ATOM 0 HA ALA A 57 -1.486 40.006 20.315 1.00 1.24 H new ATOM 0 HB1 ALA A 57 -2.237 42.238 19.568 1.00 1.33 H new ATOM 0 HB2 ALA A 57 -1.387 41.386 18.257 1.00 1.33 H new ATOM 0 HB3 ALA A 57 -3.163 41.491 18.245 1.00 1.33 H new ATOM 954 N TRP A 58 -3.589 39.360 21.631 1.00 1.35 N ATOM 955 CA TRP A 58 -4.771 39.267 22.539 1.00 1.48 C ATOM 956 C TRP A 58 -4.593 40.203 23.737 1.00 1.33 C ATOM 957 O TRP A 58 -3.522 40.313 24.300 1.00 1.26 O ATOM 958 CB TRP A 58 -4.891 37.830 23.047 1.00 1.68 C ATOM 959 CG TRP A 58 -5.303 36.936 21.924 1.00 1.88 C ATOM 960 CD1 TRP A 58 -4.455 36.201 21.167 1.00 1.95 C ATOM 961 CD2 TRP A 58 -6.641 36.667 21.419 1.00 2.05 C ATOM 962 NE1 TRP A 58 -5.190 35.497 20.229 1.00 2.16 N ATOM 963 CE2 TRP A 58 -6.542 35.752 20.344 1.00 2.23 C ATOM 964 CE3 TRP A 58 -7.920 37.125 21.785 1.00 2.08 C ATOM 965 CZ2 TRP A 58 -7.672 35.306 19.657 1.00 2.44 C ATOM 966 CZ3 TRP A 58 -9.059 36.677 21.096 1.00 2.29 C ATOM 967 CH2 TRP A 58 -8.935 35.770 20.034 1.00 2.47 C ATOM 0 H TRP A 58 -2.774 38.828 21.938 1.00 1.35 H new ATOM 0 HA TRP A 58 -5.668 39.555 21.991 1.00 1.48 H new ATOM 0 HB2 TRP A 58 -3.938 37.498 23.459 1.00 1.68 H new ATOM 0 HB3 TRP A 58 -5.622 37.778 23.854 1.00 1.68 H new ATOM 0 HD1 TRP A 58 -3.381 36.169 21.277 1.00 1.95 H new ATOM 0 HE1 TRP A 58 -4.783 34.867 19.538 1.00 2.16 H new ATOM 0 HE3 TRP A 58 -8.027 37.825 22.600 1.00 2.08 H new ATOM 0 HZ2 TRP A 58 -7.571 34.607 18.840 1.00 2.44 H new ATOM 0 HZ3 TRP A 58 -10.036 37.033 21.386 1.00 2.29 H new ATOM 0 HH2 TRP A 58 -9.815 35.430 19.508 1.00 2.47 H new ATOM 978 N GLY A 59 -5.642 40.864 24.138 1.00 1.34 N ATOM 979 CA GLY A 59 -5.549 41.780 25.311 1.00 1.27 C ATOM 980 C GLY A 59 -4.474 42.837 25.071 1.00 1.16 C ATOM 981 O GLY A 59 -4.110 43.574 25.965 1.00 1.14 O ATOM 0 H GLY A 59 -6.563 40.810 23.703 1.00 1.34 H new ATOM 0 HA2 GLY A 59 -6.511 42.262 25.482 1.00 1.27 H new ATOM 0 HA3 GLY A 59 -5.314 41.209 26.209 1.00 1.27 H new ATOM 985 N ALA A 60 -3.964 42.924 23.876 1.00 1.14 N ATOM 986 CA ALA A 60 -2.913 43.934 23.599 1.00 1.12 C ATOM 987 C ALA A 60 -3.563 45.317 23.500 1.00 1.02 C ATOM 988 O ALA A 60 -3.016 46.223 22.909 1.00 1.05 O ATOM 989 CB ALA A 60 -2.228 43.570 22.269 1.00 1.20 C ATOM 0 H ALA A 60 -4.230 42.341 23.083 1.00 1.14 H new ATOM 0 HA ALA A 60 -2.172 43.949 24.398 1.00 1.12 H new ATOM 0 HB1 ALA A 60 -1.451 44.302 22.048 1.00 1.20 H new ATOM 0 HB2 ALA A 60 -1.781 42.579 22.349 1.00 1.20 H new ATOM 0 HB3 ALA A 60 -2.966 43.571 21.467 1.00 1.20 H new ATOM 995 N ALA A 61 -4.719 45.494 24.091 1.00 0.96 N ATOM 996 CA ALA A 61 -5.384 46.829 24.032 1.00 0.92 C ATOM 997 C ALA A 61 -6.372 46.978 25.197 1.00 1.17 C ATOM 998 O ALA A 61 -7.425 46.370 25.201 1.00 1.25 O ATOM 999 CB ALA A 61 -6.134 46.957 22.700 1.00 0.72 C ATOM 0 H ALA A 61 -5.227 44.776 24.608 1.00 0.96 H new ATOM 0 HA ALA A 61 -4.630 47.612 24.109 1.00 0.92 H new ATOM 0 HB1 ALA A 61 -6.623 47.930 22.650 1.00 0.72 H new ATOM 0 HB2 ALA A 61 -5.428 46.862 21.875 1.00 0.72 H new ATOM 0 HB3 ALA A 61 -6.885 46.170 22.628 1.00 0.72 H new ATOM 1005 N PHE A 62 -6.055 47.801 26.171 1.00 1.49 N ATOM 1006 CA PHE A 62 -6.987 48.016 27.327 1.00 1.80 C ATOM 1007 C PHE A 62 -7.662 49.388 27.206 1.00 1.70 C ATOM 1008 O PHE A 62 -8.314 49.846 28.123 1.00 1.94 O ATOM 1009 CB PHE A 62 -6.206 47.918 28.649 1.00 2.32 C ATOM 1010 CG PHE A 62 -6.064 46.464 29.050 1.00 2.70 C ATOM 1011 CD1 PHE A 62 -4.973 45.702 28.615 1.00 2.93 C ATOM 1012 CD2 PHE A 62 -7.045 45.880 29.860 1.00 2.88 C ATOM 1013 CE1 PHE A 62 -4.868 44.354 28.995 1.00 3.28 C ATOM 1014 CE2 PHE A 62 -6.939 44.538 30.238 1.00 3.25 C ATOM 1015 CZ PHE A 62 -5.851 43.775 29.805 1.00 3.42 C ATOM 0 H PHE A 62 -5.187 48.335 26.215 1.00 1.49 H new ATOM 0 HA PHE A 62 -7.758 47.246 27.316 1.00 1.80 H new ATOM 0 HB2 PHE A 62 -5.222 48.372 28.536 1.00 2.32 H new ATOM 0 HB3 PHE A 62 -6.725 48.472 29.431 1.00 2.32 H new ATOM 0 HD1 PHE A 62 -4.215 46.149 27.989 1.00 2.93 H new ATOM 0 HD2 PHE A 62 -7.887 46.468 30.194 1.00 2.88 H new ATOM 0 HE1 PHE A 62 -4.027 43.764 28.662 1.00 3.28 H new ATOM 0 HE2 PHE A 62 -7.697 44.091 30.864 1.00 3.25 H new ATOM 0 HZ PHE A 62 -5.769 42.738 30.096 1.00 3.42 H new ATOM 1025 N ARG A 63 -7.551 50.020 26.062 1.00 1.42 N ATOM 1026 CA ARG A 63 -8.231 51.339 25.846 1.00 1.40 C ATOM 1027 C ARG A 63 -9.156 51.187 24.641 1.00 1.24 C ATOM 1028 O ARG A 63 -9.519 52.144 23.986 1.00 1.34 O ATOM 1029 CB ARG A 63 -7.185 52.420 25.547 1.00 1.66 C ATOM 1030 CG ARG A 63 -6.238 52.575 26.745 1.00 2.30 C ATOM 1031 CD ARG A 63 -6.980 53.190 27.947 1.00 2.72 C ATOM 1032 NE ARG A 63 -7.581 52.101 28.766 1.00 3.14 N ATOM 1033 CZ ARG A 63 -7.996 52.349 29.978 1.00 3.66 C ATOM 1034 NH1 ARG A 63 -7.882 53.551 30.477 1.00 3.90 N ATOM 1035 NH2 ARG A 63 -8.528 51.396 30.694 1.00 4.35 N ATOM 0 H ARG A 63 -7.016 49.678 25.264 1.00 1.42 H new ATOM 0 HA ARG A 63 -8.791 51.629 26.735 1.00 1.40 H new ATOM 0 HB2 ARG A 63 -6.617 52.153 24.656 1.00 1.66 H new ATOM 0 HB3 ARG A 63 -7.679 53.369 25.338 1.00 1.66 H new ATOM 0 HG2 ARG A 63 -5.830 51.603 27.021 1.00 2.30 H new ATOM 0 HG3 ARG A 63 -5.394 53.208 26.469 1.00 2.30 H new ATOM 0 HD2 ARG A 63 -6.290 53.777 28.553 1.00 2.72 H new ATOM 0 HD3 ARG A 63 -7.757 53.870 27.599 1.00 2.72 H new ATOM 0 HE ARG A 63 -7.668 51.161 28.379 1.00 3.14 H new ATOM 0 HH11 ARG A 63 -7.468 54.298 29.919 1.00 3.90 H new ATOM 0 HH12 ARG A 63 -8.207 53.743 31.425 1.00 3.90 H new ATOM 0 HH21 ARG A 63 -8.619 50.457 30.306 1.00 4.35 H new ATOM 0 HH22 ARG A 63 -8.852 51.590 31.641 1.00 4.35 H new ATOM 1049 N GLN A 64 -9.539 49.972 24.355 1.00 1.12 N ATOM 1050 CA GLN A 64 -10.445 49.701 23.203 1.00 1.12 C ATOM 1051 C GLN A 64 -11.288 48.467 23.526 1.00 1.12 C ATOM 1052 O GLN A 64 -10.863 47.606 24.272 1.00 1.09 O ATOM 1053 CB GLN A 64 -9.621 49.434 21.934 1.00 1.17 C ATOM 1054 CG GLN A 64 -8.918 50.722 21.467 1.00 1.37 C ATOM 1055 CD GLN A 64 -7.607 50.937 22.237 1.00 1.77 C ATOM 1056 OE1 GLN A 64 -7.247 50.090 23.163 1.00 2.44 O flip ATOM 1057 NE2 GLN A 64 -6.900 51.893 21.988 1.00 1.84 N flip ATOM 0 H GLN A 64 -9.258 49.144 24.879 1.00 1.12 H new ATOM 0 HA GLN A 64 -11.086 50.566 23.032 1.00 1.12 H new ATOM 0 HB2 GLN A 64 -8.880 48.659 22.131 1.00 1.17 H new ATOM 0 HB3 GLN A 64 -10.271 49.060 21.143 1.00 1.17 H new ATOM 0 HG2 GLN A 64 -8.712 50.662 20.398 1.00 1.37 H new ATOM 0 HG3 GLN A 64 -9.578 51.577 21.617 1.00 1.37 H new ATOM 0 HE21 GLN A 64 -7.177 52.558 21.265 1.00 1.84 H new ATOM 0 HE22 GLN A 64 -6.030 52.031 22.501 1.00 1.84 H new ATOM 1066 N VAL A 65 -12.468 48.360 22.970 1.00 1.28 N ATOM 1067 CA VAL A 65 -13.327 47.162 23.245 1.00 1.44 C ATOM 1068 C VAL A 65 -13.343 46.269 22.002 1.00 1.49 C ATOM 1069 O VAL A 65 -14.383 45.973 21.447 1.00 1.73 O ATOM 1070 CB VAL A 65 -14.753 47.626 23.560 1.00 1.71 C ATOM 1071 CG1 VAL A 65 -15.539 46.478 24.202 1.00 1.94 C ATOM 1072 CG2 VAL A 65 -14.694 48.811 24.528 1.00 1.68 C ATOM 0 H VAL A 65 -12.876 49.048 22.338 1.00 1.28 H new ATOM 0 HA VAL A 65 -12.931 46.605 24.094 1.00 1.44 H new ATOM 0 HB VAL A 65 -15.250 47.929 22.639 1.00 1.71 H new ATOM 0 HG11 VAL A 65 -16.553 46.811 24.425 1.00 1.94 H new ATOM 0 HG12 VAL A 65 -15.578 45.634 23.514 1.00 1.94 H new ATOM 0 HG13 VAL A 65 -15.047 46.171 25.125 1.00 1.94 H new ATOM 0 HG21 VAL A 65 -15.706 49.146 24.756 1.00 1.68 H new ATOM 0 HG22 VAL A 65 -14.197 48.504 25.449 1.00 1.68 H new ATOM 0 HG23 VAL A 65 -14.136 49.628 24.070 1.00 1.68 H new ATOM 1082 N ALA A 66 -12.188 45.827 21.570 1.00 1.31 N ATOM 1083 CA ALA A 66 -12.116 44.941 20.372 1.00 1.38 C ATOM 1084 C ALA A 66 -10.907 44.007 20.501 1.00 1.17 C ATOM 1085 O ALA A 66 -9.959 44.297 21.205 1.00 1.01 O ATOM 1086 CB ALA A 66 -11.968 45.797 19.112 1.00 1.51 C ATOM 0 H ALA A 66 -11.289 46.044 21.999 1.00 1.31 H new ATOM 0 HA ALA A 66 -13.028 44.348 20.302 1.00 1.38 H new ATOM 0 HB1 ALA A 66 -11.915 45.150 18.237 1.00 1.51 H new ATOM 0 HB2 ALA A 66 -12.827 46.462 19.021 1.00 1.51 H new ATOM 0 HB3 ALA A 66 -11.056 46.390 19.180 1.00 1.51 H new ATOM 1092 N HIS A 67 -10.931 42.897 19.809 1.00 1.23 N ATOM 1093 CA HIS A 67 -9.790 41.926 19.851 1.00 1.06 C ATOM 1094 C HIS A 67 -9.386 41.594 18.414 1.00 1.10 C ATOM 1095 O HIS A 67 -10.226 41.325 17.578 1.00 1.27 O ATOM 1096 CB HIS A 67 -10.214 40.652 20.592 1.00 1.11 C ATOM 1097 CG HIS A 67 -10.198 40.902 22.080 1.00 1.13 C ATOM 1098 ND1 HIS A 67 -11.201 40.436 22.921 1.00 1.36 N ATOM 1099 CD2 HIS A 67 -9.307 41.563 22.894 1.00 1.02 C ATOM 1100 CE1 HIS A 67 -10.892 40.820 24.174 1.00 1.39 C ATOM 1101 NE2 HIS A 67 -9.749 41.509 24.209 1.00 1.19 N ATOM 0 H HIS A 67 -11.704 42.616 19.206 1.00 1.23 H new ATOM 0 HA HIS A 67 -8.944 42.363 20.381 1.00 1.06 H new ATOM 0 HB2 HIS A 67 -11.212 40.350 20.275 1.00 1.11 H new ATOM 0 HB3 HIS A 67 -9.539 39.833 20.343 1.00 1.11 H new ATOM 0 HD2 HIS A 67 -8.402 42.049 22.561 1.00 1.02 H new ATOM 0 HE1 HIS A 67 -11.494 40.598 25.043 1.00 1.39 H new ATOM 0 HE2 HIS A 67 -9.296 41.911 25.029 1.00 1.19 H new ATOM 1109 N THR A 68 -8.112 41.634 18.107 1.00 1.01 N ATOM 1110 CA THR A 68 -7.669 41.347 16.706 1.00 1.12 C ATOM 1111 C THR A 68 -7.197 39.895 16.591 1.00 0.99 C ATOM 1112 O THR A 68 -6.270 39.476 17.254 1.00 0.86 O ATOM 1113 CB THR A 68 -6.523 42.299 16.337 1.00 1.20 C ATOM 1114 OG1 THR A 68 -6.271 42.213 14.942 1.00 1.39 O ATOM 1115 CG2 THR A 68 -5.252 41.927 17.109 1.00 1.09 C ATOM 0 H THR A 68 -7.362 41.852 18.763 1.00 1.01 H new ATOM 0 HA THR A 68 -8.505 41.497 16.023 1.00 1.12 H new ATOM 0 HB THR A 68 -6.810 43.317 16.600 1.00 1.20 H new ATOM 0 HG1 THR A 68 -5.541 42.821 14.703 1.00 1.39 H new ATOM 0 HG21 THR A 68 -4.448 42.611 16.837 1.00 1.09 H new ATOM 0 HG22 THR A 68 -5.443 41.999 18.180 1.00 1.09 H new ATOM 0 HG23 THR A 68 -4.960 40.907 16.860 1.00 1.09 H new ATOM 1123 N THR A 69 -7.843 39.130 15.745 1.00 1.06 N ATOM 1124 CA THR A 69 -7.465 37.693 15.551 1.00 0.95 C ATOM 1125 C THR A 69 -6.942 37.499 14.126 1.00 0.99 C ATOM 1126 O THR A 69 -7.627 37.771 13.161 1.00 1.16 O ATOM 1127 CB THR A 69 -8.696 36.808 15.775 1.00 1.05 C ATOM 1128 OG1 THR A 69 -8.493 35.547 15.154 1.00 1.09 O ATOM 1129 CG2 THR A 69 -9.938 37.480 15.183 1.00 1.28 C ATOM 0 H THR A 69 -8.627 39.444 15.173 1.00 1.06 H new ATOM 0 HA THR A 69 -6.689 37.416 16.264 1.00 0.95 H new ATOM 0 HB THR A 69 -8.845 36.666 16.845 1.00 1.05 H new ATOM 0 HG1 THR A 69 -9.280 34.981 15.299 1.00 1.09 H new ATOM 0 HG21 THR A 69 -10.808 36.844 15.346 1.00 1.28 H new ATOM 0 HG22 THR A 69 -10.096 38.444 15.667 1.00 1.28 H new ATOM 0 HG23 THR A 69 -9.795 37.631 14.113 1.00 1.28 H new ATOM 1137 N VAL A 70 -5.723 37.040 13.990 1.00 0.89 N ATOM 1138 CA VAL A 70 -5.131 36.830 12.631 1.00 0.97 C ATOM 1139 C VAL A 70 -4.548 35.414 12.546 1.00 0.85 C ATOM 1140 O VAL A 70 -3.388 35.200 12.840 1.00 0.80 O ATOM 1141 CB VAL A 70 -4.007 37.846 12.420 1.00 1.07 C ATOM 1142 CG1 VAL A 70 -3.410 37.665 11.025 1.00 1.24 C ATOM 1143 CG2 VAL A 70 -4.577 39.260 12.548 1.00 1.18 C ATOM 0 H VAL A 70 -5.108 36.800 14.767 1.00 0.89 H new ATOM 0 HA VAL A 70 -5.899 36.957 11.868 1.00 0.97 H new ATOM 0 HB VAL A 70 -3.230 37.693 13.169 1.00 1.07 H new ATOM 0 HG11 VAL A 70 -2.609 38.389 10.875 1.00 1.24 H new ATOM 0 HG12 VAL A 70 -3.009 36.656 10.929 1.00 1.24 H new ATOM 0 HG13 VAL A 70 -4.185 37.821 10.275 1.00 1.24 H new ATOM 0 HG21 VAL A 70 -3.780 39.988 12.399 1.00 1.18 H new ATOM 0 HG22 VAL A 70 -5.351 39.410 11.796 1.00 1.18 H new ATOM 0 HG23 VAL A 70 -5.006 39.391 13.541 1.00 1.18 H new ATOM 1153 N PRO A 71 -5.343 34.448 12.146 1.00 0.84 N ATOM 1154 CA PRO A 71 -4.891 33.038 12.024 1.00 0.75 C ATOM 1155 C PRO A 71 -4.220 32.764 10.673 1.00 0.74 C ATOM 1156 O PRO A 71 -4.708 31.994 9.870 1.00 0.78 O ATOM 1157 CB PRO A 71 -6.191 32.246 12.167 1.00 0.83 C ATOM 1158 CG PRO A 71 -7.248 33.134 11.580 1.00 0.99 C ATOM 1159 CD PRO A 71 -6.763 34.586 11.767 1.00 0.98 C ATOM 0 HA PRO A 71 -4.138 32.773 12.766 1.00 0.75 H new ATOM 0 HB2 PRO A 71 -6.135 31.295 11.638 1.00 0.83 H new ATOM 0 HB3 PRO A 71 -6.402 32.017 13.212 1.00 0.83 H new ATOM 0 HG2 PRO A 71 -7.399 32.910 10.524 1.00 0.99 H new ATOM 0 HG3 PRO A 71 -8.205 32.978 12.079 1.00 0.99 H new ATOM 0 HD2 PRO A 71 -6.876 35.165 10.850 1.00 0.98 H new ATOM 0 HD3 PRO A 71 -7.333 35.100 12.541 1.00 0.98 H new ATOM 1167 N TRP A 72 -3.102 33.387 10.426 1.00 0.72 N ATOM 1168 CA TRP A 72 -2.389 33.168 9.136 1.00 0.75 C ATOM 1169 C TRP A 72 -1.843 31.737 9.121 1.00 0.67 C ATOM 1170 O TRP A 72 -1.175 31.343 10.050 1.00 0.60 O ATOM 1171 CB TRP A 72 -1.211 34.135 9.060 1.00 0.78 C ATOM 1172 CG TRP A 72 -0.502 33.965 7.754 1.00 0.84 C ATOM 1173 CD1 TRP A 72 -0.984 34.354 6.552 1.00 0.94 C ATOM 1174 CD2 TRP A 72 0.805 33.372 7.498 1.00 0.84 C ATOM 1175 NE1 TRP A 72 -0.058 34.039 5.574 1.00 0.99 N ATOM 1176 CE2 TRP A 72 1.061 33.432 6.107 1.00 0.93 C ATOM 1177 CE3 TRP A 72 1.783 32.792 8.327 1.00 0.79 C ATOM 1178 CZ2 TRP A 72 2.245 32.937 5.560 1.00 0.97 C ATOM 1179 CZ3 TRP A 72 2.976 32.293 7.779 1.00 0.84 C ATOM 1180 CH2 TRP A 72 3.206 32.365 6.398 1.00 0.92 C ATOM 0 H TRP A 72 -2.649 34.041 11.064 1.00 0.72 H new ATOM 0 HA TRP A 72 -3.066 33.328 8.297 1.00 0.75 H new ATOM 0 HB2 TRP A 72 -1.564 35.161 9.162 1.00 0.78 H new ATOM 0 HB3 TRP A 72 -0.523 33.950 9.885 1.00 0.78 H new ATOM 0 HD1 TRP A 72 -1.937 34.833 6.383 1.00 0.94 H new ATOM 0 HE1 TRP A 72 -0.186 34.232 4.581 1.00 0.99 H new ATOM 0 HE3 TRP A 72 1.615 32.730 9.392 1.00 0.79 H new ATOM 0 HZ2 TRP A 72 2.418 32.995 4.496 1.00 0.97 H new ATOM 0 HZ3 TRP A 72 3.720 31.851 8.425 1.00 0.84 H new ATOM 0 HH2 TRP A 72 4.125 31.979 5.982 1.00 0.92 H new ATOM 1191 N PRO A 73 -2.098 30.952 8.098 1.00 0.71 N ATOM 1192 CA PRO A 73 -1.587 29.557 8.056 1.00 0.66 C ATOM 1193 C PRO A 73 -0.165 29.464 8.608 1.00 0.58 C ATOM 1194 O PRO A 73 0.633 30.366 8.448 1.00 0.61 O ATOM 1195 CB PRO A 73 -1.626 29.221 6.565 1.00 0.75 C ATOM 1196 CG PRO A 73 -2.794 29.995 6.040 1.00 0.84 C ATOM 1197 CD PRO A 73 -2.877 31.277 6.888 1.00 0.82 C ATOM 0 HA PRO A 73 -2.173 28.870 8.667 1.00 0.66 H new ATOM 0 HB2 PRO A 73 -0.701 29.512 6.068 1.00 0.75 H new ATOM 0 HB3 PRO A 73 -1.753 28.151 6.402 1.00 0.75 H new ATOM 0 HG2 PRO A 73 -2.660 30.234 4.985 1.00 0.84 H new ATOM 0 HG3 PRO A 73 -3.713 29.415 6.121 1.00 0.84 H new ATOM 0 HD2 PRO A 73 -2.457 32.133 6.360 1.00 0.82 H new ATOM 0 HD3 PRO A 73 -3.909 31.528 7.133 1.00 0.82 H new ATOM 1205 N ASN A 74 0.150 28.380 9.258 1.00 0.52 N ATOM 1206 CA ASN A 74 1.515 28.203 9.837 1.00 0.48 C ATOM 1207 C ASN A 74 2.030 26.830 9.423 1.00 0.50 C ATOM 1208 O ASN A 74 3.039 26.349 9.898 1.00 0.80 O ATOM 1209 CB ASN A 74 1.419 28.300 11.358 1.00 0.47 C ATOM 1210 CG ASN A 74 2.822 28.345 11.962 1.00 0.53 C ATOM 1211 OD1 ASN A 74 3.021 27.862 13.156 1.00 1.17 O flip ATOM 1212 ND2 ASN A 74 3.748 28.827 11.339 1.00 1.26 N flip ATOM 0 H ASN A 74 -0.486 27.598 9.416 1.00 0.52 H new ATOM 0 HA ASN A 74 2.198 28.972 9.477 1.00 0.48 H new ATOM 0 HB2 ASN A 74 0.862 29.194 11.640 1.00 0.47 H new ATOM 0 HB3 ASN A 74 0.870 27.445 11.752 1.00 0.47 H new ATOM 0 HD21 ASN A 74 3.592 29.205 10.405 1.00 1.26 H new ATOM 0 HD22 ASN A 74 4.681 28.853 11.751 1.00 1.26 H new ATOM 1219 N ALA A 75 1.319 26.200 8.536 1.00 0.47 N ATOM 1220 CA ALA A 75 1.705 24.851 8.053 1.00 0.47 C ATOM 1221 C ALA A 75 1.172 24.683 6.632 1.00 0.46 C ATOM 1222 O ALA A 75 -0.012 24.813 6.395 1.00 0.47 O ATOM 1223 CB ALA A 75 1.081 23.787 8.964 1.00 0.53 C ATOM 0 H ALA A 75 0.467 26.573 8.116 1.00 0.47 H new ATOM 0 HA ALA A 75 2.789 24.739 8.065 1.00 0.47 H new ATOM 0 HB1 ALA A 75 1.363 22.795 8.611 1.00 0.53 H new ATOM 0 HB2 ALA A 75 1.440 23.925 9.984 1.00 0.53 H new ATOM 0 HB3 ALA A 75 -0.005 23.883 8.946 1.00 0.53 H new ATOM 1229 N SER A 76 2.013 24.392 5.679 1.00 0.47 N ATOM 1230 CA SER A 76 1.493 24.223 4.298 1.00 0.48 C ATOM 1231 C SER A 76 0.897 22.830 4.218 1.00 0.48 C ATOM 1232 O SER A 76 1.593 21.834 4.200 1.00 0.49 O ATOM 1233 CB SER A 76 2.634 24.354 3.288 1.00 0.54 C ATOM 1234 OG SER A 76 2.166 23.978 1.998 1.00 1.38 O ATOM 0 H SER A 76 3.019 24.266 5.794 1.00 0.47 H new ATOM 0 HA SER A 76 0.748 24.985 4.068 1.00 0.48 H new ATOM 0 HB2 SER A 76 3.002 25.380 3.269 1.00 0.54 H new ATOM 0 HB3 SER A 76 3.471 23.720 3.583 1.00 0.54 H new ATOM 0 HG SER A 76 2.895 24.062 1.348 1.00 1.38 H new ATOM 1240 N LEU A 77 -0.399 22.762 4.202 1.00 0.50 N ATOM 1241 CA LEU A 77 -1.077 21.449 4.162 1.00 0.53 C ATOM 1242 C LEU A 77 -0.984 20.893 2.750 1.00 0.52 C ATOM 1243 O LEU A 77 -1.193 21.598 1.787 1.00 0.55 O ATOM 1244 CB LEU A 77 -2.547 21.645 4.543 1.00 0.61 C ATOM 1245 CG LEU A 77 -2.639 22.359 5.904 1.00 0.65 C ATOM 1246 CD1 LEU A 77 -4.076 22.827 6.145 1.00 0.75 C ATOM 1247 CD2 LEU A 77 -2.223 21.406 7.033 1.00 0.66 C ATOM 0 H LEU A 77 -1.022 23.569 4.215 1.00 0.50 H new ATOM 0 HA LEU A 77 -0.607 20.755 4.859 1.00 0.53 H new ATOM 0 HB2 LEU A 77 -3.056 22.232 3.778 1.00 0.61 H new ATOM 0 HB3 LEU A 77 -3.052 20.680 4.593 1.00 0.61 H new ATOM 0 HG LEU A 77 -1.968 23.218 5.894 1.00 0.65 H new ATOM 0 HD11 LEU A 77 -4.137 23.332 7.109 1.00 0.75 H new ATOM 0 HD12 LEU A 77 -4.371 23.517 5.355 1.00 0.75 H new ATOM 0 HD13 LEU A 77 -4.744 21.966 6.143 1.00 0.75 H new ATOM 0 HD21 LEU A 77 -2.293 21.923 7.990 1.00 0.66 H new ATOM 0 HD22 LEU A 77 -2.884 20.540 7.040 1.00 0.66 H new ATOM 0 HD23 LEU A 77 -1.196 21.077 6.872 1.00 0.66 H new ATOM 1259 N THR A 78 -0.671 19.636 2.622 1.00 0.51 N ATOM 1260 CA THR A 78 -0.570 19.020 1.271 1.00 0.51 C ATOM 1261 C THR A 78 -1.878 18.265 0.974 1.00 0.57 C ATOM 1262 O THR A 78 -2.138 17.237 1.565 1.00 0.66 O ATOM 1263 CB THR A 78 0.612 18.043 1.268 1.00 0.54 C ATOM 1264 OG1 THR A 78 0.792 17.556 -0.052 1.00 0.61 O ATOM 1265 CG2 THR A 78 0.347 16.870 2.230 1.00 0.63 C ATOM 0 H THR A 78 -0.479 19.004 3.400 1.00 0.51 H new ATOM 0 HA THR A 78 -0.413 19.783 0.509 1.00 0.51 H new ATOM 0 HB THR A 78 1.512 18.559 1.603 1.00 0.54 H new ATOM 0 HG1 THR A 78 1.003 18.303 -0.650 1.00 0.61 H new ATOM 0 HG21 THR A 78 1.197 16.187 2.214 1.00 0.63 H new ATOM 0 HG22 THR A 78 0.208 17.253 3.241 1.00 0.63 H new ATOM 0 HG23 THR A 78 -0.551 16.338 1.917 1.00 0.63 H new ATOM 1273 N PRO A 79 -2.717 18.746 0.081 1.00 0.65 N ATOM 1274 CA PRO A 79 -3.988 18.064 -0.244 1.00 0.77 C ATOM 1275 C PRO A 79 -3.919 17.230 -1.527 1.00 0.67 C ATOM 1276 O PRO A 79 -4.394 16.115 -1.579 1.00 0.70 O ATOM 1277 CB PRO A 79 -4.915 19.253 -0.458 1.00 0.98 C ATOM 1278 CG PRO A 79 -4.054 20.256 -1.171 1.00 0.96 C ATOM 1279 CD PRO A 79 -2.603 19.992 -0.709 1.00 0.75 C ATOM 0 HA PRO A 79 -4.289 17.355 0.527 1.00 0.77 H new ATOM 0 HB2 PRO A 79 -5.786 18.979 -1.053 1.00 0.98 H new ATOM 0 HB3 PRO A 79 -5.286 19.646 0.488 1.00 0.98 H new ATOM 0 HG2 PRO A 79 -4.144 20.146 -2.252 1.00 0.96 H new ATOM 0 HG3 PRO A 79 -4.360 21.273 -0.928 1.00 0.96 H new ATOM 0 HD2 PRO A 79 -1.927 19.871 -1.556 1.00 0.75 H new ATOM 0 HD3 PRO A 79 -2.216 20.815 -0.108 1.00 0.75 H new ATOM 1287 N LYS A 80 -3.384 17.796 -2.579 1.00 0.66 N ATOM 1288 CA LYS A 80 -3.332 17.077 -3.892 1.00 0.66 C ATOM 1289 C LYS A 80 -1.929 16.566 -4.251 1.00 0.63 C ATOM 1290 O LYS A 80 -1.793 15.497 -4.805 1.00 0.65 O ATOM 1291 CB LYS A 80 -3.785 18.042 -4.987 1.00 0.79 C ATOM 1292 CG LYS A 80 -5.276 18.329 -4.824 1.00 1.31 C ATOM 1293 CD LYS A 80 -5.738 19.293 -5.915 1.00 1.46 C ATOM 1294 CE LYS A 80 -7.230 19.573 -5.741 1.00 2.32 C ATOM 1295 NZ LYS A 80 -7.636 20.676 -6.655 1.00 2.96 N ATOM 0 H LYS A 80 -2.978 18.732 -2.586 1.00 0.66 H new ATOM 0 HA LYS A 80 -3.983 16.207 -3.810 1.00 0.66 H new ATOM 0 HB2 LYS A 80 -3.216 18.970 -4.928 1.00 0.79 H new ATOM 0 HB3 LYS A 80 -3.591 17.612 -5.970 1.00 0.79 H new ATOM 0 HG2 LYS A 80 -5.843 17.400 -4.882 1.00 1.31 H new ATOM 0 HG3 LYS A 80 -5.468 18.759 -3.841 1.00 1.31 H new ATOM 0 HD2 LYS A 80 -5.172 20.223 -5.858 1.00 1.46 H new ATOM 0 HD3 LYS A 80 -5.549 18.865 -6.899 1.00 1.46 H new ATOM 0 HE2 LYS A 80 -7.808 18.675 -5.958 1.00 2.32 H new ATOM 0 HE3 LYS A 80 -7.442 19.846 -4.707 1.00 2.32 H new ATOM 0 HZ1 LYS A 80 -8.651 20.868 -6.538 1.00 2.96 H new ATOM 0 HZ2 LYS A 80 -7.093 21.533 -6.427 1.00 2.96 H new ATOM 0 HZ3 LYS A 80 -7.448 20.398 -7.639 1.00 2.96 H new ATOM 1309 N TRP A 81 -0.893 17.337 -4.043 1.00 0.64 N ATOM 1310 CA TRP A 81 0.454 16.866 -4.505 1.00 0.67 C ATOM 1311 C TRP A 81 1.039 15.734 -3.636 1.00 0.62 C ATOM 1312 O TRP A 81 1.309 14.659 -4.138 1.00 0.63 O ATOM 1313 CB TRP A 81 1.433 18.058 -4.600 1.00 0.72 C ATOM 1314 CG TRP A 81 2.037 18.418 -3.275 1.00 0.68 C ATOM 1315 CD1 TRP A 81 3.098 17.792 -2.713 1.00 0.69 C ATOM 1316 CD2 TRP A 81 1.682 19.506 -2.369 1.00 0.67 C ATOM 1317 NE1 TRP A 81 3.401 18.409 -1.514 1.00 0.68 N ATOM 1318 CE2 TRP A 81 2.559 19.471 -1.257 1.00 0.65 C ATOM 1319 CE3 TRP A 81 0.691 20.504 -2.396 1.00 0.70 C ATOM 1320 CZ2 TRP A 81 2.459 20.393 -0.213 1.00 0.65 C ATOM 1321 CZ3 TRP A 81 0.588 21.435 -1.347 1.00 0.71 C ATOM 1322 CH2 TRP A 81 1.471 21.379 -0.258 1.00 0.67 C ATOM 0 H TRP A 81 -0.914 18.249 -3.586 1.00 0.64 H new ATOM 0 HA TRP A 81 0.314 16.436 -5.497 1.00 0.67 H new ATOM 0 HB2 TRP A 81 2.229 17.814 -5.303 1.00 0.72 H new ATOM 0 HB3 TRP A 81 0.907 18.924 -5.002 1.00 0.72 H new ATOM 0 HD1 TRP A 81 3.623 16.947 -3.134 1.00 0.69 H new ATOM 0 HE1 TRP A 81 4.156 18.115 -0.894 1.00 0.68 H new ATOM 0 HE3 TRP A 81 0.004 20.556 -3.228 1.00 0.70 H new ATOM 0 HZ2 TRP A 81 3.141 20.344 0.623 1.00 0.65 H new ATOM 0 HZ3 TRP A 81 -0.176 22.198 -1.380 1.00 0.71 H new ATOM 0 HH2 TRP A 81 1.387 22.097 0.544 1.00 0.67 H new ATOM 1333 N ASN A 82 1.277 15.938 -2.368 1.00 0.59 N ATOM 1334 CA ASN A 82 1.888 14.829 -1.560 1.00 0.59 C ATOM 1335 C ASN A 82 0.859 13.765 -1.193 1.00 0.53 C ATOM 1336 O ASN A 82 1.154 12.589 -1.191 1.00 0.49 O ATOM 1337 CB ASN A 82 2.520 15.373 -0.284 1.00 0.69 C ATOM 1338 CG ASN A 82 3.502 14.341 0.285 1.00 1.07 C ATOM 1339 OD1 ASN A 82 3.449 14.038 1.554 1.00 0.96 O flip ATOM 1340 ND2 ASN A 82 4.326 13.809 -0.432 1.00 1.86 N flip ATOM 0 H ASN A 82 1.082 16.801 -1.861 1.00 0.59 H new ATOM 0 HA ASN A 82 2.657 14.371 -2.182 1.00 0.59 H new ATOM 0 HB2 ASN A 82 3.040 16.308 -0.494 1.00 0.69 H new ATOM 0 HB3 ASN A 82 1.746 15.597 0.450 1.00 0.69 H new ATOM 0 HD21 ASN A 82 4.368 14.045 -1.423 1.00 1.86 H new ATOM 0 HD22 ASN A 82 4.976 13.126 -0.043 1.00 1.86 H new ATOM 1347 N ASN A 83 -0.336 14.150 -0.849 1.00 0.56 N ATOM 1348 CA ASN A 83 -1.335 13.123 -0.453 1.00 0.57 C ATOM 1349 C ASN A 83 -1.562 12.158 -1.614 1.00 0.52 C ATOM 1350 O ASN A 83 -1.521 10.955 -1.442 1.00 0.51 O ATOM 1351 CB ASN A 83 -2.653 13.798 -0.081 1.00 0.66 C ATOM 1352 CG ASN A 83 -3.670 12.731 0.324 1.00 1.21 C ATOM 1353 OD1 ASN A 83 -4.780 12.715 -0.171 1.00 1.99 O ATOM 1354 ND2 ASN A 83 -3.338 11.832 1.209 1.00 1.83 N ATOM 0 H ASN A 83 -0.661 15.117 -0.825 1.00 0.56 H new ATOM 0 HA ASN A 83 -0.961 12.571 0.409 1.00 0.57 H new ATOM 0 HB2 ASN A 83 -2.497 14.498 0.739 1.00 0.66 H new ATOM 0 HB3 ASN A 83 -3.030 14.375 -0.925 1.00 0.66 H new ATOM 0 HD21 ASN A 83 -4.010 11.116 1.485 1.00 1.83 H new ATOM 0 HD22 ASN A 83 -2.407 11.845 1.625 1.00 1.83 H new ATOM 1361 N GLU A 84 -1.788 12.653 -2.798 1.00 0.52 N ATOM 1362 CA GLU A 84 -1.997 11.721 -3.939 1.00 0.52 C ATOM 1363 C GLU A 84 -0.750 10.859 -4.112 1.00 0.46 C ATOM 1364 O GLU A 84 -0.835 9.662 -4.291 1.00 0.47 O ATOM 1365 CB GLU A 84 -2.252 12.505 -5.224 1.00 0.55 C ATOM 1366 CG GLU A 84 -3.624 13.174 -5.146 1.00 1.26 C ATOM 1367 CD GLU A 84 -3.881 13.959 -6.432 1.00 1.71 C ATOM 1368 OE1 GLU A 84 -2.953 14.099 -7.212 1.00 2.23 O ATOM 1369 OE2 GLU A 84 -5.000 14.408 -6.615 1.00 2.29 O ATOM 0 H GLU A 84 -1.837 13.647 -3.023 1.00 0.52 H new ATOM 0 HA GLU A 84 -2.863 11.092 -3.733 1.00 0.52 H new ATOM 0 HB2 GLU A 84 -1.476 13.257 -5.364 1.00 0.55 H new ATOM 0 HB3 GLU A 84 -2.209 11.838 -6.085 1.00 0.55 H new ATOM 0 HG2 GLU A 84 -4.400 12.422 -5.005 1.00 1.26 H new ATOM 0 HG3 GLU A 84 -3.667 13.841 -4.285 1.00 1.26 H new ATOM 1376 N THR A 85 0.412 11.454 -4.048 1.00 0.44 N ATOM 1377 CA THR A 85 1.650 10.645 -4.197 1.00 0.42 C ATOM 1378 C THR A 85 1.800 9.748 -2.970 1.00 0.38 C ATOM 1379 O THR A 85 2.198 8.604 -3.074 1.00 0.39 O ATOM 1380 CB THR A 85 2.877 11.558 -4.317 1.00 0.44 C ATOM 1381 OG1 THR A 85 3.045 12.283 -3.109 1.00 0.43 O ATOM 1382 CG2 THR A 85 2.701 12.538 -5.486 1.00 0.49 C ATOM 0 H THR A 85 0.554 12.453 -3.901 1.00 0.44 H new ATOM 0 HA THR A 85 1.579 10.040 -5.101 1.00 0.42 H new ATOM 0 HB THR A 85 3.758 10.944 -4.503 1.00 0.44 H new ATOM 0 HG1 THR A 85 2.180 12.368 -2.655 1.00 0.43 H new ATOM 0 HG21 THR A 85 3.579 13.179 -5.559 1.00 0.49 H new ATOM 0 HG22 THR A 85 2.582 11.979 -6.414 1.00 0.49 H new ATOM 0 HG23 THR A 85 1.817 13.152 -5.316 1.00 0.49 H new ATOM 1390 N TRP A 86 1.499 10.257 -1.802 1.00 0.36 N ATOM 1391 CA TRP A 86 1.646 9.415 -0.584 1.00 0.34 C ATOM 1392 C TRP A 86 0.665 8.242 -0.644 1.00 0.34 C ATOM 1393 O TRP A 86 1.013 7.119 -0.347 1.00 0.34 O ATOM 1394 CB TRP A 86 1.380 10.233 0.688 1.00 0.34 C ATOM 1395 CG TRP A 86 1.986 9.502 1.845 1.00 0.32 C ATOM 1396 CD1 TRP A 86 1.359 8.582 2.616 1.00 0.34 C ATOM 1397 CD2 TRP A 86 3.345 9.597 2.345 1.00 0.29 C ATOM 1398 NE1 TRP A 86 2.258 8.103 3.554 1.00 0.33 N ATOM 1399 CE2 TRP A 86 3.496 8.702 3.426 1.00 0.29 C ATOM 1400 CE3 TRP A 86 4.451 10.370 1.962 1.00 0.27 C ATOM 1401 CZ2 TRP A 86 4.710 8.576 4.104 1.00 0.28 C ATOM 1402 CZ3 TRP A 86 5.670 10.250 2.643 1.00 0.26 C ATOM 1403 CH2 TRP A 86 5.800 9.353 3.711 1.00 0.27 C ATOM 0 H TRP A 86 1.162 11.207 -1.643 1.00 0.36 H new ATOM 0 HA TRP A 86 2.670 9.043 -0.551 1.00 0.34 H new ATOM 0 HB2 TRP A 86 1.813 11.229 0.598 1.00 0.34 H new ATOM 0 HB3 TRP A 86 0.309 10.364 0.839 1.00 0.34 H new ATOM 0 HD1 TRP A 86 0.329 8.273 2.516 1.00 0.34 H new ATOM 0 HE1 TRP A 86 2.034 7.395 4.253 1.00 0.33 H new ATOM 0 HE3 TRP A 86 4.363 11.062 1.137 1.00 0.27 H new ATOM 0 HZ2 TRP A 86 4.805 7.882 4.926 1.00 0.28 H new ATOM 0 HZ3 TRP A 86 6.514 10.853 2.343 1.00 0.26 H new ATOM 0 HH2 TRP A 86 6.743 9.263 4.230 1.00 0.27 H new ATOM 1414 N GLN A 87 -0.558 8.478 -1.034 1.00 0.37 N ATOM 1415 CA GLN A 87 -1.508 7.340 -1.110 1.00 0.39 C ATOM 1416 C GLN A 87 -0.938 6.338 -2.105 1.00 0.37 C ATOM 1417 O GLN A 87 -0.966 5.143 -1.899 1.00 0.38 O ATOM 1418 CB GLN A 87 -2.878 7.830 -1.580 1.00 0.43 C ATOM 1419 CG GLN A 87 -3.519 8.671 -0.476 1.00 0.46 C ATOM 1420 CD GLN A 87 -4.812 9.299 -0.994 1.00 0.53 C ATOM 1421 OE1 GLN A 87 -4.932 9.595 -2.167 1.00 1.21 O ATOM 1422 NE2 GLN A 87 -5.794 9.515 -0.162 1.00 1.03 N ATOM 0 H GLN A 87 -0.932 9.390 -1.297 1.00 0.37 H new ATOM 0 HA GLN A 87 -1.635 6.878 -0.131 1.00 0.39 H new ATOM 0 HB2 GLN A 87 -2.773 8.422 -2.489 1.00 0.43 H new ATOM 0 HB3 GLN A 87 -3.517 6.981 -1.824 1.00 0.43 H new ATOM 0 HG2 GLN A 87 -3.728 8.048 0.394 1.00 0.46 H new ATOM 0 HG3 GLN A 87 -2.829 9.450 -0.152 1.00 0.46 H new ATOM 0 HE21 GLN A 87 -5.693 9.266 0.822 1.00 1.03 H new ATOM 0 HE22 GLN A 87 -6.663 9.932 -0.496 1.00 1.03 H new ATOM 1431 N GLU A 88 -0.385 6.835 -3.170 1.00 0.37 N ATOM 1432 CA GLU A 88 0.235 5.950 -4.185 1.00 0.37 C ATOM 1433 C GLU A 88 1.426 5.231 -3.545 1.00 0.34 C ATOM 1434 O GLU A 88 1.679 4.072 -3.801 1.00 0.35 O ATOM 1435 CB GLU A 88 0.704 6.789 -5.378 1.00 0.39 C ATOM 1436 CG GLU A 88 1.306 5.873 -6.444 1.00 1.18 C ATOM 1437 CD GLU A 88 1.748 6.707 -7.647 1.00 1.42 C ATOM 1438 OE1 GLU A 88 1.416 7.881 -7.684 1.00 1.93 O ATOM 1439 OE2 GLU A 88 2.411 6.159 -8.513 1.00 1.96 O ATOM 0 H GLU A 88 -0.336 7.831 -3.383 1.00 0.37 H new ATOM 0 HA GLU A 88 -0.489 5.216 -4.537 1.00 0.37 H new ATOM 0 HB2 GLU A 88 -0.134 7.347 -5.795 1.00 0.39 H new ATOM 0 HB3 GLU A 88 1.444 7.520 -5.053 1.00 0.39 H new ATOM 0 HG2 GLU A 88 2.157 5.330 -6.033 1.00 1.18 H new ATOM 0 HG3 GLU A 88 0.573 5.129 -6.754 1.00 1.18 H new ATOM 1446 N TRP A 89 2.172 5.927 -2.727 1.00 0.32 N ATOM 1447 CA TRP A 89 3.371 5.316 -2.082 1.00 0.30 C ATOM 1448 C TRP A 89 2.959 4.109 -1.233 1.00 0.30 C ATOM 1449 O TRP A 89 3.528 3.044 -1.361 1.00 0.30 O ATOM 1450 CB TRP A 89 4.034 6.380 -1.199 1.00 0.28 C ATOM 1451 CG TRP A 89 5.106 5.787 -0.342 1.00 0.25 C ATOM 1452 CD1 TRP A 89 6.336 5.426 -0.769 1.00 0.25 C ATOM 1453 CD2 TRP A 89 5.071 5.516 1.090 1.00 0.24 C ATOM 1454 NE1 TRP A 89 7.057 4.941 0.308 1.00 0.23 N ATOM 1455 CE2 TRP A 89 6.320 4.976 1.476 1.00 0.23 C ATOM 1456 CE3 TRP A 89 4.085 5.680 2.081 1.00 0.26 C ATOM 1457 CZ2 TRP A 89 6.583 4.614 2.798 1.00 0.23 C ATOM 1458 CZ3 TRP A 89 4.346 5.318 3.413 1.00 0.26 C ATOM 1459 CH2 TRP A 89 5.593 4.785 3.770 1.00 0.25 C ATOM 0 H TRP A 89 2.000 6.901 -2.477 1.00 0.32 H new ATOM 0 HA TRP A 89 4.070 4.971 -2.844 1.00 0.30 H new ATOM 0 HB2 TRP A 89 4.460 7.163 -1.827 1.00 0.28 H new ATOM 0 HB3 TRP A 89 3.281 6.852 -0.568 1.00 0.28 H new ATOM 0 HD1 TRP A 89 6.697 5.503 -1.784 1.00 0.25 H new ATOM 0 HE1 TRP A 89 8.016 4.599 0.247 1.00 0.23 H new ATOM 0 HE3 TRP A 89 3.121 6.087 1.815 1.00 0.26 H new ATOM 0 HZ2 TRP A 89 7.545 4.204 3.068 1.00 0.23 H new ATOM 0 HZ3 TRP A 89 3.583 5.451 4.166 1.00 0.26 H new ATOM 0 HH2 TRP A 89 5.788 4.507 4.795 1.00 0.25 H new ATOM 1470 N GLU A 90 1.982 4.241 -0.380 1.00 0.31 N ATOM 1471 CA GLU A 90 1.578 3.060 0.435 1.00 0.33 C ATOM 1472 C GLU A 90 0.950 2.005 -0.482 1.00 0.33 C ATOM 1473 O GLU A 90 1.189 0.823 -0.331 1.00 0.34 O ATOM 1474 CB GLU A 90 0.583 3.478 1.522 1.00 0.37 C ATOM 1475 CG GLU A 90 -0.601 4.204 0.888 1.00 0.85 C ATOM 1476 CD GLU A 90 -1.546 4.694 1.985 1.00 1.16 C ATOM 1477 OE1 GLU A 90 -1.369 4.281 3.120 1.00 1.81 O ATOM 1478 OE2 GLU A 90 -2.427 5.477 1.674 1.00 1.68 O ATOM 0 H GLU A 90 1.454 5.098 -0.213 1.00 0.31 H new ATOM 0 HA GLU A 90 2.458 2.639 0.921 1.00 0.33 H new ATOM 0 HB2 GLU A 90 0.234 2.600 2.066 1.00 0.37 H new ATOM 0 HB3 GLU A 90 1.074 4.127 2.247 1.00 0.37 H new ATOM 0 HG2 GLU A 90 -0.248 5.047 0.294 1.00 0.85 H new ATOM 0 HG3 GLU A 90 -1.130 3.535 0.209 1.00 0.85 H new ATOM 1485 N ARG A 91 0.159 2.417 -1.438 1.00 0.34 N ATOM 1486 CA ARG A 91 -0.459 1.421 -2.358 1.00 0.36 C ATOM 1487 C ARG A 91 0.638 0.686 -3.125 1.00 0.34 C ATOM 1488 O ARG A 91 0.572 -0.512 -3.309 1.00 0.35 O ATOM 1489 CB ARG A 91 -1.392 2.132 -3.337 1.00 0.40 C ATOM 1490 CG ARG A 91 -2.632 2.627 -2.588 1.00 0.44 C ATOM 1491 CD ARG A 91 -3.523 3.419 -3.544 1.00 1.07 C ATOM 1492 NE ARG A 91 -2.811 4.653 -3.969 1.00 1.68 N ATOM 1493 CZ ARG A 91 -3.235 5.331 -4.998 1.00 2.31 C ATOM 1494 NH1 ARG A 91 -4.297 4.936 -5.646 1.00 2.62 N ATOM 1495 NH2 ARG A 91 -2.598 6.405 -5.377 1.00 3.18 N ATOM 0 H ARG A 91 -0.083 3.391 -1.620 1.00 0.34 H new ATOM 0 HA ARG A 91 -1.036 0.701 -1.778 1.00 0.36 H new ATOM 0 HB2 ARG A 91 -0.876 2.971 -3.804 1.00 0.40 H new ATOM 0 HB3 ARG A 91 -1.684 1.452 -4.137 1.00 0.40 H new ATOM 0 HG2 ARG A 91 -3.183 1.781 -2.177 1.00 0.44 H new ATOM 0 HG3 ARG A 91 -2.336 3.254 -1.747 1.00 0.44 H new ATOM 0 HD2 ARG A 91 -3.773 2.812 -4.414 1.00 1.07 H new ATOM 0 HD3 ARG A 91 -4.462 3.677 -3.055 1.00 1.07 H new ATOM 0 HE ARG A 91 -1.989 4.969 -3.454 1.00 1.68 H new ATOM 0 HH11 ARG A 91 -4.794 4.097 -5.347 1.00 2.62 H new ATOM 0 HH12 ARG A 91 -4.630 5.466 -6.451 1.00 2.62 H new ATOM 0 HH21 ARG A 91 -1.769 6.713 -4.868 1.00 3.18 H new ATOM 0 HH22 ARG A 91 -2.929 6.937 -6.182 1.00 3.18 H new ATOM 1509 N LYS A 92 1.662 1.378 -3.559 1.00 0.34 N ATOM 1510 CA LYS A 92 2.751 0.670 -4.287 1.00 0.34 C ATOM 1511 C LYS A 92 3.340 -0.384 -3.355 1.00 0.31 C ATOM 1512 O LYS A 92 3.589 -1.505 -3.747 1.00 0.32 O ATOM 1513 CB LYS A 92 3.837 1.660 -4.717 1.00 0.34 C ATOM 1514 CG LYS A 92 3.359 2.450 -5.945 1.00 0.68 C ATOM 1515 CD LYS A 92 4.423 3.480 -6.362 1.00 1.08 C ATOM 1516 CE LYS A 92 5.517 2.811 -7.199 1.00 1.41 C ATOM 1517 NZ LYS A 92 6.485 3.846 -7.658 1.00 2.14 N ATOM 0 H LYS A 92 1.788 2.383 -3.442 1.00 0.34 H new ATOM 0 HA LYS A 92 2.352 0.198 -5.185 1.00 0.34 H new ATOM 0 HB2 LYS A 92 4.065 2.343 -3.899 1.00 0.34 H new ATOM 0 HB3 LYS A 92 4.758 1.126 -4.952 1.00 0.34 H new ATOM 0 HG2 LYS A 92 3.160 1.767 -6.771 1.00 0.68 H new ATOM 0 HG3 LYS A 92 2.421 2.957 -5.718 1.00 0.68 H new ATOM 0 HD2 LYS A 92 3.957 4.281 -6.935 1.00 1.08 H new ATOM 0 HD3 LYS A 92 4.863 3.937 -5.475 1.00 1.08 H new ATOM 0 HE2 LYS A 92 6.030 2.052 -6.608 1.00 1.41 H new ATOM 0 HE3 LYS A 92 5.076 2.303 -8.056 1.00 1.41 H new ATOM 0 HZ1 LYS A 92 7.230 3.396 -8.227 1.00 2.14 H new ATOM 0 HZ2 LYS A 92 5.988 4.554 -8.235 1.00 2.14 H new ATOM 0 HZ3 LYS A 92 6.913 4.311 -6.832 1.00 2.14 H new ATOM 1531 N VAL A 93 3.536 -0.041 -2.110 1.00 0.29 N ATOM 1532 CA VAL A 93 4.080 -1.036 -1.147 1.00 0.28 C ATOM 1533 C VAL A 93 3.112 -2.215 -1.080 1.00 0.29 C ATOM 1534 O VAL A 93 3.509 -3.363 -1.061 1.00 0.29 O ATOM 1535 CB VAL A 93 4.199 -0.395 0.247 1.00 0.28 C ATOM 1536 CG1 VAL A 93 4.519 -1.477 1.290 1.00 0.29 C ATOM 1537 CG2 VAL A 93 5.305 0.677 0.245 1.00 0.28 C ATOM 0 H VAL A 93 3.343 0.882 -1.721 1.00 0.29 H new ATOM 0 HA VAL A 93 5.066 -1.371 -1.470 1.00 0.28 H new ATOM 0 HB VAL A 93 3.251 0.079 0.502 1.00 0.28 H new ATOM 0 HG11 VAL A 93 4.602 -1.019 2.276 1.00 0.29 H new ATOM 0 HG12 VAL A 93 3.721 -2.219 1.301 1.00 0.29 H new ATOM 0 HG13 VAL A 93 5.461 -1.962 1.034 1.00 0.29 H new ATOM 0 HG21 VAL A 93 5.380 1.124 1.236 1.00 0.28 H new ATOM 0 HG22 VAL A 93 6.257 0.217 -0.019 1.00 0.28 H new ATOM 0 HG23 VAL A 93 5.061 1.450 -0.484 1.00 0.28 H new ATOM 1547 N ASP A 94 1.839 -1.934 -1.037 1.00 0.30 N ATOM 1548 CA ASP A 94 0.836 -3.029 -0.968 1.00 0.32 C ATOM 1549 C ASP A 94 0.974 -3.928 -2.200 1.00 0.33 C ATOM 1550 O ASP A 94 1.051 -5.135 -2.090 1.00 0.35 O ATOM 1551 CB ASP A 94 -0.569 -2.421 -0.918 1.00 0.35 C ATOM 1552 CG ASP A 94 -1.611 -3.531 -0.772 1.00 1.26 C ATOM 1553 OD1 ASP A 94 -1.277 -4.671 -1.049 1.00 1.96 O ATOM 1554 OD2 ASP A 94 -2.725 -3.221 -0.383 1.00 2.03 O ATOM 0 H ASP A 94 1.451 -0.991 -1.047 1.00 0.30 H new ATOM 0 HA ASP A 94 1.003 -3.627 -0.072 1.00 0.32 H new ATOM 0 HB2 ASP A 94 -0.645 -1.727 -0.081 1.00 0.35 H new ATOM 0 HB3 ASP A 94 -0.760 -1.848 -1.826 1.00 0.35 H new ATOM 1559 N PHE A 95 1.012 -3.352 -3.375 1.00 0.34 N ATOM 1560 CA PHE A 95 1.153 -4.191 -4.600 1.00 0.36 C ATOM 1561 C PHE A 95 2.470 -4.962 -4.547 1.00 0.34 C ATOM 1562 O PHE A 95 2.506 -6.158 -4.759 1.00 0.35 O ATOM 1563 CB PHE A 95 1.125 -3.309 -5.851 1.00 0.39 C ATOM 1564 CG PHE A 95 -0.288 -2.834 -6.100 1.00 0.43 C ATOM 1565 CD1 PHE A 95 -1.265 -3.747 -6.513 1.00 0.47 C ATOM 1566 CD2 PHE A 95 -0.622 -1.488 -5.910 1.00 0.43 C ATOM 1567 CE1 PHE A 95 -2.576 -3.315 -6.739 1.00 0.51 C ATOM 1568 CE2 PHE A 95 -1.936 -1.055 -6.135 1.00 0.47 C ATOM 1569 CZ PHE A 95 -2.913 -1.969 -6.549 1.00 0.51 C ATOM 0 H PHE A 95 0.952 -2.347 -3.537 1.00 0.34 H new ATOM 0 HA PHE A 95 0.321 -4.894 -4.643 1.00 0.36 H new ATOM 0 HB2 PHE A 95 1.790 -2.455 -5.722 1.00 0.39 H new ATOM 0 HB3 PHE A 95 1.489 -3.869 -6.712 1.00 0.39 H new ATOM 0 HD1 PHE A 95 -1.007 -4.786 -6.657 1.00 0.47 H new ATOM 0 HD2 PHE A 95 0.132 -0.784 -5.590 1.00 0.43 H new ATOM 0 HE1 PHE A 95 -3.329 -4.020 -7.060 1.00 0.51 H new ATOM 0 HE2 PHE A 95 -2.195 -0.017 -5.989 1.00 0.47 H new ATOM 0 HZ PHE A 95 -3.926 -1.636 -6.722 1.00 0.51 H new ATOM 1579 N LEU A 96 3.559 -4.295 -4.260 1.00 0.33 N ATOM 1580 CA LEU A 96 4.856 -5.017 -4.195 1.00 0.32 C ATOM 1581 C LEU A 96 4.804 -6.005 -3.034 1.00 0.31 C ATOM 1582 O LEU A 96 5.255 -7.129 -3.138 1.00 0.32 O ATOM 1583 CB LEU A 96 5.993 -4.019 -3.963 1.00 0.32 C ATOM 1584 CG LEU A 96 6.063 -3.013 -5.120 1.00 0.33 C ATOM 1585 CD1 LEU A 96 7.148 -1.977 -4.813 1.00 0.35 C ATOM 1586 CD2 LEU A 96 6.402 -3.737 -6.436 1.00 0.36 C ATOM 0 H LEU A 96 3.603 -3.294 -4.071 1.00 0.33 H new ATOM 0 HA LEU A 96 5.033 -5.546 -5.132 1.00 0.32 H new ATOM 0 HB2 LEU A 96 5.836 -3.491 -3.022 1.00 0.32 H new ATOM 0 HB3 LEU A 96 6.941 -4.551 -3.876 1.00 0.32 H new ATOM 0 HG LEU A 96 5.096 -2.521 -5.229 1.00 0.33 H new ATOM 0 HD11 LEU A 96 7.205 -1.257 -5.630 1.00 0.35 H new ATOM 0 HD12 LEU A 96 6.903 -1.456 -3.887 1.00 0.35 H new ATOM 0 HD13 LEU A 96 8.109 -2.479 -4.703 1.00 0.35 H new ATOM 0 HD21 LEU A 96 6.449 -3.012 -7.249 1.00 0.36 H new ATOM 0 HD22 LEU A 96 7.366 -4.236 -6.339 1.00 0.36 H new ATOM 0 HD23 LEU A 96 5.631 -4.477 -6.653 1.00 0.36 H new ATOM 1598 N GLU A 97 4.241 -5.598 -1.929 1.00 0.31 N ATOM 1599 CA GLU A 97 4.145 -6.521 -0.769 1.00 0.32 C ATOM 1600 C GLU A 97 3.326 -7.745 -1.176 1.00 0.34 C ATOM 1601 O GLU A 97 3.693 -8.870 -0.904 1.00 0.36 O ATOM 1602 CB GLU A 97 3.466 -5.807 0.401 1.00 0.34 C ATOM 1603 CG GLU A 97 3.379 -6.752 1.601 1.00 0.95 C ATOM 1604 CD GLU A 97 2.814 -5.995 2.803 1.00 1.22 C ATOM 1605 OE1 GLU A 97 2.643 -4.792 2.693 1.00 1.86 O ATOM 1606 OE2 GLU A 97 2.562 -6.631 3.814 1.00 1.69 O ATOM 0 H GLU A 97 3.846 -4.669 -1.782 1.00 0.31 H new ATOM 0 HA GLU A 97 5.143 -6.834 -0.461 1.00 0.32 H new ATOM 0 HB2 GLU A 97 4.029 -4.913 0.670 1.00 0.34 H new ATOM 0 HB3 GLU A 97 2.468 -5.480 0.110 1.00 0.34 H new ATOM 0 HG2 GLU A 97 2.742 -7.604 1.362 1.00 0.95 H new ATOM 0 HG3 GLU A 97 4.366 -7.148 1.838 1.00 0.95 H new ATOM 1613 N GLU A 98 2.212 -7.531 -1.828 1.00 0.35 N ATOM 1614 CA GLU A 98 1.366 -8.682 -2.253 1.00 0.37 C ATOM 1615 C GLU A 98 2.155 -9.563 -3.222 1.00 0.36 C ATOM 1616 O GLU A 98 2.132 -10.774 -3.134 1.00 0.38 O ATOM 1617 CB GLU A 98 0.100 -8.165 -2.945 1.00 0.41 C ATOM 1618 CG GLU A 98 -0.800 -9.348 -3.320 1.00 1.18 C ATOM 1619 CD GLU A 98 -2.071 -8.832 -3.996 1.00 1.32 C ATOM 1620 OE1 GLU A 98 -2.256 -7.626 -4.023 1.00 1.77 O ATOM 1621 OE2 GLU A 98 -2.836 -9.651 -4.478 1.00 1.85 O ATOM 0 H GLU A 98 1.854 -6.611 -2.083 1.00 0.35 H new ATOM 0 HA GLU A 98 1.084 -9.266 -1.377 1.00 0.37 H new ATOM 0 HB2 GLU A 98 -0.435 -7.483 -2.284 1.00 0.41 H new ATOM 0 HB3 GLU A 98 0.366 -7.600 -3.838 1.00 0.41 H new ATOM 0 HG2 GLU A 98 -0.269 -10.024 -3.990 1.00 1.18 H new ATOM 0 HG3 GLU A 98 -1.057 -9.920 -2.428 1.00 1.18 H new ATOM 1628 N ASN A 99 2.851 -8.964 -4.152 1.00 0.35 N ATOM 1629 CA ASN A 99 3.635 -9.774 -5.125 1.00 0.36 C ATOM 1630 C ASN A 99 4.717 -10.546 -4.379 1.00 0.34 C ATOM 1631 O ASN A 99 4.987 -11.695 -4.667 1.00 0.35 O ATOM 1632 CB ASN A 99 4.284 -8.850 -6.159 1.00 0.37 C ATOM 1633 CG ASN A 99 3.203 -8.264 -7.070 1.00 1.26 C ATOM 1634 OD1 ASN A 99 2.237 -9.033 -7.494 1.00 2.16 O flip ATOM 1635 ND2 ASN A 99 3.238 -7.096 -7.400 1.00 1.83 N flip ATOM 0 H ASN A 99 2.909 -7.954 -4.278 1.00 0.35 H new ATOM 0 HA ASN A 99 2.972 -10.473 -5.635 1.00 0.36 H new ATOM 0 HB2 ASN A 99 4.825 -8.048 -5.657 1.00 0.37 H new ATOM 0 HB3 ASN A 99 5.012 -9.404 -6.751 1.00 0.37 H new ATOM 0 HD21 ASN A 99 3.993 -6.495 -7.069 1.00 1.83 H new ATOM 0 HD22 ASN A 99 2.513 -6.716 -8.008 1.00 1.83 H new ATOM 1642 N ILE A 100 5.336 -9.924 -3.417 1.00 0.32 N ATOM 1643 CA ILE A 100 6.397 -10.623 -2.650 1.00 0.30 C ATOM 1644 C ILE A 100 5.762 -11.730 -1.807 1.00 0.32 C ATOM 1645 O ILE A 100 6.280 -12.822 -1.714 1.00 0.33 O ATOM 1646 CB ILE A 100 7.102 -9.610 -1.744 1.00 0.29 C ATOM 1647 CG1 ILE A 100 7.915 -8.647 -2.613 1.00 0.29 C ATOM 1648 CG2 ILE A 100 8.037 -10.339 -0.773 1.00 0.29 C ATOM 1649 CD1 ILE A 100 8.395 -7.469 -1.763 1.00 0.30 C ATOM 0 H ILE A 100 5.152 -8.963 -3.130 1.00 0.32 H new ATOM 0 HA ILE A 100 7.124 -11.067 -3.330 1.00 0.30 H new ATOM 0 HB ILE A 100 6.359 -9.055 -1.170 1.00 0.29 H new ATOM 0 HG12 ILE A 100 8.769 -9.166 -3.048 1.00 0.29 H new ATOM 0 HG13 ILE A 100 7.306 -8.286 -3.442 1.00 0.29 H new ATOM 0 HG21 ILE A 100 8.535 -9.611 -0.132 1.00 0.29 H new ATOM 0 HG22 ILE A 100 7.458 -11.028 -0.158 1.00 0.29 H new ATOM 0 HG23 ILE A 100 8.784 -10.897 -1.337 1.00 0.29 H new ATOM 0 HD11 ILE A 100 8.974 -6.785 -2.383 1.00 0.30 H new ATOM 0 HD12 ILE A 100 7.534 -6.944 -1.349 1.00 0.30 H new ATOM 0 HD13 ILE A 100 9.020 -7.838 -0.950 1.00 0.30 H new ATOM 1661 N THR A 101 4.636 -11.469 -1.204 1.00 0.33 N ATOM 1662 CA THR A 101 3.984 -12.525 -0.381 1.00 0.36 C ATOM 1663 C THR A 101 3.600 -13.701 -1.278 1.00 0.38 C ATOM 1664 O THR A 101 3.790 -14.849 -0.927 1.00 0.40 O ATOM 1665 CB THR A 101 2.729 -11.957 0.283 1.00 0.39 C ATOM 1666 OG1 THR A 101 1.908 -11.351 -0.704 1.00 0.40 O ATOM 1667 CG2 THR A 101 3.125 -10.917 1.334 1.00 0.39 C ATOM 0 H THR A 101 4.142 -10.577 -1.245 1.00 0.33 H new ATOM 0 HA THR A 101 4.676 -12.865 0.389 1.00 0.36 H new ATOM 0 HB THR A 101 2.179 -12.763 0.769 1.00 0.39 H new ATOM 0 HG1 THR A 101 2.433 -11.197 -1.517 1.00 0.40 H new ATOM 0 HG21 THR A 101 2.228 -10.515 1.804 1.00 0.39 H new ATOM 0 HG22 THR A 101 3.753 -11.386 2.092 1.00 0.39 H new ATOM 0 HG23 THR A 101 3.677 -10.108 0.855 1.00 0.39 H new ATOM 1675 N ALA A 102 3.062 -13.427 -2.433 1.00 0.39 N ATOM 1676 CA ALA A 102 2.670 -14.535 -3.345 1.00 0.42 C ATOM 1677 C ALA A 102 3.905 -15.356 -3.723 1.00 0.41 C ATOM 1678 O ALA A 102 3.888 -16.570 -3.680 1.00 0.43 O ATOM 1679 CB ALA A 102 2.033 -13.955 -4.609 1.00 0.44 C ATOM 0 H ALA A 102 2.877 -12.487 -2.784 1.00 0.39 H new ATOM 0 HA ALA A 102 1.952 -15.180 -2.839 1.00 0.42 H new ATOM 0 HB1 ALA A 102 1.746 -14.767 -5.277 1.00 0.44 H new ATOM 0 HB2 ALA A 102 1.149 -13.378 -4.339 1.00 0.44 H new ATOM 0 HB3 ALA A 102 2.750 -13.307 -5.113 1.00 0.44 H new ATOM 1685 N LEU A 103 4.975 -14.707 -4.100 1.00 0.38 N ATOM 1686 CA LEU A 103 6.200 -15.465 -4.485 1.00 0.37 C ATOM 1687 C LEU A 103 6.729 -16.235 -3.278 1.00 0.35 C ATOM 1688 O LEU A 103 7.140 -17.373 -3.392 1.00 0.37 O ATOM 1689 CB LEU A 103 7.269 -14.489 -4.982 1.00 0.35 C ATOM 1690 CG LEU A 103 6.797 -13.812 -6.277 1.00 0.36 C ATOM 1691 CD1 LEU A 103 7.788 -12.710 -6.659 1.00 0.38 C ATOM 1692 CD2 LEU A 103 6.697 -14.842 -7.420 1.00 0.44 C ATOM 0 H LEU A 103 5.053 -13.692 -4.158 1.00 0.38 H new ATOM 0 HA LEU A 103 5.955 -16.169 -5.280 1.00 0.37 H new ATOM 0 HB2 LEU A 103 7.469 -13.736 -4.220 1.00 0.35 H new ATOM 0 HB3 LEU A 103 8.204 -15.020 -5.159 1.00 0.35 H new ATOM 0 HG LEU A 103 5.810 -13.381 -6.113 1.00 0.36 H new ATOM 0 HD11 LEU A 103 7.457 -12.226 -7.578 1.00 0.38 H new ATOM 0 HD12 LEU A 103 7.838 -11.972 -5.858 1.00 0.38 H new ATOM 0 HD13 LEU A 103 8.775 -13.146 -6.813 1.00 0.38 H new ATOM 0 HD21 LEU A 103 6.361 -14.344 -8.330 1.00 0.44 H new ATOM 0 HD22 LEU A 103 7.675 -15.291 -7.592 1.00 0.44 H new ATOM 0 HD23 LEU A 103 5.984 -15.620 -7.147 1.00 0.44 H new ATOM 1704 N LEU A 104 6.714 -15.640 -2.115 1.00 0.33 N ATOM 1705 CA LEU A 104 7.206 -16.374 -0.919 1.00 0.33 C ATOM 1706 C LEU A 104 6.350 -17.619 -0.713 1.00 0.38 C ATOM 1707 O LEU A 104 6.853 -18.690 -0.448 1.00 0.39 O ATOM 1708 CB LEU A 104 7.126 -15.485 0.325 1.00 0.33 C ATOM 1709 CG LEU A 104 8.169 -14.362 0.240 1.00 0.29 C ATOM 1710 CD1 LEU A 104 7.914 -13.355 1.368 1.00 0.31 C ATOM 1711 CD2 LEU A 104 9.593 -14.943 0.366 1.00 0.27 C ATOM 0 H LEU A 104 6.386 -14.689 -1.945 1.00 0.33 H new ATOM 0 HA LEU A 104 8.246 -16.658 -1.077 1.00 0.33 H new ATOM 0 HB2 LEU A 104 6.127 -15.058 0.412 1.00 0.33 H new ATOM 0 HB3 LEU A 104 7.296 -16.083 1.220 1.00 0.33 H new ATOM 0 HG LEU A 104 8.084 -13.863 -0.725 1.00 0.29 H new ATOM 0 HD11 LEU A 104 8.651 -12.554 1.314 1.00 0.31 H new ATOM 0 HD12 LEU A 104 6.914 -12.935 1.262 1.00 0.31 H new ATOM 0 HD13 LEU A 104 7.996 -13.859 2.331 1.00 0.31 H new ATOM 0 HD21 LEU A 104 10.322 -14.135 0.304 1.00 0.27 H new ATOM 0 HD22 LEU A 104 9.695 -15.451 1.325 1.00 0.27 H new ATOM 0 HD23 LEU A 104 9.769 -15.653 -0.442 1.00 0.27 H new ATOM 1723 N GLU A 105 5.059 -17.492 -0.844 1.00 0.41 N ATOM 1724 CA GLU A 105 4.188 -18.681 -0.661 1.00 0.45 C ATOM 1725 C GLU A 105 4.588 -19.735 -1.692 1.00 0.46 C ATOM 1726 O GLU A 105 4.813 -20.884 -1.365 1.00 0.48 O ATOM 1727 CB GLU A 105 2.725 -18.272 -0.861 1.00 0.49 C ATOM 1728 CG GLU A 105 1.812 -19.484 -0.663 1.00 0.54 C ATOM 1729 CD GLU A 105 0.356 -19.059 -0.857 1.00 1.15 C ATOM 1730 OE1 GLU A 105 0.115 -17.866 -0.941 1.00 1.84 O ATOM 1731 OE2 GLU A 105 -0.494 -19.932 -0.912 1.00 1.82 O ATOM 0 H GLU A 105 4.574 -16.623 -1.068 1.00 0.41 H new ATOM 0 HA GLU A 105 4.303 -19.089 0.343 1.00 0.45 H new ATOM 0 HB2 GLU A 105 2.458 -17.486 -0.154 1.00 0.49 H new ATOM 0 HB3 GLU A 105 2.587 -17.862 -1.861 1.00 0.49 H new ATOM 0 HG2 GLU A 105 2.071 -20.269 -1.374 1.00 0.54 H new ATOM 0 HG3 GLU A 105 1.951 -19.899 0.335 1.00 0.54 H new ATOM 1738 N GLU A 106 4.698 -19.350 -2.935 1.00 0.46 N ATOM 1739 CA GLU A 106 5.107 -20.327 -3.981 1.00 0.48 C ATOM 1740 C GLU A 106 6.533 -20.794 -3.689 1.00 0.44 C ATOM 1741 O GLU A 106 6.859 -21.957 -3.819 1.00 0.46 O ATOM 1742 CB GLU A 106 5.063 -19.651 -5.356 1.00 0.49 C ATOM 1743 CG GLU A 106 5.467 -20.652 -6.444 1.00 1.17 C ATOM 1744 CD GLU A 106 5.406 -19.971 -7.814 1.00 1.67 C ATOM 1745 OE1 GLU A 106 5.087 -18.794 -7.856 1.00 2.27 O ATOM 1746 OE2 GLU A 106 5.688 -20.636 -8.797 1.00 2.26 O ATOM 0 H GLU A 106 4.522 -18.403 -3.270 1.00 0.46 H new ATOM 0 HA GLU A 106 4.429 -21.180 -3.977 1.00 0.48 H new ATOM 0 HB2 GLU A 106 4.060 -19.272 -5.553 1.00 0.49 H new ATOM 0 HB3 GLU A 106 5.736 -18.794 -5.371 1.00 0.49 H new ATOM 0 HG2 GLU A 106 6.474 -21.023 -6.255 1.00 1.17 H new ATOM 0 HG3 GLU A 106 4.801 -21.514 -6.425 1.00 1.17 H new ATOM 1753 N ALA A 107 7.389 -19.888 -3.294 1.00 0.40 N ATOM 1754 CA ALA A 107 8.795 -20.275 -2.995 1.00 0.38 C ATOM 1755 C ALA A 107 8.815 -21.264 -1.829 1.00 0.40 C ATOM 1756 O ALA A 107 9.494 -22.270 -1.875 1.00 0.41 O ATOM 1757 CB ALA A 107 9.605 -19.029 -2.633 1.00 0.34 C ATOM 0 H ALA A 107 7.174 -18.899 -3.166 1.00 0.40 H new ATOM 0 HA ALA A 107 9.237 -20.746 -3.873 1.00 0.38 H new ATOM 0 HB1 ALA A 107 10.634 -19.315 -2.414 1.00 0.34 H new ATOM 0 HB2 ALA A 107 9.592 -18.331 -3.470 1.00 0.34 H new ATOM 0 HB3 ALA A 107 9.167 -18.552 -1.756 1.00 0.34 H new ATOM 1763 N GLN A 108 8.072 -20.998 -0.786 1.00 0.42 N ATOM 1764 CA GLN A 108 8.061 -21.950 0.358 1.00 0.46 C ATOM 1765 C GLN A 108 7.571 -23.310 -0.133 1.00 0.51 C ATOM 1766 O GLN A 108 8.181 -24.329 0.123 1.00 0.53 O ATOM 1767 CB GLN A 108 7.138 -21.429 1.464 1.00 0.50 C ATOM 1768 CG GLN A 108 7.778 -20.209 2.132 1.00 0.48 C ATOM 1769 CD GLN A 108 6.781 -19.573 3.101 1.00 0.98 C ATOM 1770 OE1 GLN A 108 5.600 -19.512 2.824 1.00 1.69 O ATOM 1771 NE2 GLN A 108 7.212 -19.094 4.236 1.00 1.58 N ATOM 0 H GLN A 108 7.481 -20.174 -0.679 1.00 0.42 H new ATOM 0 HA GLN A 108 9.068 -22.048 0.763 1.00 0.46 H new ATOM 0 HB2 GLN A 108 6.168 -21.161 1.046 1.00 0.50 H new ATOM 0 HB3 GLN A 108 6.962 -22.211 2.203 1.00 0.50 H new ATOM 0 HG2 GLN A 108 8.681 -20.506 2.666 1.00 0.48 H new ATOM 0 HG3 GLN A 108 8.079 -19.484 1.376 1.00 0.48 H new ATOM 0 HE21 GLN A 108 8.204 -19.146 4.468 1.00 1.58 H new ATOM 0 HE22 GLN A 108 6.557 -18.668 4.891 1.00 1.58 H new ATOM 1780 N ILE A 109 6.481 -23.337 -0.852 1.00 0.53 N ATOM 1781 CA ILE A 109 5.975 -24.636 -1.370 1.00 0.58 C ATOM 1782 C ILE A 109 7.044 -25.261 -2.270 1.00 0.56 C ATOM 1783 O ILE A 109 7.396 -26.415 -2.128 1.00 0.58 O ATOM 1784 CB ILE A 109 4.693 -24.406 -2.174 1.00 0.61 C ATOM 1785 CG1 ILE A 109 3.609 -23.847 -1.248 1.00 0.64 C ATOM 1786 CG2 ILE A 109 4.221 -25.737 -2.763 1.00 0.67 C ATOM 1787 CD1 ILE A 109 2.419 -23.377 -2.084 1.00 0.67 C ATOM 0 H ILE A 109 5.924 -22.520 -1.101 1.00 0.53 H new ATOM 0 HA ILE A 109 5.756 -25.305 -0.538 1.00 0.58 H new ATOM 0 HB ILE A 109 4.886 -23.698 -2.980 1.00 0.61 H new ATOM 0 HG12 ILE A 109 3.290 -24.612 -0.540 1.00 0.64 H new ATOM 0 HG13 ILE A 109 4.007 -23.018 -0.663 1.00 0.64 H new ATOM 0 HG21 ILE A 109 3.308 -25.578 -3.337 1.00 0.67 H new ATOM 0 HG22 ILE A 109 4.994 -26.140 -3.417 1.00 0.67 H new ATOM 0 HG23 ILE A 109 4.024 -26.443 -1.956 1.00 0.67 H new ATOM 0 HD11 ILE A 109 1.647 -22.979 -1.426 1.00 0.67 H new ATOM 0 HD12 ILE A 109 2.744 -22.599 -2.774 1.00 0.67 H new ATOM 0 HD13 ILE A 109 2.016 -24.218 -2.649 1.00 0.67 H new ATOM 1799 N GLN A 110 7.559 -24.500 -3.202 1.00 0.53 N ATOM 1800 CA GLN A 110 8.604 -25.040 -4.119 1.00 0.52 C ATOM 1801 C GLN A 110 9.853 -25.416 -3.313 1.00 0.48 C ATOM 1802 O GLN A 110 10.481 -26.425 -3.561 1.00 0.50 O ATOM 1803 CB GLN A 110 8.970 -23.972 -5.156 1.00 0.51 C ATOM 1804 CG GLN A 110 10.039 -24.519 -6.107 1.00 1.18 C ATOM 1805 CD GLN A 110 10.313 -23.492 -7.209 1.00 1.47 C ATOM 1806 OE1 GLN A 110 9.598 -22.519 -7.340 1.00 2.12 O ATOM 1807 NE2 GLN A 110 11.320 -23.676 -8.020 1.00 1.93 N ATOM 0 H GLN A 110 7.300 -23.527 -3.366 1.00 0.53 H new ATOM 0 HA GLN A 110 8.220 -25.926 -4.624 1.00 0.52 H new ATOM 0 HB2 GLN A 110 8.084 -23.680 -5.719 1.00 0.51 H new ATOM 0 HB3 GLN A 110 9.339 -23.077 -4.655 1.00 0.51 H new ATOM 0 HG2 GLN A 110 10.956 -24.732 -5.557 1.00 1.18 H new ATOM 0 HG3 GLN A 110 9.704 -25.459 -6.546 1.00 1.18 H new ATOM 0 HE21 GLN A 110 11.921 -24.493 -7.910 1.00 1.93 H new ATOM 0 HE22 GLN A 110 11.506 -23.003 -8.763 1.00 1.93 H new ATOM 1816 N GLN A 111 10.218 -24.608 -2.352 1.00 0.45 N ATOM 1817 CA GLN A 111 11.427 -24.918 -1.535 1.00 0.43 C ATOM 1818 C GLN A 111 11.230 -26.262 -0.835 1.00 0.49 C ATOM 1819 O GLN A 111 12.107 -27.105 -0.823 1.00 0.49 O ATOM 1820 CB GLN A 111 11.627 -23.819 -0.486 1.00 0.42 C ATOM 1821 CG GLN A 111 12.981 -24.000 0.208 1.00 0.42 C ATOM 1822 CD GLN A 111 14.110 -23.662 -0.768 1.00 0.37 C ATOM 1823 OE1 GLN A 111 14.008 -22.720 -1.531 1.00 0.37 O ATOM 1824 NE2 GLN A 111 15.194 -24.387 -0.768 1.00 0.40 N ATOM 0 H GLN A 111 9.731 -23.748 -2.098 1.00 0.45 H new ATOM 0 HA GLN A 111 12.304 -24.967 -2.180 1.00 0.43 H new ATOM 0 HB2 GLN A 111 11.580 -22.839 -0.960 1.00 0.42 H new ATOM 0 HB3 GLN A 111 10.824 -23.856 0.250 1.00 0.42 H new ATOM 0 HG2 GLN A 111 13.040 -23.355 1.085 1.00 0.42 H new ATOM 0 HG3 GLN A 111 13.086 -25.026 0.559 1.00 0.42 H new ATOM 0 HE21 GLN A 111 15.279 -25.177 -0.128 1.00 0.40 H new ATOM 0 HE22 GLN A 111 15.957 -24.164 -1.408 1.00 0.40 H new ATOM 1833 N GLU A 112 10.080 -26.472 -0.257 1.00 0.53 N ATOM 1834 CA GLU A 112 9.819 -27.762 0.436 1.00 0.60 C ATOM 1835 C GLU A 112 9.772 -28.884 -0.602 1.00 0.62 C ATOM 1836 O GLU A 112 10.263 -29.974 -0.378 1.00 0.64 O ATOM 1837 CB GLU A 112 8.474 -27.690 1.163 1.00 0.66 C ATOM 1838 CG GLU A 112 8.587 -26.735 2.353 1.00 1.29 C ATOM 1839 CD GLU A 112 9.470 -27.363 3.432 1.00 1.72 C ATOM 1840 OE1 GLU A 112 9.626 -28.572 3.412 1.00 2.27 O ATOM 1841 OE2 GLU A 112 9.977 -26.623 4.260 1.00 2.24 O ATOM 0 H GLU A 112 9.309 -25.804 -0.235 1.00 0.53 H new ATOM 0 HA GLU A 112 10.611 -27.957 1.159 1.00 0.60 H new ATOM 0 HB2 GLU A 112 7.697 -27.346 0.480 1.00 0.66 H new ATOM 0 HB3 GLU A 112 8.180 -28.682 1.506 1.00 0.66 H new ATOM 0 HG2 GLU A 112 9.011 -25.784 2.030 1.00 1.29 H new ATOM 0 HG3 GLU A 112 7.597 -26.522 2.757 1.00 1.29 H new ATOM 1848 N LYS A 113 9.175 -28.628 -1.735 1.00 0.62 N ATOM 1849 CA LYS A 113 9.087 -29.679 -2.784 1.00 0.65 C ATOM 1850 C LYS A 113 10.495 -30.020 -3.282 1.00 0.60 C ATOM 1851 O LYS A 113 10.816 -31.169 -3.510 1.00 0.63 O ATOM 1852 CB LYS A 113 8.245 -29.152 -3.954 1.00 0.68 C ATOM 1853 CG LYS A 113 6.768 -29.027 -3.543 1.00 0.75 C ATOM 1854 CD LYS A 113 6.066 -30.392 -3.603 1.00 1.27 C ATOM 1855 CE LYS A 113 4.562 -30.196 -3.396 1.00 1.52 C ATOM 1856 NZ LYS A 113 3.981 -29.482 -4.569 1.00 2.10 N ATOM 0 H LYS A 113 8.745 -27.735 -1.978 1.00 0.62 H new ATOM 0 HA LYS A 113 8.622 -30.574 -2.371 1.00 0.65 H new ATOM 0 HB2 LYS A 113 8.623 -28.181 -4.273 1.00 0.68 H new ATOM 0 HB3 LYS A 113 8.335 -29.825 -4.807 1.00 0.68 H new ATOM 0 HG2 LYS A 113 6.700 -28.623 -2.533 1.00 0.75 H new ATOM 0 HG3 LYS A 113 6.261 -28.323 -4.203 1.00 0.75 H new ATOM 0 HD2 LYS A 113 6.253 -30.868 -4.565 1.00 1.27 H new ATOM 0 HD3 LYS A 113 6.467 -31.054 -2.836 1.00 1.27 H new ATOM 0 HE2 LYS A 113 4.074 -31.162 -3.268 1.00 1.52 H new ATOM 0 HE3 LYS A 113 4.382 -29.625 -2.485 1.00 1.52 H new ATOM 0 HZ1 LYS A 113 2.963 -29.684 -4.629 1.00 2.10 H new ATOM 0 HZ2 LYS A 113 4.125 -28.458 -4.458 1.00 2.10 H new ATOM 0 HZ3 LYS A 113 4.450 -29.805 -5.439 1.00 2.10 H new ATOM 1870 N ASN A 114 11.343 -29.037 -3.443 1.00 0.53 N ATOM 1871 CA ASN A 114 12.726 -29.330 -3.917 1.00 0.48 C ATOM 1872 C ASN A 114 13.437 -30.203 -2.889 1.00 0.49 C ATOM 1873 O ASN A 114 14.118 -31.151 -3.228 1.00 0.50 O ATOM 1874 CB ASN A 114 13.503 -28.023 -4.093 1.00 0.44 C ATOM 1875 CG ASN A 114 12.945 -27.252 -5.290 1.00 0.46 C ATOM 1876 OD1 ASN A 114 12.383 -27.837 -6.193 1.00 1.19 O ATOM 1877 ND2 ASN A 114 13.083 -25.956 -5.336 1.00 1.18 N ATOM 0 H ASN A 114 11.139 -28.053 -3.268 1.00 0.53 H new ATOM 0 HA ASN A 114 12.675 -29.851 -4.873 1.00 0.48 H new ATOM 0 HB2 ASN A 114 13.426 -27.418 -3.190 1.00 0.44 H new ATOM 0 HB3 ASN A 114 14.561 -28.235 -4.245 1.00 0.44 H new ATOM 0 HD21 ASN A 114 12.718 -25.432 -6.132 1.00 1.18 H new ATOM 0 HD22 ASN A 114 13.556 -25.466 -4.576 1.00 1.18 H new ATOM 1884 N MET A 115 13.276 -29.900 -1.632 1.00 0.50 N ATOM 1885 CA MET A 115 13.934 -30.724 -0.587 1.00 0.53 C ATOM 1886 C MET A 115 13.297 -32.113 -0.579 1.00 0.60 C ATOM 1887 O MET A 115 13.969 -33.116 -0.443 1.00 0.63 O ATOM 1888 CB MET A 115 13.750 -30.052 0.775 1.00 0.56 C ATOM 1889 CG MET A 115 14.533 -30.821 1.839 1.00 0.71 C ATOM 1890 SD MET A 115 14.352 -29.989 3.436 1.00 0.94 S ATOM 1891 CE MET A 115 15.136 -31.267 4.447 1.00 1.45 C ATOM 0 H MET A 115 12.718 -29.119 -1.286 1.00 0.50 H new ATOM 0 HA MET A 115 15.000 -30.817 -0.795 1.00 0.53 H new ATOM 0 HB2 MET A 115 14.095 -29.019 0.731 1.00 0.56 H new ATOM 0 HB3 MET A 115 12.692 -30.024 1.037 1.00 0.56 H new ATOM 0 HG2 MET A 115 14.167 -31.845 1.907 1.00 0.71 H new ATOM 0 HG3 MET A 115 15.586 -30.876 1.563 1.00 0.71 H new ATOM 0 HE1 MET A 115 15.134 -30.956 5.492 1.00 1.45 H new ATOM 0 HE2 MET A 115 14.584 -32.201 4.345 1.00 1.45 H new ATOM 0 HE3 MET A 115 16.163 -31.415 4.114 1.00 1.45 H new ATOM 1901 N TYR A 116 12.001 -32.181 -0.735 1.00 0.65 N ATOM 1902 CA TYR A 116 11.319 -33.505 -0.748 1.00 0.73 C ATOM 1903 C TYR A 116 11.877 -34.349 -1.896 1.00 0.71 C ATOM 1904 O TYR A 116 12.173 -35.516 -1.735 1.00 0.76 O ATOM 1905 CB TYR A 116 9.813 -33.310 -0.937 1.00 0.78 C ATOM 1906 CG TYR A 116 9.125 -34.655 -0.940 1.00 0.87 C ATOM 1907 CD1 TYR A 116 8.666 -35.205 0.265 1.00 0.95 C ATOM 1908 CD2 TYR A 116 8.944 -35.353 -2.140 1.00 0.91 C ATOM 1909 CE1 TYR A 116 8.028 -36.451 0.268 1.00 1.04 C ATOM 1910 CE2 TYR A 116 8.304 -36.600 -2.136 1.00 1.01 C ATOM 1911 CZ TYR A 116 7.847 -37.148 -0.932 1.00 1.07 C ATOM 1912 OH TYR A 116 7.219 -38.378 -0.927 1.00 1.18 O ATOM 0 H TYR A 116 11.387 -31.376 -0.854 1.00 0.65 H new ATOM 0 HA TYR A 116 11.496 -34.014 0.199 1.00 0.73 H new ATOM 0 HB2 TYR A 116 9.413 -32.687 -0.137 1.00 0.78 H new ATOM 0 HB3 TYR A 116 9.618 -32.788 -1.874 1.00 0.78 H new ATOM 0 HD1 TYR A 116 8.805 -34.667 1.191 1.00 0.95 H new ATOM 0 HD2 TYR A 116 9.298 -34.931 -3.069 1.00 0.91 H new ATOM 0 HE1 TYR A 116 7.675 -36.875 1.197 1.00 1.04 H new ATOM 0 HE2 TYR A 116 8.164 -37.138 -3.062 1.00 1.01 H new ATOM 0 HH TYR A 116 7.174 -38.726 -1.842 1.00 1.18 H new ATOM 1922 N GLU A 117 12.019 -33.768 -3.061 1.00 0.67 N ATOM 1923 CA GLU A 117 12.556 -34.543 -4.217 1.00 0.68 C ATOM 1924 C GLU A 117 13.965 -35.034 -3.886 1.00 0.64 C ATOM 1925 O GLU A 117 14.337 -36.148 -4.198 1.00 0.68 O ATOM 1926 CB GLU A 117 12.608 -33.643 -5.455 1.00 0.65 C ATOM 1927 CG GLU A 117 11.186 -33.345 -5.935 1.00 0.72 C ATOM 1928 CD GLU A 117 11.243 -32.446 -7.171 1.00 0.73 C ATOM 1929 OE1 GLU A 117 12.323 -31.977 -7.487 1.00 1.29 O ATOM 1930 OE2 GLU A 117 10.207 -32.244 -7.781 1.00 1.28 O ATOM 0 H GLU A 117 11.787 -32.795 -3.259 1.00 0.67 H new ATOM 0 HA GLU A 117 11.909 -35.397 -4.416 1.00 0.68 H new ATOM 0 HB2 GLU A 117 13.125 -32.713 -5.219 1.00 0.65 H new ATOM 0 HB3 GLU A 117 13.175 -34.131 -6.248 1.00 0.65 H new ATOM 0 HG2 GLU A 117 10.668 -34.275 -6.172 1.00 0.72 H new ATOM 0 HG3 GLU A 117 10.618 -32.857 -5.143 1.00 0.72 H new ATOM 1937 N LEU A 118 14.754 -34.208 -3.251 1.00 0.58 N ATOM 1938 CA LEU A 118 16.137 -34.625 -2.897 1.00 0.55 C ATOM 1939 C LEU A 118 16.067 -35.846 -1.975 1.00 0.64 C ATOM 1940 O LEU A 118 16.807 -36.798 -2.127 1.00 0.66 O ATOM 1941 CB LEU A 118 16.848 -33.467 -2.183 1.00 0.51 C ATOM 1942 CG LEU A 118 18.281 -33.867 -1.805 1.00 0.51 C ATOM 1943 CD1 LEU A 118 19.091 -34.199 -3.073 1.00 0.53 C ATOM 1944 CD2 LEU A 118 18.945 -32.700 -1.066 1.00 0.53 C ATOM 0 H LEU A 118 14.498 -33.263 -2.963 1.00 0.58 H new ATOM 0 HA LEU A 118 16.694 -34.883 -3.798 1.00 0.55 H new ATOM 0 HB2 LEU A 118 16.868 -32.590 -2.830 1.00 0.51 H new ATOM 0 HB3 LEU A 118 16.293 -33.189 -1.287 1.00 0.51 H new ATOM 0 HG LEU A 118 18.253 -34.748 -1.164 1.00 0.51 H new ATOM 0 HD11 LEU A 118 20.106 -34.481 -2.793 1.00 0.53 H new ATOM 0 HD12 LEU A 118 18.617 -35.026 -3.601 1.00 0.53 H new ATOM 0 HD13 LEU A 118 19.124 -33.325 -3.723 1.00 0.53 H new ATOM 0 HD21 LEU A 118 19.964 -32.975 -0.793 1.00 0.53 H new ATOM 0 HD22 LEU A 118 18.967 -31.824 -1.714 1.00 0.53 H new ATOM 0 HD23 LEU A 118 18.377 -32.470 -0.164 1.00 0.53 H new ATOM 1956 N GLN A 119 15.174 -35.826 -1.020 1.00 0.70 N ATOM 1957 CA GLN A 119 15.045 -36.979 -0.085 1.00 0.81 C ATOM 1958 C GLN A 119 14.668 -38.238 -0.871 1.00 0.86 C ATOM 1959 O GLN A 119 15.153 -39.318 -0.601 1.00 0.92 O ATOM 1960 CB GLN A 119 13.959 -36.676 0.950 1.00 0.88 C ATOM 1961 CG GLN A 119 14.454 -35.580 1.895 1.00 0.87 C ATOM 1962 CD GLN A 119 13.363 -35.250 2.913 1.00 0.95 C ATOM 1963 OE1 GLN A 119 12.193 -35.238 2.586 1.00 1.28 O ATOM 1964 NE2 GLN A 119 13.699 -34.978 4.145 1.00 1.46 N ATOM 0 H GLN A 119 14.527 -35.057 -0.848 1.00 0.70 H new ATOM 0 HA GLN A 119 15.995 -37.143 0.423 1.00 0.81 H new ATOM 0 HB2 GLN A 119 13.044 -36.356 0.451 1.00 0.88 H new ATOM 0 HB3 GLN A 119 13.717 -37.577 1.514 1.00 0.88 H new ATOM 0 HG2 GLN A 119 15.357 -35.909 2.409 1.00 0.87 H new ATOM 0 HG3 GLN A 119 14.718 -34.688 1.327 1.00 0.87 H new ATOM 0 HE21 GLN A 119 14.681 -34.988 4.420 1.00 1.46 H new ATOM 0 HE22 GLN A 119 12.979 -34.756 4.833 1.00 1.46 H new ATOM 1973 N LYS A 120 13.802 -38.106 -1.838 1.00 0.85 N ATOM 1974 CA LYS A 120 13.388 -39.293 -2.641 1.00 0.93 C ATOM 1975 C LYS A 120 14.613 -39.895 -3.324 1.00 0.90 C ATOM 1976 O LYS A 120 14.761 -41.098 -3.398 1.00 0.98 O ATOM 1977 CB LYS A 120 12.353 -38.874 -3.693 1.00 0.95 C ATOM 1978 CG LYS A 120 11.029 -38.486 -3.011 1.00 1.01 C ATOM 1979 CD LYS A 120 10.181 -39.744 -2.699 1.00 1.57 C ATOM 1980 CE LYS A 120 9.213 -40.032 -3.853 1.00 1.88 C ATOM 1981 NZ LYS A 120 9.905 -39.813 -5.154 1.00 2.44 N ATOM 0 H LYS A 120 13.362 -37.226 -2.108 1.00 0.85 H new ATOM 0 HA LYS A 120 12.940 -40.038 -1.984 1.00 0.93 H new ATOM 0 HB2 LYS A 120 12.733 -38.032 -4.272 1.00 0.95 H new ATOM 0 HB3 LYS A 120 12.184 -39.692 -4.393 1.00 0.95 H new ATOM 0 HG2 LYS A 120 11.235 -37.943 -2.089 1.00 1.01 H new ATOM 0 HG3 LYS A 120 10.465 -37.813 -3.657 1.00 1.01 H new ATOM 0 HD2 LYS A 120 10.835 -40.602 -2.541 1.00 1.57 H new ATOM 0 HD3 LYS A 120 9.622 -39.594 -1.775 1.00 1.57 H new ATOM 0 HE2 LYS A 120 8.852 -41.059 -3.790 1.00 1.88 H new ATOM 0 HE3 LYS A 120 8.341 -39.382 -3.780 1.00 1.88 H new ATOM 0 HZ1 LYS A 120 9.257 -40.042 -5.935 1.00 2.44 H new ATOM 0 HZ2 LYS A 120 10.199 -38.818 -5.228 1.00 2.44 H new ATOM 0 HZ3 LYS A 120 10.743 -40.426 -5.209 1.00 2.44 H new ATOM 1995 N LEU A 121 15.499 -39.077 -3.819 1.00 0.79 N ATOM 1996 CA LEU A 121 16.711 -39.628 -4.483 1.00 0.78 C ATOM 1997 C LEU A 121 17.455 -40.471 -3.452 1.00 0.86 C ATOM 1998 O LEU A 121 17.837 -41.594 -3.714 1.00 0.95 O ATOM 1999 CB LEU A 121 17.609 -38.482 -4.957 1.00 0.67 C ATOM 2000 CG LEU A 121 16.877 -37.636 -6.008 1.00 0.66 C ATOM 2001 CD1 LEU A 121 17.748 -36.433 -6.380 1.00 0.61 C ATOM 2002 CD2 LEU A 121 16.598 -38.476 -7.269 1.00 0.76 C ATOM 0 H LEU A 121 15.437 -38.059 -3.793 1.00 0.79 H new ATOM 0 HA LEU A 121 16.435 -40.231 -5.348 1.00 0.78 H new ATOM 0 HB2 LEU A 121 17.892 -37.858 -4.110 1.00 0.67 H new ATOM 0 HB3 LEU A 121 18.530 -38.883 -5.379 1.00 0.67 H new ATOM 0 HG LEU A 121 15.928 -37.295 -5.594 1.00 0.66 H new ATOM 0 HD11 LEU A 121 17.233 -35.828 -7.126 1.00 0.61 H new ATOM 0 HD12 LEU A 121 17.935 -35.831 -5.491 1.00 0.61 H new ATOM 0 HD13 LEU A 121 18.696 -36.783 -6.788 1.00 0.61 H new ATOM 0 HD21 LEU A 121 16.078 -37.864 -8.006 1.00 0.76 H new ATOM 0 HD22 LEU A 121 17.541 -38.827 -7.688 1.00 0.76 H new ATOM 0 HD23 LEU A 121 15.977 -39.332 -7.006 1.00 0.76 H new ATOM 2014 N ASN A 122 17.638 -39.939 -2.268 1.00 0.88 N ATOM 2015 CA ASN A 122 18.331 -40.701 -1.182 1.00 1.02 C ATOM 2016 C ASN A 122 17.393 -40.800 0.025 1.00 1.08 C ATOM 2017 O ASN A 122 17.698 -40.323 1.099 1.00 1.15 O ATOM 2018 CB ASN A 122 19.605 -39.958 -0.772 1.00 1.10 C ATOM 2019 CG ASN A 122 20.354 -40.773 0.286 1.00 1.31 C ATOM 2020 OD1 ASN A 122 20.265 -40.488 1.464 1.00 1.78 O ATOM 2021 ND2 ASN A 122 21.094 -41.783 -0.086 1.00 1.70 N ATOM 0 H ASN A 122 17.334 -39.001 -2.005 1.00 0.88 H new ATOM 0 HA ASN A 122 18.592 -41.698 -1.536 1.00 1.02 H new ATOM 0 HB2 ASN A 122 20.242 -39.799 -1.642 1.00 1.10 H new ATOM 0 HB3 ASN A 122 19.353 -38.974 -0.377 1.00 1.10 H new ATOM 0 HD21 ASN A 122 21.596 -42.332 0.612 1.00 1.70 H new ATOM 0 HD22 ASN A 122 21.169 -42.023 -1.074 1.00 1.70 H new ATOM 2028 N SER A 123 16.249 -41.418 -0.144 1.00 1.09 N ATOM 2029 CA SER A 123 15.290 -41.548 0.995 1.00 1.18 C ATOM 2030 C SER A 123 15.599 -42.829 1.772 1.00 1.37 C ATOM 2031 O SER A 123 16.327 -43.656 1.250 1.00 1.92 O ATOM 2032 CB SER A 123 13.860 -41.618 0.448 1.00 1.16 C ATOM 2033 OG SER A 123 13.056 -42.390 1.331 1.00 1.83 O ATOM 2034 OXT SER A 123 15.100 -42.962 2.878 1.00 1.65 O ATOM 0 H SER A 123 15.939 -41.837 -1.021 1.00 1.09 H new ATOM 0 HA SER A 123 15.387 -40.687 1.656 1.00 1.18 H new ATOM 0 HB2 SER A 123 13.448 -40.614 0.346 1.00 1.16 H new ATOM 0 HB3 SER A 123 13.860 -42.065 -0.546 1.00 1.16 H new ATOM 0 HG SER A 123 12.140 -42.435 0.985 1.00 1.83 H new TER 2040 SER A 123 ATOM 2041 N ALA B 1 29.967 -36.864 -17.389 1.00 0.82 N ATOM 2042 CA ALA B 1 28.554 -36.579 -17.772 1.00 0.80 C ATOM 2043 C ALA B 1 27.887 -35.752 -16.670 1.00 0.71 C ATOM 2044 O ALA B 1 26.697 -35.507 -16.694 1.00 0.71 O ATOM 2045 CB ALA B 1 27.797 -37.898 -17.945 1.00 0.91 C ATOM 0 H1 ALA B 1 30.402 -37.482 -18.103 1.00 0.82 H new ATOM 0 H2 ALA B 1 30.498 -35.972 -17.333 1.00 0.82 H new ATOM 0 H3 ALA B 1 29.987 -37.337 -16.463 1.00 0.82 H new ATOM 0 HA ALA B 1 28.535 -36.023 -18.709 1.00 0.80 H new ATOM 0 HB1 ALA B 1 26.764 -37.691 -18.225 1.00 0.91 H new ATOM 0 HB2 ALA B 1 28.273 -38.491 -18.726 1.00 0.91 H new ATOM 0 HB3 ALA B 1 27.814 -38.453 -17.007 1.00 0.91 H new ATOM 2053 N GLN B 2 28.649 -35.322 -15.702 1.00 0.67 N ATOM 2054 CA GLN B 2 28.076 -34.510 -14.589 1.00 0.60 C ATOM 2055 C GLN B 2 27.937 -33.051 -15.030 1.00 0.52 C ATOM 2056 O GLN B 2 28.755 -32.534 -15.764 1.00 0.52 O ATOM 2057 CB GLN B 2 29.015 -34.587 -13.384 1.00 0.62 C ATOM 2058 CG GLN B 2 28.969 -35.994 -12.785 1.00 0.72 C ATOM 2059 CD GLN B 2 27.616 -36.220 -12.107 1.00 1.27 C ATOM 2060 OE1 GLN B 2 26.839 -37.176 -12.535 1.00 2.00 O flip ATOM 2061 NE2 GLN B 2 27.265 -35.521 -11.177 1.00 1.88 N flip ATOM 0 H GLN B 2 29.651 -35.499 -15.633 1.00 0.67 H new ATOM 0 HA GLN B 2 27.093 -34.899 -14.322 1.00 0.60 H new ATOM 0 HB2 GLN B 2 30.033 -34.344 -13.688 1.00 0.62 H new ATOM 0 HB3 GLN B 2 28.722 -33.852 -12.634 1.00 0.62 H new ATOM 0 HG2 GLN B 2 29.124 -36.738 -13.566 1.00 0.72 H new ATOM 0 HG3 GLN B 2 29.775 -36.119 -12.062 1.00 0.72 H new ATOM 0 HE21 GLN B 2 27.873 -34.774 -10.843 1.00 1.88 H new ATOM 0 HE22 GLN B 2 26.362 -35.682 -10.731 1.00 1.88 H new ATOM 2070 N SER B 3 26.908 -32.378 -14.581 1.00 0.47 N ATOM 2071 CA SER B 3 26.721 -30.947 -14.966 1.00 0.41 C ATOM 2072 C SER B 3 27.428 -30.053 -13.944 1.00 0.37 C ATOM 2073 O SER B 3 26.817 -29.218 -13.305 1.00 0.34 O ATOM 2074 CB SER B 3 25.227 -30.620 -14.985 1.00 0.41 C ATOM 2075 OG SER B 3 24.783 -30.367 -13.658 1.00 1.37 O ATOM 0 H SER B 3 26.190 -32.758 -13.965 1.00 0.47 H new ATOM 0 HA SER B 3 27.144 -30.773 -15.956 1.00 0.41 H new ATOM 0 HB2 SER B 3 25.042 -29.750 -15.615 1.00 0.41 H new ATOM 0 HB3 SER B 3 24.667 -31.450 -15.416 1.00 0.41 H new ATOM 0 HG SER B 3 25.137 -29.506 -13.353 1.00 1.37 H new ATOM 2081 N ARG B 4 28.713 -30.218 -13.791 1.00 0.41 N ATOM 2082 CA ARG B 4 29.464 -29.375 -12.818 1.00 0.42 C ATOM 2083 C ARG B 4 29.444 -27.923 -13.293 1.00 0.42 C ATOM 2084 O ARG B 4 29.298 -27.003 -12.511 1.00 0.43 O ATOM 2085 CB ARG B 4 30.909 -29.871 -12.735 1.00 0.51 C ATOM 2086 CG ARG B 4 30.936 -31.232 -12.037 1.00 0.91 C ATOM 2087 CD ARG B 4 32.378 -31.737 -11.956 1.00 1.03 C ATOM 2088 NE ARG B 4 32.392 -33.108 -11.373 1.00 1.97 N ATOM 2089 CZ ARG B 4 33.449 -33.860 -11.508 1.00 2.55 C ATOM 2090 NH1 ARG B 4 34.484 -33.418 -12.167 1.00 2.53 N ATOM 2091 NH2 ARG B 4 33.468 -35.057 -10.987 1.00 3.56 N ATOM 0 H ARG B 4 29.276 -30.901 -14.298 1.00 0.41 H new ATOM 0 HA ARG B 4 29.001 -29.441 -11.833 1.00 0.42 H new ATOM 0 HB2 ARG B 4 31.335 -29.953 -13.735 1.00 0.51 H new ATOM 0 HB3 ARG B 4 31.521 -29.155 -12.186 1.00 0.51 H new ATOM 0 HG2 ARG B 4 30.513 -31.147 -11.036 1.00 0.91 H new ATOM 0 HG3 ARG B 4 30.320 -31.945 -12.585 1.00 0.91 H new ATOM 0 HD2 ARG B 4 32.827 -31.748 -12.949 1.00 1.03 H new ATOM 0 HD3 ARG B 4 32.977 -31.063 -11.343 1.00 1.03 H new ATOM 0 HE ARG B 4 31.577 -33.458 -10.869 1.00 1.97 H new ATOM 0 HH11 ARG B 4 34.467 -32.484 -12.577 1.00 2.53 H new ATOM 0 HH12 ARG B 4 35.311 -34.006 -12.273 1.00 2.53 H new ATOM 0 HH21 ARG B 4 32.657 -35.403 -10.475 1.00 3.56 H new ATOM 0 HH22 ARG B 4 34.294 -35.646 -11.092 1.00 3.56 H new ATOM 2105 N THR B 5 29.587 -27.710 -14.573 1.00 0.45 N ATOM 2106 CA THR B 5 29.572 -26.320 -15.104 1.00 0.49 C ATOM 2107 C THR B 5 28.227 -25.662 -14.776 1.00 0.44 C ATOM 2108 O THR B 5 28.170 -24.527 -14.349 1.00 0.46 O ATOM 2109 CB THR B 5 29.778 -26.353 -16.623 1.00 0.54 C ATOM 2110 OG1 THR B 5 29.834 -25.025 -17.121 1.00 0.68 O ATOM 2111 CG2 THR B 5 28.623 -27.104 -17.289 1.00 0.57 C ATOM 0 H THR B 5 29.714 -28.440 -15.274 1.00 0.45 H new ATOM 0 HA THR B 5 30.375 -25.744 -14.644 1.00 0.49 H new ATOM 0 HB THR B 5 30.713 -26.866 -16.848 1.00 0.54 H new ATOM 0 HG1 THR B 5 29.967 -25.045 -18.092 1.00 0.68 H new ATOM 0 HG21 THR B 5 28.776 -27.124 -18.368 1.00 0.57 H new ATOM 0 HG22 THR B 5 28.586 -28.125 -16.909 1.00 0.57 H new ATOM 0 HG23 THR B 5 27.683 -26.599 -17.065 1.00 0.57 H new ATOM 2119 N LEU B 6 27.146 -26.370 -14.973 1.00 0.39 N ATOM 2120 CA LEU B 6 25.806 -25.789 -14.669 1.00 0.36 C ATOM 2121 C LEU B 6 25.745 -25.437 -13.179 1.00 0.32 C ATOM 2122 O LEU B 6 25.281 -24.382 -12.793 1.00 0.33 O ATOM 2123 CB LEU B 6 24.725 -26.819 -15.018 1.00 0.35 C ATOM 2124 CG LEU B 6 23.326 -26.259 -14.719 1.00 0.35 C ATOM 2125 CD1 LEU B 6 23.071 -24.993 -15.558 1.00 0.41 C ATOM 2126 CD2 LEU B 6 22.278 -27.327 -15.063 1.00 0.37 C ATOM 0 H LEU B 6 27.133 -27.325 -15.331 1.00 0.39 H new ATOM 0 HA LEU B 6 25.639 -24.886 -15.257 1.00 0.36 H new ATOM 0 HB2 LEU B 6 24.797 -27.087 -16.072 1.00 0.35 H new ATOM 0 HB3 LEU B 6 24.887 -27.732 -14.445 1.00 0.35 H new ATOM 0 HG LEU B 6 23.258 -25.998 -13.663 1.00 0.35 H new ATOM 0 HD11 LEU B 6 22.077 -24.605 -15.338 1.00 0.41 H new ATOM 0 HD12 LEU B 6 23.818 -24.238 -15.313 1.00 0.41 H new ATOM 0 HD13 LEU B 6 23.138 -25.239 -16.618 1.00 0.41 H new ATOM 0 HD21 LEU B 6 21.281 -26.939 -14.854 1.00 0.37 H new ATOM 0 HD22 LEU B 6 22.353 -27.584 -16.120 1.00 0.37 H new ATOM 0 HD23 LEU B 6 22.454 -28.218 -14.460 1.00 0.37 H new ATOM 2138 N LEU B 7 26.227 -26.316 -12.344 1.00 0.29 N ATOM 2139 CA LEU B 7 26.228 -26.052 -10.878 1.00 0.27 C ATOM 2140 C LEU B 7 27.048 -24.799 -10.587 1.00 0.30 C ATOM 2141 O LEU B 7 26.695 -23.999 -9.743 1.00 0.29 O ATOM 2142 CB LEU B 7 26.810 -27.258 -10.132 1.00 0.27 C ATOM 2143 CG LEU B 7 25.798 -28.420 -10.154 1.00 0.24 C ATOM 2144 CD1 LEU B 7 26.524 -29.743 -9.873 1.00 0.28 C ATOM 2145 CD2 LEU B 7 24.710 -28.208 -9.084 1.00 0.23 C ATOM 0 H LEU B 7 26.624 -27.215 -12.618 1.00 0.29 H new ATOM 0 HA LEU B 7 25.205 -25.893 -10.536 1.00 0.27 H new ATOM 0 HB2 LEU B 7 27.745 -27.569 -10.597 1.00 0.27 H new ATOM 0 HB3 LEU B 7 27.042 -26.984 -9.103 1.00 0.27 H new ATOM 0 HG LEU B 7 25.331 -28.453 -11.138 1.00 0.24 H new ATOM 0 HD11 LEU B 7 25.806 -30.563 -9.889 1.00 0.28 H new ATOM 0 HD12 LEU B 7 27.283 -29.911 -10.637 1.00 0.28 H new ATOM 0 HD13 LEU B 7 26.999 -29.696 -8.893 1.00 0.28 H new ATOM 0 HD21 LEU B 7 24.004 -29.038 -9.114 1.00 0.23 H new ATOM 0 HD22 LEU B 7 25.173 -28.161 -8.098 1.00 0.23 H new ATOM 0 HD23 LEU B 7 24.182 -27.275 -9.282 1.00 0.23 H new ATOM 2157 N ALA B 8 28.147 -24.618 -11.267 1.00 0.35 N ATOM 2158 CA ALA B 8 28.976 -23.412 -11.004 1.00 0.39 C ATOM 2159 C ALA B 8 28.118 -22.171 -11.250 1.00 0.38 C ATOM 2160 O ALA B 8 28.129 -21.237 -10.477 1.00 0.38 O ATOM 2161 CB ALA B 8 30.186 -23.400 -11.949 1.00 0.45 C ATOM 0 H ALA B 8 28.503 -25.247 -11.986 1.00 0.35 H new ATOM 0 HA ALA B 8 29.333 -23.421 -9.974 1.00 0.39 H new ATOM 0 HB1 ALA B 8 30.791 -22.515 -11.754 1.00 0.45 H new ATOM 0 HB2 ALA B 8 30.786 -24.294 -11.783 1.00 0.45 H new ATOM 0 HB3 ALA B 8 29.840 -23.382 -12.983 1.00 0.45 H new ATOM 2167 N GLY B 9 27.351 -22.162 -12.304 1.00 0.38 N ATOM 2168 CA GLY B 9 26.479 -20.984 -12.564 1.00 0.39 C ATOM 2169 C GLY B 9 25.470 -20.863 -11.420 1.00 0.34 C ATOM 2170 O GLY B 9 25.277 -19.806 -10.855 1.00 0.34 O ATOM 0 H GLY B 9 27.290 -22.913 -12.992 1.00 0.38 H new ATOM 0 HA2 GLY B 9 27.080 -20.077 -12.637 1.00 0.39 H new ATOM 0 HA3 GLY B 9 25.960 -21.100 -13.516 1.00 0.39 H new ATOM 2174 N ILE B 10 24.835 -21.950 -11.071 1.00 0.30 N ATOM 2175 CA ILE B 10 23.847 -21.922 -9.956 1.00 0.27 C ATOM 2176 C ILE B 10 24.545 -21.478 -8.670 1.00 0.26 C ATOM 2177 O ILE B 10 24.069 -20.614 -7.960 1.00 0.25 O ATOM 2178 CB ILE B 10 23.255 -23.320 -9.775 1.00 0.25 C ATOM 2179 CG1 ILE B 10 22.396 -23.656 -10.994 1.00 0.28 C ATOM 2180 CG2 ILE B 10 22.386 -23.359 -8.514 1.00 0.26 C ATOM 2181 CD1 ILE B 10 22.010 -25.134 -10.957 1.00 0.26 C ATOM 0 H ILE B 10 24.960 -22.861 -11.513 1.00 0.30 H new ATOM 0 HA ILE B 10 23.046 -21.219 -10.187 1.00 0.27 H new ATOM 0 HB ILE B 10 24.061 -24.047 -9.674 1.00 0.25 H new ATOM 0 HG12 ILE B 10 21.500 -23.036 -11.002 1.00 0.28 H new ATOM 0 HG13 ILE B 10 22.944 -23.436 -11.910 1.00 0.28 H new ATOM 0 HG21 ILE B 10 21.967 -24.358 -8.391 1.00 0.26 H new ATOM 0 HG22 ILE B 10 22.995 -23.111 -7.645 1.00 0.26 H new ATOM 0 HG23 ILE B 10 21.576 -22.635 -8.608 1.00 0.26 H new ATOM 0 HD11 ILE B 10 21.398 -25.372 -11.827 1.00 0.26 H new ATOM 0 HD12 ILE B 10 22.912 -25.746 -10.970 1.00 0.26 H new ATOM 0 HD13 ILE B 10 21.445 -25.340 -10.048 1.00 0.26 H new ATOM 2193 N VAL B 11 25.675 -22.060 -8.364 1.00 0.26 N ATOM 2194 CA VAL B 11 26.394 -21.660 -7.122 1.00 0.27 C ATOM 2195 C VAL B 11 26.733 -20.170 -7.219 1.00 0.29 C ATOM 2196 O VAL B 11 26.491 -19.406 -6.306 1.00 0.28 O ATOM 2197 CB VAL B 11 27.684 -22.481 -6.991 1.00 0.30 C ATOM 2198 CG1 VAL B 11 28.551 -21.917 -5.861 1.00 0.35 C ATOM 2199 CG2 VAL B 11 27.326 -23.938 -6.688 1.00 0.29 C ATOM 0 H VAL B 11 26.127 -22.789 -8.916 1.00 0.26 H new ATOM 0 HA VAL B 11 25.770 -21.843 -6.247 1.00 0.27 H new ATOM 0 HB VAL B 11 28.243 -22.427 -7.925 1.00 0.30 H new ATOM 0 HG11 VAL B 11 29.464 -22.505 -5.775 1.00 0.35 H new ATOM 0 HG12 VAL B 11 28.807 -20.880 -6.081 1.00 0.35 H new ATOM 0 HG13 VAL B 11 28.000 -21.963 -4.922 1.00 0.35 H new ATOM 0 HG21 VAL B 11 28.240 -24.525 -6.594 1.00 0.29 H new ATOM 0 HG22 VAL B 11 26.765 -23.988 -5.755 1.00 0.29 H new ATOM 0 HG23 VAL B 11 26.718 -24.340 -7.499 1.00 0.29 H new ATOM 2209 N GLN B 12 27.270 -19.752 -8.334 1.00 0.32 N ATOM 2210 CA GLN B 12 27.603 -18.311 -8.515 1.00 0.34 C ATOM 2211 C GLN B 12 26.327 -17.479 -8.391 1.00 0.32 C ATOM 2212 O GLN B 12 26.323 -16.410 -7.811 1.00 0.32 O ATOM 2213 CB GLN B 12 28.226 -18.097 -9.896 1.00 0.39 C ATOM 2214 CG GLN B 12 29.629 -18.708 -9.923 1.00 1.18 C ATOM 2215 CD GLN B 12 30.574 -17.849 -9.082 1.00 1.63 C ATOM 2216 OE1 GLN B 12 31.258 -18.350 -8.212 1.00 1.99 O ATOM 2217 NE2 GLN B 12 30.644 -16.565 -9.308 1.00 2.40 N ATOM 0 H GLN B 12 27.493 -20.350 -9.130 1.00 0.32 H new ATOM 0 HA GLN B 12 28.315 -18.002 -7.750 1.00 0.34 H new ATOM 0 HB2 GLN B 12 27.603 -18.557 -10.663 1.00 0.39 H new ATOM 0 HB3 GLN B 12 28.277 -17.032 -10.123 1.00 0.39 H new ATOM 0 HG2 GLN B 12 29.602 -19.726 -9.534 1.00 1.18 H new ATOM 0 HG3 GLN B 12 29.991 -18.769 -10.949 1.00 1.18 H new ATOM 0 HE21 GLN B 12 30.070 -16.144 -10.038 1.00 2.40 H new ATOM 0 HE22 GLN B 12 31.273 -15.983 -8.754 1.00 2.40 H new ATOM 2226 N GLN B 13 25.241 -17.958 -8.937 1.00 0.30 N ATOM 2227 CA GLN B 13 23.967 -17.191 -8.854 1.00 0.28 C ATOM 2228 C GLN B 13 23.600 -17.000 -7.383 1.00 0.25 C ATOM 2229 O GLN B 13 23.198 -15.930 -6.969 1.00 0.25 O ATOM 2230 CB GLN B 13 22.858 -17.977 -9.560 1.00 0.28 C ATOM 2231 CG GLN B 13 21.581 -17.133 -9.635 1.00 0.30 C ATOM 2232 CD GLN B 13 21.801 -15.952 -10.584 1.00 0.38 C ATOM 2233 OE1 GLN B 13 22.783 -15.905 -11.298 1.00 0.84 O ATOM 2234 NE2 GLN B 13 20.912 -14.997 -10.634 1.00 0.64 N ATOM 0 H GLN B 13 25.182 -18.846 -9.436 1.00 0.30 H new ATOM 0 HA GLN B 13 24.084 -16.219 -9.334 1.00 0.28 H new ATOM 0 HB2 GLN B 13 23.180 -18.254 -10.564 1.00 0.28 H new ATOM 0 HB3 GLN B 13 22.660 -18.904 -9.022 1.00 0.28 H new ATOM 0 HG2 GLN B 13 20.749 -17.744 -9.985 1.00 0.30 H new ATOM 0 HG3 GLN B 13 21.314 -16.770 -8.642 1.00 0.30 H new ATOM 0 HE21 GLN B 13 20.087 -15.036 -10.035 1.00 0.64 H new ATOM 0 HE22 GLN B 13 21.042 -14.212 -11.272 1.00 0.64 H new ATOM 2243 N GLN B 14 23.749 -18.022 -6.585 1.00 0.22 N ATOM 2244 CA GLN B 14 23.424 -17.883 -5.139 1.00 0.20 C ATOM 2245 C GLN B 14 24.347 -16.837 -4.513 1.00 0.22 C ATOM 2246 O GLN B 14 23.932 -16.038 -3.697 1.00 0.21 O ATOM 2247 CB GLN B 14 23.611 -19.226 -4.431 1.00 0.20 C ATOM 2248 CG GLN B 14 22.519 -20.198 -4.880 1.00 0.18 C ATOM 2249 CD GLN B 14 22.708 -21.541 -4.171 1.00 0.20 C ATOM 2250 OE1 GLN B 14 21.721 -22.047 -3.482 1.00 0.29 O flip ATOM 2251 NE2 GLN B 14 23.768 -22.132 -4.238 1.00 0.24 N flip ATOM 0 H GLN B 14 24.080 -18.943 -6.871 1.00 0.22 H new ATOM 0 HA GLN B 14 22.386 -17.567 -5.030 1.00 0.20 H new ATOM 0 HB2 GLN B 14 24.594 -19.636 -4.661 1.00 0.20 H new ATOM 0 HB3 GLN B 14 23.568 -19.088 -3.351 1.00 0.20 H new ATOM 0 HG2 GLN B 14 21.536 -19.788 -4.650 1.00 0.18 H new ATOM 0 HG3 GLN B 14 22.562 -20.336 -5.960 1.00 0.18 H new ATOM 0 HE21 GLN B 14 24.539 -21.737 -4.776 1.00 0.24 H new ATOM 0 HE22 GLN B 14 23.886 -23.023 -3.756 1.00 0.24 H new ATOM 2260 N GLN B 15 25.598 -16.831 -4.889 1.00 0.26 N ATOM 2261 CA GLN B 15 26.539 -15.832 -4.312 1.00 0.29 C ATOM 2262 C GLN B 15 26.044 -14.424 -4.638 1.00 0.28 C ATOM 2263 O GLN B 15 25.988 -13.563 -3.783 1.00 0.29 O ATOM 2264 CB GLN B 15 27.936 -16.042 -4.906 1.00 0.34 C ATOM 2265 CG GLN B 15 28.911 -15.019 -4.318 1.00 0.38 C ATOM 2266 CD GLN B 15 30.312 -15.270 -4.876 1.00 0.44 C ATOM 2267 OE1 GLN B 15 30.484 -15.427 -6.069 1.00 0.82 O ATOM 2268 NE2 GLN B 15 31.328 -15.314 -4.060 1.00 0.81 N ATOM 0 H GLN B 15 26.006 -17.473 -5.568 1.00 0.26 H new ATOM 0 HA GLN B 15 26.588 -15.956 -3.230 1.00 0.29 H new ATOM 0 HB2 GLN B 15 28.283 -17.053 -4.692 1.00 0.34 H new ATOM 0 HB3 GLN B 15 27.899 -15.940 -5.991 1.00 0.34 H new ATOM 0 HG2 GLN B 15 28.586 -14.008 -4.564 1.00 0.38 H new ATOM 0 HG3 GLN B 15 28.922 -15.095 -3.231 1.00 0.38 H new ATOM 0 HE21 GLN B 15 31.184 -15.182 -3.059 1.00 0.81 H new ATOM 0 HE22 GLN B 15 32.267 -15.480 -4.423 1.00 0.81 H new ATOM 2277 N GLN B 16 25.680 -14.181 -5.867 1.00 0.28 N ATOM 2278 CA GLN B 16 25.183 -12.828 -6.232 1.00 0.29 C ATOM 2279 C GLN B 16 23.927 -12.519 -5.419 1.00 0.25 C ATOM 2280 O GLN B 16 23.764 -11.432 -4.900 1.00 0.26 O ATOM 2281 CB GLN B 16 24.862 -12.790 -7.728 1.00 0.31 C ATOM 2282 CG GLN B 16 26.165 -12.855 -8.527 1.00 0.36 C ATOM 2283 CD GLN B 16 25.852 -12.827 -10.024 1.00 0.39 C ATOM 2284 OE1 GLN B 16 26.582 -13.383 -10.819 1.00 0.93 O ATOM 2285 NE2 GLN B 16 24.782 -12.207 -10.443 1.00 0.87 N ATOM 0 H GLN B 16 25.705 -14.858 -6.630 1.00 0.28 H new ATOM 0 HA GLN B 16 25.946 -12.081 -6.013 1.00 0.29 H new ATOM 0 HB2 GLN B 16 24.217 -13.627 -7.994 1.00 0.31 H new ATOM 0 HB3 GLN B 16 24.318 -11.878 -7.972 1.00 0.31 H new ATOM 0 HG2 GLN B 16 26.807 -12.014 -8.264 1.00 0.36 H new ATOM 0 HG3 GLN B 16 26.712 -13.764 -8.277 1.00 0.36 H new ATOM 0 HE21 GLN B 16 24.169 -11.740 -9.775 1.00 0.87 H new ATOM 0 HE22 GLN B 16 24.559 -12.190 -11.438 1.00 0.87 H new ATOM 2294 N LEU B 17 23.040 -13.470 -5.290 1.00 0.22 N ATOM 2295 CA LEU B 17 21.809 -13.222 -4.493 1.00 0.19 C ATOM 2296 C LEU B 17 22.211 -12.926 -3.048 1.00 0.18 C ATOM 2297 O LEU B 17 21.713 -12.007 -2.428 1.00 0.18 O ATOM 2298 CB LEU B 17 20.904 -14.459 -4.537 1.00 0.16 C ATOM 2299 CG LEU B 17 20.327 -14.643 -5.950 1.00 0.18 C ATOM 2300 CD1 LEU B 17 19.634 -16.006 -6.037 1.00 0.18 C ATOM 2301 CD2 LEU B 17 19.311 -13.528 -6.271 1.00 0.20 C ATOM 0 H LEU B 17 23.116 -14.401 -5.700 1.00 0.22 H new ATOM 0 HA LEU B 17 21.264 -12.373 -4.907 1.00 0.19 H new ATOM 0 HB2 LEU B 17 21.471 -15.344 -4.250 1.00 0.16 H new ATOM 0 HB3 LEU B 17 20.093 -14.352 -3.816 1.00 0.16 H new ATOM 0 HG LEU B 17 21.141 -14.591 -6.673 1.00 0.18 H new ATOM 0 HD11 LEU B 17 19.223 -16.142 -7.037 1.00 0.18 H new ATOM 0 HD12 LEU B 17 20.357 -16.795 -5.831 1.00 0.18 H new ATOM 0 HD13 LEU B 17 18.828 -16.052 -5.304 1.00 0.18 H new ATOM 0 HD21 LEU B 17 18.914 -13.676 -7.275 1.00 0.20 H new ATOM 0 HD22 LEU B 17 18.495 -13.561 -5.550 1.00 0.20 H new ATOM 0 HD23 LEU B 17 19.805 -12.558 -6.215 1.00 0.20 H new ATOM 2313 N LEU B 18 23.124 -13.692 -2.512 1.00 0.19 N ATOM 2314 CA LEU B 18 23.574 -13.446 -1.115 1.00 0.20 C ATOM 2315 C LEU B 18 24.170 -12.042 -1.022 1.00 0.22 C ATOM 2316 O LEU B 18 23.905 -11.306 -0.091 1.00 0.22 O ATOM 2317 CB LEU B 18 24.628 -14.489 -0.723 1.00 0.22 C ATOM 2318 CG LEU B 18 25.111 -14.256 0.719 1.00 0.25 C ATOM 2319 CD1 LEU B 18 23.939 -14.377 1.704 1.00 0.26 C ATOM 2320 CD2 LEU B 18 26.179 -15.305 1.055 1.00 0.29 C ATOM 0 H LEU B 18 23.576 -14.476 -2.982 1.00 0.19 H new ATOM 0 HA LEU B 18 22.726 -13.526 -0.434 1.00 0.20 H new ATOM 0 HB2 LEU B 18 24.208 -15.491 -0.814 1.00 0.22 H new ATOM 0 HB3 LEU B 18 25.474 -14.435 -1.409 1.00 0.22 H new ATOM 0 HG LEU B 18 25.529 -13.253 0.803 1.00 0.25 H new ATOM 0 HD11 LEU B 18 24.298 -14.209 2.719 1.00 0.26 H new ATOM 0 HD12 LEU B 18 23.180 -13.633 1.460 1.00 0.26 H new ATOM 0 HD13 LEU B 18 23.505 -15.374 1.633 1.00 0.26 H new ATOM 0 HD21 LEU B 18 26.531 -15.152 2.075 1.00 0.29 H new ATOM 0 HD22 LEU B 18 25.750 -16.303 0.965 1.00 0.29 H new ATOM 0 HD23 LEU B 18 27.016 -15.206 0.364 1.00 0.29 H new ATOM 2332 N ASP B 19 24.979 -11.664 -1.976 1.00 0.25 N ATOM 2333 CA ASP B 19 25.588 -10.309 -1.925 1.00 0.28 C ATOM 2334 C ASP B 19 24.473 -9.263 -1.929 1.00 0.26 C ATOM 2335 O ASP B 19 24.445 -8.375 -1.103 1.00 0.27 O ATOM 2336 CB ASP B 19 26.490 -10.107 -3.148 1.00 0.32 C ATOM 2337 CG ASP B 19 27.129 -8.715 -3.101 1.00 0.35 C ATOM 2338 OD1 ASP B 19 26.580 -7.848 -2.442 1.00 1.12 O ATOM 2339 OD2 ASP B 19 28.165 -8.543 -3.723 1.00 1.13 O ATOM 0 H ASP B 19 25.241 -12.232 -2.781 1.00 0.25 H new ATOM 0 HA ASP B 19 26.185 -10.205 -1.019 1.00 0.28 H new ATOM 0 HB2 ASP B 19 27.266 -10.872 -3.169 1.00 0.32 H new ATOM 0 HB3 ASP B 19 25.908 -10.219 -4.063 1.00 0.32 H new ATOM 2344 N VAL B 20 23.545 -9.363 -2.842 1.00 0.25 N ATOM 2345 CA VAL B 20 22.436 -8.370 -2.871 1.00 0.24 C ATOM 2346 C VAL B 20 21.673 -8.425 -1.548 1.00 0.21 C ATOM 2347 O VAL B 20 21.352 -7.409 -0.966 1.00 0.23 O ATOM 2348 CB VAL B 20 21.490 -8.670 -4.040 1.00 0.24 C ATOM 2349 CG1 VAL B 20 20.228 -7.807 -3.919 1.00 0.24 C ATOM 2350 CG2 VAL B 20 22.199 -8.341 -5.358 1.00 0.30 C ATOM 0 H VAL B 20 23.507 -10.083 -3.563 1.00 0.25 H new ATOM 0 HA VAL B 20 22.849 -7.371 -3.008 1.00 0.24 H new ATOM 0 HB VAL B 20 21.212 -9.724 -4.020 1.00 0.24 H new ATOM 0 HG11 VAL B 20 19.558 -8.023 -4.751 1.00 0.24 H new ATOM 0 HG12 VAL B 20 19.723 -8.031 -2.979 1.00 0.24 H new ATOM 0 HG13 VAL B 20 20.505 -6.753 -3.940 1.00 0.24 H new ATOM 0 HG21 VAL B 20 21.531 -8.552 -6.193 1.00 0.30 H new ATOM 0 HG22 VAL B 20 22.473 -7.286 -5.370 1.00 0.30 H new ATOM 0 HG23 VAL B 20 23.098 -8.950 -5.449 1.00 0.30 H new ATOM 2360 N VAL B 21 21.378 -9.600 -1.062 1.00 0.18 N ATOM 2361 CA VAL B 21 20.634 -9.694 0.223 1.00 0.18 C ATOM 2362 C VAL B 21 21.461 -9.012 1.317 1.00 0.22 C ATOM 2363 O VAL B 21 20.945 -8.249 2.110 1.00 0.21 O ATOM 2364 CB VAL B 21 20.391 -11.168 0.570 1.00 0.18 C ATOM 2365 CG1 VAL B 21 19.820 -11.285 1.985 1.00 0.21 C ATOM 2366 CG2 VAL B 21 19.389 -11.766 -0.422 1.00 0.15 C ATOM 0 H VAL B 21 21.618 -10.491 -1.496 1.00 0.18 H new ATOM 0 HA VAL B 21 19.667 -9.198 0.139 1.00 0.18 H new ATOM 0 HB VAL B 21 21.337 -11.706 0.515 1.00 0.18 H new ATOM 0 HG11 VAL B 21 19.650 -12.335 2.223 1.00 0.21 H new ATOM 0 HG12 VAL B 21 20.526 -10.860 2.699 1.00 0.21 H new ATOM 0 HG13 VAL B 21 18.876 -10.743 2.042 1.00 0.21 H new ATOM 0 HG21 VAL B 21 19.215 -12.814 -0.177 1.00 0.15 H new ATOM 0 HG22 VAL B 21 18.448 -11.219 -0.363 1.00 0.15 H new ATOM 0 HG23 VAL B 21 19.789 -11.692 -1.433 1.00 0.15 H new ATOM 2376 N LYS B 22 22.746 -9.262 1.355 1.00 0.27 N ATOM 2377 CA LYS B 22 23.600 -8.601 2.383 1.00 0.32 C ATOM 2378 C LYS B 22 23.507 -7.086 2.188 1.00 0.32 C ATOM 2379 O LYS B 22 23.379 -6.331 3.132 1.00 0.33 O ATOM 2380 CB LYS B 22 25.054 -9.050 2.215 1.00 0.38 C ATOM 2381 CG LYS B 22 25.909 -8.463 3.342 1.00 0.45 C ATOM 2382 CD LYS B 22 27.362 -8.916 3.167 1.00 0.75 C ATOM 2383 CE LYS B 22 28.225 -8.319 4.282 1.00 1.12 C ATOM 2384 NZ LYS B 22 29.584 -8.928 4.235 1.00 1.91 N ATOM 0 H LYS B 22 23.237 -9.892 0.721 1.00 0.27 H new ATOM 0 HA LYS B 22 23.259 -8.874 3.382 1.00 0.32 H new ATOM 0 HB2 LYS B 22 25.113 -10.138 2.230 1.00 0.38 H new ATOM 0 HB3 LYS B 22 25.436 -8.724 1.248 1.00 0.38 H new ATOM 0 HG2 LYS B 22 25.852 -7.375 3.328 1.00 0.45 H new ATOM 0 HG3 LYS B 22 25.529 -8.790 4.310 1.00 0.45 H new ATOM 0 HD2 LYS B 22 27.420 -10.004 3.192 1.00 0.75 H new ATOM 0 HD3 LYS B 22 27.737 -8.599 2.194 1.00 0.75 H new ATOM 0 HE2 LYS B 22 28.295 -7.238 4.164 1.00 1.12 H new ATOM 0 HE3 LYS B 22 27.765 -8.505 5.252 1.00 1.12 H new ATOM 0 HZ1 LYS B 22 29.904 -9.138 5.202 1.00 1.91 H new ATOM 0 HZ2 LYS B 22 29.551 -9.808 3.682 1.00 1.91 H new ATOM 0 HZ3 LYS B 22 30.247 -8.263 3.788 1.00 1.91 H new ATOM 2398 N ARG B 23 23.559 -6.639 0.957 1.00 0.32 N ATOM 2399 CA ARG B 23 23.461 -5.178 0.684 1.00 0.34 C ATOM 2400 C ARG B 23 22.091 -4.677 1.140 1.00 0.28 C ATOM 2401 O ARG B 23 21.970 -3.611 1.711 1.00 0.29 O ATOM 2402 CB ARG B 23 23.634 -4.922 -0.817 1.00 0.38 C ATOM 2403 CG ARG B 23 25.086 -5.198 -1.217 1.00 0.59 C ATOM 2404 CD ARG B 23 25.255 -4.941 -2.716 1.00 0.93 C ATOM 2405 NE ARG B 23 26.580 -5.477 -3.176 1.00 0.81 N ATOM 2406 CZ ARG B 23 27.704 -5.083 -2.640 1.00 1.05 C ATOM 2407 NH1 ARG B 23 27.730 -4.073 -1.815 1.00 1.67 N ATOM 2408 NH2 ARG B 23 28.818 -5.675 -2.973 1.00 1.08 N ATOM 0 H ARG B 23 23.665 -7.227 0.130 1.00 0.32 H new ATOM 0 HA ARG B 23 24.244 -4.648 1.227 1.00 0.34 H new ATOM 0 HB2 ARG B 23 22.961 -5.563 -1.386 1.00 0.38 H new ATOM 0 HB3 ARG B 23 23.370 -3.891 -1.054 1.00 0.38 H new ATOM 0 HG2 ARG B 23 25.760 -4.557 -0.648 1.00 0.59 H new ATOM 0 HG3 ARG B 23 25.351 -6.229 -0.981 1.00 0.59 H new ATOM 0 HD2 ARG B 23 24.447 -5.419 -3.270 1.00 0.93 H new ATOM 0 HD3 ARG B 23 25.194 -3.872 -2.921 1.00 0.93 H new ATOM 0 HE ARG B 23 26.603 -6.167 -3.927 1.00 0.81 H new ATOM 0 HH11 ARG B 23 26.867 -3.582 -1.582 1.00 1.67 H new ATOM 0 HH12 ARG B 23 28.614 -3.774 -1.402 1.00 1.67 H new ATOM 0 HH21 ARG B 23 28.807 -6.440 -3.648 1.00 1.08 H new ATOM 0 HH22 ARG B 23 29.700 -5.373 -2.559 1.00 1.08 H new ATOM 2422 N GLN B 24 21.057 -5.443 0.910 1.00 0.24 N ATOM 2423 CA GLN B 24 19.710 -4.999 1.355 1.00 0.19 C ATOM 2424 C GLN B 24 19.725 -4.816 2.873 1.00 0.19 C ATOM 2425 O GLN B 24 19.167 -3.877 3.401 1.00 0.19 O ATOM 2426 CB GLN B 24 18.658 -6.037 0.959 1.00 0.16 C ATOM 2427 CG GLN B 24 18.457 -5.993 -0.557 1.00 0.17 C ATOM 2428 CD GLN B 24 17.496 -7.102 -0.986 1.00 0.16 C ATOM 2429 OE1 GLN B 24 17.497 -8.175 -0.418 1.00 0.19 O ATOM 2430 NE2 GLN B 24 16.670 -6.885 -1.974 1.00 0.18 N ATOM 0 H GLN B 24 21.089 -6.347 0.438 1.00 0.24 H new ATOM 0 HA GLN B 24 19.458 -4.053 0.876 1.00 0.19 H new ATOM 0 HB2 GLN B 24 18.977 -7.033 1.267 1.00 0.16 H new ATOM 0 HB3 GLN B 24 17.717 -5.832 1.469 1.00 0.16 H new ATOM 0 HG2 GLN B 24 18.060 -5.022 -0.852 1.00 0.17 H new ATOM 0 HG3 GLN B 24 19.415 -6.113 -1.063 1.00 0.17 H new ATOM 0 HE21 GLN B 24 16.670 -5.983 -2.450 1.00 0.18 H new ATOM 0 HE22 GLN B 24 16.025 -7.617 -2.269 1.00 0.18 H new ATOM 2439 N GLN B 25 20.378 -5.701 3.581 1.00 0.21 N ATOM 2440 CA GLN B 25 20.442 -5.565 5.065 1.00 0.23 C ATOM 2441 C GLN B 25 21.103 -4.234 5.426 1.00 0.25 C ATOM 2442 O GLN B 25 20.590 -3.471 6.219 1.00 0.25 O ATOM 2443 CB GLN B 25 21.252 -6.729 5.653 1.00 0.28 C ATOM 2444 CG GLN B 25 21.364 -6.588 7.179 1.00 0.32 C ATOM 2445 CD GLN B 25 19.968 -6.558 7.808 1.00 0.34 C ATOM 2446 OE1 GLN B 25 19.488 -7.640 8.356 1.00 1.06 O flip ATOM 2447 NE2 GLN B 25 19.312 -5.535 7.808 1.00 1.13 N flip ATOM 0 H GLN B 25 20.868 -6.509 3.197 1.00 0.21 H new ATOM 0 HA GLN B 25 19.434 -5.588 5.478 1.00 0.23 H new ATOM 0 HB2 GLN B 25 20.773 -7.676 5.403 1.00 0.28 H new ATOM 0 HB3 GLN B 25 22.247 -6.748 5.209 1.00 0.28 H new ATOM 0 HG2 GLN B 25 21.938 -7.420 7.588 1.00 0.32 H new ATOM 0 HG3 GLN B 25 21.904 -5.675 7.429 1.00 0.32 H new ATOM 0 HE21 GLN B 25 19.687 -4.689 7.380 1.00 1.13 H new ATOM 0 HE22 GLN B 25 18.386 -5.523 8.236 1.00 1.13 H new ATOM 2456 N GLU B 26 22.239 -3.946 4.851 1.00 0.27 N ATOM 2457 CA GLU B 26 22.917 -2.658 5.168 1.00 0.29 C ATOM 2458 C GLU B 26 22.019 -1.504 4.723 1.00 0.26 C ATOM 2459 O GLU B 26 21.861 -0.518 5.416 1.00 0.26 O ATOM 2460 CB GLU B 26 24.246 -2.590 4.416 1.00 0.33 C ATOM 2461 CG GLU B 26 25.219 -3.609 5.009 1.00 0.53 C ATOM 2462 CD GLU B 26 26.549 -3.542 4.258 1.00 1.19 C ATOM 2463 OE1 GLU B 26 26.612 -2.832 3.268 1.00 1.85 O ATOM 2464 OE2 GLU B 26 27.482 -4.206 4.682 1.00 1.94 O ATOM 0 H GLU B 26 22.724 -4.542 4.180 1.00 0.27 H new ATOM 0 HA GLU B 26 23.103 -2.588 6.240 1.00 0.29 H new ATOM 0 HB2 GLU B 26 24.088 -2.795 3.357 1.00 0.33 H new ATOM 0 HB3 GLU B 26 24.665 -1.586 4.487 1.00 0.33 H new ATOM 0 HG2 GLU B 26 25.376 -3.404 6.068 1.00 0.53 H new ATOM 0 HG3 GLU B 26 24.799 -4.612 4.938 1.00 0.53 H new ATOM 2471 N LEU B 27 21.418 -1.635 3.574 1.00 0.24 N ATOM 2472 CA LEU B 27 20.511 -0.570 3.067 1.00 0.22 C ATOM 2473 C LEU B 27 19.304 -0.463 3.994 1.00 0.19 C ATOM 2474 O LEU B 27 18.831 0.613 4.300 1.00 0.19 O ATOM 2475 CB LEU B 27 20.062 -0.925 1.648 1.00 0.21 C ATOM 2476 CG LEU B 27 18.996 0.061 1.152 1.00 0.21 C ATOM 2477 CD1 LEU B 27 19.487 1.501 1.318 1.00 0.25 C ATOM 2478 CD2 LEU B 27 18.714 -0.214 -0.332 1.00 0.23 C ATOM 0 H LEU B 27 21.518 -2.443 2.959 1.00 0.24 H new ATOM 0 HA LEU B 27 21.030 0.388 3.044 1.00 0.22 H new ATOM 0 HB2 LEU B 27 20.920 -0.909 0.976 1.00 0.21 H new ATOM 0 HB3 LEU B 27 19.662 -1.939 1.631 1.00 0.21 H new ATOM 0 HG LEU B 27 18.086 -0.069 1.737 1.00 0.21 H new ATOM 0 HD11 LEU B 27 18.721 2.190 0.962 1.00 0.25 H new ATOM 0 HD12 LEU B 27 19.691 1.697 2.371 1.00 0.25 H new ATOM 0 HD13 LEU B 27 20.400 1.643 0.739 1.00 0.25 H new ATOM 0 HD21 LEU B 27 17.957 0.482 -0.694 1.00 0.23 H new ATOM 0 HD22 LEU B 27 19.631 -0.084 -0.907 1.00 0.23 H new ATOM 0 HD23 LEU B 27 18.353 -1.236 -0.451 1.00 0.23 H new ATOM 2490 N LEU B 28 18.804 -1.577 4.445 1.00 0.18 N ATOM 2491 CA LEU B 28 17.631 -1.547 5.356 1.00 0.18 C ATOM 2492 C LEU B 28 18.010 -0.757 6.608 1.00 0.20 C ATOM 2493 O LEU B 28 17.231 0.023 7.120 1.00 0.21 O ATOM 2494 CB LEU B 28 17.257 -2.989 5.733 1.00 0.19 C ATOM 2495 CG LEU B 28 16.483 -3.655 4.575 1.00 0.19 C ATOM 2496 CD1 LEU B 28 16.571 -5.189 4.686 1.00 0.21 C ATOM 2497 CD2 LEU B 28 15.004 -3.237 4.623 1.00 0.22 C ATOM 0 H LEU B 28 19.158 -2.507 4.222 1.00 0.18 H new ATOM 0 HA LEU B 28 16.778 -1.073 4.871 1.00 0.18 H new ATOM 0 HB2 LEU B 28 18.158 -3.561 5.955 1.00 0.19 H new ATOM 0 HB3 LEU B 28 16.648 -2.991 6.637 1.00 0.19 H new ATOM 0 HG LEU B 28 16.928 -3.332 3.634 1.00 0.19 H new ATOM 0 HD11 LEU B 28 16.021 -5.645 3.863 1.00 0.21 H new ATOM 0 HD12 LEU B 28 17.615 -5.498 4.640 1.00 0.21 H new ATOM 0 HD13 LEU B 28 16.139 -5.511 5.634 1.00 0.21 H new ATOM 0 HD21 LEU B 28 14.465 -3.711 3.803 1.00 0.22 H new ATOM 0 HD22 LEU B 28 14.568 -3.549 5.572 1.00 0.22 H new ATOM 0 HD23 LEU B 28 14.929 -2.154 4.528 1.00 0.22 H new ATOM 2509 N ARG B 29 19.204 -0.938 7.097 1.00 0.22 N ATOM 2510 CA ARG B 29 19.626 -0.178 8.303 1.00 0.24 C ATOM 2511 C ARG B 29 19.587 1.324 7.997 1.00 0.24 C ATOM 2512 O ARG B 29 19.182 2.121 8.819 1.00 0.25 O ATOM 2513 CB ARG B 29 21.052 -0.577 8.689 1.00 0.28 C ATOM 2514 CG ARG B 29 21.056 -2.007 9.231 1.00 0.29 C ATOM 2515 CD ARG B 29 22.479 -2.390 9.637 1.00 0.33 C ATOM 2516 NE ARG B 29 22.532 -3.841 9.964 1.00 0.38 N ATOM 2517 CZ ARG B 29 23.683 -4.447 10.043 1.00 0.88 C ATOM 2518 NH1 ARG B 29 24.785 -3.776 9.847 1.00 1.82 N ATOM 2519 NH2 ARG B 29 23.733 -5.720 10.326 1.00 0.86 N ATOM 0 H ARG B 29 19.902 -1.576 6.715 1.00 0.22 H new ATOM 0 HA ARG B 29 18.949 -0.404 9.127 1.00 0.24 H new ATOM 0 HB2 ARG B 29 21.708 -0.504 7.822 1.00 0.28 H new ATOM 0 HB3 ARG B 29 21.441 0.109 9.441 1.00 0.28 H new ATOM 0 HG2 ARG B 29 20.388 -2.085 10.088 1.00 0.29 H new ATOM 0 HG3 ARG B 29 20.684 -2.696 8.473 1.00 0.29 H new ATOM 0 HD2 ARG B 29 23.172 -2.164 8.827 1.00 0.33 H new ATOM 0 HD3 ARG B 29 22.793 -1.801 10.499 1.00 0.33 H new ATOM 0 HE ARG B 29 21.669 -4.360 10.126 1.00 0.38 H new ATOM 0 HH11 ARG B 29 24.744 -2.780 9.633 1.00 1.82 H new ATOM 0 HH12 ARG B 29 25.687 -4.248 9.908 1.00 1.82 H new ATOM 0 HH21 ARG B 29 22.871 -6.241 10.485 1.00 0.86 H new ATOM 0 HH22 ARG B 29 24.634 -6.194 10.388 1.00 0.86 H new ATOM 2533 N LEU B 30 20.008 1.719 6.821 1.00 0.23 N ATOM 2534 CA LEU B 30 19.994 3.173 6.481 1.00 0.23 C ATOM 2535 C LEU B 30 18.562 3.708 6.550 1.00 0.21 C ATOM 2536 O LEU B 30 18.322 4.794 7.038 1.00 0.22 O ATOM 2537 CB LEU B 30 20.527 3.385 5.059 1.00 0.24 C ATOM 2538 CG LEU B 30 21.967 2.870 4.933 1.00 0.27 C ATOM 2539 CD1 LEU B 30 22.448 3.091 3.496 1.00 0.29 C ATOM 2540 CD2 LEU B 30 22.894 3.618 5.908 1.00 0.33 C ATOM 0 H LEU B 30 20.358 1.102 6.088 1.00 0.23 H new ATOM 0 HA LEU B 30 20.625 3.703 7.195 1.00 0.23 H new ATOM 0 HB2 LEU B 30 19.887 2.866 4.345 1.00 0.24 H new ATOM 0 HB3 LEU B 30 20.492 4.445 4.807 1.00 0.24 H new ATOM 0 HG LEU B 30 21.991 1.808 5.178 1.00 0.27 H new ATOM 0 HD11 LEU B 30 23.471 2.728 3.395 1.00 0.29 H new ATOM 0 HD12 LEU B 30 21.801 2.547 2.808 1.00 0.29 H new ATOM 0 HD13 LEU B 30 22.415 4.155 3.261 1.00 0.29 H new ATOM 0 HD21 LEU B 30 23.911 3.240 5.805 1.00 0.33 H new ATOM 0 HD22 LEU B 30 22.878 4.684 5.680 1.00 0.33 H new ATOM 0 HD23 LEU B 30 22.550 3.461 6.930 1.00 0.33 H new ATOM 2552 N THR B 31 17.604 2.965 6.058 1.00 0.19 N ATOM 2553 CA THR B 31 16.196 3.457 6.097 1.00 0.18 C ATOM 2554 C THR B 31 15.746 3.602 7.548 1.00 0.18 C ATOM 2555 O THR B 31 15.087 4.554 7.914 1.00 0.18 O ATOM 2556 CB THR B 31 15.282 2.461 5.378 1.00 0.17 C ATOM 2557 OG1 THR B 31 15.386 1.190 6.003 1.00 0.18 O ATOM 2558 CG2 THR B 31 15.695 2.350 3.910 1.00 0.19 C ATOM 0 H THR B 31 17.735 2.046 5.634 1.00 0.19 H new ATOM 0 HA THR B 31 16.139 4.425 5.599 1.00 0.18 H new ATOM 0 HB THR B 31 14.250 2.809 5.433 1.00 0.17 H new ATOM 0 HG1 THR B 31 16.301 1.059 6.328 1.00 0.18 H new ATOM 0 HG21 THR B 31 15.043 1.640 3.401 1.00 0.19 H new ATOM 0 HG22 THR B 31 15.611 3.327 3.433 1.00 0.19 H new ATOM 0 HG23 THR B 31 16.727 2.004 3.847 1.00 0.19 H new ATOM 2566 N VAL B 32 16.109 2.668 8.380 1.00 0.18 N ATOM 2567 CA VAL B 32 15.716 2.754 9.810 1.00 0.20 C ATOM 2568 C VAL B 32 16.367 3.995 10.419 1.00 0.20 C ATOM 2569 O VAL B 32 15.767 4.719 11.189 1.00 0.21 O ATOM 2570 CB VAL B 32 16.213 1.498 10.530 1.00 0.22 C ATOM 2571 CG1 VAL B 32 15.939 1.617 12.031 1.00 0.23 C ATOM 2572 CG2 VAL B 32 15.494 0.265 9.968 1.00 0.22 C ATOM 0 H VAL B 32 16.662 1.848 8.130 1.00 0.18 H new ATOM 0 HA VAL B 32 14.633 2.825 9.910 1.00 0.20 H new ATOM 0 HB VAL B 32 17.286 1.394 10.371 1.00 0.22 H new ATOM 0 HG11 VAL B 32 16.295 0.720 12.538 1.00 0.23 H new ATOM 0 HG12 VAL B 32 16.459 2.489 12.428 1.00 0.23 H new ATOM 0 HG13 VAL B 32 14.867 1.727 12.198 1.00 0.23 H new ATOM 0 HG21 VAL B 32 15.849 -0.629 10.481 1.00 0.22 H new ATOM 0 HG22 VAL B 32 14.420 0.369 10.121 1.00 0.22 H new ATOM 0 HG23 VAL B 32 15.702 0.177 8.902 1.00 0.22 H new ATOM 2582 N TRP B 33 17.598 4.243 10.064 1.00 0.21 N ATOM 2583 CA TRP B 33 18.318 5.431 10.598 1.00 0.23 C ATOM 2584 C TRP B 33 17.579 6.714 10.209 1.00 0.22 C ATOM 2585 O TRP B 33 17.327 7.567 11.037 1.00 0.23 O ATOM 2586 CB TRP B 33 19.732 5.457 10.016 1.00 0.25 C ATOM 2587 CG TRP B 33 20.467 6.649 10.534 1.00 0.27 C ATOM 2588 CD1 TRP B 33 21.108 6.715 11.723 1.00 0.32 C ATOM 2589 CD2 TRP B 33 20.650 7.944 9.896 1.00 0.27 C ATOM 2590 NE1 TRP B 33 21.675 7.971 11.856 1.00 0.33 N ATOM 2591 CE2 TRP B 33 21.420 8.765 10.753 1.00 0.31 C ATOM 2592 CE3 TRP B 33 20.227 8.479 8.667 1.00 0.26 C ATOM 2593 CZ2 TRP B 33 21.759 10.072 10.401 1.00 0.32 C ATOM 2594 CZ3 TRP B 33 20.565 9.794 8.309 1.00 0.29 C ATOM 2595 CH2 TRP B 33 21.329 10.589 9.175 1.00 0.31 C ATOM 0 H TRP B 33 18.140 3.667 9.420 1.00 0.21 H new ATOM 0 HA TRP B 33 18.364 5.369 11.685 1.00 0.23 H new ATOM 0 HB2 TRP B 33 20.264 4.544 10.286 1.00 0.25 H new ATOM 0 HB3 TRP B 33 19.687 5.490 8.927 1.00 0.25 H new ATOM 0 HD1 TRP B 33 21.168 5.918 12.450 1.00 0.32 H new ATOM 0 HE1 TRP B 33 22.214 8.273 12.667 1.00 0.33 H new ATOM 0 HE3 TRP B 33 19.638 7.874 7.993 1.00 0.26 H new ATOM 0 HZ2 TRP B 33 22.349 10.680 11.071 1.00 0.32 H new ATOM 0 HZ3 TRP B 33 20.235 10.195 7.362 1.00 0.29 H new ATOM 0 HH2 TRP B 33 21.585 11.600 8.895 1.00 0.31 H new ATOM 2606 N GLY B 34 17.235 6.871 8.956 1.00 0.22 N ATOM 2607 CA GLY B 34 16.526 8.106 8.543 1.00 0.23 C ATOM 2608 C GLY B 34 15.195 8.212 9.285 1.00 0.22 C ATOM 2609 O GLY B 34 14.900 9.209 9.906 1.00 0.23 O ATOM 0 H GLY B 34 17.415 6.199 8.210 1.00 0.22 H new ATOM 0 HA2 GLY B 34 17.143 8.979 8.757 1.00 0.23 H new ATOM 0 HA3 GLY B 34 16.353 8.094 7.467 1.00 0.23 H new ATOM 2613 N THR B 35 14.387 7.192 9.225 1.00 0.22 N ATOM 2614 CA THR B 35 13.071 7.243 9.919 1.00 0.24 C ATOM 2615 C THR B 35 13.276 7.450 11.423 1.00 0.24 C ATOM 2616 O THR B 35 12.657 8.302 12.032 1.00 0.24 O ATOM 2617 CB THR B 35 12.336 5.921 9.683 1.00 0.27 C ATOM 2618 OG1 THR B 35 12.138 5.736 8.289 1.00 0.30 O ATOM 2619 CG2 THR B 35 10.980 5.950 10.388 1.00 0.30 C ATOM 0 H THR B 35 14.581 6.324 8.725 1.00 0.22 H new ATOM 0 HA THR B 35 12.485 8.074 9.525 1.00 0.24 H new ATOM 0 HB THR B 35 12.932 5.100 10.083 1.00 0.27 H new ATOM 0 HG1 THR B 35 11.178 5.741 8.091 1.00 0.30 H new ATOM 0 HG21 THR B 35 10.461 5.007 10.217 1.00 0.30 H new ATOM 0 HG22 THR B 35 11.129 6.093 11.458 1.00 0.30 H new ATOM 0 HG23 THR B 35 10.382 6.771 9.992 1.00 0.30 H new ATOM 2627 N LYS B 36 14.131 6.676 12.031 1.00 0.25 N ATOM 2628 CA LYS B 36 14.359 6.831 13.493 1.00 0.28 C ATOM 2629 C LYS B 36 14.947 8.215 13.778 1.00 0.28 C ATOM 2630 O LYS B 36 14.589 8.868 14.738 1.00 0.30 O ATOM 2631 CB LYS B 36 15.326 5.749 13.972 1.00 0.32 C ATOM 2632 CG LYS B 36 15.327 5.712 15.499 1.00 0.47 C ATOM 2633 CD LYS B 36 16.275 4.613 15.984 1.00 0.77 C ATOM 2634 CE LYS B 36 16.282 4.581 17.512 1.00 1.44 C ATOM 2635 NZ LYS B 36 16.888 5.842 18.026 1.00 2.01 N ATOM 0 H LYS B 36 14.680 5.945 11.579 1.00 0.25 H new ATOM 0 HA LYS B 36 13.412 6.730 14.023 1.00 0.28 H new ATOM 0 HB2 LYS B 36 15.030 4.779 13.574 1.00 0.32 H new ATOM 0 HB3 LYS B 36 16.330 5.953 13.601 1.00 0.32 H new ATOM 0 HG2 LYS B 36 15.640 6.678 15.896 1.00 0.47 H new ATOM 0 HG3 LYS B 36 14.319 5.526 15.869 1.00 0.47 H new ATOM 0 HD2 LYS B 36 15.959 3.647 15.591 1.00 0.77 H new ATOM 0 HD3 LYS B 36 17.282 4.796 15.609 1.00 0.77 H new ATOM 0 HE2 LYS B 36 15.266 4.472 17.890 1.00 1.44 H new ATOM 0 HE3 LYS B 36 16.849 3.720 17.867 1.00 1.44 H new ATOM 0 HZ1 LYS B 36 17.206 5.700 19.006 1.00 2.01 H new ATOM 0 HZ2 LYS B 36 17.701 6.104 17.432 1.00 2.01 H new ATOM 0 HZ3 LYS B 36 16.180 6.604 17.999 1.00 2.01 H new ATOM 2649 N ASN B 37 15.843 8.672 12.946 1.00 0.27 N ATOM 2650 CA ASN B 37 16.449 10.015 13.165 1.00 0.30 C ATOM 2651 C ASN B 37 15.345 11.074 13.139 1.00 0.29 C ATOM 2652 O ASN B 37 15.345 12.008 13.916 1.00 0.32 O ATOM 2653 CB ASN B 37 17.466 10.309 12.067 1.00 0.32 C ATOM 2654 CG ASN B 37 18.101 11.677 12.320 1.00 0.37 C ATOM 2655 OD1 ASN B 37 18.164 12.546 11.348 1.00 0.74 O flip ATOM 2656 ND2 ASN B 37 18.545 11.959 13.416 1.00 0.48 N flip ATOM 0 H ASN B 37 16.181 8.172 12.124 1.00 0.27 H new ATOM 0 HA ASN B 37 16.953 10.033 14.131 1.00 0.30 H new ATOM 0 HB2 ASN B 37 18.234 9.536 12.051 1.00 0.32 H new ATOM 0 HB3 ASN B 37 16.980 10.296 11.092 1.00 0.32 H new ATOM 0 HD21 ASN B 37 18.496 11.281 14.176 1.00 0.48 H new ATOM 0 HD22 ASN B 37 18.966 12.874 13.576 1.00 0.48 H new ATOM 2663 N LEU B 38 14.401 10.931 12.248 1.00 0.26 N ATOM 2664 CA LEU B 38 13.292 11.922 12.167 1.00 0.27 C ATOM 2665 C LEU B 38 12.545 11.952 13.495 1.00 0.26 C ATOM 2666 O LEU B 38 12.143 12.998 13.960 1.00 0.28 O ATOM 2667 CB LEU B 38 12.322 11.544 11.047 1.00 0.26 C ATOM 2668 CG LEU B 38 12.964 11.785 9.675 1.00 0.30 C ATOM 2669 CD1 LEU B 38 12.030 11.231 8.597 1.00 0.34 C ATOM 2670 CD2 LEU B 38 13.191 13.295 9.440 1.00 0.35 C ATOM 0 H LEU B 38 14.351 10.169 11.572 1.00 0.26 H new ATOM 0 HA LEU B 38 13.711 12.906 11.954 1.00 0.27 H new ATOM 0 HB2 LEU B 38 12.038 10.496 11.143 1.00 0.26 H new ATOM 0 HB3 LEU B 38 11.408 12.132 11.136 1.00 0.26 H new ATOM 0 HG LEU B 38 13.931 11.283 9.633 1.00 0.30 H new ATOM 0 HD11 LEU B 38 12.472 11.394 7.614 1.00 0.34 H new ATOM 0 HD12 LEU B 38 11.884 10.163 8.756 1.00 0.34 H new ATOM 0 HD13 LEU B 38 11.068 11.741 8.652 1.00 0.34 H new ATOM 0 HD21 LEU B 38 13.647 13.446 8.462 1.00 0.35 H new ATOM 0 HD22 LEU B 38 12.235 13.817 9.479 1.00 0.35 H new ATOM 0 HD23 LEU B 38 13.851 13.688 10.213 1.00 0.35 H new ATOM 2682 N GLN B 39 12.344 10.821 14.111 1.00 0.26 N ATOM 2683 CA GLN B 39 11.606 10.827 15.401 1.00 0.29 C ATOM 2684 C GLN B 39 12.373 11.696 16.396 1.00 0.33 C ATOM 2685 O GLN B 39 11.789 12.457 17.140 1.00 0.35 O ATOM 2686 CB GLN B 39 11.523 9.402 15.950 1.00 0.32 C ATOM 2687 CG GLN B 39 10.687 9.391 17.232 1.00 0.40 C ATOM 2688 CD GLN B 39 10.607 7.965 17.778 1.00 0.45 C ATOM 2689 OE1 GLN B 39 11.600 7.266 17.832 1.00 0.84 O ATOM 2690 NE2 GLN B 39 9.461 7.503 18.192 1.00 0.98 N ATOM 0 H GLN B 39 12.654 9.906 13.782 1.00 0.26 H new ATOM 0 HA GLN B 39 10.600 11.218 15.249 1.00 0.29 H new ATOM 0 HB2 GLN B 39 11.076 8.741 15.207 1.00 0.32 H new ATOM 0 HB3 GLN B 39 12.524 9.022 16.154 1.00 0.32 H new ATOM 0 HG2 GLN B 39 11.133 10.052 17.975 1.00 0.40 H new ATOM 0 HG3 GLN B 39 9.686 9.770 17.029 1.00 0.40 H new ATOM 0 HE21 GLN B 39 8.628 8.090 18.147 1.00 0.98 H new ATOM 0 HE22 GLN B 39 9.397 6.554 18.562 1.00 0.98 H new ATOM 2699 N THR B 40 13.677 11.619 16.403 1.00 0.36 N ATOM 2700 CA THR B 40 14.447 12.479 17.343 1.00 0.42 C ATOM 2701 C THR B 40 14.134 13.940 17.016 1.00 0.41 C ATOM 2702 O THR B 40 13.916 14.750 17.895 1.00 0.43 O ATOM 2703 CB THR B 40 15.948 12.215 17.191 1.00 0.47 C ATOM 2704 OG1 THR B 40 16.390 12.688 15.927 1.00 0.46 O ATOM 2705 CG2 THR B 40 16.214 10.712 17.302 1.00 0.49 C ATOM 0 H THR B 40 14.234 11.007 15.807 1.00 0.36 H new ATOM 0 HA THR B 40 14.166 12.255 18.372 1.00 0.42 H new ATOM 0 HB THR B 40 16.491 12.738 17.979 1.00 0.47 H new ATOM 0 HG1 THR B 40 16.117 12.057 15.228 1.00 0.46 H new ATOM 0 HG21 THR B 40 17.282 10.523 17.194 1.00 0.49 H new ATOM 0 HG22 THR B 40 15.879 10.354 18.275 1.00 0.49 H new ATOM 0 HG23 THR B 40 15.671 10.187 16.516 1.00 0.49 H new ATOM 2713 N ARG B 41 14.073 14.277 15.753 1.00 0.39 N ATOM 2714 CA ARG B 41 13.732 15.678 15.380 1.00 0.40 C ATOM 2715 C ARG B 41 12.310 15.970 15.833 1.00 0.36 C ATOM 2716 O ARG B 41 12.013 17.040 16.323 1.00 0.37 O ATOM 2717 CB ARG B 41 13.845 15.886 13.868 1.00 0.43 C ATOM 2718 CG ARG B 41 15.318 15.862 13.461 1.00 0.55 C ATOM 2719 CD ARG B 41 15.456 16.301 12.003 1.00 0.66 C ATOM 2720 NE ARG B 41 16.908 16.431 11.662 1.00 0.89 N ATOM 2721 CZ ARG B 41 17.686 17.258 12.305 1.00 1.05 C ATOM 2722 NH1 ARG B 41 17.184 18.155 13.108 1.00 1.23 N ATOM 2723 NH2 ARG B 41 18.966 17.225 12.095 1.00 1.32 N ATOM 0 H ARG B 41 14.244 13.646 14.970 1.00 0.39 H new ATOM 0 HA ARG B 41 14.432 16.357 15.867 1.00 0.40 H new ATOM 0 HB2 ARG B 41 13.298 15.105 13.340 1.00 0.43 H new ATOM 0 HB3 ARG B 41 13.394 16.837 13.586 1.00 0.43 H new ATOM 0 HG2 ARG B 41 15.895 16.524 14.107 1.00 0.55 H new ATOM 0 HG3 ARG B 41 15.725 14.859 13.589 1.00 0.55 H new ATOM 0 HD2 ARG B 41 14.980 15.574 11.345 1.00 0.66 H new ATOM 0 HD3 ARG B 41 14.947 17.252 11.848 1.00 0.66 H new ATOM 0 HE ARG B 41 17.297 15.861 10.911 1.00 0.89 H new ATOM 0 HH11 ARG B 41 16.174 18.215 13.238 1.00 1.23 H new ATOM 0 HH12 ARG B 41 17.801 18.797 13.606 1.00 1.23 H new ATOM 0 HH21 ARG B 41 19.357 16.556 11.431 1.00 1.32 H new ATOM 0 HH22 ARG B 41 19.581 17.868 12.593 1.00 1.32 H new ATOM 2737 N VAL B 42 11.425 15.025 15.681 1.00 0.33 N ATOM 2738 CA VAL B 42 10.029 15.270 16.112 1.00 0.35 C ATOM 2739 C VAL B 42 10.040 15.573 17.607 1.00 0.38 C ATOM 2740 O VAL B 42 9.421 16.513 18.052 1.00 0.40 O ATOM 2741 CB VAL B 42 9.171 14.031 15.833 1.00 0.37 C ATOM 2742 CG1 VAL B 42 7.802 14.189 16.503 1.00 0.43 C ATOM 2743 CG2 VAL B 42 8.970 13.882 14.323 1.00 0.38 C ATOM 0 H VAL B 42 11.608 14.105 15.281 1.00 0.33 H new ATOM 0 HA VAL B 42 9.606 16.111 15.562 1.00 0.35 H new ATOM 0 HB VAL B 42 9.674 13.150 16.231 1.00 0.37 H new ATOM 0 HG11 VAL B 42 7.195 13.306 16.302 1.00 0.43 H new ATOM 0 HG12 VAL B 42 7.934 14.302 17.579 1.00 0.43 H new ATOM 0 HG13 VAL B 42 7.302 15.072 16.105 1.00 0.43 H new ATOM 0 HG21 VAL B 42 8.360 13.001 14.122 1.00 0.38 H new ATOM 0 HG22 VAL B 42 8.468 14.768 13.934 1.00 0.38 H new ATOM 0 HG23 VAL B 42 9.939 13.771 13.836 1.00 0.38 H new ATOM 2753 N THR B 43 10.763 14.819 18.387 1.00 0.39 N ATOM 2754 CA THR B 43 10.806 15.123 19.845 1.00 0.45 C ATOM 2755 C THR B 43 11.357 16.536 20.029 1.00 0.44 C ATOM 2756 O THR B 43 10.883 17.299 20.849 1.00 0.47 O ATOM 2757 CB THR B 43 11.717 14.123 20.564 1.00 0.50 C ATOM 2758 OG1 THR B 43 13.026 14.195 20.017 1.00 0.50 O ATOM 2759 CG2 THR B 43 11.166 12.705 20.400 1.00 0.51 C ATOM 0 H THR B 43 11.318 14.018 18.085 1.00 0.39 H new ATOM 0 HA THR B 43 9.803 15.049 20.266 1.00 0.45 H new ATOM 0 HB THR B 43 11.754 14.369 21.625 1.00 0.50 H new ATOM 0 HG1 THR B 43 12.969 14.343 19.050 1.00 0.50 H new ATOM 0 HG21 THR B 43 11.819 11.999 20.914 1.00 0.51 H new ATOM 0 HG22 THR B 43 10.165 12.652 20.829 1.00 0.51 H new ATOM 0 HG23 THR B 43 11.121 12.452 19.341 1.00 0.51 H new ATOM 2767 N ALA B 44 12.347 16.898 19.257 1.00 0.42 N ATOM 2768 CA ALA B 44 12.918 18.272 19.371 1.00 0.43 C ATOM 2769 C ALA B 44 11.852 19.277 18.931 1.00 0.39 C ATOM 2770 O ALA B 44 11.673 20.316 19.534 1.00 0.39 O ATOM 2771 CB ALA B 44 14.155 18.392 18.471 1.00 0.45 C ATOM 0 H ALA B 44 12.784 16.303 18.554 1.00 0.42 H new ATOM 0 HA ALA B 44 13.214 18.473 20.401 1.00 0.43 H new ATOM 0 HB1 ALA B 44 14.571 19.396 18.556 1.00 0.45 H new ATOM 0 HB2 ALA B 44 14.903 17.662 18.781 1.00 0.45 H new ATOM 0 HB3 ALA B 44 13.871 18.203 17.436 1.00 0.45 H new ATOM 2777 N ILE B 45 11.123 18.950 17.898 1.00 0.35 N ATOM 2778 CA ILE B 45 10.032 19.849 17.414 1.00 0.32 C ATOM 2779 C ILE B 45 8.959 19.979 18.496 1.00 0.32 C ATOM 2780 O ILE B 45 8.409 21.041 18.709 1.00 0.31 O ATOM 2781 CB ILE B 45 9.419 19.286 16.127 1.00 0.31 C ATOM 2782 CG1 ILE B 45 10.434 19.424 14.983 1.00 0.32 C ATOM 2783 CG2 ILE B 45 8.137 20.049 15.774 1.00 0.30 C ATOM 2784 CD1 ILE B 45 9.964 18.633 13.756 1.00 0.33 C ATOM 0 H ILE B 45 11.237 18.090 17.362 1.00 0.35 H new ATOM 0 HA ILE B 45 10.446 20.834 17.200 1.00 0.32 H new ATOM 0 HB ILE B 45 9.172 18.235 16.276 1.00 0.31 H new ATOM 0 HG12 ILE B 45 10.557 20.475 14.721 1.00 0.32 H new ATOM 0 HG13 ILE B 45 11.409 19.060 15.307 1.00 0.32 H new ATOM 0 HG21 ILE B 45 7.711 19.640 14.858 1.00 0.30 H new ATOM 0 HG22 ILE B 45 7.417 19.947 16.586 1.00 0.30 H new ATOM 0 HG23 ILE B 45 8.370 21.103 15.626 1.00 0.30 H new ATOM 0 HD11 ILE B 45 10.693 18.740 12.953 1.00 0.33 H new ATOM 0 HD12 ILE B 45 9.865 17.580 14.018 1.00 0.33 H new ATOM 0 HD13 ILE B 45 8.999 19.016 13.424 1.00 0.33 H new ATOM 2796 N GLU B 46 8.641 18.906 19.171 1.00 0.34 N ATOM 2797 CA GLU B 46 7.589 18.986 20.220 1.00 0.36 C ATOM 2798 C GLU B 46 8.029 19.990 21.270 1.00 0.38 C ATOM 2799 O GLU B 46 7.250 20.789 21.751 1.00 0.38 O ATOM 2800 CB GLU B 46 7.415 17.617 20.888 1.00 0.43 C ATOM 2801 CG GLU B 46 6.765 16.634 19.913 1.00 1.20 C ATOM 2802 CD GLU B 46 6.601 15.273 20.595 1.00 1.67 C ATOM 2803 OE1 GLU B 46 7.158 15.098 21.666 1.00 2.17 O ATOM 2804 OE2 GLU B 46 5.930 14.426 20.029 1.00 2.26 O ATOM 0 H GLU B 46 9.062 17.986 19.041 1.00 0.34 H new ATOM 0 HA GLU B 46 6.645 19.291 19.769 1.00 0.36 H new ATOM 0 HB2 GLU B 46 8.384 17.235 21.209 1.00 0.43 H new ATOM 0 HB3 GLU B 46 6.799 17.716 21.782 1.00 0.43 H new ATOM 0 HG2 GLU B 46 5.794 17.012 19.592 1.00 1.20 H new ATOM 0 HG3 GLU B 46 7.379 16.533 19.018 1.00 1.20 H new ATOM 2811 N LYS B 47 9.278 19.968 21.612 1.00 0.41 N ATOM 2812 CA LYS B 47 9.789 20.933 22.611 1.00 0.43 C ATOM 2813 C LYS B 47 9.574 22.362 22.107 1.00 0.41 C ATOM 2814 O LYS B 47 9.097 23.221 22.824 1.00 0.42 O ATOM 2815 CB LYS B 47 11.279 20.658 22.835 1.00 0.48 C ATOM 2816 CG LYS B 47 11.893 21.699 23.775 1.00 1.21 C ATOM 2817 CD LYS B 47 11.180 21.679 25.131 1.00 1.54 C ATOM 2818 CE LYS B 47 12.045 22.381 26.180 1.00 2.31 C ATOM 2819 NZ LYS B 47 11.269 22.531 27.445 1.00 2.88 N ATOM 0 H LYS B 47 9.972 19.319 21.241 1.00 0.41 H new ATOM 0 HA LYS B 47 9.254 20.821 23.554 1.00 0.43 H new ATOM 0 HB2 LYS B 47 11.409 19.661 23.256 1.00 0.48 H new ATOM 0 HB3 LYS B 47 11.803 20.672 21.879 1.00 0.48 H new ATOM 0 HG2 LYS B 47 12.955 21.494 23.912 1.00 1.21 H new ATOM 0 HG3 LYS B 47 11.815 22.691 23.330 1.00 1.21 H new ATOM 0 HD2 LYS B 47 10.213 22.176 25.051 1.00 1.54 H new ATOM 0 HD3 LYS B 47 10.986 20.651 25.435 1.00 1.54 H new ATOM 0 HE2 LYS B 47 12.952 21.805 26.363 1.00 2.31 H new ATOM 0 HE3 LYS B 47 12.357 23.359 25.814 1.00 2.31 H new ATOM 0 HZ1 LYS B 47 11.857 23.008 28.158 1.00 2.88 H new ATOM 0 HZ2 LYS B 47 10.416 23.098 27.264 1.00 2.88 H new ATOM 0 HZ3 LYS B 47 10.993 21.592 27.796 1.00 2.88 H new ATOM 2833 N TYR B 48 9.936 22.630 20.882 1.00 0.38 N ATOM 2834 CA TYR B 48 9.767 24.008 20.342 1.00 0.36 C ATOM 2835 C TYR B 48 8.285 24.395 20.334 1.00 0.32 C ATOM 2836 O TYR B 48 7.929 25.511 20.649 1.00 0.33 O ATOM 2837 CB TYR B 48 10.327 24.068 18.914 1.00 0.37 C ATOM 2838 CG TYR B 48 11.836 24.158 18.970 1.00 0.40 C ATOM 2839 CD1 TYR B 48 12.439 25.324 19.448 1.00 0.45 C ATOM 2840 CD2 TYR B 48 12.630 23.080 18.555 1.00 0.41 C ATOM 2841 CE1 TYR B 48 13.833 25.421 19.508 1.00 0.51 C ATOM 2842 CE2 TYR B 48 14.026 23.174 18.617 1.00 0.46 C ATOM 2843 CZ TYR B 48 14.628 24.346 19.093 1.00 0.51 C ATOM 2844 OH TYR B 48 16.003 24.441 19.154 1.00 0.57 O ATOM 0 H TYR B 48 10.341 21.955 20.233 1.00 0.38 H new ATOM 0 HA TYR B 48 10.309 24.709 20.977 1.00 0.36 H new ATOM 0 HB2 TYR B 48 10.025 23.182 18.355 1.00 0.37 H new ATOM 0 HB3 TYR B 48 9.919 24.931 18.388 1.00 0.37 H new ATOM 0 HD1 TYR B 48 11.827 26.153 19.772 1.00 0.45 H new ATOM 0 HD2 TYR B 48 12.165 22.177 18.187 1.00 0.41 H new ATOM 0 HE1 TYR B 48 14.296 26.325 19.874 1.00 0.51 H new ATOM 0 HE2 TYR B 48 14.638 22.343 18.298 1.00 0.46 H new ATOM 0 HH TYR B 48 16.366 23.652 19.608 1.00 0.57 H new ATOM 2854 N LEU B 49 7.418 23.489 19.978 1.00 0.30 N ATOM 2855 CA LEU B 49 5.966 23.827 19.956 1.00 0.29 C ATOM 2856 C LEU B 49 5.526 24.240 21.369 1.00 0.32 C ATOM 2857 O LEU B 49 4.770 25.178 21.548 1.00 0.32 O ATOM 2858 CB LEU B 49 5.169 22.601 19.482 1.00 0.29 C ATOM 2859 CG LEU B 49 5.440 22.326 17.990 1.00 0.25 C ATOM 2860 CD1 LEU B 49 4.841 20.967 17.612 1.00 0.27 C ATOM 2861 CD2 LEU B 49 4.792 23.413 17.110 1.00 0.25 C ATOM 0 H LEU B 49 7.649 22.534 19.703 1.00 0.30 H new ATOM 0 HA LEU B 49 5.781 24.654 19.271 1.00 0.29 H new ATOM 0 HB2 LEU B 49 5.445 21.729 20.075 1.00 0.29 H new ATOM 0 HB3 LEU B 49 4.104 22.769 19.639 1.00 0.29 H new ATOM 0 HG LEU B 49 6.518 22.329 17.826 1.00 0.25 H new ATOM 0 HD11 LEU B 49 5.030 20.767 16.557 1.00 0.27 H new ATOM 0 HD12 LEU B 49 5.301 20.186 18.217 1.00 0.27 H new ATOM 0 HD13 LEU B 49 3.766 20.980 17.792 1.00 0.27 H new ATOM 0 HD21 LEU B 49 4.995 23.200 16.060 1.00 0.25 H new ATOM 0 HD22 LEU B 49 3.715 23.422 17.277 1.00 0.25 H new ATOM 0 HD23 LEU B 49 5.207 24.387 17.370 1.00 0.25 H new ATOM 2873 N LYS B 50 6.014 23.561 22.375 1.00 0.35 N ATOM 2874 CA LYS B 50 5.648 23.916 23.781 1.00 0.39 C ATOM 2875 C LYS B 50 6.082 25.360 24.072 1.00 0.39 C ATOM 2876 O LYS B 50 5.384 26.120 24.723 1.00 0.41 O ATOM 2877 CB LYS B 50 6.340 22.948 24.748 1.00 0.44 C ATOM 2878 CG LYS B 50 5.830 23.186 26.172 1.00 1.03 C ATOM 2879 CD LYS B 50 6.512 22.207 27.134 1.00 1.21 C ATOM 2880 CE LYS B 50 5.964 22.408 28.549 1.00 1.58 C ATOM 2881 NZ LYS B 50 6.331 21.237 29.394 1.00 2.18 N ATOM 0 H LYS B 50 6.654 22.772 22.283 1.00 0.35 H new ATOM 0 HA LYS B 50 4.569 23.837 23.913 1.00 0.39 H new ATOM 0 HB2 LYS B 50 6.144 21.918 24.449 1.00 0.44 H new ATOM 0 HB3 LYS B 50 7.420 23.091 24.710 1.00 0.44 H new ATOM 0 HG2 LYS B 50 6.036 24.212 26.476 1.00 1.03 H new ATOM 0 HG3 LYS B 50 4.749 23.053 26.209 1.00 1.03 H new ATOM 0 HD2 LYS B 50 6.338 21.181 26.808 1.00 1.21 H new ATOM 0 HD3 LYS B 50 7.590 22.365 27.125 1.00 1.21 H new ATOM 0 HE2 LYS B 50 6.369 23.323 28.981 1.00 1.58 H new ATOM 0 HE3 LYS B 50 4.880 22.523 28.518 1.00 1.58 H new ATOM 0 HZ1 LYS B 50 5.959 21.373 30.356 1.00 2.18 H new ATOM 0 HZ2 LYS B 50 5.924 20.372 28.984 1.00 2.18 H new ATOM 0 HZ3 LYS B 50 7.366 21.148 29.433 1.00 2.18 H new ATOM 2895 N ASP B 51 7.231 25.741 23.592 1.00 0.38 N ATOM 2896 CA ASP B 51 7.724 27.125 23.835 1.00 0.40 C ATOM 2897 C ASP B 51 6.718 28.112 23.242 1.00 0.38 C ATOM 2898 O ASP B 51 6.427 29.140 23.819 1.00 0.40 O ATOM 2899 CB ASP B 51 9.084 27.310 23.157 1.00 0.42 C ATOM 2900 CG ASP B 51 10.140 26.487 23.898 1.00 1.29 C ATOM 2901 OD1 ASP B 51 9.939 26.218 25.071 1.00 2.07 O ATOM 2902 OD2 ASP B 51 11.131 26.139 23.278 1.00 1.96 O ATOM 0 H ASP B 51 7.853 25.151 23.039 1.00 0.38 H new ATOM 0 HA ASP B 51 7.832 27.301 24.905 1.00 0.40 H new ATOM 0 HB2 ASP B 51 9.028 26.996 22.115 1.00 0.42 H new ATOM 0 HB3 ASP B 51 9.362 28.364 23.158 1.00 0.42 H new ATOM 2907 N GLN B 52 6.180 27.802 22.095 1.00 0.36 N ATOM 2908 CA GLN B 52 5.187 28.717 21.462 1.00 0.38 C ATOM 2909 C GLN B 52 3.992 28.883 22.412 1.00 0.38 C ATOM 2910 O GLN B 52 3.461 29.963 22.568 1.00 0.40 O ATOM 2911 CB GLN B 52 4.729 28.112 20.115 1.00 0.42 C ATOM 2912 CG GLN B 52 5.487 28.766 18.951 1.00 1.31 C ATOM 2913 CD GLN B 52 6.991 28.751 19.240 1.00 2.37 C ATOM 2914 OE1 GLN B 52 7.502 27.768 19.928 1.00 3.28 O flip ATOM 2915 NE2 GLN B 52 7.708 29.644 18.832 1.00 2.59 N flip ATOM 0 H GLN B 52 6.385 26.953 21.567 1.00 0.36 H new ATOM 0 HA GLN B 52 5.632 29.694 21.275 1.00 0.38 H new ATOM 0 HB2 GLN B 52 4.905 27.036 20.113 1.00 0.42 H new ATOM 0 HB3 GLN B 52 3.657 28.260 19.988 1.00 0.42 H new ATOM 0 HG2 GLN B 52 5.280 28.232 18.024 1.00 1.31 H new ATOM 0 HG3 GLN B 52 5.144 29.791 18.812 1.00 1.31 H new ATOM 0 HE21 GLN B 52 7.309 30.413 18.294 1.00 2.59 H new ATOM 0 HE22 GLN B 52 8.709 29.624 19.028 1.00 2.59 H new ATOM 2924 N ALA B 53 3.571 27.830 23.054 1.00 0.39 N ATOM 2925 CA ALA B 53 2.425 27.948 23.994 1.00 0.45 C ATOM 2926 C ALA B 53 2.754 28.990 25.060 1.00 0.47 C ATOM 2927 O ALA B 53 1.894 29.707 25.529 1.00 0.53 O ATOM 2928 CB ALA B 53 2.192 26.606 24.677 1.00 0.50 C ATOM 0 H ALA B 53 3.970 26.895 22.968 1.00 0.39 H new ATOM 0 HA ALA B 53 1.533 28.245 23.443 1.00 0.45 H new ATOM 0 HB1 ALA B 53 1.352 26.690 25.367 1.00 0.50 H new ATOM 0 HB2 ALA B 53 1.970 25.849 23.925 1.00 0.50 H new ATOM 0 HB3 ALA B 53 3.087 26.318 25.228 1.00 0.50 H new ATOM 2934 N GLN B 54 3.993 29.069 25.460 1.00 0.45 N ATOM 2935 CA GLN B 54 4.368 30.057 26.513 1.00 0.50 C ATOM 2936 C GLN B 54 4.038 31.471 26.028 1.00 0.55 C ATOM 2937 O GLN B 54 3.566 32.296 26.784 1.00 0.62 O ATOM 2938 CB GLN B 54 5.866 29.946 26.811 1.00 0.51 C ATOM 2939 CG GLN B 54 6.235 30.885 27.962 1.00 0.58 C ATOM 2940 CD GLN B 54 7.731 30.763 28.252 1.00 0.62 C ATOM 2941 OE1 GLN B 54 8.544 30.857 27.355 1.00 0.97 O ATOM 2942 NE2 GLN B 54 8.132 30.550 29.476 1.00 1.03 N ATOM 0 H GLN B 54 4.759 28.496 25.106 1.00 0.45 H new ATOM 0 HA GLN B 54 3.806 29.849 27.423 1.00 0.50 H new ATOM 0 HB2 GLN B 54 6.119 28.918 27.072 1.00 0.51 H new ATOM 0 HB3 GLN B 54 6.443 30.201 25.922 1.00 0.51 H new ATOM 0 HG2 GLN B 54 5.986 31.914 27.702 1.00 0.58 H new ATOM 0 HG3 GLN B 54 5.658 30.633 28.852 1.00 0.58 H new ATOM 0 HE21 GLN B 54 7.449 30.471 30.230 1.00 1.03 H new ATOM 0 HE22 GLN B 54 9.128 30.463 29.678 1.00 1.03 H new ATOM 2951 N LEU B 55 4.270 31.764 24.777 1.00 0.54 N ATOM 2952 CA LEU B 55 3.951 33.128 24.269 1.00 0.62 C ATOM 2953 C LEU B 55 2.433 33.266 24.123 1.00 0.66 C ATOM 2954 O LEU B 55 1.816 32.590 23.325 1.00 0.60 O ATOM 2955 CB LEU B 55 4.617 33.329 22.901 1.00 0.60 C ATOM 2956 CG LEU B 55 6.138 33.191 23.037 1.00 0.63 C ATOM 2957 CD1 LEU B 55 6.778 33.307 21.649 1.00 0.65 C ATOM 2958 CD2 LEU B 55 6.688 34.297 23.961 1.00 0.78 C ATOM 0 H LEU B 55 4.664 31.122 24.089 1.00 0.54 H new ATOM 0 HA LEU B 55 4.322 33.878 24.967 1.00 0.62 H new ATOM 0 HB2 LEU B 55 4.238 32.594 22.191 1.00 0.60 H new ATOM 0 HB3 LEU B 55 4.366 34.313 22.506 1.00 0.60 H new ATOM 0 HG LEU B 55 6.378 32.220 23.472 1.00 0.63 H new ATOM 0 HD11 LEU B 55 7.860 33.210 21.738 1.00 0.65 H new ATOM 0 HD12 LEU B 55 6.394 32.516 21.004 1.00 0.65 H new ATOM 0 HD13 LEU B 55 6.535 34.278 21.216 1.00 0.65 H new ATOM 0 HD21 LEU B 55 7.769 34.191 24.052 1.00 0.78 H new ATOM 0 HD22 LEU B 55 6.453 35.274 23.539 1.00 0.78 H new ATOM 0 HD23 LEU B 55 6.231 34.208 24.947 1.00 0.78 H new ATOM 2970 N ASN B 56 1.824 34.140 24.893 1.00 0.78 N ATOM 2971 CA ASN B 56 0.338 34.331 24.811 1.00 0.86 C ATOM 2972 C ASN B 56 0.018 35.826 24.745 1.00 0.97 C ATOM 2973 O ASN B 56 -0.402 36.338 23.727 1.00 0.92 O ATOM 2974 CB ASN B 56 -0.313 33.729 26.057 1.00 0.92 C ATOM 2975 CG ASN B 56 0.133 32.273 26.208 1.00 0.85 C ATOM 2976 OD1 ASN B 56 0.795 31.925 27.165 1.00 1.37 O ATOM 2977 ND2 ASN B 56 -0.207 31.403 25.298 1.00 1.36 N ATOM 0 H ASN B 56 2.295 34.732 25.578 1.00 0.78 H new ATOM 0 HA ASN B 56 -0.046 33.838 23.918 1.00 0.86 H new ATOM 0 HB2 ASN B 56 -0.031 34.301 26.941 1.00 0.92 H new ATOM 0 HB3 ASN B 56 -1.399 33.782 25.976 1.00 0.92 H new ATOM 0 HD21 ASN B 56 0.083 30.429 25.390 1.00 1.36 H new ATOM 0 HD22 ASN B 56 -0.763 31.696 24.495 1.00 1.36 H new ATOM 2984 N ALA B 57 0.222 36.528 25.827 1.00 1.13 N ATOM 2985 CA ALA B 57 -0.058 37.996 25.848 1.00 1.24 C ATOM 2986 C ALA B 57 0.947 38.671 26.786 1.00 1.36 C ATOM 2987 O ALA B 57 0.704 38.842 27.964 1.00 1.50 O ATOM 2988 CB ALA B 57 -1.490 38.231 26.346 1.00 1.33 C ATOM 0 H ALA B 57 0.573 36.146 26.705 1.00 1.13 H new ATOM 0 HA ALA B 57 0.039 38.417 24.847 1.00 1.24 H new ATOM 0 HB1 ALA B 57 -1.698 39.301 26.363 1.00 1.33 H new ATOM 0 HB2 ALA B 57 -2.194 37.735 25.678 1.00 1.33 H new ATOM 0 HB3 ALA B 57 -1.597 37.825 27.352 1.00 1.33 H new ATOM 2994 N TRP B 58 2.083 39.042 26.261 1.00 1.35 N ATOM 2995 CA TRP B 58 3.142 39.697 27.089 1.00 1.48 C ATOM 2996 C TRP B 58 3.117 41.212 26.878 1.00 1.33 C ATOM 2997 O TRP B 58 2.961 41.694 25.772 1.00 1.26 O ATOM 2998 CB TRP B 58 4.507 39.159 26.664 1.00 1.68 C ATOM 2999 CG TRP B 58 4.635 37.730 27.083 1.00 1.88 C ATOM 3000 CD1 TRP B 58 4.384 36.664 26.290 1.00 1.95 C ATOM 3001 CD2 TRP B 58 5.040 37.193 28.375 1.00 2.05 C ATOM 3002 NE1 TRP B 58 4.610 35.505 27.013 1.00 2.17 N ATOM 3003 CE2 TRP B 58 5.016 35.780 28.304 1.00 2.24 C ATOM 3004 CE3 TRP B 58 5.423 37.789 29.590 1.00 2.09 C ATOM 3005 CZ2 TRP B 58 5.359 34.986 29.400 1.00 2.44 C ATOM 3006 CZ3 TRP B 58 5.769 36.993 30.694 1.00 2.29 C ATOM 3007 CH2 TRP B 58 5.736 35.595 30.600 1.00 2.47 C ATOM 0 H TRP B 58 2.328 38.918 25.279 1.00 1.35 H new ATOM 0 HA TRP B 58 2.959 39.480 28.141 1.00 1.48 H new ATOM 0 HB2 TRP B 58 4.622 39.243 25.583 1.00 1.68 H new ATOM 0 HB3 TRP B 58 5.301 39.754 27.116 1.00 1.68 H new ATOM 0 HD1 TRP B 58 4.060 36.709 25.261 1.00 1.95 H new ATOM 0 HE1 TRP B 58 4.491 34.564 26.638 1.00 2.17 H new ATOM 0 HE3 TRP B 58 5.451 38.865 29.674 1.00 2.09 H new ATOM 0 HZ2 TRP B 58 5.333 33.909 29.321 1.00 2.44 H new ATOM 0 HZ3 TRP B 58 6.063 37.461 31.622 1.00 2.29 H new ATOM 0 HH2 TRP B 58 6.002 34.989 31.454 1.00 2.47 H new ATOM 3018 N GLY B 59 3.288 41.965 27.928 1.00 1.34 N ATOM 3019 CA GLY B 59 3.295 43.448 27.794 1.00 1.27 C ATOM 3020 C GLY B 59 1.988 43.925 27.166 1.00 1.16 C ATOM 3021 O GLY B 59 1.851 45.078 26.807 1.00 1.13 O ATOM 0 H GLY B 59 3.424 41.616 28.877 1.00 1.34 H new ATOM 0 HA2 GLY B 59 3.426 43.909 28.773 1.00 1.27 H new ATOM 0 HA3 GLY B 59 4.139 43.761 27.179 1.00 1.27 H new ATOM 3025 N ALA B 60 1.025 43.058 27.029 1.00 1.14 N ATOM 3026 CA ALA B 60 -0.258 43.484 26.417 1.00 1.11 C ATOM 3027 C ALA B 60 -1.046 44.315 27.433 1.00 1.02 C ATOM 3028 O ALA B 60 -2.248 44.440 27.340 1.00 1.06 O ATOM 3029 CB ALA B 60 -1.055 42.227 26.022 1.00 1.20 C ATOM 0 H ALA B 60 1.072 42.079 27.313 1.00 1.14 H new ATOM 0 HA ALA B 60 -0.076 44.091 25.530 1.00 1.11 H new ATOM 0 HB1 ALA B 60 -2.002 42.523 25.570 1.00 1.20 H new ATOM 0 HB2 ALA B 60 -0.479 41.641 25.306 1.00 1.20 H new ATOM 0 HB3 ALA B 60 -1.249 41.625 26.910 1.00 1.20 H new ATOM 3035 N ALA B 61 -0.376 44.900 28.392 1.00 0.96 N ATOM 3036 CA ALA B 61 -1.100 45.729 29.396 1.00 0.92 C ATOM 3037 C ALA B 61 -0.138 46.733 30.043 1.00 1.17 C ATOM 3038 O ALA B 61 0.706 46.363 30.835 1.00 1.25 O ATOM 3039 CB ALA B 61 -1.689 44.811 30.473 1.00 0.72 C ATOM 0 H ALA B 61 0.634 44.839 28.522 1.00 0.96 H new ATOM 0 HA ALA B 61 -1.901 46.279 28.901 1.00 0.92 H new ATOM 0 HB1 ALA B 61 -2.221 45.411 31.212 1.00 0.72 H new ATOM 0 HB2 ALA B 61 -2.381 44.106 30.012 1.00 0.72 H new ATOM 0 HB3 ALA B 61 -0.885 44.262 30.963 1.00 0.72 H new ATOM 3045 N PHE B 62 -0.273 48.002 29.732 1.00 1.49 N ATOM 3046 CA PHE B 62 0.617 49.041 30.351 1.00 1.80 C ATOM 3047 C PHE B 62 -0.167 49.847 31.390 1.00 1.71 C ATOM 3048 O PHE B 62 0.303 50.855 31.881 1.00 1.94 O ATOM 3049 CB PHE B 62 1.170 49.971 29.258 1.00 2.32 C ATOM 3050 CG PHE B 62 2.382 49.333 28.612 1.00 2.70 C ATOM 3051 CD1 PHE B 62 2.247 48.487 27.503 1.00 2.93 C ATOM 3052 CD2 PHE B 62 3.651 49.593 29.141 1.00 2.87 C ATOM 3053 CE1 PHE B 62 3.388 47.903 26.929 1.00 3.28 C ATOM 3054 CE2 PHE B 62 4.786 49.012 28.568 1.00 3.24 C ATOM 3055 CZ PHE B 62 4.655 48.167 27.462 1.00 3.42 C ATOM 0 H PHE B 62 -0.963 48.365 29.074 1.00 1.49 H new ATOM 0 HA PHE B 62 1.452 48.549 30.849 1.00 1.80 H new ATOM 0 HB2 PHE B 62 0.403 50.162 28.507 1.00 2.32 H new ATOM 0 HB3 PHE B 62 1.441 50.935 29.689 1.00 2.32 H new ATOM 0 HD1 PHE B 62 1.269 48.285 27.091 1.00 2.93 H new ATOM 0 HD2 PHE B 62 3.754 50.245 29.996 1.00 2.87 H new ATOM 0 HE1 PHE B 62 3.288 47.249 26.075 1.00 3.28 H new ATOM 0 HE2 PHE B 62 5.764 49.216 28.979 1.00 3.24 H new ATOM 0 HZ PHE B 62 5.532 47.718 27.019 1.00 3.42 H new ATOM 3065 N ARG B 63 -1.333 49.382 31.767 1.00 1.43 N ATOM 3066 CA ARG B 63 -2.133 50.084 32.823 1.00 1.41 C ATOM 3067 C ARG B 63 -2.385 49.084 33.949 1.00 1.25 C ATOM 3068 O ARG B 63 -3.312 49.210 34.723 1.00 1.34 O ATOM 3069 CB ARG B 63 -3.478 50.537 32.241 1.00 1.67 C ATOM 3070 CG ARG B 63 -3.246 51.538 31.099 1.00 2.31 C ATOM 3071 CD ARG B 63 -2.684 52.863 31.646 1.00 2.72 C ATOM 3072 NE ARG B 63 -1.198 52.793 31.679 1.00 3.14 N ATOM 3073 CZ ARG B 63 -0.497 53.885 31.814 1.00 3.66 C ATOM 3074 NH1 ARG B 63 -1.099 55.039 31.910 1.00 3.89 N ATOM 3075 NH2 ARG B 63 0.806 53.823 31.850 1.00 4.35 N ATOM 0 H ARG B 63 -1.769 48.542 31.387 1.00 1.43 H new ATOM 0 HA ARG B 63 -1.596 50.959 33.189 1.00 1.41 H new ATOM 0 HB2 ARG B 63 -4.033 49.674 31.872 1.00 1.67 H new ATOM 0 HB3 ARG B 63 -4.085 50.997 33.021 1.00 1.67 H new ATOM 0 HG2 ARG B 63 -2.552 51.115 30.372 1.00 2.31 H new ATOM 0 HG3 ARG B 63 -4.183 51.723 30.574 1.00 2.31 H new ATOM 0 HD2 ARG B 63 -3.006 53.694 31.019 1.00 2.72 H new ATOM 0 HD3 ARG B 63 -3.073 53.050 32.647 1.00 2.72 H new ATOM 0 HE ARG B 63 -0.728 51.892 31.596 1.00 3.14 H new ATOM 0 HH11 ARG B 63 -2.117 55.087 31.879 1.00 3.89 H new ATOM 0 HH12 ARG B 63 -0.551 55.893 32.016 1.00 3.89 H new ATOM 0 HH21 ARG B 63 1.276 52.921 31.773 1.00 4.35 H new ATOM 0 HH22 ARG B 63 1.354 54.676 31.956 1.00 4.35 H new ATOM 3089 N GLN B 64 -1.545 48.088 34.036 1.00 1.12 N ATOM 3090 CA GLN B 64 -1.688 47.049 35.096 1.00 1.12 C ATOM 3091 C GLN B 64 -0.299 46.515 35.442 1.00 1.12 C ATOM 3092 O GLN B 64 0.591 46.522 34.614 1.00 1.09 O ATOM 3093 CB GLN B 64 -2.564 45.894 34.589 1.00 1.17 C ATOM 3094 CG GLN B 64 -4.024 46.357 34.422 1.00 1.37 C ATOM 3095 CD GLN B 64 -4.221 47.056 33.069 1.00 1.77 C ATOM 3096 OE1 GLN B 64 -3.210 47.209 32.258 1.00 2.44 O flip ATOM 3097 NE2 GLN B 64 -5.318 47.469 32.746 1.00 1.84 N flip ATOM 0 H GLN B 64 -0.754 47.949 33.408 1.00 1.12 H new ATOM 0 HA GLN B 64 -2.158 47.487 35.977 1.00 1.12 H new ATOM 0 HB2 GLN B 64 -2.180 45.530 33.636 1.00 1.17 H new ATOM 0 HB3 GLN B 64 -2.519 45.060 35.290 1.00 1.17 H new ATOM 0 HG2 GLN B 64 -4.693 45.500 34.495 1.00 1.37 H new ATOM 0 HG3 GLN B 64 -4.289 47.038 35.231 1.00 1.37 H new ATOM 0 HE21 GLN B 64 -6.112 47.353 33.375 1.00 1.84 H new ATOM 0 HE22 GLN B 64 -5.444 47.932 31.846 1.00 1.84 H new ATOM 3106 N VAL B 65 -0.101 46.042 36.647 1.00 1.28 N ATOM 3107 CA VAL B 65 1.240 45.495 37.031 1.00 1.44 C ATOM 3108 C VAL B 65 1.144 43.971 37.119 1.00 1.49 C ATOM 3109 O VAL B 65 1.419 43.376 38.142 1.00 1.72 O ATOM 3110 CB VAL B 65 1.643 46.060 38.397 1.00 1.71 C ATOM 3111 CG1 VAL B 65 3.137 45.824 38.632 1.00 1.94 C ATOM 3112 CG2 VAL B 65 1.354 47.562 38.424 1.00 1.67 C ATOM 0 H VAL B 65 -0.808 46.010 37.382 1.00 1.28 H new ATOM 0 HA VAL B 65 1.986 45.777 36.288 1.00 1.44 H new ATOM 0 HB VAL B 65 1.073 45.561 39.181 1.00 1.71 H new ATOM 0 HG11 VAL B 65 3.420 46.227 39.604 1.00 1.94 H new ATOM 0 HG12 VAL B 65 3.345 44.754 38.608 1.00 1.94 H new ATOM 0 HG13 VAL B 65 3.711 46.323 37.851 1.00 1.94 H new ATOM 0 HG21 VAL B 65 1.639 47.970 39.394 1.00 1.67 H new ATOM 0 HG22 VAL B 65 1.927 48.057 37.640 1.00 1.67 H new ATOM 0 HG23 VAL B 65 0.290 47.731 38.258 1.00 1.67 H new ATOM 3122 N ALA B 66 0.762 43.335 36.041 1.00 1.30 N ATOM 3123 CA ALA B 66 0.654 41.848 36.038 1.00 1.38 C ATOM 3124 C ALA B 66 0.926 41.319 34.627 1.00 1.17 C ATOM 3125 O ALA B 66 0.766 42.024 33.650 1.00 1.01 O ATOM 3126 CB ALA B 66 -0.755 41.438 36.469 1.00 1.51 C ATOM 0 H ALA B 66 0.519 43.786 35.159 1.00 1.30 H new ATOM 0 HA ALA B 66 1.384 41.431 36.732 1.00 1.38 H new ATOM 0 HB1 ALA B 66 -0.834 40.351 36.467 1.00 1.51 H new ATOM 0 HB2 ALA B 66 -0.952 41.814 37.473 1.00 1.51 H new ATOM 0 HB3 ALA B 66 -1.484 41.856 35.775 1.00 1.51 H new ATOM 3132 N HIS B 67 1.316 40.075 34.519 1.00 1.22 N ATOM 3133 CA HIS B 67 1.588 39.458 33.178 1.00 1.05 C ATOM 3134 C HIS B 67 0.817 38.142 33.087 1.00 1.10 C ATOM 3135 O HIS B 67 0.832 37.344 34.004 1.00 1.27 O ATOM 3136 CB HIS B 67 3.091 39.209 33.014 1.00 1.10 C ATOM 3137 CG HIS B 67 3.788 40.505 32.681 1.00 1.12 C ATOM 3138 ND1 HIS B 67 5.001 40.862 33.255 1.00 1.35 N ATOM 3139 CD2 HIS B 67 3.459 41.538 31.833 1.00 1.02 C ATOM 3140 CE1 HIS B 67 5.355 42.060 32.752 1.00 1.38 C ATOM 3141 NE2 HIS B 67 4.448 42.513 31.883 1.00 1.19 N ATOM 0 H HIS B 67 1.460 39.449 35.311 1.00 1.22 H new ATOM 0 HA HIS B 67 1.265 40.129 32.382 1.00 1.05 H new ATOM 0 HB2 HIS B 67 3.502 38.789 33.932 1.00 1.10 H new ATOM 0 HB3 HIS B 67 3.264 38.478 32.224 1.00 1.10 H new ATOM 0 HD2 HIS B 67 2.569 41.584 31.223 1.00 1.02 H new ATOM 0 HE1 HIS B 67 6.259 42.588 33.018 1.00 1.38 H new ATOM 0 HE2 HIS B 67 4.475 43.391 31.364 1.00 1.19 H new ATOM 3149 N THR B 68 0.120 37.910 31.999 1.00 1.01 N ATOM 3150 CA THR B 68 -0.677 36.648 31.874 1.00 1.12 C ATOM 3151 C THR B 68 0.103 35.612 31.060 1.00 0.99 C ATOM 3152 O THR B 68 0.434 35.826 29.911 1.00 0.86 O ATOM 3153 CB THR B 68 -2.009 36.960 31.178 1.00 1.20 C ATOM 3154 OG1 THR B 68 -2.868 35.835 31.286 1.00 1.39 O ATOM 3155 CG2 THR B 68 -1.775 37.284 29.697 1.00 1.09 C ATOM 0 H THR B 68 0.069 38.537 31.196 1.00 1.01 H new ATOM 0 HA THR B 68 -0.868 36.241 32.867 1.00 1.12 H new ATOM 0 HB THR B 68 -2.467 37.825 31.658 1.00 1.20 H new ATOM 0 HG1 THR B 68 -3.721 36.031 30.844 1.00 1.39 H new ATOM 0 HG21 THR B 68 -2.729 37.503 29.217 1.00 1.09 H new ATOM 0 HG22 THR B 68 -1.119 38.151 29.613 1.00 1.09 H new ATOM 0 HG23 THR B 68 -1.310 36.429 29.206 1.00 1.09 H new ATOM 3163 N THR B 69 0.397 34.487 31.664 1.00 1.06 N ATOM 3164 CA THR B 69 1.155 33.403 30.963 1.00 0.95 C ATOM 3165 C THR B 69 0.250 32.180 30.798 1.00 0.99 C ATOM 3166 O THR B 69 -0.250 31.632 31.760 1.00 1.16 O ATOM 3167 CB THR B 69 2.388 33.026 31.792 1.00 1.05 C ATOM 3168 OG1 THR B 69 2.834 31.732 31.412 1.00 1.09 O ATOM 3169 CG2 THR B 69 2.040 33.034 33.283 1.00 1.28 C ATOM 0 H THR B 69 0.140 34.270 32.627 1.00 1.06 H new ATOM 0 HA THR B 69 1.475 33.753 29.981 1.00 0.95 H new ATOM 0 HB THR B 69 3.179 33.753 31.610 1.00 1.05 H new ATOM 0 HG1 THR B 69 3.623 31.490 31.940 1.00 1.09 H new ATOM 0 HG21 THR B 69 2.922 32.765 33.864 1.00 1.28 H new ATOM 0 HG22 THR B 69 1.704 34.030 33.573 1.00 1.28 H new ATOM 0 HG23 THR B 69 1.245 32.313 33.475 1.00 1.28 H new ATOM 3177 N VAL B 70 0.028 31.754 29.579 1.00 0.89 N ATOM 3178 CA VAL B 70 -0.853 30.570 29.329 1.00 0.97 C ATOM 3179 C VAL B 70 -0.123 29.578 28.415 1.00 0.85 C ATOM 3180 O VAL B 70 -0.241 29.643 27.207 1.00 0.80 O ATOM 3181 CB VAL B 70 -2.130 31.044 28.634 1.00 1.07 C ATOM 3182 CG1 VAL B 70 -3.056 29.850 28.397 1.00 1.24 C ATOM 3183 CG2 VAL B 70 -2.836 32.066 29.526 1.00 1.18 C ATOM 0 H VAL B 70 0.422 32.179 28.740 1.00 0.89 H new ATOM 0 HA VAL B 70 -1.098 30.084 30.274 1.00 0.97 H new ATOM 0 HB VAL B 70 -1.879 31.502 27.677 1.00 1.07 H new ATOM 0 HG11 VAL B 70 -3.966 30.188 27.902 1.00 1.24 H new ATOM 0 HG12 VAL B 70 -2.551 29.117 27.768 1.00 1.24 H new ATOM 0 HG13 VAL B 70 -3.312 29.392 29.353 1.00 1.24 H new ATOM 0 HG21 VAL B 70 -3.748 32.408 29.036 1.00 1.18 H new ATOM 0 HG22 VAL B 70 -3.088 31.603 30.480 1.00 1.18 H new ATOM 0 HG23 VAL B 70 -2.176 32.916 29.698 1.00 1.18 H new ATOM 3193 N PRO B 71 0.630 28.663 28.981 1.00 0.84 N ATOM 3194 CA PRO B 71 1.384 27.650 28.198 1.00 0.75 C ATOM 3195 C PRO B 71 0.522 26.430 27.855 1.00 0.74 C ATOM 3196 O PRO B 71 0.779 25.329 28.300 1.00 0.78 O ATOM 3197 CB PRO B 71 2.529 27.273 29.141 1.00 0.84 C ATOM 3198 CG PRO B 71 1.956 27.419 30.519 1.00 0.99 C ATOM 3199 CD PRO B 71 0.850 28.488 30.431 1.00 0.98 C ATOM 0 HA PRO B 71 1.722 28.028 27.233 1.00 0.75 H new ATOM 0 HB2 PRO B 71 2.870 26.254 28.961 1.00 0.84 H new ATOM 0 HB3 PRO B 71 3.389 27.927 28.999 1.00 0.84 H new ATOM 0 HG2 PRO B 71 1.550 26.471 30.871 1.00 0.99 H new ATOM 0 HG3 PRO B 71 2.727 27.718 31.229 1.00 0.99 H new ATOM 0 HD2 PRO B 71 -0.060 28.162 30.935 1.00 0.98 H new ATOM 0 HD3 PRO B 71 1.159 29.421 30.902 1.00 0.98 H new ATOM 3207 N TRP B 72 -0.496 26.623 27.062 1.00 0.72 N ATOM 3208 CA TRP B 72 -1.378 25.484 26.681 1.00 0.75 C ATOM 3209 C TRP B 72 -0.585 24.537 25.774 1.00 0.68 C ATOM 3210 O TRP B 72 -0.013 24.977 24.804 1.00 0.60 O ATOM 3211 CB TRP B 72 -2.563 26.032 25.888 1.00 0.78 C ATOM 3212 CG TRP B 72 -3.489 24.913 25.528 1.00 0.84 C ATOM 3213 CD1 TRP B 72 -4.292 24.258 26.397 1.00 0.94 C ATOM 3214 CD2 TRP B 72 -3.723 24.309 24.221 1.00 0.84 C ATOM 3215 NE1 TRP B 72 -5.004 23.291 25.707 1.00 0.99 N ATOM 3216 CE2 TRP B 72 -4.687 23.284 24.364 1.00 0.94 C ATOM 3217 CE3 TRP B 72 -3.196 24.550 22.938 1.00 0.79 C ATOM 3218 CZ2 TRP B 72 -5.113 22.523 23.274 1.00 0.97 C ATOM 3219 CZ3 TRP B 72 -3.624 23.787 21.839 1.00 0.84 C ATOM 3220 CH2 TRP B 72 -4.581 22.776 22.007 1.00 0.92 C ATOM 0 H TRP B 72 -0.756 27.524 26.660 1.00 0.72 H new ATOM 0 HA TRP B 72 -1.725 24.959 27.571 1.00 0.75 H new ATOM 0 HB2 TRP B 72 -3.093 26.780 26.478 1.00 0.78 H new ATOM 0 HB3 TRP B 72 -2.210 26.530 24.985 1.00 0.78 H new ATOM 0 HD1 TRP B 72 -4.366 24.457 27.456 1.00 0.94 H new ATOM 0 HE1 TRP B 72 -5.680 22.661 26.139 1.00 0.99 H new ATOM 0 HE3 TRP B 72 -2.458 25.326 22.798 1.00 0.79 H new ATOM 0 HZ2 TRP B 72 -5.849 21.744 23.409 1.00 0.97 H new ATOM 0 HZ3 TRP B 72 -3.214 23.980 20.859 1.00 0.84 H new ATOM 0 HH2 TRP B 72 -4.907 22.193 21.158 1.00 0.92 H new ATOM 3231 N PRO B 73 -0.535 23.252 26.058 1.00 0.71 N ATOM 3232 CA PRO B 73 0.231 22.308 25.204 1.00 0.66 C ATOM 3233 C PRO B 73 0.078 22.644 23.720 1.00 0.58 C ATOM 3234 O PRO B 73 -0.961 23.094 23.279 1.00 0.61 O ATOM 3235 CB PRO B 73 -0.397 20.954 25.536 1.00 0.75 C ATOM 3236 CG PRO B 73 -0.808 21.079 26.971 1.00 0.85 C ATOM 3237 CD PRO B 73 -1.183 22.555 27.186 1.00 0.82 C ATOM 0 HA PRO B 73 1.304 22.340 25.391 1.00 0.66 H new ATOM 0 HB2 PRO B 73 -1.252 20.744 24.894 1.00 0.75 H new ATOM 0 HB3 PRO B 73 0.314 20.140 25.395 1.00 0.75 H new ATOM 0 HG2 PRO B 73 -1.653 20.427 27.191 1.00 0.85 H new ATOM 0 HG3 PRO B 73 0.004 20.784 27.635 1.00 0.85 H new ATOM 0 HD2 PRO B 73 -2.263 22.698 27.177 1.00 0.82 H new ATOM 0 HD3 PRO B 73 -0.820 22.924 28.145 1.00 0.82 H new ATOM 3245 N ASN B 74 1.110 22.432 22.955 1.00 0.52 N ATOM 3246 CA ASN B 74 1.058 22.735 21.494 1.00 0.48 C ATOM 3247 C ASN B 74 1.590 21.523 20.742 1.00 0.50 C ATOM 3248 O ASN B 74 1.830 21.557 19.551 1.00 0.80 O ATOM 3249 CB ASN B 74 1.926 23.962 21.212 1.00 0.47 C ATOM 3250 CG ASN B 74 1.709 24.428 19.772 1.00 0.53 C ATOM 3251 OD1 ASN B 74 2.681 25.021 19.137 1.00 1.17 O flip ATOM 3252 ND2 ASN B 74 0.641 24.251 19.218 1.00 1.26 N flip ATOM 0 H ASN B 74 2.000 22.057 23.282 1.00 0.52 H new ATOM 0 HA ASN B 74 0.038 22.946 21.172 1.00 0.48 H new ATOM 0 HB2 ASN B 74 1.675 24.764 21.906 1.00 0.47 H new ATOM 0 HB3 ASN B 74 2.977 23.720 21.372 1.00 0.47 H new ATOM 0 HD21 ASN B 74 -0.120 23.787 19.714 1.00 1.26 H new ATOM 0 HD22 ASN B 74 0.506 24.566 18.257 1.00 1.26 H new ATOM 3259 N ALA B 75 1.781 20.453 21.453 1.00 0.47 N ATOM 3260 CA ALA B 75 2.304 19.206 20.842 1.00 0.47 C ATOM 3261 C ALA B 75 1.788 18.024 21.656 1.00 0.46 C ATOM 3262 O ALA B 75 2.010 17.947 22.847 1.00 0.47 O ATOM 3263 CB ALA B 75 3.837 19.219 20.874 1.00 0.53 C ATOM 0 H ALA B 75 1.593 20.389 22.453 1.00 0.47 H new ATOM 0 HA ALA B 75 1.973 19.127 19.807 1.00 0.47 H new ATOM 0 HB1 ALA B 75 4.218 18.302 20.425 1.00 0.53 H new ATOM 0 HB2 ALA B 75 4.205 20.078 20.313 1.00 0.53 H new ATOM 0 HB3 ALA B 75 4.179 19.286 21.907 1.00 0.53 H new ATOM 3269 N SER B 76 1.110 17.096 21.044 1.00 0.47 N ATOM 3270 CA SER B 76 0.614 15.943 21.837 1.00 0.49 C ATOM 3271 C SER B 76 1.783 14.991 22.014 1.00 0.48 C ATOM 3272 O SER B 76 2.213 14.323 21.095 1.00 0.49 O ATOM 3273 CB SER B 76 -0.517 15.240 21.084 1.00 0.54 C ATOM 3274 OG SER B 76 -0.841 14.026 21.753 1.00 1.38 O ATOM 0 H SER B 76 0.882 17.085 20.050 1.00 0.47 H new ATOM 0 HA SER B 76 0.227 16.272 22.802 1.00 0.49 H new ATOM 0 HB2 SER B 76 -1.393 15.886 21.034 1.00 0.54 H new ATOM 0 HB3 SER B 76 -0.213 15.034 20.058 1.00 0.54 H new ATOM 0 HG SER B 76 -1.566 13.573 21.275 1.00 1.38 H new ATOM 3280 N LEU B 77 2.316 14.957 23.198 1.00 0.50 N ATOM 3281 CA LEU B 77 3.481 14.089 23.468 1.00 0.53 C ATOM 3282 C LEU B 77 3.003 12.653 23.596 1.00 0.52 C ATOM 3283 O LEU B 77 2.012 12.377 24.237 1.00 0.56 O ATOM 3284 CB LEU B 77 4.134 14.534 24.781 1.00 0.61 C ATOM 3285 CG LEU B 77 4.470 16.033 24.711 1.00 0.65 C ATOM 3286 CD1 LEU B 77 4.830 16.547 26.107 1.00 0.75 C ATOM 3287 CD2 LEU B 77 5.655 16.266 23.762 1.00 0.66 C ATOM 0 H LEU B 77 1.989 15.500 23.997 1.00 0.50 H new ATOM 0 HA LEU B 77 4.205 14.161 22.657 1.00 0.53 H new ATOM 0 HB2 LEU B 77 3.461 14.341 25.617 1.00 0.61 H new ATOM 0 HB3 LEU B 77 5.041 13.956 24.962 1.00 0.61 H new ATOM 0 HG LEU B 77 3.600 16.571 24.336 1.00 0.65 H new ATOM 0 HD11 LEU B 77 5.068 17.609 26.053 1.00 0.75 H new ATOM 0 HD12 LEU B 77 3.985 16.397 26.779 1.00 0.75 H new ATOM 0 HD13 LEU B 77 5.694 16.001 26.484 1.00 0.75 H new ATOM 0 HD21 LEU B 77 5.884 17.331 23.720 1.00 0.66 H new ATOM 0 HD22 LEU B 77 6.526 15.722 24.127 1.00 0.66 H new ATOM 0 HD23 LEU B 77 5.397 15.911 22.764 1.00 0.66 H new ATOM 3299 N THR B 78 3.701 11.737 22.989 1.00 0.51 N ATOM 3300 CA THR B 78 3.300 10.306 23.073 1.00 0.51 C ATOM 3301 C THR B 78 4.163 9.616 24.146 1.00 0.58 C ATOM 3302 O THR B 78 5.342 9.407 23.942 1.00 0.66 O ATOM 3303 CB THR B 78 3.537 9.651 21.709 1.00 0.55 C ATOM 3304 OG1 THR B 78 3.027 8.329 21.747 1.00 0.61 O ATOM 3305 CG2 THR B 78 5.040 9.625 21.370 1.00 0.63 C ATOM 0 H THR B 78 4.538 11.919 22.435 1.00 0.51 H new ATOM 0 HA THR B 78 2.247 10.214 23.341 1.00 0.51 H new ATOM 0 HB THR B 78 3.027 10.228 20.938 1.00 0.55 H new ATOM 0 HG1 THR B 78 2.080 8.351 21.999 1.00 0.61 H new ATOM 0 HG21 THR B 78 5.185 9.156 20.397 1.00 0.63 H new ATOM 0 HG22 THR B 78 5.424 10.645 21.342 1.00 0.63 H new ATOM 0 HG23 THR B 78 5.575 9.056 22.131 1.00 0.63 H new ATOM 3313 N PRO B 79 3.613 9.260 25.289 1.00 0.66 N ATOM 3314 CA PRO B 79 4.392 8.594 26.356 1.00 0.77 C ATOM 3315 C PRO B 79 4.195 7.075 26.392 1.00 0.68 C ATOM 3316 O PRO B 79 5.138 6.323 26.529 1.00 0.70 O ATOM 3317 CB PRO B 79 3.777 9.218 27.601 1.00 0.99 C ATOM 3318 CG PRO B 79 2.313 9.307 27.275 1.00 0.97 C ATOM 3319 CD PRO B 79 2.219 9.459 25.739 1.00 0.75 C ATOM 0 HA PRO B 79 5.467 8.727 26.234 1.00 0.77 H new ATOM 0 HB2 PRO B 79 3.953 8.604 28.484 1.00 0.99 H new ATOM 0 HB3 PRO B 79 4.201 10.201 27.806 1.00 0.99 H new ATOM 0 HG2 PRO B 79 1.785 8.414 27.610 1.00 0.97 H new ATOM 0 HG3 PRO B 79 1.853 10.157 27.779 1.00 0.97 H new ATOM 0 HD2 PRO B 79 1.547 8.720 25.303 1.00 0.75 H new ATOM 0 HD3 PRO B 79 1.841 10.441 25.455 1.00 0.75 H new ATOM 3327 N LYS B 80 2.967 6.628 26.330 1.00 0.66 N ATOM 3328 CA LYS B 80 2.681 5.160 26.423 1.00 0.67 C ATOM 3329 C LYS B 80 2.294 4.529 25.078 1.00 0.64 C ATOM 3330 O LYS B 80 2.670 3.411 24.797 1.00 0.65 O ATOM 3331 CB LYS B 80 1.524 4.958 27.400 1.00 0.79 C ATOM 3332 CG LYS B 80 1.993 5.296 28.814 1.00 1.31 C ATOM 3333 CD LYS B 80 0.840 5.096 29.798 1.00 1.46 C ATOM 3334 CE LYS B 80 1.313 5.437 31.212 1.00 2.32 C ATOM 3335 NZ LYS B 80 0.144 5.467 32.136 1.00 2.97 N ATOM 0 H LYS B 80 2.143 7.219 26.218 1.00 0.66 H new ATOM 0 HA LYS B 80 3.597 4.672 26.757 1.00 0.67 H new ATOM 0 HB2 LYS B 80 0.683 5.593 27.122 1.00 0.79 H new ATOM 0 HB3 LYS B 80 1.173 3.927 27.358 1.00 0.79 H new ATOM 0 HG2 LYS B 80 2.835 4.661 29.090 1.00 1.31 H new ATOM 0 HG3 LYS B 80 2.345 6.327 28.855 1.00 1.31 H new ATOM 0 HD2 LYS B 80 -0.002 5.730 29.522 1.00 1.46 H new ATOM 0 HD3 LYS B 80 0.489 4.065 29.759 1.00 1.46 H new ATOM 0 HE2 LYS B 80 2.039 4.698 31.552 1.00 2.32 H new ATOM 0 HE3 LYS B 80 1.817 6.404 31.215 1.00 2.32 H new ATOM 0 HZ1 LYS B 80 0.467 5.699 33.097 1.00 2.97 H new ATOM 0 HZ2 LYS B 80 -0.534 6.188 31.815 1.00 2.97 H new ATOM 0 HZ3 LYS B 80 -0.318 4.535 32.142 1.00 2.97 H new ATOM 3349 N TRP B 81 1.475 5.167 24.283 1.00 0.65 N ATOM 3350 CA TRP B 81 1.021 4.486 23.027 1.00 0.67 C ATOM 3351 C TRP B 81 2.111 4.407 21.939 1.00 0.62 C ATOM 3352 O TRP B 81 2.474 3.325 21.518 1.00 0.64 O ATOM 3353 CB TRP B 81 -0.256 5.166 22.485 1.00 0.73 C ATOM 3354 CG TRP B 81 0.039 6.400 21.685 1.00 0.69 C ATOM 3355 CD1 TRP B 81 0.406 6.404 20.382 1.00 0.70 C ATOM 3356 CD2 TRP B 81 -0.062 7.802 22.082 1.00 0.68 C ATOM 3357 NE1 TRP B 81 0.560 7.712 19.963 1.00 0.68 N ATOM 3358 CE2 TRP B 81 0.284 8.610 20.971 1.00 0.66 C ATOM 3359 CE3 TRP B 81 -0.405 8.446 23.285 1.00 0.71 C ATOM 3360 CZ2 TRP B 81 0.286 10.003 21.047 1.00 0.66 C ATOM 3361 CZ3 TRP B 81 -0.404 9.850 23.365 1.00 0.72 C ATOM 3362 CH2 TRP B 81 -0.060 10.626 22.248 1.00 0.68 C ATOM 0 H TRP B 81 1.107 6.105 24.439 1.00 0.65 H new ATOM 0 HA TRP B 81 0.797 3.453 23.295 1.00 0.67 H new ATOM 0 HB2 TRP B 81 -0.804 4.458 21.863 1.00 0.73 H new ATOM 0 HB3 TRP B 81 -0.906 5.426 23.320 1.00 0.73 H new ATOM 0 HD1 TRP B 81 0.554 5.527 19.769 1.00 0.70 H new ATOM 0 HE1 TRP B 81 0.844 7.980 19.021 1.00 0.68 H new ATOM 0 HE3 TRP B 81 -0.671 7.859 24.152 1.00 0.71 H new ATOM 0 HZ2 TRP B 81 0.553 10.595 20.184 1.00 0.66 H new ATOM 0 HZ3 TRP B 81 -0.670 10.334 24.293 1.00 0.72 H new ATOM 0 HH2 TRP B 81 -0.063 11.704 22.317 1.00 0.68 H new ATOM 3373 N ASN B 82 2.624 5.502 21.447 1.00 0.59 N ATOM 3374 CA ASN B 82 3.652 5.391 20.360 1.00 0.59 C ATOM 3375 C ASN B 82 5.020 5.004 20.913 1.00 0.53 C ATOM 3376 O ASN B 82 5.741 4.240 20.306 1.00 0.49 O ATOM 3377 CB ASN B 82 3.777 6.707 19.597 1.00 0.69 C ATOM 3378 CG ASN B 82 4.469 6.454 18.253 1.00 1.07 C ATOM 3379 OD1 ASN B 82 5.449 7.229 17.882 1.00 0.96 O flip ATOM 3380 ND2 ASN B 82 4.113 5.539 17.538 1.00 1.86 N flip ATOM 0 H ASN B 82 2.386 6.450 21.739 1.00 0.59 H new ATOM 0 HA ASN B 82 3.314 4.605 19.684 1.00 0.59 H new ATOM 0 HB2 ASN B 82 2.790 7.141 19.434 1.00 0.69 H new ATOM 0 HB3 ASN B 82 4.349 7.427 20.183 1.00 0.69 H new ATOM 0 HD21 ASN B 82 3.346 4.933 17.829 1.00 1.86 H new ATOM 0 HD22 ASN B 82 4.581 5.377 16.646 1.00 1.86 H new ATOM 3387 N ASN B 83 5.409 5.537 22.033 1.00 0.56 N ATOM 3388 CA ASN B 83 6.756 5.195 22.563 1.00 0.57 C ATOM 3389 C ASN B 83 6.842 3.689 22.805 1.00 0.53 C ATOM 3390 O ASN B 83 7.781 3.045 22.383 1.00 0.52 O ATOM 3391 CB ASN B 83 7.005 5.940 23.873 1.00 0.66 C ATOM 3392 CG ASN B 83 8.393 5.577 24.406 1.00 1.22 C ATOM 3393 OD1 ASN B 83 8.537 5.205 25.553 1.00 1.99 O ATOM 3394 ND2 ASN B 83 9.427 5.670 23.615 1.00 1.84 N ATOM 0 H ASN B 83 4.862 6.186 22.599 1.00 0.56 H new ATOM 0 HA ASN B 83 7.512 5.490 21.836 1.00 0.57 H new ATOM 0 HB2 ASN B 83 6.935 7.016 23.712 1.00 0.66 H new ATOM 0 HB3 ASN B 83 6.242 5.677 24.605 1.00 0.66 H new ATOM 0 HD21 ASN B 83 10.356 5.430 23.960 1.00 1.84 H new ATOM 0 HD22 ASN B 83 9.306 5.982 22.652 1.00 1.84 H new ATOM 3401 N GLU B 84 5.878 3.110 23.465 1.00 0.53 N ATOM 3402 CA GLU B 84 5.944 1.641 23.695 1.00 0.52 C ATOM 3403 C GLU B 84 5.977 0.929 22.347 1.00 0.47 C ATOM 3404 O GLU B 84 6.755 0.020 22.133 1.00 0.48 O ATOM 3405 CB GLU B 84 4.726 1.173 24.488 1.00 0.56 C ATOM 3406 CG GLU B 84 4.821 1.690 25.924 1.00 1.26 C ATOM 3407 CD GLU B 84 3.602 1.223 26.720 1.00 1.71 C ATOM 3408 OE1 GLU B 84 2.685 0.700 26.109 1.00 2.23 O ATOM 3409 OE2 GLU B 84 3.605 1.396 27.928 1.00 2.29 O ATOM 0 H GLU B 84 5.060 3.582 23.850 1.00 0.53 H new ATOM 0 HA GLU B 84 6.844 1.407 24.264 1.00 0.52 H new ATOM 0 HB2 GLU B 84 3.812 1.537 24.019 1.00 0.56 H new ATOM 0 HB3 GLU B 84 4.674 0.084 24.485 1.00 0.56 H new ATOM 0 HG2 GLU B 84 5.735 1.325 26.393 1.00 1.26 H new ATOM 0 HG3 GLU B 84 4.874 2.779 25.926 1.00 1.26 H new ATOM 3416 N THR B 85 5.147 1.338 21.425 1.00 0.44 N ATOM 3417 CA THR B 85 5.157 0.679 20.093 1.00 0.42 C ATOM 3418 C THR B 85 6.459 1.034 19.382 1.00 0.38 C ATOM 3419 O THR B 85 7.057 0.211 18.720 1.00 0.39 O ATOM 3420 CB THR B 85 3.967 1.153 19.249 1.00 0.45 C ATOM 3421 OG1 THR B 85 4.103 2.539 18.980 1.00 0.43 O ATOM 3422 CG2 THR B 85 2.650 0.898 19.997 1.00 0.50 C ATOM 0 H THR B 85 4.470 2.093 21.537 1.00 0.44 H new ATOM 0 HA THR B 85 5.079 -0.400 20.224 1.00 0.42 H new ATOM 0 HB THR B 85 3.951 0.597 18.311 1.00 0.45 H new ATOM 0 HG1 THR B 85 4.655 2.954 19.675 1.00 0.43 H new ATOM 0 HG21 THR B 85 1.813 1.239 19.387 1.00 0.50 H new ATOM 0 HG22 THR B 85 2.544 -0.169 20.194 1.00 0.50 H new ATOM 0 HG23 THR B 85 2.656 1.443 20.941 1.00 0.50 H new ATOM 3430 N TRP B 86 6.902 2.260 19.499 1.00 0.36 N ATOM 3431 CA TRP B 86 8.160 2.642 18.808 1.00 0.34 C ATOM 3432 C TRP B 86 9.331 1.855 19.397 1.00 0.34 C ATOM 3433 O TRP B 86 10.169 1.348 18.680 1.00 0.33 O ATOM 3434 CB TRP B 86 8.438 4.145 18.949 1.00 0.34 C ATOM 3435 CG TRP B 86 9.408 4.541 17.881 1.00 0.32 C ATOM 3436 CD1 TRP B 86 10.755 4.545 17.999 1.00 0.34 C ATOM 3437 CD2 TRP B 86 9.114 4.958 16.523 1.00 0.29 C ATOM 3438 NE1 TRP B 86 11.307 4.937 16.789 1.00 0.33 N ATOM 3439 CE2 TRP B 86 10.331 5.205 15.848 1.00 0.29 C ATOM 3440 CE3 TRP B 86 7.915 5.145 15.821 1.00 0.28 C ATOM 3441 CZ2 TRP B 86 10.354 5.620 14.515 1.00 0.28 C ATOM 3442 CZ3 TRP B 86 7.931 5.566 14.486 1.00 0.27 C ATOM 3443 CH2 TRP B 86 9.149 5.803 13.831 1.00 0.27 C ATOM 0 H TRP B 86 6.451 3.001 20.036 1.00 0.36 H new ATOM 0 HA TRP B 86 8.048 2.409 17.749 1.00 0.34 H new ATOM 0 HB2 TRP B 86 7.513 4.714 18.853 1.00 0.34 H new ATOM 0 HB3 TRP B 86 8.847 4.366 19.935 1.00 0.34 H new ATOM 0 HD1 TRP B 86 11.309 4.286 18.889 1.00 0.34 H new ATOM 0 HE1 TRP B 86 12.309 5.018 16.615 1.00 0.33 H new ATOM 0 HE3 TRP B 86 6.972 4.963 16.314 1.00 0.28 H new ATOM 0 HZ2 TRP B 86 11.295 5.798 14.017 1.00 0.28 H new ATOM 0 HZ3 TRP B 86 7.000 5.709 13.957 1.00 0.27 H new ATOM 0 HH2 TRP B 86 9.155 6.126 12.800 1.00 0.27 H new ATOM 3454 N GLN B 87 9.408 1.732 20.695 1.00 0.37 N ATOM 3455 CA GLN B 87 10.536 0.956 21.270 1.00 0.39 C ATOM 3456 C GLN B 87 10.439 -0.460 20.719 1.00 0.37 C ATOM 3457 O GLN B 87 11.416 -1.075 20.345 1.00 0.38 O ATOM 3458 CB GLN B 87 10.435 0.940 22.796 1.00 0.43 C ATOM 3459 CG GLN B 87 10.737 2.340 23.334 1.00 0.46 C ATOM 3460 CD GLN B 87 10.486 2.379 24.841 1.00 0.52 C ATOM 3461 OE1 GLN B 87 9.626 1.684 25.345 1.00 1.21 O ATOM 3462 NE2 GLN B 87 11.207 3.170 25.587 1.00 1.03 N ATOM 0 H GLN B 87 8.751 2.128 21.368 1.00 0.37 H new ATOM 0 HA GLN B 87 11.492 1.405 21.003 1.00 0.39 H new ATOM 0 HB2 GLN B 87 9.437 0.627 23.103 1.00 0.43 H new ATOM 0 HB3 GLN B 87 11.138 0.218 23.212 1.00 0.43 H new ATOM 0 HG2 GLN B 87 11.772 2.606 23.121 1.00 0.46 H new ATOM 0 HG3 GLN B 87 10.109 3.076 22.832 1.00 0.46 H new ATOM 0 HE21 GLN B 87 11.929 3.753 25.163 1.00 1.03 H new ATOM 0 HE22 GLN B 87 11.049 3.205 26.594 1.00 1.03 H new ATOM 3471 N GLU B 88 9.244 -0.964 20.636 1.00 0.37 N ATOM 3472 CA GLU B 88 9.032 -2.321 20.077 1.00 0.37 C ATOM 3473 C GLU B 88 9.463 -2.318 18.606 1.00 0.34 C ATOM 3474 O GLU B 88 10.038 -3.265 18.113 1.00 0.34 O ATOM 3475 CB GLU B 88 7.552 -2.696 20.193 1.00 0.39 C ATOM 3476 CG GLU B 88 7.342 -4.111 19.655 1.00 1.17 C ATOM 3477 CD GLU B 88 5.870 -4.499 19.800 1.00 1.41 C ATOM 3478 OE1 GLU B 88 5.144 -3.761 20.446 1.00 1.92 O ATOM 3479 OE2 GLU B 88 5.492 -5.527 19.263 1.00 1.95 O ATOM 0 H GLU B 88 8.394 -0.486 20.936 1.00 0.37 H new ATOM 0 HA GLU B 88 9.622 -3.053 20.629 1.00 0.37 H new ATOM 0 HB2 GLU B 88 7.232 -2.640 21.233 1.00 0.39 H new ATOM 0 HB3 GLU B 88 6.941 -1.988 19.633 1.00 0.39 H new ATOM 0 HG2 GLU B 88 7.641 -4.161 18.608 1.00 1.17 H new ATOM 0 HG3 GLU B 88 7.970 -4.816 20.200 1.00 1.17 H new ATOM 3486 N TRP B 89 9.166 -1.260 17.900 1.00 0.32 N ATOM 3487 CA TRP B 89 9.523 -1.188 16.454 1.00 0.29 C ATOM 3488 C TRP B 89 11.038 -1.313 16.273 1.00 0.29 C ATOM 3489 O TRP B 89 11.500 -2.108 15.482 1.00 0.30 O ATOM 3490 CB TRP B 89 9.034 0.160 15.906 1.00 0.28 C ATOM 3491 CG TRP B 89 9.553 0.411 14.526 1.00 0.25 C ATOM 3492 CD1 TRP B 89 9.084 -0.169 13.400 1.00 0.24 C ATOM 3493 CD2 TRP B 89 10.605 1.329 14.109 1.00 0.24 C ATOM 3494 NE1 TRP B 89 9.790 0.324 12.317 1.00 0.23 N ATOM 3495 CE2 TRP B 89 10.737 1.252 12.704 1.00 0.22 C ATOM 3496 CE3 TRP B 89 11.450 2.208 14.808 1.00 0.26 C ATOM 3497 CZ2 TRP B 89 11.675 2.021 12.015 1.00 0.22 C ATOM 3498 CZ3 TRP B 89 12.395 2.985 14.118 1.00 0.26 C ATOM 3499 CH2 TRP B 89 12.507 2.892 12.724 1.00 0.25 C ATOM 0 H TRP B 89 8.688 -0.437 18.266 1.00 0.32 H new ATOM 0 HA TRP B 89 9.050 -2.007 15.912 1.00 0.29 H new ATOM 0 HB2 TRP B 89 7.944 0.176 15.894 1.00 0.28 H new ATOM 0 HB3 TRP B 89 9.357 0.962 16.569 1.00 0.28 H new ATOM 0 HD1 TRP B 89 8.288 -0.898 13.353 1.00 0.24 H new ATOM 0 HE1 TRP B 89 9.631 0.037 11.351 1.00 0.23 H new ATOM 0 HE3 TRP B 89 11.372 2.287 15.882 1.00 0.26 H new ATOM 0 HZ2 TRP B 89 11.758 1.944 10.941 1.00 0.22 H new ATOM 0 HZ3 TRP B 89 13.039 3.658 14.665 1.00 0.26 H new ATOM 0 HH2 TRP B 89 13.235 3.492 12.199 1.00 0.25 H new ATOM 3510 N GLU B 90 11.826 -0.558 16.989 1.00 0.31 N ATOM 3511 CA GLU B 90 13.300 -0.695 16.814 1.00 0.33 C ATOM 3512 C GLU B 90 13.746 -2.064 17.336 1.00 0.33 C ATOM 3513 O GLU B 90 14.577 -2.721 16.740 1.00 0.34 O ATOM 3514 CB GLU B 90 14.025 0.426 17.565 1.00 0.37 C ATOM 3515 CG GLU B 90 13.589 0.434 19.027 1.00 0.84 C ATOM 3516 CD GLU B 90 14.253 1.606 19.750 1.00 1.16 C ATOM 3517 OE1 GLU B 90 15.148 2.202 19.173 1.00 1.82 O ATOM 3518 OE2 GLU B 90 13.853 1.891 20.866 1.00 1.67 O ATOM 0 H GLU B 90 11.522 0.134 17.674 1.00 0.31 H new ATOM 0 HA GLU B 90 13.550 -0.617 15.756 1.00 0.33 H new ATOM 0 HB2 GLU B 90 15.103 0.283 17.498 1.00 0.37 H new ATOM 0 HB3 GLU B 90 13.802 1.388 17.104 1.00 0.37 H new ATOM 0 HG2 GLU B 90 12.504 0.519 19.094 1.00 0.84 H new ATOM 0 HG3 GLU B 90 13.865 -0.506 19.505 1.00 0.84 H new ATOM 3525 N ARG B 91 13.196 -2.511 18.434 1.00 0.34 N ATOM 3526 CA ARG B 91 13.592 -3.845 18.964 1.00 0.36 C ATOM 3527 C ARG B 91 13.237 -4.926 17.942 1.00 0.34 C ATOM 3528 O ARG B 91 14.004 -5.839 17.710 1.00 0.34 O ATOM 3529 CB ARG B 91 12.863 -4.110 20.281 1.00 0.40 C ATOM 3530 CG ARG B 91 13.433 -3.196 21.368 1.00 0.44 C ATOM 3531 CD ARG B 91 12.647 -3.398 22.663 1.00 1.07 C ATOM 3532 NE ARG B 91 11.246 -2.936 22.460 1.00 1.67 N ATOM 3533 CZ ARG B 91 10.318 -3.275 23.312 1.00 2.30 C ATOM 3534 NH1 ARG B 91 10.621 -4.004 24.350 1.00 2.62 N ATOM 3535 NH2 ARG B 91 9.086 -2.887 23.123 1.00 3.17 N ATOM 0 H ARG B 91 12.495 -2.013 18.982 1.00 0.34 H new ATOM 0 HA ARG B 91 14.667 -3.862 19.143 1.00 0.36 H new ATOM 0 HB2 ARG B 91 11.795 -3.929 20.161 1.00 0.40 H new ATOM 0 HB3 ARG B 91 12.979 -5.154 20.570 1.00 0.40 H new ATOM 0 HG2 ARG B 91 14.487 -3.419 21.531 1.00 0.44 H new ATOM 0 HG3 ARG B 91 13.373 -2.155 21.052 1.00 0.44 H new ATOM 0 HD2 ARG B 91 12.658 -4.450 22.950 1.00 1.07 H new ATOM 0 HD3 ARG B 91 13.112 -2.841 23.476 1.00 1.07 H new ATOM 0 HE ARG B 91 11.012 -2.355 21.655 1.00 1.67 H new ATOM 0 HH11 ARG B 91 11.583 -4.309 24.496 1.00 2.62 H new ATOM 0 HH12 ARG B 91 9.896 -4.269 25.016 1.00 2.62 H new ATOM 0 HH21 ARG B 91 8.849 -2.319 22.309 1.00 3.17 H new ATOM 0 HH22 ARG B 91 8.360 -3.152 23.789 1.00 3.17 H new ATOM 3549 N LYS B 92 12.095 -4.830 17.305 1.00 0.33 N ATOM 3550 CA LYS B 92 11.749 -5.862 16.290 1.00 0.33 C ATOM 3551 C LYS B 92 12.821 -5.842 15.203 1.00 0.31 C ATOM 3552 O LYS B 92 13.286 -6.869 14.756 1.00 0.32 O ATOM 3553 CB LYS B 92 10.373 -5.569 15.679 1.00 0.34 C ATOM 3554 CG LYS B 92 9.270 -5.982 16.666 1.00 0.68 C ATOM 3555 CD LYS B 92 7.884 -5.656 16.086 1.00 1.09 C ATOM 3556 CE LYS B 92 7.446 -6.744 15.100 1.00 1.41 C ATOM 3557 NZ LYS B 92 6.065 -6.447 14.622 1.00 2.14 N ATOM 0 H LYS B 92 11.402 -4.095 17.443 1.00 0.33 H new ATOM 0 HA LYS B 92 11.708 -6.845 16.759 1.00 0.33 H new ATOM 0 HB2 LYS B 92 10.287 -4.508 15.445 1.00 0.34 H new ATOM 0 HB3 LYS B 92 10.258 -6.112 14.741 1.00 0.34 H new ATOM 0 HG2 LYS B 92 9.342 -7.049 16.876 1.00 0.68 H new ATOM 0 HG3 LYS B 92 9.407 -5.461 17.613 1.00 0.68 H new ATOM 0 HD2 LYS B 92 7.156 -5.573 16.893 1.00 1.09 H new ATOM 0 HD3 LYS B 92 7.912 -4.690 15.582 1.00 1.09 H new ATOM 0 HE2 LYS B 92 8.135 -6.785 14.256 1.00 1.41 H new ATOM 0 HE3 LYS B 92 7.474 -7.721 15.582 1.00 1.41 H new ATOM 0 HZ1 LYS B 92 5.764 -7.183 13.952 1.00 2.14 H new ATOM 0 HZ2 LYS B 92 5.414 -6.429 15.432 1.00 2.14 H new ATOM 0 HZ3 LYS B 92 6.053 -5.522 14.147 1.00 2.14 H new ATOM 3571 N VAL B 93 13.239 -4.675 14.794 1.00 0.29 N ATOM 3572 CA VAL B 93 14.304 -4.594 13.760 1.00 0.28 C ATOM 3573 C VAL B 93 15.552 -5.289 14.303 1.00 0.29 C ATOM 3574 O VAL B 93 16.221 -6.027 13.608 1.00 0.29 O ATOM 3575 CB VAL B 93 14.629 -3.119 13.466 1.00 0.28 C ATOM 3576 CG1 VAL B 93 15.889 -3.028 12.591 1.00 0.29 C ATOM 3577 CG2 VAL B 93 13.441 -2.446 12.755 1.00 0.28 C ATOM 0 H VAL B 93 12.889 -3.778 15.131 1.00 0.29 H new ATOM 0 HA VAL B 93 13.971 -5.075 12.840 1.00 0.28 H new ATOM 0 HB VAL B 93 14.812 -2.601 14.408 1.00 0.28 H new ATOM 0 HG11 VAL B 93 16.115 -1.982 12.386 1.00 0.29 H new ATOM 0 HG12 VAL B 93 16.729 -3.485 13.114 1.00 0.29 H new ATOM 0 HG13 VAL B 93 15.718 -3.553 11.651 1.00 0.29 H new ATOM 0 HG21 VAL B 93 13.682 -1.403 12.552 1.00 0.28 H new ATOM 0 HG22 VAL B 93 13.240 -2.961 11.816 1.00 0.28 H new ATOM 0 HG23 VAL B 93 12.559 -2.497 13.393 1.00 0.28 H new ATOM 3587 N ASP B 94 15.870 -5.050 15.546 1.00 0.30 N ATOM 3588 CA ASP B 94 17.073 -5.686 16.145 1.00 0.32 C ATOM 3589 C ASP B 94 16.923 -7.208 16.087 1.00 0.33 C ATOM 3590 O ASP B 94 17.812 -7.908 15.645 1.00 0.35 O ATOM 3591 CB ASP B 94 17.213 -5.228 17.599 1.00 0.35 C ATOM 3592 CG ASP B 94 18.483 -5.822 18.211 1.00 1.26 C ATOM 3593 OD1 ASP B 94 18.991 -6.782 17.656 1.00 1.96 O ATOM 3594 OD2 ASP B 94 18.927 -5.304 19.223 1.00 2.03 O ATOM 0 H ASP B 94 15.346 -4.440 16.173 1.00 0.30 H new ATOM 0 HA ASP B 94 17.964 -5.394 15.589 1.00 0.32 H new ATOM 0 HB2 ASP B 94 17.251 -4.140 17.645 1.00 0.35 H new ATOM 0 HB3 ASP B 94 16.341 -5.541 18.174 1.00 0.35 H new ATOM 3599 N PHE B 95 15.808 -7.732 16.525 1.00 0.34 N ATOM 3600 CA PHE B 95 15.624 -9.211 16.478 1.00 0.36 C ATOM 3601 C PHE B 95 15.695 -9.693 15.029 1.00 0.34 C ATOM 3602 O PHE B 95 16.402 -10.628 14.714 1.00 0.35 O ATOM 3603 CB PHE B 95 14.269 -9.596 17.078 1.00 0.39 C ATOM 3604 CG PHE B 95 14.329 -9.450 18.582 1.00 0.43 C ATOM 3605 CD1 PHE B 95 15.108 -10.336 19.335 1.00 0.47 C ATOM 3606 CD2 PHE B 95 13.615 -8.430 19.218 1.00 0.43 C ATOM 3607 CE1 PHE B 95 15.172 -10.201 20.727 1.00 0.51 C ATOM 3608 CE2 PHE B 95 13.680 -8.294 20.611 1.00 0.47 C ATOM 3609 CZ PHE B 95 14.458 -9.181 21.365 1.00 0.51 C ATOM 0 H PHE B 95 15.024 -7.205 16.910 1.00 0.34 H new ATOM 0 HA PHE B 95 16.417 -9.682 17.059 1.00 0.36 H new ATOM 0 HB2 PHE B 95 13.484 -8.959 16.670 1.00 0.39 H new ATOM 0 HB3 PHE B 95 14.018 -10.622 16.810 1.00 0.39 H new ATOM 0 HD1 PHE B 95 15.659 -11.123 18.843 1.00 0.47 H new ATOM 0 HD2 PHE B 95 13.014 -7.747 18.636 1.00 0.43 H new ATOM 0 HE1 PHE B 95 15.773 -10.885 21.309 1.00 0.51 H new ATOM 0 HE2 PHE B 95 13.130 -7.505 21.103 1.00 0.47 H new ATOM 0 HZ PHE B 95 14.507 -9.078 22.439 1.00 0.51 H new ATOM 3619 N LEU B 96 14.973 -9.064 14.138 1.00 0.32 N ATOM 3620 CA LEU B 96 15.026 -9.508 12.720 1.00 0.32 C ATOM 3621 C LEU B 96 16.434 -9.261 12.185 1.00 0.31 C ATOM 3622 O LEU B 96 16.996 -10.078 11.482 1.00 0.32 O ATOM 3623 CB LEU B 96 14.017 -8.710 11.889 1.00 0.32 C ATOM 3624 CG LEU B 96 12.594 -8.942 12.415 1.00 0.33 C ATOM 3625 CD1 LEU B 96 11.626 -8.056 11.624 1.00 0.35 C ATOM 3626 CD2 LEU B 96 12.197 -10.420 12.242 1.00 0.36 C ATOM 0 H LEU B 96 14.358 -8.273 14.330 1.00 0.32 H new ATOM 0 HA LEU B 96 14.780 -10.568 12.655 1.00 0.32 H new ATOM 0 HB2 LEU B 96 14.259 -7.648 11.931 1.00 0.32 H new ATOM 0 HB3 LEU B 96 14.079 -9.010 10.843 1.00 0.32 H new ATOM 0 HG LEU B 96 12.553 -8.691 13.475 1.00 0.33 H new ATOM 0 HD11 LEU B 96 10.610 -8.211 11.988 1.00 0.35 H new ATOM 0 HD12 LEU B 96 11.902 -7.010 11.754 1.00 0.35 H new ATOM 0 HD13 LEU B 96 11.676 -8.316 10.567 1.00 0.35 H new ATOM 0 HD21 LEU B 96 11.186 -10.572 12.619 1.00 0.36 H new ATOM 0 HD22 LEU B 96 12.234 -10.685 11.185 1.00 0.36 H new ATOM 0 HD23 LEU B 96 12.890 -11.050 12.799 1.00 0.36 H new ATOM 3638 N GLU B 97 17.015 -8.145 12.527 1.00 0.31 N ATOM 3639 CA GLU B 97 18.392 -7.854 12.054 1.00 0.32 C ATOM 3640 C GLU B 97 19.334 -8.941 12.574 1.00 0.33 C ATOM 3641 O GLU B 97 20.149 -9.473 11.846 1.00 0.35 O ATOM 3642 CB GLU B 97 18.831 -6.485 12.576 1.00 0.34 C ATOM 3643 CG GLU B 97 20.245 -6.179 12.080 1.00 0.95 C ATOM 3644 CD GLU B 97 20.640 -4.761 12.496 1.00 1.23 C ATOM 3645 OE1 GLU B 97 19.790 -4.059 13.020 1.00 1.86 O ATOM 3646 OE2 GLU B 97 21.787 -4.400 12.284 1.00 1.69 O ATOM 0 H GLU B 97 16.594 -7.424 13.113 1.00 0.31 H new ATOM 0 HA GLU B 97 18.419 -7.841 10.964 1.00 0.32 H new ATOM 0 HB2 GLU B 97 18.140 -5.715 12.234 1.00 0.34 H new ATOM 0 HB3 GLU B 97 18.806 -6.474 13.666 1.00 0.34 H new ATOM 0 HG2 GLU B 97 20.950 -6.900 12.494 1.00 0.95 H new ATOM 0 HG3 GLU B 97 20.290 -6.276 10.995 1.00 0.95 H new ATOM 3653 N GLU B 98 19.227 -9.275 13.834 1.00 0.34 N ATOM 3654 CA GLU B 98 20.114 -10.329 14.403 1.00 0.37 C ATOM 3655 C GLU B 98 19.865 -11.652 13.679 1.00 0.36 C ATOM 3656 O GLU B 98 20.788 -12.366 13.337 1.00 0.37 O ATOM 3657 CB GLU B 98 19.819 -10.502 15.895 1.00 0.40 C ATOM 3658 CG GLU B 98 20.780 -11.536 16.490 1.00 1.18 C ATOM 3659 CD GLU B 98 20.503 -11.688 17.985 1.00 1.33 C ATOM 3660 OE1 GLU B 98 19.699 -10.927 18.497 1.00 1.78 O ATOM 3661 OE2 GLU B 98 21.098 -12.563 18.591 1.00 1.85 O ATOM 0 H GLU B 98 18.564 -8.863 14.491 1.00 0.34 H new ATOM 0 HA GLU B 98 21.155 -10.032 14.272 1.00 0.37 H new ATOM 0 HB2 GLU B 98 19.929 -9.548 16.411 1.00 0.40 H new ATOM 0 HB3 GLU B 98 18.788 -10.824 16.038 1.00 0.40 H new ATOM 0 HG2 GLU B 98 20.656 -12.495 15.987 1.00 1.18 H new ATOM 0 HG3 GLU B 98 21.812 -11.223 16.330 1.00 1.18 H new ATOM 3668 N ASN B 99 18.624 -11.990 13.448 1.00 0.35 N ATOM 3669 CA ASN B 99 18.323 -13.271 12.751 1.00 0.35 C ATOM 3670 C ASN B 99 18.893 -13.219 11.339 1.00 0.33 C ATOM 3671 O ASN B 99 19.434 -14.187 10.838 1.00 0.34 O ATOM 3672 CB ASN B 99 16.806 -13.475 12.681 1.00 0.36 C ATOM 3673 CG ASN B 99 16.268 -13.770 14.082 1.00 1.25 C ATOM 3674 OD1 ASN B 99 16.934 -14.573 14.865 1.00 2.16 O flip ATOM 3675 ND2 ASN B 99 15.232 -13.267 14.468 1.00 1.82 N flip ATOM 0 H ASN B 99 17.809 -11.435 13.711 1.00 0.35 H new ATOM 0 HA ASN B 99 18.773 -14.099 13.299 1.00 0.35 H new ATOM 0 HB2 ASN B 99 16.326 -12.584 12.275 1.00 0.36 H new ATOM 0 HB3 ASN B 99 16.569 -14.299 12.008 1.00 0.36 H new ATOM 0 HD21 ASN B 99 14.711 -12.639 13.856 1.00 1.82 H new ATOM 0 HD22 ASN B 99 14.883 -13.473 15.404 1.00 1.82 H new ATOM 3682 N ILE B 100 18.782 -12.095 10.693 1.00 0.31 N ATOM 3683 CA ILE B 100 19.324 -11.982 9.316 1.00 0.30 C ATOM 3684 C ILE B 100 20.850 -12.046 9.370 1.00 0.31 C ATOM 3685 O ILE B 100 21.478 -12.694 8.562 1.00 0.32 O ATOM 3686 CB ILE B 100 18.872 -10.650 8.712 1.00 0.28 C ATOM 3687 CG1 ILE B 100 17.364 -10.704 8.457 1.00 0.29 C ATOM 3688 CG2 ILE B 100 19.606 -10.401 7.390 1.00 0.28 C ATOM 3689 CD1 ILE B 100 16.850 -9.302 8.124 1.00 0.30 C ATOM 0 H ILE B 100 18.340 -11.252 11.059 1.00 0.31 H new ATOM 0 HA ILE B 100 18.956 -12.800 8.697 1.00 0.30 H new ATOM 0 HB ILE B 100 19.102 -9.840 9.404 1.00 0.28 H new ATOM 0 HG12 ILE B 100 17.148 -11.386 7.635 1.00 0.29 H new ATOM 0 HG13 ILE B 100 16.850 -11.092 9.336 1.00 0.29 H new ATOM 0 HG21 ILE B 100 19.279 -9.452 6.966 1.00 0.28 H new ATOM 0 HG22 ILE B 100 20.680 -10.367 7.571 1.00 0.28 H new ATOM 0 HG23 ILE B 100 19.381 -11.207 6.691 1.00 0.28 H new ATOM 0 HD11 ILE B 100 15.776 -9.342 7.943 1.00 0.30 H new ATOM 0 HD12 ILE B 100 17.052 -8.632 8.960 1.00 0.30 H new ATOM 0 HD13 ILE B 100 17.355 -8.932 7.232 1.00 0.30 H new ATOM 3701 N THR B 101 21.455 -11.392 10.321 1.00 0.33 N ATOM 3702 CA THR B 101 22.940 -11.437 10.409 1.00 0.36 C ATOM 3703 C THR B 101 23.391 -12.873 10.670 1.00 0.38 C ATOM 3704 O THR B 101 24.338 -13.353 10.080 1.00 0.40 O ATOM 3705 CB THR B 101 23.412 -10.537 11.554 1.00 0.39 C ATOM 3706 OG1 THR B 101 22.714 -10.883 12.741 1.00 0.40 O ATOM 3707 CG2 THR B 101 23.144 -9.069 11.209 1.00 0.39 C ATOM 0 H THR B 101 20.990 -10.832 11.036 1.00 0.33 H new ATOM 0 HA THR B 101 23.370 -11.086 9.471 1.00 0.36 H new ATOM 0 HB THR B 101 24.483 -10.676 11.705 1.00 0.39 H new ATOM 0 HG1 THR B 101 21.941 -11.441 12.515 1.00 0.40 H new ATOM 0 HG21 THR B 101 23.483 -8.435 12.028 1.00 0.39 H new ATOM 0 HG22 THR B 101 23.683 -8.805 10.299 1.00 0.39 H new ATOM 0 HG23 THR B 101 22.075 -8.921 11.053 1.00 0.39 H new ATOM 3715 N ALA B 102 22.718 -13.567 11.547 1.00 0.38 N ATOM 3716 CA ALA B 102 23.113 -14.972 11.836 1.00 0.41 C ATOM 3717 C ALA B 102 22.999 -15.814 10.564 1.00 0.40 C ATOM 3718 O ALA B 102 23.890 -16.567 10.226 1.00 0.42 O ATOM 3719 CB ALA B 102 22.199 -15.547 12.919 1.00 0.43 C ATOM 0 H ALA B 102 21.915 -13.222 12.073 1.00 0.38 H new ATOM 0 HA ALA B 102 24.145 -14.992 12.186 1.00 0.41 H new ATOM 0 HB1 ALA B 102 22.488 -16.576 13.131 1.00 0.43 H new ATOM 0 HB2 ALA B 102 22.290 -14.950 13.827 1.00 0.43 H new ATOM 0 HB3 ALA B 102 21.166 -15.525 12.573 1.00 0.43 H new ATOM 3725 N LEU B 103 21.906 -15.700 9.857 1.00 0.37 N ATOM 3726 CA LEU B 103 21.746 -16.506 8.614 1.00 0.36 C ATOM 3727 C LEU B 103 22.804 -16.091 7.592 1.00 0.34 C ATOM 3728 O LEU B 103 23.383 -16.921 6.919 1.00 0.36 O ATOM 3729 CB LEU B 103 20.350 -16.278 8.031 1.00 0.34 C ATOM 3730 CG LEU B 103 19.285 -16.817 8.997 1.00 0.35 C ATOM 3731 CD1 LEU B 103 17.896 -16.417 8.493 1.00 0.37 C ATOM 3732 CD2 LEU B 103 19.381 -18.355 9.101 1.00 0.43 C ATOM 0 H LEU B 103 21.123 -15.088 10.085 1.00 0.37 H new ATOM 0 HA LEU B 103 21.870 -17.563 8.851 1.00 0.36 H new ATOM 0 HB2 LEU B 103 20.189 -15.214 7.856 1.00 0.34 H new ATOM 0 HB3 LEU B 103 20.264 -16.777 7.066 1.00 0.34 H new ATOM 0 HG LEU B 103 19.453 -16.391 9.986 1.00 0.35 H new ATOM 0 HD11 LEU B 103 17.137 -16.798 9.177 1.00 0.37 H new ATOM 0 HD12 LEU B 103 17.826 -15.330 8.443 1.00 0.37 H new ATOM 0 HD13 LEU B 103 17.734 -16.837 7.500 1.00 0.37 H new ATOM 0 HD21 LEU B 103 18.619 -18.721 9.789 1.00 0.43 H new ATOM 0 HD22 LEU B 103 19.223 -18.797 8.117 1.00 0.43 H new ATOM 0 HD23 LEU B 103 20.368 -18.634 9.470 1.00 0.43 H new ATOM 3744 N LEU B 104 23.078 -14.819 7.471 1.00 0.33 N ATOM 3745 CA LEU B 104 24.117 -14.392 6.495 1.00 0.33 C ATOM 3746 C LEU B 104 25.449 -15.023 6.881 1.00 0.37 C ATOM 3747 O LEU B 104 26.173 -15.526 6.047 1.00 0.39 O ATOM 3748 CB LEU B 104 24.255 -12.866 6.493 1.00 0.33 C ATOM 3749 CG LEU B 104 23.006 -12.225 5.870 1.00 0.29 C ATOM 3750 CD1 LEU B 104 23.057 -10.709 6.096 1.00 0.31 C ATOM 3751 CD2 LEU B 104 22.945 -12.530 4.358 1.00 0.28 C ATOM 0 H LEU B 104 22.633 -14.068 7.999 1.00 0.33 H new ATOM 0 HA LEU B 104 23.824 -14.716 5.496 1.00 0.33 H new ATOM 0 HB2 LEU B 104 24.390 -12.504 7.512 1.00 0.33 H new ATOM 0 HB3 LEU B 104 25.142 -12.574 5.931 1.00 0.33 H new ATOM 0 HG LEU B 104 22.114 -12.638 6.341 1.00 0.29 H new ATOM 0 HD11 LEU B 104 22.174 -10.246 5.657 1.00 0.31 H new ATOM 0 HD12 LEU B 104 23.082 -10.501 7.166 1.00 0.31 H new ATOM 0 HD13 LEU B 104 23.952 -10.301 5.626 1.00 0.31 H new ATOM 0 HD21 LEU B 104 22.055 -12.070 3.930 1.00 0.28 H new ATOM 0 HD22 LEU B 104 23.832 -12.128 3.870 1.00 0.28 H new ATOM 0 HD23 LEU B 104 22.905 -13.609 4.206 1.00 0.28 H new ATOM 3763 N GLU B 105 25.776 -15.018 8.143 1.00 0.40 N ATOM 3764 CA GLU B 105 27.060 -15.632 8.566 1.00 0.45 C ATOM 3765 C GLU B 105 27.044 -17.107 8.172 1.00 0.46 C ATOM 3766 O GLU B 105 27.971 -17.608 7.566 1.00 0.48 O ATOM 3767 CB GLU B 105 27.215 -15.491 10.083 1.00 0.49 C ATOM 3768 CG GLU B 105 28.543 -16.107 10.528 1.00 0.53 C ATOM 3769 CD GLU B 105 28.688 -15.954 12.043 1.00 1.15 C ATOM 3770 OE1 GLU B 105 27.885 -15.241 12.624 1.00 1.84 O ATOM 3771 OE2 GLU B 105 29.598 -16.550 12.595 1.00 1.82 O ATOM 0 H GLU B 105 25.213 -14.618 8.893 1.00 0.40 H new ATOM 0 HA GLU B 105 27.899 -15.133 8.081 1.00 0.45 H new ATOM 0 HB2 GLU B 105 27.179 -14.439 10.365 1.00 0.49 H new ATOM 0 HB3 GLU B 105 26.386 -15.985 10.590 1.00 0.49 H new ATOM 0 HG2 GLU B 105 28.579 -17.161 10.252 1.00 0.53 H new ATOM 0 HG3 GLU B 105 29.373 -15.616 10.020 1.00 0.53 H new ATOM 3778 N GLU B 106 25.990 -17.807 8.497 1.00 0.45 N ATOM 3779 CA GLU B 106 25.913 -19.243 8.121 1.00 0.47 C ATOM 3780 C GLU B 106 25.866 -19.351 6.598 1.00 0.44 C ATOM 3781 O GLU B 106 26.489 -20.210 6.005 1.00 0.46 O ATOM 3782 CB GLU B 106 24.640 -19.857 8.714 1.00 0.48 C ATOM 3783 CG GLU B 106 24.550 -21.340 8.338 1.00 1.17 C ATOM 3784 CD GLU B 106 23.282 -21.939 8.946 1.00 1.66 C ATOM 3785 OE1 GLU B 106 22.545 -21.199 9.577 1.00 2.27 O ATOM 3786 OE2 GLU B 106 23.065 -23.125 8.765 1.00 2.26 O ATOM 0 H GLU B 106 25.183 -17.445 9.005 1.00 0.45 H new ATOM 0 HA GLU B 106 26.783 -19.775 8.505 1.00 0.47 H new ATOM 0 HB2 GLU B 106 24.645 -19.748 9.799 1.00 0.48 H new ATOM 0 HB3 GLU B 106 23.763 -19.325 8.344 1.00 0.48 H new ATOM 0 HG2 GLU B 106 24.535 -21.452 7.254 1.00 1.17 H new ATOM 0 HG3 GLU B 106 25.428 -21.873 8.702 1.00 1.17 H new ATOM 3793 N ALA B 107 25.129 -18.481 5.962 1.00 0.39 N ATOM 3794 CA ALA B 107 25.039 -18.526 4.478 1.00 0.37 C ATOM 3795 C ALA B 107 26.423 -18.281 3.874 1.00 0.40 C ATOM 3796 O ALA B 107 26.847 -18.980 2.975 1.00 0.41 O ATOM 3797 CB ALA B 107 24.063 -17.455 3.990 1.00 0.34 C ATOM 0 H ALA B 107 24.586 -17.742 6.408 1.00 0.39 H new ATOM 0 HA ALA B 107 24.679 -19.506 4.166 1.00 0.37 H new ATOM 0 HB1 ALA B 107 23.999 -17.490 2.902 1.00 0.34 H new ATOM 0 HB2 ALA B 107 23.077 -17.639 4.418 1.00 0.34 H new ATOM 0 HB3 ALA B 107 24.416 -16.472 4.301 1.00 0.34 H new ATOM 3803 N GLN B 108 27.138 -17.298 4.361 1.00 0.42 N ATOM 3804 CA GLN B 108 28.495 -17.037 3.804 1.00 0.46 C ATOM 3805 C GLN B 108 29.360 -18.279 4.001 1.00 0.50 C ATOM 3806 O GLN B 108 30.003 -18.750 3.086 1.00 0.53 O ATOM 3807 CB GLN B 108 29.134 -15.837 4.513 1.00 0.50 C ATOM 3808 CG GLN B 108 28.419 -14.550 4.092 1.00 0.48 C ATOM 3809 CD GLN B 108 28.927 -13.382 4.938 1.00 0.98 C ATOM 3810 OE1 GLN B 108 29.180 -13.533 6.116 1.00 1.68 O ATOM 3811 NE2 GLN B 108 29.091 -12.212 4.380 1.00 1.58 N ATOM 0 H GLN B 108 26.843 -16.673 5.111 1.00 0.42 H new ATOM 0 HA GLN B 108 28.415 -16.810 2.741 1.00 0.46 H new ATOM 0 HB2 GLN B 108 29.069 -15.964 5.594 1.00 0.50 H new ATOM 0 HB3 GLN B 108 30.193 -15.775 4.262 1.00 0.50 H new ATOM 0 HG2 GLN B 108 28.598 -14.352 3.035 1.00 0.48 H new ATOM 0 HG3 GLN B 108 27.342 -14.662 4.218 1.00 0.48 H new ATOM 0 HE21 GLN B 108 28.879 -12.085 3.391 1.00 1.58 H new ATOM 0 HE22 GLN B 108 29.431 -11.426 4.934 1.00 1.58 H new ATOM 3820 N ILE B 109 29.368 -18.827 5.186 1.00 0.52 N ATOM 3821 CA ILE B 109 30.175 -20.053 5.422 1.00 0.57 C ATOM 3822 C ILE B 109 29.676 -21.162 4.493 1.00 0.56 C ATOM 3823 O ILE B 109 30.444 -21.807 3.806 1.00 0.58 O ATOM 3824 CB ILE B 109 30.030 -20.494 6.881 1.00 0.61 C ATOM 3825 CG1 ILE B 109 30.597 -19.405 7.797 1.00 0.64 C ATOM 3826 CG2 ILE B 109 30.808 -21.793 7.098 1.00 0.67 C ATOM 3827 CD1 ILE B 109 30.230 -19.714 9.251 1.00 0.67 C ATOM 0 H ILE B 109 28.853 -18.480 5.995 1.00 0.52 H new ATOM 0 HA ILE B 109 31.226 -19.848 5.218 1.00 0.57 H new ATOM 0 HB ILE B 109 28.977 -20.656 7.111 1.00 0.61 H new ATOM 0 HG12 ILE B 109 31.680 -19.352 7.688 1.00 0.64 H new ATOM 0 HG13 ILE B 109 30.200 -18.431 7.510 1.00 0.64 H new ATOM 0 HG21 ILE B 109 30.706 -22.109 8.136 1.00 0.67 H new ATOM 0 HG22 ILE B 109 30.412 -22.568 6.442 1.00 0.67 H new ATOM 0 HG23 ILE B 109 31.861 -21.629 6.870 1.00 0.67 H new ATOM 0 HD11 ILE B 109 30.634 -18.938 9.901 1.00 0.67 H new ATOM 0 HD12 ILE B 109 29.145 -19.745 9.354 1.00 0.67 H new ATOM 0 HD13 ILE B 109 30.649 -20.680 9.535 1.00 0.67 H new ATOM 3839 N GLN B 110 28.388 -21.390 4.474 1.00 0.52 N ATOM 3840 CA GLN B 110 27.829 -22.459 3.598 1.00 0.52 C ATOM 3841 C GLN B 110 28.093 -22.111 2.130 1.00 0.48 C ATOM 3842 O GLN B 110 28.424 -22.964 1.330 1.00 0.50 O ATOM 3843 CB GLN B 110 26.319 -22.569 3.837 1.00 0.50 C ATOM 3844 CG GLN B 110 25.734 -23.668 2.946 1.00 1.17 C ATOM 3845 CD GLN B 110 24.249 -23.851 3.268 1.00 1.46 C ATOM 3846 OE1 GLN B 110 23.752 -23.310 4.235 1.00 2.12 O ATOM 3847 NE2 GLN B 110 23.519 -24.608 2.494 1.00 1.93 N ATOM 0 H GLN B 110 27.700 -20.881 5.028 1.00 0.52 H new ATOM 0 HA GLN B 110 28.306 -23.410 3.832 1.00 0.52 H new ATOM 0 HB2 GLN B 110 26.122 -22.794 4.885 1.00 0.50 H new ATOM 0 HB3 GLN B 110 25.836 -21.616 3.620 1.00 0.50 H new ATOM 0 HG2 GLN B 110 25.859 -23.404 1.896 1.00 1.17 H new ATOM 0 HG3 GLN B 110 26.270 -24.604 3.106 1.00 1.17 H new ATOM 0 HE21 GLN B 110 23.938 -25.062 1.682 1.00 1.93 H new ATOM 0 HE22 GLN B 110 22.530 -24.746 2.701 1.00 1.93 H new ATOM 3856 N GLN B 111 27.947 -20.864 1.769 1.00 0.45 N ATOM 3857 CA GLN B 111 28.189 -20.466 0.353 1.00 0.43 C ATOM 3858 C GLN B 111 29.632 -20.798 -0.023 1.00 0.49 C ATOM 3859 O GLN B 111 29.903 -21.349 -1.073 1.00 0.49 O ATOM 3860 CB GLN B 111 27.953 -18.961 0.205 1.00 0.42 C ATOM 3861 CG GLN B 111 27.971 -18.572 -1.276 1.00 0.42 C ATOM 3862 CD GLN B 111 26.720 -19.120 -1.968 1.00 0.38 C ATOM 3863 OE1 GLN B 111 25.641 -19.091 -1.408 1.00 0.37 O ATOM 3864 NE2 GLN B 111 26.817 -19.610 -3.173 1.00 0.40 N ATOM 0 H GLN B 111 27.671 -20.105 2.393 1.00 0.45 H new ATOM 0 HA GLN B 111 27.509 -21.007 -0.305 1.00 0.43 H new ATOM 0 HB2 GLN B 111 26.996 -18.689 0.649 1.00 0.42 H new ATOM 0 HB3 GLN B 111 28.723 -18.409 0.744 1.00 0.42 H new ATOM 0 HG2 GLN B 111 28.009 -17.487 -1.377 1.00 0.42 H new ATOM 0 HG3 GLN B 111 28.866 -18.968 -1.755 1.00 0.42 H new ATOM 0 HE21 GLN B 111 27.722 -19.634 -3.642 1.00 0.40 H new ATOM 0 HE22 GLN B 111 25.988 -19.969 -3.646 1.00 0.40 H new ATOM 3873 N GLU B 112 30.564 -20.467 0.828 1.00 0.54 N ATOM 3874 CA GLU B 112 31.988 -20.768 0.521 1.00 0.60 C ATOM 3875 C GLU B 112 32.190 -22.282 0.518 1.00 0.62 C ATOM 3876 O GLU B 112 32.905 -22.823 -0.303 1.00 0.64 O ATOM 3877 CB GLU B 112 32.884 -20.139 1.591 1.00 0.66 C ATOM 3878 CG GLU B 112 32.867 -18.616 1.444 1.00 1.29 C ATOM 3879 CD GLU B 112 33.609 -18.216 0.169 1.00 1.72 C ATOM 3880 OE1 GLU B 112 34.395 -19.015 -0.312 1.00 2.27 O ATOM 3881 OE2 GLU B 112 33.378 -17.116 -0.307 1.00 2.25 O ATOM 0 H GLU B 112 30.400 -20.002 1.721 1.00 0.54 H new ATOM 0 HA GLU B 112 32.247 -20.359 -0.456 1.00 0.60 H new ATOM 0 HB2 GLU B 112 32.536 -20.423 2.584 1.00 0.66 H new ATOM 0 HB3 GLU B 112 33.903 -20.513 1.492 1.00 0.66 H new ATOM 0 HG2 GLU B 112 31.839 -18.256 1.407 1.00 1.29 H new ATOM 0 HG3 GLU B 112 33.337 -18.152 2.311 1.00 1.29 H new ATOM 3888 N LYS B 113 31.569 -22.970 1.438 1.00 0.62 N ATOM 3889 CA LYS B 113 31.726 -24.449 1.499 1.00 0.65 C ATOM 3890 C LYS B 113 31.134 -25.078 0.234 1.00 0.60 C ATOM 3891 O LYS B 113 31.690 -26.002 -0.325 1.00 0.63 O ATOM 3892 CB LYS B 113 30.983 -24.982 2.731 1.00 0.68 C ATOM 3893 CG LYS B 113 31.706 -24.557 4.024 1.00 0.75 C ATOM 3894 CD LYS B 113 32.905 -25.474 4.303 1.00 1.28 C ATOM 3895 CE LYS B 113 33.469 -25.163 5.692 1.00 1.53 C ATOM 3896 NZ LYS B 113 32.492 -25.584 6.735 1.00 2.10 N ATOM 0 H LYS B 113 30.959 -22.569 2.151 1.00 0.62 H new ATOM 0 HA LYS B 113 32.783 -24.704 1.568 1.00 0.65 H new ATOM 0 HB2 LYS B 113 29.961 -24.604 2.738 1.00 0.68 H new ATOM 0 HB3 LYS B 113 30.920 -26.069 2.683 1.00 0.68 H new ATOM 0 HG2 LYS B 113 32.045 -23.525 3.934 1.00 0.75 H new ATOM 0 HG3 LYS B 113 31.011 -24.593 4.863 1.00 0.75 H new ATOM 0 HD2 LYS B 113 32.599 -26.519 4.248 1.00 1.28 H new ATOM 0 HD3 LYS B 113 33.674 -25.327 3.545 1.00 1.28 H new ATOM 0 HE2 LYS B 113 34.416 -25.683 5.836 1.00 1.53 H new ATOM 0 HE3 LYS B 113 33.674 -24.096 5.781 1.00 1.53 H new ATOM 0 HZ1 LYS B 113 32.988 -25.727 7.638 1.00 2.10 H new ATOM 0 HZ2 LYS B 113 31.768 -24.846 6.851 1.00 2.10 H new ATOM 0 HZ3 LYS B 113 32.037 -26.473 6.446 1.00 2.10 H new ATOM 3910 N ASN B 114 30.015 -24.582 -0.231 1.00 0.53 N ATOM 3911 CA ASN B 114 29.411 -25.161 -1.465 1.00 0.49 C ATOM 3912 C ASN B 114 30.367 -24.954 -2.635 1.00 0.49 C ATOM 3913 O ASN B 114 30.580 -25.838 -3.442 1.00 0.50 O ATOM 3914 CB ASN B 114 28.080 -24.465 -1.767 1.00 0.44 C ATOM 3915 CG ASN B 114 27.040 -24.872 -0.723 1.00 0.46 C ATOM 3916 OD1 ASN B 114 27.139 -25.927 -0.129 1.00 1.19 O ATOM 3917 ND2 ASN B 114 26.037 -24.075 -0.472 1.00 1.18 N ATOM 0 H ASN B 114 29.499 -23.808 0.187 1.00 0.53 H new ATOM 0 HA ASN B 114 29.233 -26.226 -1.316 1.00 0.49 H new ATOM 0 HB2 ASN B 114 28.214 -23.383 -1.759 1.00 0.44 H new ATOM 0 HB3 ASN B 114 27.734 -24.736 -2.764 1.00 0.44 H new ATOM 0 HD21 ASN B 114 25.338 -24.338 0.222 1.00 1.18 H new ATOM 0 HD22 ASN B 114 25.953 -23.189 -0.970 1.00 1.18 H new ATOM 3924 N MET B 115 30.956 -23.796 -2.730 1.00 0.50 N ATOM 3925 CA MET B 115 31.906 -23.542 -3.842 1.00 0.54 C ATOM 3926 C MET B 115 33.141 -24.421 -3.647 1.00 0.61 C ATOM 3927 O MET B 115 33.674 -24.978 -4.585 1.00 0.63 O ATOM 3928 CB MET B 115 32.305 -22.065 -3.839 1.00 0.57 C ATOM 3929 CG MET B 115 33.179 -21.766 -5.056 1.00 0.72 C ATOM 3930 SD MET B 115 33.609 -20.007 -5.066 1.00 0.94 S ATOM 3931 CE MET B 115 34.806 -20.077 -6.420 1.00 1.46 C ATOM 0 H MET B 115 30.820 -23.017 -2.086 1.00 0.50 H new ATOM 0 HA MET B 115 31.439 -23.780 -4.798 1.00 0.54 H new ATOM 0 HB2 MET B 115 31.414 -21.437 -3.856 1.00 0.57 H new ATOM 0 HB3 MET B 115 32.846 -21.826 -2.923 1.00 0.57 H new ATOM 0 HG2 MET B 115 34.084 -22.373 -5.026 1.00 0.72 H new ATOM 0 HG3 MET B 115 32.649 -22.028 -5.972 1.00 0.72 H new ATOM 0 HE1 MET B 115 35.208 -19.080 -6.602 1.00 1.46 H new ATOM 0 HE2 MET B 115 35.619 -20.753 -6.153 1.00 1.46 H new ATOM 0 HE3 MET B 115 34.314 -20.440 -7.322 1.00 1.46 H new ATOM 3941 N TYR B 116 33.594 -24.560 -2.429 1.00 0.65 N ATOM 3942 CA TYR B 116 34.786 -25.414 -2.171 1.00 0.73 C ATOM 3943 C TYR B 116 34.489 -26.847 -2.625 1.00 0.72 C ATOM 3944 O TYR B 116 35.297 -27.483 -3.273 1.00 0.76 O ATOM 3945 CB TYR B 116 35.115 -25.403 -0.676 1.00 0.78 C ATOM 3946 CG TYR B 116 36.330 -26.263 -0.420 1.00 0.87 C ATOM 3947 CD1 TYR B 116 36.183 -27.626 -0.138 1.00 0.91 C ATOM 3948 CD2 TYR B 116 37.608 -25.692 -0.467 1.00 0.95 C ATOM 3949 CE1 TYR B 116 37.314 -28.418 0.098 1.00 1.01 C ATOM 3950 CE2 TYR B 116 38.738 -26.483 -0.232 1.00 1.05 C ATOM 3951 CZ TYR B 116 38.592 -27.846 0.051 1.00 1.07 C ATOM 3952 OH TYR B 116 39.706 -28.627 0.282 1.00 1.18 O ATOM 0 H TYR B 116 33.189 -24.119 -1.603 1.00 0.65 H new ATOM 0 HA TYR B 116 35.640 -25.026 -2.726 1.00 0.73 H new ATOM 0 HB2 TYR B 116 35.302 -24.383 -0.342 1.00 0.78 H new ATOM 0 HB3 TYR B 116 34.266 -25.776 -0.103 1.00 0.78 H new ATOM 0 HD1 TYR B 116 35.198 -28.067 -0.102 1.00 0.91 H new ATOM 0 HD2 TYR B 116 37.721 -24.640 -0.685 1.00 0.95 H new ATOM 0 HE1 TYR B 116 37.201 -29.470 0.316 1.00 1.01 H new ATOM 0 HE2 TYR B 116 39.723 -26.042 -0.269 1.00 1.05 H new ATOM 0 HH TYR B 116 40.513 -28.075 0.211 1.00 1.18 H new ATOM 3962 N GLU B 117 33.335 -27.363 -2.286 1.00 0.68 N ATOM 3963 CA GLU B 117 32.993 -28.756 -2.698 1.00 0.68 C ATOM 3964 C GLU B 117 32.996 -28.847 -4.224 1.00 0.64 C ATOM 3965 O GLU B 117 33.458 -29.813 -4.798 1.00 0.68 O ATOM 3966 CB GLU B 117 31.601 -29.117 -2.172 1.00 0.66 C ATOM 3967 CG GLU B 117 31.653 -29.265 -0.650 1.00 0.72 C ATOM 3968 CD GLU B 117 30.262 -29.625 -0.123 1.00 0.73 C ATOM 3969 OE1 GLU B 117 29.326 -29.589 -0.905 1.00 1.29 O ATOM 3970 OE2 GLU B 117 30.159 -29.935 1.051 1.00 1.28 O ATOM 0 H GLU B 117 32.618 -26.881 -1.744 1.00 0.68 H new ATOM 0 HA GLU B 117 33.728 -29.448 -2.287 1.00 0.68 H new ATOM 0 HB2 GLU B 117 30.884 -28.344 -2.449 1.00 0.66 H new ATOM 0 HB3 GLU B 117 31.258 -30.046 -2.627 1.00 0.66 H new ATOM 0 HG2 GLU B 117 32.369 -30.039 -0.374 1.00 0.72 H new ATOM 0 HG3 GLU B 117 31.996 -28.336 -0.195 1.00 0.72 H new ATOM 3977 N LEU B 118 32.483 -27.845 -4.883 1.00 0.58 N ATOM 3978 CA LEU B 118 32.457 -27.869 -6.371 1.00 0.56 C ATOM 3979 C LEU B 118 33.895 -27.957 -6.893 1.00 0.64 C ATOM 3980 O LEU B 118 34.190 -28.699 -7.809 1.00 0.67 O ATOM 3981 CB LEU B 118 31.785 -26.590 -6.886 1.00 0.51 C ATOM 3982 CG LEU B 118 31.744 -26.587 -8.422 1.00 0.52 C ATOM 3983 CD1 LEU B 118 30.922 -27.785 -8.932 1.00 0.53 C ATOM 3984 CD2 LEU B 118 31.101 -25.280 -8.897 1.00 0.53 C ATOM 0 H LEU B 118 32.081 -27.011 -4.455 1.00 0.58 H new ATOM 0 HA LEU B 118 31.893 -28.733 -6.723 1.00 0.56 H new ATOM 0 HB2 LEU B 118 30.772 -26.518 -6.489 1.00 0.51 H new ATOM 0 HB3 LEU B 118 32.330 -25.716 -6.529 1.00 0.51 H new ATOM 0 HG LEU B 118 32.758 -26.667 -8.814 1.00 0.52 H new ATOM 0 HD11 LEU B 118 30.899 -27.773 -10.022 1.00 0.53 H new ATOM 0 HD12 LEU B 118 31.380 -28.713 -8.589 1.00 0.53 H new ATOM 0 HD13 LEU B 118 29.904 -27.718 -8.547 1.00 0.53 H new ATOM 0 HD21 LEU B 118 31.066 -25.266 -9.986 1.00 0.53 H new ATOM 0 HD22 LEU B 118 30.088 -25.208 -8.501 1.00 0.53 H new ATOM 0 HD23 LEU B 118 31.690 -24.435 -8.542 1.00 0.53 H new ATOM 3996 N GLN B 119 34.788 -27.200 -6.312 1.00 0.71 N ATOM 3997 CA GLN B 119 36.210 -27.230 -6.764 1.00 0.81 C ATOM 3998 C GLN B 119 36.784 -28.636 -6.564 1.00 0.86 C ATOM 3999 O GLN B 119 37.519 -29.140 -7.388 1.00 0.92 O ATOM 4000 CB GLN B 119 37.022 -26.223 -5.946 1.00 0.88 C ATOM 4001 CG GLN B 119 36.616 -24.801 -6.340 1.00 0.87 C ATOM 4002 CD GLN B 119 37.409 -23.792 -5.509 1.00 0.95 C ATOM 4003 OE1 GLN B 119 37.661 -24.013 -4.342 1.00 1.29 O ATOM 4004 NE2 GLN B 119 37.812 -22.683 -6.066 1.00 1.45 N ATOM 0 H GLN B 119 34.593 -26.560 -5.542 1.00 0.71 H new ATOM 0 HA GLN B 119 36.262 -26.968 -7.821 1.00 0.81 H new ATOM 0 HB2 GLN B 119 36.850 -26.380 -4.881 1.00 0.88 H new ATOM 0 HB3 GLN B 119 38.088 -26.370 -6.122 1.00 0.88 H new ATOM 0 HG2 GLN B 119 36.803 -24.640 -7.402 1.00 0.87 H new ATOM 0 HG3 GLN B 119 35.547 -24.659 -6.179 1.00 0.87 H new ATOM 0 HE21 GLN B 119 37.600 -22.498 -7.046 1.00 1.45 H new ATOM 0 HE22 GLN B 119 38.339 -22.001 -5.521 1.00 1.45 H new ATOM 4013 N LYS B 120 36.452 -29.273 -5.474 1.00 0.86 N ATOM 4014 CA LYS B 120 36.977 -30.645 -5.218 1.00 0.93 C ATOM 4015 C LYS B 120 36.525 -31.576 -6.343 1.00 0.90 C ATOM 4016 O LYS B 120 37.276 -32.412 -6.804 1.00 0.99 O ATOM 4017 CB LYS B 120 36.452 -31.157 -3.870 1.00 0.95 C ATOM 4018 CG LYS B 120 37.089 -30.360 -2.715 1.00 1.01 C ATOM 4019 CD LYS B 120 38.493 -30.915 -2.371 1.00 1.57 C ATOM 4020 CE LYS B 120 38.393 -31.961 -1.255 1.00 1.89 C ATOM 4021 NZ LYS B 120 37.202 -32.826 -1.487 1.00 2.45 N ATOM 0 H LYS B 120 35.839 -28.902 -4.748 1.00 0.86 H new ATOM 0 HA LYS B 120 38.066 -30.620 -5.186 1.00 0.93 H new ATOM 0 HB2 LYS B 120 35.367 -31.060 -3.833 1.00 0.95 H new ATOM 0 HB3 LYS B 120 36.682 -32.217 -3.761 1.00 0.95 H new ATOM 0 HG2 LYS B 120 37.167 -29.309 -2.992 1.00 1.01 H new ATOM 0 HG3 LYS B 120 36.448 -30.411 -1.835 1.00 1.01 H new ATOM 0 HD2 LYS B 120 38.942 -31.362 -3.258 1.00 1.57 H new ATOM 0 HD3 LYS B 120 39.147 -30.101 -2.058 1.00 1.57 H new ATOM 0 HE2 LYS B 120 39.297 -32.569 -1.230 1.00 1.89 H new ATOM 0 HE3 LYS B 120 38.314 -31.468 -0.286 1.00 1.89 H new ATOM 0 HZ1 LYS B 120 37.135 -33.535 -0.729 1.00 2.45 H new ATOM 0 HZ2 LYS B 120 36.343 -32.240 -1.490 1.00 2.45 H new ATOM 0 HZ3 LYS B 120 37.296 -33.307 -2.404 1.00 2.45 H new ATOM 4035 N LEU B 121 35.312 -31.440 -6.797 1.00 0.80 N ATOM 4036 CA LEU B 121 34.844 -32.322 -7.897 1.00 0.78 C ATOM 4037 C LEU B 121 35.766 -32.095 -9.092 1.00 0.86 C ATOM 4038 O LEU B 121 36.260 -33.029 -9.693 1.00 0.95 O ATOM 4039 CB LEU B 121 33.406 -31.959 -8.280 1.00 0.67 C ATOM 4040 CG LEU B 121 32.467 -32.196 -7.089 1.00 0.67 C ATOM 4041 CD1 LEU B 121 31.062 -31.715 -7.458 1.00 0.62 C ATOM 4042 CD2 LEU B 121 32.421 -33.694 -6.734 1.00 0.77 C ATOM 0 H LEU B 121 34.630 -30.762 -6.457 1.00 0.80 H new ATOM 0 HA LEU B 121 34.865 -33.366 -7.585 1.00 0.78 H new ATOM 0 HB2 LEU B 121 33.356 -30.915 -8.590 1.00 0.67 H new ATOM 0 HB3 LEU B 121 33.085 -32.560 -9.131 1.00 0.67 H new ATOM 0 HG LEU B 121 32.836 -31.643 -6.225 1.00 0.67 H new ATOM 0 HD11 LEU B 121 30.388 -31.880 -6.617 1.00 0.62 H new ATOM 0 HD12 LEU B 121 31.092 -30.652 -7.696 1.00 0.62 H new ATOM 0 HD13 LEU B 121 30.703 -32.270 -8.325 1.00 0.62 H new ATOM 0 HD21 LEU B 121 31.751 -33.847 -5.888 1.00 0.77 H new ATOM 0 HD22 LEU B 121 32.057 -34.260 -7.592 1.00 0.77 H new ATOM 0 HD23 LEU B 121 33.422 -34.037 -6.471 1.00 0.77 H new ATOM 4054 N ASN B 122 36.020 -30.852 -9.421 1.00 0.88 N ATOM 4055 CA ASN B 122 36.936 -30.531 -10.560 1.00 1.02 C ATOM 4056 C ASN B 122 38.080 -29.654 -10.038 1.00 1.08 C ATOM 4057 O ASN B 122 38.256 -28.530 -10.465 1.00 1.15 O ATOM 4058 CB ASN B 122 36.163 -29.763 -11.635 1.00 1.10 C ATOM 4059 CG ASN B 122 37.078 -29.504 -12.835 1.00 1.30 C ATOM 4060 OD1 ASN B 122 37.606 -28.420 -12.986 1.00 1.77 O ATOM 4061 ND2 ASN B 122 37.291 -30.459 -13.699 1.00 1.70 N ATOM 0 H ASN B 122 35.629 -30.039 -8.945 1.00 0.88 H new ATOM 0 HA ASN B 122 37.333 -31.451 -10.988 1.00 1.02 H new ATOM 0 HB2 ASN B 122 35.289 -30.334 -11.947 1.00 1.10 H new ATOM 0 HB3 ASN B 122 35.799 -28.818 -11.231 1.00 1.10 H new ATOM 0 HD21 ASN B 122 37.900 -30.295 -14.500 1.00 1.70 H new ATOM 0 HD22 ASN B 122 36.848 -31.369 -13.573 1.00 1.70 H new ATOM 4068 N SER B 123 38.859 -30.160 -9.113 1.00 1.09 N ATOM 4069 CA SER B 123 39.993 -29.358 -8.560 1.00 1.18 C ATOM 4070 C SER B 123 41.244 -29.597 -9.408 1.00 1.37 C ATOM 4071 O SER B 123 41.245 -30.547 -10.173 1.00 1.92 O ATOM 4072 CB SER B 123 40.270 -29.796 -7.118 1.00 1.16 C ATOM 4073 OG SER B 123 41.648 -29.605 -6.823 1.00 1.84 O ATOM 4074 OXT SER B 123 42.180 -28.825 -9.277 1.00 1.65 O ATOM 0 H SER B 123 38.758 -31.095 -8.717 1.00 1.09 H new ATOM 0 HA SER B 123 39.734 -28.299 -8.578 1.00 1.18 H new ATOM 0 HB2 SER B 123 39.655 -29.219 -6.427 1.00 1.16 H new ATOM 0 HB3 SER B 123 40.000 -30.844 -6.986 1.00 1.16 H new ATOM 0 HG SER B 123 42.035 -28.973 -7.464 1.00 1.84 H new TER 4080 SER B 123 ATOM 4081 N ALA C 1 20.160 -40.655 -15.993 1.00 0.82 N ATOM 4082 CA ALA C 1 20.275 -40.738 -14.511 1.00 0.80 C ATOM 4083 C ALA C 1 20.597 -39.350 -13.951 1.00 0.71 C ATOM 4084 O ALA C 1 20.868 -39.188 -12.778 1.00 0.70 O ATOM 4085 CB ALA C 1 21.401 -41.708 -14.144 1.00 0.90 C ATOM 0 H1 ALA C 1 19.975 -41.602 -16.380 1.00 0.82 H new ATOM 0 H2 ALA C 1 19.377 -40.019 -16.245 1.00 0.82 H new ATOM 0 H3 ALA C 1 21.048 -40.286 -16.390 1.00 0.82 H new ATOM 0 HA ALA C 1 19.335 -41.094 -14.089 1.00 0.80 H new ATOM 0 HB1 ALA C 1 21.488 -41.771 -13.059 1.00 0.90 H new ATOM 0 HB2 ALA C 1 21.177 -42.695 -14.548 1.00 0.90 H new ATOM 0 HB3 ALA C 1 22.341 -41.349 -14.563 1.00 0.90 H new ATOM 4093 N GLN C 2 20.571 -38.347 -14.786 1.00 0.67 N ATOM 4094 CA GLN C 2 20.877 -36.965 -14.318 1.00 0.60 C ATOM 4095 C GLN C 2 19.638 -36.356 -13.658 1.00 0.52 C ATOM 4096 O GLN C 2 18.522 -36.601 -14.070 1.00 0.52 O ATOM 4097 CB GLN C 2 21.283 -36.110 -15.519 1.00 0.62 C ATOM 4098 CG GLN C 2 22.652 -36.562 -16.031 1.00 0.72 C ATOM 4099 CD GLN C 2 23.733 -36.168 -15.021 1.00 1.27 C ATOM 4100 OE1 GLN C 2 23.912 -35.001 -14.734 1.00 2.01 O ATOM 4101 NE2 GLN C 2 24.468 -37.094 -14.470 1.00 1.88 N ATOM 0 H GLN C 2 20.350 -38.426 -15.779 1.00 0.67 H new ATOM 0 HA GLN C 2 21.690 -36.998 -13.593 1.00 0.60 H new ATOM 0 HB2 GLN C 2 20.539 -36.201 -16.311 1.00 0.62 H new ATOM 0 HB3 GLN C 2 21.319 -35.058 -15.234 1.00 0.62 H new ATOM 0 HG2 GLN C 2 22.657 -37.642 -16.182 1.00 0.72 H new ATOM 0 HG3 GLN C 2 22.859 -36.104 -16.998 1.00 0.72 H new ATOM 0 HE21 GLN C 2 24.319 -38.074 -14.710 1.00 1.88 H new ATOM 0 HE22 GLN C 2 25.192 -36.838 -13.799 1.00 1.88 H new ATOM 4110 N SER C 3 19.824 -35.555 -12.640 1.00 0.47 N ATOM 4111 CA SER C 3 18.653 -34.924 -11.962 1.00 0.41 C ATOM 4112 C SER C 3 18.348 -33.579 -12.626 1.00 0.37 C ATOM 4113 O SER C 3 18.369 -32.542 -11.993 1.00 0.34 O ATOM 4114 CB SER C 3 18.982 -34.701 -10.484 1.00 0.40 C ATOM 4115 OG SER C 3 19.757 -33.518 -10.348 1.00 1.37 O ATOM 0 H SER C 3 20.734 -35.311 -12.250 1.00 0.47 H new ATOM 0 HA SER C 3 17.785 -35.577 -12.046 1.00 0.41 H new ATOM 0 HB2 SER C 3 18.063 -34.616 -9.904 1.00 0.40 H new ATOM 0 HB3 SER C 3 19.530 -35.556 -10.089 1.00 0.40 H new ATOM 0 HG SER C 3 19.202 -32.738 -10.558 1.00 1.37 H new ATOM 4121 N ARG C 4 18.060 -33.591 -13.899 1.00 0.41 N ATOM 4122 CA ARG C 4 17.748 -32.319 -14.609 1.00 0.42 C ATOM 4123 C ARG C 4 16.446 -31.741 -14.056 1.00 0.42 C ATOM 4124 O ARG C 4 16.312 -30.547 -13.868 1.00 0.43 O ATOM 4125 CB ARG C 4 17.593 -32.605 -16.102 1.00 0.51 C ATOM 4126 CG ARG C 4 18.962 -32.954 -16.691 1.00 0.90 C ATOM 4127 CD ARG C 4 18.815 -33.241 -18.186 1.00 1.03 C ATOM 4128 NE ARG C 4 20.123 -33.687 -18.740 1.00 1.97 N ATOM 4129 CZ ARG C 4 20.168 -34.298 -19.893 1.00 2.55 C ATOM 4130 NH1 ARG C 4 19.066 -34.531 -20.554 1.00 2.53 N ATOM 4131 NH2 ARG C 4 21.315 -34.678 -20.385 1.00 3.56 N ATOM 0 H ARG C 4 18.027 -34.429 -14.479 1.00 0.41 H new ATOM 0 HA ARG C 4 18.554 -31.601 -14.459 1.00 0.42 H new ATOM 0 HB2 ARG C 4 16.896 -33.429 -16.256 1.00 0.51 H new ATOM 0 HB3 ARG C 4 17.176 -31.735 -16.610 1.00 0.51 H new ATOM 0 HG2 ARG C 4 19.658 -32.130 -16.535 1.00 0.90 H new ATOM 0 HG3 ARG C 4 19.378 -33.823 -16.182 1.00 0.90 H new ATOM 0 HD2 ARG C 4 18.059 -34.010 -18.346 1.00 1.03 H new ATOM 0 HD3 ARG C 4 18.474 -32.346 -18.707 1.00 1.03 H new ATOM 0 HE ARG C 4 20.983 -33.515 -18.219 1.00 1.97 H new ATOM 0 HH11 ARG C 4 18.169 -34.236 -20.170 1.00 2.53 H new ATOM 0 HH12 ARG C 4 19.103 -35.008 -21.455 1.00 2.53 H new ATOM 0 HH21 ARG C 4 22.176 -34.498 -19.869 1.00 3.56 H new ATOM 0 HH22 ARG C 4 21.351 -35.155 -21.286 1.00 3.56 H new ATOM 4145 N THR C 5 15.483 -32.583 -13.790 1.00 0.45 N ATOM 4146 CA THR C 5 14.190 -32.090 -13.244 1.00 0.49 C ATOM 4147 C THR C 5 14.436 -31.393 -11.902 1.00 0.44 C ATOM 4148 O THR C 5 13.905 -30.333 -11.637 1.00 0.46 O ATOM 4149 CB THR C 5 13.237 -33.275 -13.044 1.00 0.54 C ATOM 4150 OG1 THR C 5 11.979 -32.800 -12.587 1.00 0.68 O ATOM 4151 CG2 THR C 5 13.824 -34.244 -12.015 1.00 0.56 C ATOM 0 H THR C 5 15.538 -33.592 -13.928 1.00 0.45 H new ATOM 0 HA THR C 5 13.744 -31.381 -13.942 1.00 0.49 H new ATOM 0 HB THR C 5 13.106 -33.796 -13.993 1.00 0.54 H new ATOM 0 HG1 THR C 5 11.370 -33.557 -12.461 1.00 0.68 H new ATOM 0 HG21 THR C 5 13.143 -35.084 -11.876 1.00 0.56 H new ATOM 0 HG22 THR C 5 14.787 -34.612 -12.370 1.00 0.56 H new ATOM 0 HG23 THR C 5 13.961 -33.727 -11.065 1.00 0.56 H new ATOM 4159 N LEU C 6 15.240 -31.979 -11.056 1.00 0.39 N ATOM 4160 CA LEU C 6 15.525 -31.348 -9.735 1.00 0.37 C ATOM 4161 C LEU C 6 16.180 -29.985 -9.970 1.00 0.32 C ATOM 4162 O LEU C 6 15.843 -29.000 -9.342 1.00 0.33 O ATOM 4163 CB LEU C 6 16.466 -32.259 -8.937 1.00 0.35 C ATOM 4164 CG LEU C 6 16.783 -31.643 -7.566 1.00 0.35 C ATOM 4165 CD1 LEU C 6 15.489 -31.456 -6.752 1.00 0.41 C ATOM 4166 CD2 LEU C 6 17.738 -32.579 -6.811 1.00 0.37 C ATOM 0 H LEU C 6 15.712 -32.868 -11.223 1.00 0.39 H new ATOM 0 HA LEU C 6 14.602 -31.211 -9.172 1.00 0.37 H new ATOM 0 HB2 LEU C 6 16.006 -33.238 -8.804 1.00 0.35 H new ATOM 0 HB3 LEU C 6 17.390 -32.414 -9.494 1.00 0.35 H new ATOM 0 HG LEU C 6 17.249 -30.668 -7.706 1.00 0.35 H new ATOM 0 HD11 LEU C 6 15.729 -31.019 -5.783 1.00 0.41 H new ATOM 0 HD12 LEU C 6 14.812 -30.793 -7.292 1.00 0.41 H new ATOM 0 HD13 LEU C 6 15.009 -32.423 -6.605 1.00 0.41 H new ATOM 0 HD21 LEU C 6 17.970 -32.152 -5.835 1.00 0.37 H new ATOM 0 HD22 LEU C 6 17.264 -33.552 -6.678 1.00 0.37 H new ATOM 0 HD23 LEU C 6 18.658 -32.699 -7.383 1.00 0.37 H new ATOM 4178 N LEU C 7 17.109 -29.923 -10.885 1.00 0.29 N ATOM 4179 CA LEU C 7 17.790 -28.633 -11.193 1.00 0.27 C ATOM 4180 C LEU C 7 16.761 -27.612 -11.674 1.00 0.30 C ATOM 4181 O LEU C 7 16.837 -26.444 -11.349 1.00 0.29 O ATOM 4182 CB LEU C 7 18.863 -28.853 -12.265 1.00 0.27 C ATOM 4183 CG LEU C 7 20.065 -29.601 -11.657 1.00 0.24 C ATOM 4184 CD1 LEU C 7 20.885 -30.254 -12.775 1.00 0.27 C ATOM 4185 CD2 LEU C 7 20.970 -28.627 -10.876 1.00 0.23 C ATOM 0 H LEU C 7 17.428 -30.719 -11.438 1.00 0.29 H new ATOM 0 HA LEU C 7 18.270 -28.253 -10.291 1.00 0.27 H new ATOM 0 HB2 LEU C 7 18.449 -29.426 -13.095 1.00 0.27 H new ATOM 0 HB3 LEU C 7 19.187 -27.894 -12.670 1.00 0.27 H new ATOM 0 HG LEU C 7 19.688 -30.364 -10.976 1.00 0.24 H new ATOM 0 HD11 LEU C 7 21.734 -30.782 -12.342 1.00 0.27 H new ATOM 0 HD12 LEU C 7 20.259 -30.960 -13.321 1.00 0.27 H new ATOM 0 HD13 LEU C 7 21.246 -29.485 -13.458 1.00 0.27 H new ATOM 0 HD21 LEU C 7 21.813 -29.173 -10.454 1.00 0.23 H new ATOM 0 HD22 LEU C 7 21.339 -27.854 -11.550 1.00 0.23 H new ATOM 0 HD23 LEU C 7 20.398 -28.165 -10.072 1.00 0.23 H new ATOM 4197 N ALA C 8 15.804 -28.035 -12.454 1.00 0.35 N ATOM 4198 CA ALA C 8 14.787 -27.068 -12.949 1.00 0.39 C ATOM 4199 C ALA C 8 14.090 -26.438 -11.743 1.00 0.38 C ATOM 4200 O ALA C 8 13.879 -25.245 -11.692 1.00 0.39 O ATOM 4201 CB ALA C 8 13.757 -27.808 -13.812 1.00 0.45 C ATOM 0 H ALA C 8 15.684 -28.998 -12.767 1.00 0.35 H new ATOM 0 HA ALA C 8 15.264 -26.294 -13.550 1.00 0.39 H new ATOM 0 HB1 ALA C 8 13.011 -27.101 -14.175 1.00 0.45 H new ATOM 0 HB2 ALA C 8 14.260 -28.273 -14.660 1.00 0.45 H new ATOM 0 HB3 ALA C 8 13.267 -28.577 -13.215 1.00 0.45 H new ATOM 4207 N GLY C 9 13.759 -27.223 -10.757 1.00 0.38 N ATOM 4208 CA GLY C 9 13.105 -26.648 -9.551 1.00 0.39 C ATOM 4209 C GLY C 9 14.082 -25.676 -8.887 1.00 0.34 C ATOM 4210 O GLY C 9 13.740 -24.557 -8.561 1.00 0.34 O ATOM 0 H GLY C 9 13.912 -28.231 -10.734 1.00 0.38 H new ATOM 0 HA2 GLY C 9 12.186 -26.131 -9.828 1.00 0.39 H new ATOM 0 HA3 GLY C 9 12.828 -27.441 -8.856 1.00 0.39 H new ATOM 4214 N ILE C 10 15.302 -26.101 -8.696 1.00 0.30 N ATOM 4215 CA ILE C 10 16.318 -25.212 -8.068 1.00 0.27 C ATOM 4216 C ILE C 10 16.495 -23.959 -8.928 1.00 0.25 C ATOM 4217 O ILE C 10 16.483 -22.850 -8.432 1.00 0.25 O ATOM 4218 CB ILE C 10 17.646 -25.965 -7.965 1.00 0.25 C ATOM 4219 CG1 ILE C 10 17.497 -27.099 -6.949 1.00 0.28 C ATOM 4220 CG2 ILE C 10 18.749 -25.008 -7.504 1.00 0.26 C ATOM 4221 CD1 ILE C 10 18.717 -28.018 -7.021 1.00 0.26 C ATOM 0 H ILE C 10 15.639 -27.030 -8.949 1.00 0.30 H new ATOM 0 HA ILE C 10 15.990 -24.918 -7.071 1.00 0.27 H new ATOM 0 HB ILE C 10 17.912 -26.373 -8.940 1.00 0.25 H new ATOM 0 HG12 ILE C 10 17.397 -26.689 -5.944 1.00 0.28 H new ATOM 0 HG13 ILE C 10 16.589 -27.667 -7.153 1.00 0.28 H new ATOM 0 HG21 ILE C 10 19.693 -25.548 -7.432 1.00 0.26 H new ATOM 0 HG22 ILE C 10 18.850 -24.196 -8.224 1.00 0.26 H new ATOM 0 HG23 ILE C 10 18.490 -24.598 -6.528 1.00 0.26 H new ATOM 0 HD11 ILE C 10 18.608 -28.825 -6.296 1.00 0.26 H new ATOM 0 HD12 ILE C 10 18.797 -28.439 -8.023 1.00 0.26 H new ATOM 0 HD13 ILE C 10 19.617 -27.446 -6.795 1.00 0.26 H new ATOM 4233 N VAL C 11 16.656 -24.123 -10.215 1.00 0.26 N ATOM 4234 CA VAL C 11 16.826 -22.930 -11.093 1.00 0.27 C ATOM 4235 C VAL C 11 15.581 -22.049 -10.961 1.00 0.28 C ATOM 4236 O VAL C 11 15.669 -20.853 -10.764 1.00 0.28 O ATOM 4237 CB VAL C 11 16.989 -23.386 -12.547 1.00 0.30 C ATOM 4238 CG1 VAL C 11 16.922 -22.178 -13.487 1.00 0.35 C ATOM 4239 CG2 VAL C 11 18.338 -24.094 -12.705 1.00 0.29 C ATOM 0 H VAL C 11 16.677 -25.024 -10.692 1.00 0.26 H new ATOM 0 HA VAL C 11 17.711 -22.367 -10.798 1.00 0.27 H new ATOM 0 HB VAL C 11 16.183 -24.074 -12.803 1.00 0.30 H new ATOM 0 HG11 VAL C 11 17.039 -22.512 -14.518 1.00 0.35 H new ATOM 0 HG12 VAL C 11 15.958 -21.682 -13.373 1.00 0.35 H new ATOM 0 HG13 VAL C 11 17.721 -21.479 -13.239 1.00 0.35 H new ATOM 0 HG21 VAL C 11 18.459 -24.420 -13.738 1.00 0.29 H new ATOM 0 HG22 VAL C 11 19.143 -23.406 -12.445 1.00 0.29 H new ATOM 0 HG23 VAL C 11 18.374 -24.960 -12.044 1.00 0.29 H new ATOM 4249 N GLN C 12 14.422 -22.643 -11.045 1.00 0.32 N ATOM 4250 CA GLN C 12 13.165 -21.856 -10.898 1.00 0.34 C ATOM 4251 C GLN C 12 13.140 -21.201 -9.517 1.00 0.32 C ATOM 4252 O GLN C 12 12.725 -20.069 -9.364 1.00 0.33 O ATOM 4253 CB GLN C 12 11.959 -22.785 -11.050 1.00 0.39 C ATOM 4254 CG GLN C 12 11.837 -23.226 -12.510 1.00 1.18 C ATOM 4255 CD GLN C 12 11.358 -22.048 -13.360 1.00 1.63 C ATOM 4256 OE1 GLN C 12 11.962 -21.721 -14.361 1.00 1.99 O ATOM 4257 NE2 GLN C 12 10.285 -21.393 -13.003 1.00 2.40 N ATOM 0 H GLN C 12 14.291 -23.641 -11.209 1.00 0.32 H new ATOM 0 HA GLN C 12 13.123 -21.085 -11.667 1.00 0.34 H new ATOM 0 HB2 GLN C 12 12.073 -23.656 -10.404 1.00 0.39 H new ATOM 0 HB3 GLN C 12 11.050 -22.272 -10.736 1.00 0.39 H new ATOM 0 HG2 GLN C 12 12.800 -23.584 -12.875 1.00 1.18 H new ATOM 0 HG3 GLN C 12 11.136 -24.057 -12.593 1.00 1.18 H new ATOM 0 HE21 GLN C 12 9.777 -21.667 -12.162 1.00 2.40 H new ATOM 0 HE22 GLN C 12 9.956 -20.608 -13.565 1.00 2.40 H new ATOM 4266 N GLN C 13 13.577 -21.906 -8.508 1.00 0.30 N ATOM 4267 CA GLN C 13 13.571 -21.325 -7.137 1.00 0.29 C ATOM 4268 C GLN C 13 14.445 -20.071 -7.130 1.00 0.25 C ATOM 4269 O GLN C 13 14.081 -19.054 -6.573 1.00 0.25 O ATOM 4270 CB GLN C 13 14.137 -22.351 -6.148 1.00 0.29 C ATOM 4271 CG GLN C 13 13.986 -21.833 -4.713 1.00 0.30 C ATOM 4272 CD GLN C 13 12.504 -21.800 -4.334 1.00 0.38 C ATOM 4273 OE1 GLN C 13 11.672 -22.333 -5.040 1.00 0.84 O ATOM 4274 NE2 GLN C 13 12.139 -21.201 -3.234 1.00 0.64 N ATOM 0 H GLN C 13 13.937 -22.858 -8.575 1.00 0.30 H new ATOM 0 HA GLN C 13 12.553 -21.068 -6.845 1.00 0.29 H new ATOM 0 HB2 GLN C 13 13.614 -23.301 -6.258 1.00 0.29 H new ATOM 0 HB3 GLN C 13 15.188 -22.539 -6.367 1.00 0.29 H new ATOM 0 HG2 GLN C 13 14.534 -22.476 -4.024 1.00 0.30 H new ATOM 0 HG3 GLN C 13 14.416 -20.835 -4.628 1.00 0.30 H new ATOM 0 HE21 GLN C 13 12.838 -20.753 -2.641 1.00 0.64 H new ATOM 0 HE22 GLN C 13 11.155 -21.180 -2.967 1.00 0.64 H new ATOM 4283 N GLN C 14 15.586 -20.126 -7.761 1.00 0.22 N ATOM 4284 CA GLN C 14 16.465 -18.925 -7.802 1.00 0.20 C ATOM 4285 C GLN C 14 15.737 -17.789 -8.522 1.00 0.22 C ATOM 4286 O GLN C 14 15.813 -16.643 -8.126 1.00 0.21 O ATOM 4287 CB GLN C 14 17.761 -19.254 -8.544 1.00 0.20 C ATOM 4288 CG GLN C 14 18.606 -20.204 -7.694 1.00 0.18 C ATOM 4289 CD GLN C 14 19.903 -20.533 -8.435 1.00 0.19 C ATOM 4290 OE1 GLN C 14 21.047 -20.316 -7.847 1.00 0.28 O flip ATOM 4291 NE2 GLN C 14 19.874 -20.987 -9.562 1.00 0.23 N flip ATOM 0 H GLN C 14 15.946 -20.947 -8.248 1.00 0.22 H new ATOM 0 HA GLN C 14 16.705 -18.619 -6.784 1.00 0.20 H new ATOM 0 HB2 GLN C 14 17.535 -19.713 -9.507 1.00 0.20 H new ATOM 0 HB3 GLN C 14 18.318 -18.340 -8.749 1.00 0.20 H new ATOM 0 HG2 GLN C 14 18.831 -19.745 -6.731 1.00 0.18 H new ATOM 0 HG3 GLN C 14 18.049 -21.119 -7.489 1.00 0.18 H new ATOM 0 HE21 GLN C 14 18.979 -21.156 -10.021 1.00 0.23 H new ATOM 0 HE22 GLN C 14 20.745 -21.199 -10.049 1.00 0.23 H new ATOM 4300 N GLN C 15 15.029 -18.096 -9.576 1.00 0.26 N ATOM 4301 CA GLN C 15 14.298 -17.026 -10.313 1.00 0.29 C ATOM 4302 C GLN C 15 13.299 -16.358 -9.371 1.00 0.28 C ATOM 4303 O GLN C 15 13.224 -15.148 -9.292 1.00 0.29 O ATOM 4304 CB GLN C 15 13.554 -17.641 -11.506 1.00 0.34 C ATOM 4305 CG GLN C 15 12.800 -16.547 -12.272 1.00 0.38 C ATOM 4306 CD GLN C 15 12.112 -17.162 -13.492 1.00 0.44 C ATOM 4307 OE1 GLN C 15 11.455 -18.179 -13.386 1.00 0.82 O ATOM 4308 NE2 GLN C 15 12.236 -16.583 -14.655 1.00 0.81 N ATOM 0 H GLN C 15 14.926 -19.037 -9.957 1.00 0.26 H new ATOM 0 HA GLN C 15 15.006 -16.282 -10.678 1.00 0.29 H new ATOM 0 HB2 GLN C 15 14.261 -18.139 -12.169 1.00 0.34 H new ATOM 0 HB3 GLN C 15 12.854 -18.401 -11.157 1.00 0.34 H new ATOM 0 HG2 GLN C 15 12.061 -16.077 -11.623 1.00 0.38 H new ATOM 0 HG3 GLN C 15 13.492 -15.765 -12.586 1.00 0.38 H new ATOM 0 HE21 GLN C 15 12.787 -15.729 -14.744 1.00 0.81 H new ATOM 0 HE22 GLN C 15 11.781 -16.984 -15.475 1.00 0.81 H new ATOM 4317 N GLN C 16 12.535 -17.130 -8.652 1.00 0.28 N ATOM 4318 CA GLN C 16 11.552 -16.525 -7.715 1.00 0.29 C ATOM 4319 C GLN C 16 12.300 -15.678 -6.685 1.00 0.25 C ATOM 4320 O GLN C 16 11.904 -14.574 -6.370 1.00 0.26 O ATOM 4321 CB GLN C 16 10.768 -17.633 -7.012 1.00 0.31 C ATOM 4322 CG GLN C 16 9.839 -18.310 -8.021 1.00 0.36 C ATOM 4323 CD GLN C 16 9.057 -19.429 -7.333 1.00 0.40 C ATOM 4324 OE1 GLN C 16 8.695 -20.405 -7.959 1.00 0.93 O ATOM 4325 NE2 GLN C 16 8.782 -19.333 -6.061 1.00 0.87 N ATOM 0 H GLN C 16 12.549 -18.150 -8.673 1.00 0.28 H new ATOM 0 HA GLN C 16 10.855 -15.893 -8.265 1.00 0.29 H new ATOM 0 HB2 GLN C 16 11.453 -18.364 -6.583 1.00 0.31 H new ATOM 0 HB3 GLN C 16 10.188 -17.218 -6.188 1.00 0.31 H new ATOM 0 HG2 GLN C 16 9.150 -17.578 -8.443 1.00 0.36 H new ATOM 0 HG3 GLN C 16 10.420 -18.716 -8.849 1.00 0.36 H new ATOM 0 HE21 GLN C 16 9.085 -18.514 -5.534 1.00 0.87 H new ATOM 0 HE22 GLN C 16 8.264 -20.077 -5.594 1.00 0.87 H new ATOM 4334 N LEU C 17 13.388 -16.181 -6.163 1.00 0.22 N ATOM 4335 CA LEU C 17 14.159 -15.391 -5.165 1.00 0.19 C ATOM 4336 C LEU C 17 14.647 -14.105 -5.832 1.00 0.18 C ATOM 4337 O LEU C 17 14.548 -13.028 -5.277 1.00 0.18 O ATOM 4338 CB LEU C 17 15.358 -16.208 -4.670 1.00 0.16 C ATOM 4339 CG LEU C 17 14.875 -17.393 -3.818 1.00 0.18 C ATOM 4340 CD1 LEU C 17 16.058 -18.327 -3.539 1.00 0.18 C ATOM 4341 CD2 LEU C 17 14.287 -16.900 -2.481 1.00 0.20 C ATOM 0 H LEU C 17 13.772 -17.099 -6.384 1.00 0.22 H new ATOM 0 HA LEU C 17 13.525 -15.149 -4.312 1.00 0.19 H new ATOM 0 HB2 LEU C 17 15.935 -16.573 -5.520 1.00 0.16 H new ATOM 0 HB3 LEU C 17 16.022 -15.574 -4.082 1.00 0.16 H new ATOM 0 HG LEU C 17 14.097 -17.925 -4.365 1.00 0.18 H new ATOM 0 HD11 LEU C 17 15.722 -19.170 -2.935 1.00 0.18 H new ATOM 0 HD12 LEU C 17 16.461 -18.695 -4.482 1.00 0.18 H new ATOM 0 HD13 LEU C 17 16.833 -17.781 -3.001 1.00 0.18 H new ATOM 0 HD21 LEU C 17 13.951 -17.755 -1.894 1.00 0.20 H new ATOM 0 HD22 LEU C 17 15.051 -16.356 -1.926 1.00 0.20 H new ATOM 0 HD23 LEU C 17 13.442 -16.240 -2.677 1.00 0.20 H new ATOM 4353 N LEU C 18 15.161 -14.209 -7.028 1.00 0.19 N ATOM 4354 CA LEU C 18 15.638 -12.992 -7.739 1.00 0.20 C ATOM 4355 C LEU C 18 14.468 -12.025 -7.917 1.00 0.22 C ATOM 4356 O LEU C 18 14.597 -10.835 -7.710 1.00 0.23 O ATOM 4357 CB LEU C 18 16.204 -13.387 -9.110 1.00 0.22 C ATOM 4358 CG LEU C 18 16.703 -12.145 -9.871 1.00 0.25 C ATOM 4359 CD1 LEU C 18 17.822 -11.447 -9.082 1.00 0.26 C ATOM 4360 CD2 LEU C 18 17.236 -12.584 -11.241 1.00 0.29 C ATOM 0 H LEU C 18 15.270 -15.084 -7.541 1.00 0.19 H new ATOM 0 HA LEU C 18 16.423 -12.508 -7.157 1.00 0.20 H new ATOM 0 HB2 LEU C 18 17.023 -14.094 -8.981 1.00 0.22 H new ATOM 0 HB3 LEU C 18 15.435 -13.893 -9.694 1.00 0.22 H new ATOM 0 HG LEU C 18 15.878 -11.444 -9.997 1.00 0.25 H new ATOM 0 HD11 LEU C 18 18.164 -10.571 -9.633 1.00 0.26 H new ATOM 0 HD12 LEU C 18 17.442 -11.138 -8.108 1.00 0.26 H new ATOM 0 HD13 LEU C 18 18.655 -12.137 -8.944 1.00 0.26 H new ATOM 0 HD21 LEU C 18 17.592 -11.712 -11.789 1.00 0.29 H new ATOM 0 HD22 LEU C 18 18.058 -13.287 -11.104 1.00 0.29 H new ATOM 0 HD23 LEU C 18 16.437 -13.066 -11.805 1.00 0.29 H new ATOM 4372 N ASP C 19 13.323 -12.524 -8.307 1.00 0.25 N ATOM 4373 CA ASP C 19 12.158 -11.620 -8.502 1.00 0.28 C ATOM 4374 C ASP C 19 11.842 -10.924 -7.179 1.00 0.27 C ATOM 4375 O ASP C 19 11.714 -9.719 -7.121 1.00 0.28 O ATOM 4376 CB ASP C 19 10.944 -12.440 -8.956 1.00 0.32 C ATOM 4377 CG ASP C 19 9.738 -11.516 -9.166 1.00 0.36 C ATOM 4378 OD1 ASP C 19 9.725 -10.440 -8.593 1.00 1.12 O ATOM 4379 OD2 ASP C 19 8.847 -11.902 -9.905 1.00 1.13 O ATOM 0 H ASP C 19 13.148 -13.511 -8.497 1.00 0.25 H new ATOM 0 HA ASP C 19 12.391 -10.875 -9.262 1.00 0.28 H new ATOM 0 HB2 ASP C 19 11.176 -12.966 -9.882 1.00 0.32 H new ATOM 0 HB3 ASP C 19 10.707 -13.198 -8.210 1.00 0.32 H new ATOM 4384 N VAL C 20 11.729 -11.665 -6.111 1.00 0.25 N ATOM 4385 CA VAL C 20 11.434 -11.023 -4.802 1.00 0.24 C ATOM 4386 C VAL C 20 12.551 -10.037 -4.459 1.00 0.21 C ATOM 4387 O VAL C 20 12.300 -8.931 -4.028 1.00 0.23 O ATOM 4388 CB VAL C 20 11.319 -12.089 -3.706 1.00 0.24 C ATOM 4389 CG1 VAL C 20 11.264 -11.410 -2.330 1.00 0.24 C ATOM 4390 CG2 VAL C 20 10.036 -12.897 -3.922 1.00 0.30 C ATOM 0 H VAL C 20 11.828 -12.680 -6.089 1.00 0.25 H new ATOM 0 HA VAL C 20 10.486 -10.488 -4.868 1.00 0.24 H new ATOM 0 HB VAL C 20 12.185 -12.750 -3.750 1.00 0.24 H new ATOM 0 HG11 VAL C 20 11.182 -12.170 -1.552 1.00 0.24 H new ATOM 0 HG12 VAL C 20 12.173 -10.828 -2.175 1.00 0.24 H new ATOM 0 HG13 VAL C 20 10.398 -10.750 -2.285 1.00 0.24 H new ATOM 0 HG21 VAL C 20 9.949 -13.657 -3.145 1.00 0.30 H new ATOM 0 HG22 VAL C 20 9.174 -12.231 -3.876 1.00 0.30 H new ATOM 0 HG23 VAL C 20 10.070 -13.379 -4.899 1.00 0.30 H new ATOM 4400 N VAL C 21 13.786 -10.422 -4.648 1.00 0.18 N ATOM 4401 CA VAL C 21 14.897 -9.488 -4.323 1.00 0.18 C ATOM 4402 C VAL C 21 14.741 -8.229 -5.180 1.00 0.22 C ATOM 4403 O VAL C 21 14.874 -7.120 -4.696 1.00 0.21 O ATOM 4404 CB VAL C 21 16.244 -10.167 -4.606 1.00 0.17 C ATOM 4405 CG1 VAL C 21 17.379 -9.147 -4.480 1.00 0.21 C ATOM 4406 CG2 VAL C 21 16.466 -11.294 -3.592 1.00 0.15 C ATOM 0 H VAL C 21 14.069 -11.333 -5.009 1.00 0.18 H new ATOM 0 HA VAL C 21 14.865 -9.216 -3.268 1.00 0.18 H new ATOM 0 HB VAL C 21 16.235 -10.573 -5.617 1.00 0.17 H new ATOM 0 HG11 VAL C 21 18.332 -9.636 -4.682 1.00 0.21 H new ATOM 0 HG12 VAL C 21 17.225 -8.341 -5.198 1.00 0.21 H new ATOM 0 HG13 VAL C 21 17.389 -8.737 -3.470 1.00 0.21 H new ATOM 0 HG21 VAL C 21 17.422 -11.779 -3.790 1.00 0.15 H new ATOM 0 HG22 VAL C 21 16.471 -10.880 -2.584 1.00 0.15 H new ATOM 0 HG23 VAL C 21 15.663 -12.026 -3.680 1.00 0.15 H new ATOM 4416 N LYS C 22 14.441 -8.386 -6.445 1.00 0.28 N ATOM 4417 CA LYS C 22 14.252 -7.189 -7.315 1.00 0.33 C ATOM 4418 C LYS C 22 13.099 -6.359 -6.753 1.00 0.32 C ATOM 4419 O LYS C 22 13.168 -5.148 -6.672 1.00 0.33 O ATOM 4420 CB LYS C 22 13.911 -7.635 -8.741 1.00 0.39 C ATOM 4421 CG LYS C 22 13.838 -6.412 -9.661 1.00 0.46 C ATOM 4422 CD LYS C 22 13.497 -6.864 -11.084 1.00 0.75 C ATOM 4423 CE LYS C 22 13.401 -5.646 -12.007 1.00 1.12 C ATOM 4424 NZ LYS C 22 13.274 -6.103 -13.420 1.00 1.91 N ATOM 0 H LYS C 22 14.320 -9.286 -6.909 1.00 0.28 H new ATOM 0 HA LYS C 22 15.167 -6.597 -7.337 1.00 0.33 H new ATOM 0 HB2 LYS C 22 14.666 -8.331 -9.105 1.00 0.39 H new ATOM 0 HB3 LYS C 22 12.959 -8.165 -8.749 1.00 0.39 H new ATOM 0 HG2 LYS C 22 13.082 -5.715 -9.298 1.00 0.46 H new ATOM 0 HG3 LYS C 22 14.790 -5.881 -9.655 1.00 0.46 H new ATOM 0 HD2 LYS C 22 14.261 -7.550 -11.450 1.00 0.75 H new ATOM 0 HD3 LYS C 22 12.553 -7.408 -11.086 1.00 0.75 H new ATOM 0 HE2 LYS C 22 12.541 -5.035 -11.732 1.00 1.12 H new ATOM 0 HE3 LYS C 22 14.286 -5.020 -11.894 1.00 1.12 H new ATOM 0 HZ1 LYS C 22 13.871 -5.510 -14.032 1.00 1.91 H new ATOM 0 HZ2 LYS C 22 13.580 -7.094 -13.493 1.00 1.91 H new ATOM 0 HZ3 LYS C 22 12.282 -6.024 -13.723 1.00 1.91 H new ATOM 4438 N ARG C 23 12.037 -7.010 -6.349 1.00 0.33 N ATOM 4439 CA ARG C 23 10.879 -6.269 -5.776 1.00 0.34 C ATOM 4440 C ARG C 23 11.321 -5.570 -4.492 1.00 0.29 C ATOM 4441 O ARG C 23 10.951 -4.442 -4.232 1.00 0.29 O ATOM 4442 CB ARG C 23 9.745 -7.252 -5.471 1.00 0.39 C ATOM 4443 CG ARG C 23 9.146 -7.765 -6.781 1.00 0.59 C ATOM 4444 CD ARG C 23 8.014 -8.745 -6.473 1.00 0.93 C ATOM 4445 NE ARG C 23 7.611 -9.471 -7.725 1.00 0.81 N ATOM 4446 CZ ARG C 23 7.217 -8.830 -8.794 1.00 1.05 C ATOM 4447 NH1 ARG C 23 6.977 -7.549 -8.749 1.00 1.68 N ATOM 4448 NH2 ARG C 23 7.012 -9.486 -9.904 1.00 1.08 N ATOM 0 H ARG C 23 11.925 -8.023 -6.392 1.00 0.33 H new ATOM 0 HA ARG C 23 10.523 -5.526 -6.490 1.00 0.34 H new ATOM 0 HB2 ARG C 23 10.122 -8.087 -4.880 1.00 0.39 H new ATOM 0 HB3 ARG C 23 8.975 -6.762 -4.875 1.00 0.39 H new ATOM 0 HG2 ARG C 23 8.769 -6.931 -7.372 1.00 0.59 H new ATOM 0 HG3 ARG C 23 9.915 -8.256 -7.377 1.00 0.59 H new ATOM 0 HD2 ARG C 23 8.336 -9.460 -5.716 1.00 0.93 H new ATOM 0 HD3 ARG C 23 7.159 -8.209 -6.062 1.00 0.93 H new ATOM 0 HE ARG C 23 7.646 -10.490 -7.741 1.00 0.81 H new ATOM 0 HH11 ARG C 23 7.096 -7.038 -7.874 1.00 1.68 H new ATOM 0 HH12 ARG C 23 6.670 -7.058 -9.589 1.00 1.68 H new ATOM 0 HH21 ARG C 23 7.159 -10.495 -9.935 1.00 1.08 H new ATOM 0 HH22 ARG C 23 6.705 -8.990 -10.740 1.00 1.08 H new ATOM 4462 N GLN C 24 12.125 -6.221 -3.692 1.00 0.24 N ATOM 4463 CA GLN C 24 12.595 -5.570 -2.441 1.00 0.19 C ATOM 4464 C GLN C 24 13.360 -4.296 -2.802 1.00 0.19 C ATOM 4465 O GLN C 24 13.222 -3.277 -2.158 1.00 0.19 O ATOM 4466 CB GLN C 24 13.501 -6.526 -1.659 1.00 0.16 C ATOM 4467 CG GLN C 24 12.650 -7.651 -1.063 1.00 0.17 C ATOM 4468 CD GLN C 24 13.554 -8.672 -0.372 1.00 0.17 C ATOM 4469 OE1 GLN C 24 14.649 -8.939 -0.827 1.00 0.19 O ATOM 4470 NE2 GLN C 24 13.138 -9.259 0.718 1.00 0.18 N ATOM 0 H GLN C 24 12.472 -7.167 -3.852 1.00 0.24 H new ATOM 0 HA GLN C 24 11.739 -5.317 -1.815 1.00 0.19 H new ATOM 0 HB2 GLN C 24 14.265 -6.941 -2.316 1.00 0.16 H new ATOM 0 HB3 GLN C 24 14.020 -5.987 -0.866 1.00 0.16 H new ATOM 0 HG2 GLN C 24 11.937 -7.241 -0.348 1.00 0.17 H new ATOM 0 HG3 GLN C 24 12.071 -8.137 -1.848 1.00 0.17 H new ATOM 0 HE21 GLN C 24 12.219 -9.034 1.099 1.00 0.18 H new ATOM 0 HE22 GLN C 24 13.732 -9.942 1.188 1.00 0.18 H new ATOM 4479 N GLN C 25 14.151 -4.340 -3.840 1.00 0.21 N ATOM 4480 CA GLN C 25 14.906 -3.121 -4.245 1.00 0.23 C ATOM 4481 C GLN C 25 13.919 -2.000 -4.574 1.00 0.25 C ATOM 4482 O GLN C 25 14.043 -0.893 -4.090 1.00 0.25 O ATOM 4483 CB GLN C 25 15.767 -3.440 -5.476 1.00 0.28 C ATOM 4484 CG GLN C 25 16.524 -2.187 -5.940 1.00 0.32 C ATOM 4485 CD GLN C 25 17.411 -1.659 -4.809 1.00 0.34 C ATOM 4486 OE1 GLN C 25 18.687 -1.929 -4.816 1.00 1.06 O flip ATOM 4487 NE2 GLN C 25 16.938 -0.988 -3.913 1.00 1.13 N flip ATOM 0 H GLN C 25 14.306 -5.163 -4.422 1.00 0.21 H new ATOM 0 HA GLN C 25 15.554 -2.800 -3.429 1.00 0.23 H new ATOM 0 HB2 GLN C 25 16.476 -4.233 -5.236 1.00 0.28 H new ATOM 0 HB3 GLN C 25 15.135 -3.811 -6.283 1.00 0.28 H new ATOM 0 HG2 GLN C 25 17.135 -2.423 -6.811 1.00 0.32 H new ATOM 0 HG3 GLN C 25 15.816 -1.417 -6.247 1.00 0.32 H new ATOM 0 HE21 GLN C 25 15.940 -0.776 -3.907 1.00 1.13 H new ATOM 0 HE22 GLN C 25 17.539 -0.637 -3.167 1.00 1.13 H new ATOM 4496 N GLU C 26 12.937 -2.273 -5.389 1.00 0.27 N ATOM 4497 CA GLU C 26 11.948 -1.213 -5.735 1.00 0.29 C ATOM 4498 C GLU C 26 11.213 -0.787 -4.465 1.00 0.26 C ATOM 4499 O GLU C 26 10.986 0.381 -4.222 1.00 0.26 O ATOM 4500 CB GLU C 26 10.942 -1.767 -6.744 1.00 0.34 C ATOM 4501 CG GLU C 26 11.643 -1.988 -8.085 1.00 0.54 C ATOM 4502 CD GLU C 26 10.643 -2.542 -9.100 1.00 1.19 C ATOM 4503 OE1 GLU C 26 9.526 -2.835 -8.704 1.00 1.85 O ATOM 4504 OE2 GLU C 26 11.011 -2.669 -10.256 1.00 1.94 O ATOM 0 H GLU C 26 12.777 -3.180 -5.828 1.00 0.27 H new ATOM 0 HA GLU C 26 12.461 -0.355 -6.170 1.00 0.29 H new ATOM 0 HB2 GLU C 26 10.523 -2.705 -6.380 1.00 0.34 H new ATOM 0 HB3 GLU C 26 10.111 -1.073 -6.865 1.00 0.34 H new ATOM 0 HG2 GLU C 26 12.062 -1.049 -8.447 1.00 0.54 H new ATOM 0 HG3 GLU C 26 12.475 -2.682 -7.962 1.00 0.54 H new ATOM 4511 N LEU C 27 10.856 -1.737 -3.647 1.00 0.24 N ATOM 4512 CA LEU C 27 10.151 -1.417 -2.375 1.00 0.22 C ATOM 4513 C LEU C 27 11.089 -0.618 -1.474 1.00 0.19 C ATOM 4514 O LEU C 27 10.689 0.321 -0.816 1.00 0.20 O ATOM 4515 CB LEU C 27 9.739 -2.719 -1.689 1.00 0.22 C ATOM 4516 CG LEU C 27 9.155 -2.441 -0.298 1.00 0.22 C ATOM 4517 CD1 LEU C 27 8.042 -1.392 -0.388 1.00 0.25 C ATOM 4518 CD2 LEU C 27 8.581 -3.746 0.272 1.00 0.23 C ATOM 0 H LEU C 27 11.024 -2.730 -3.807 1.00 0.24 H new ATOM 0 HA LEU C 27 9.259 -0.824 -2.577 1.00 0.22 H new ATOM 0 HB2 LEU C 27 9.002 -3.240 -2.300 1.00 0.22 H new ATOM 0 HB3 LEU C 27 10.603 -3.378 -1.601 1.00 0.22 H new ATOM 0 HG LEU C 27 9.943 -2.062 0.353 1.00 0.22 H new ATOM 0 HD11 LEU C 27 7.637 -1.205 0.607 1.00 0.25 H new ATOM 0 HD12 LEU C 27 8.447 -0.466 -0.795 1.00 0.25 H new ATOM 0 HD13 LEU C 27 7.249 -1.758 -1.040 1.00 0.25 H new ATOM 0 HD21 LEU C 27 8.163 -3.558 1.261 1.00 0.23 H new ATOM 0 HD22 LEU C 27 7.797 -4.118 -0.388 1.00 0.23 H new ATOM 0 HD23 LEU C 27 9.374 -4.490 0.348 1.00 0.23 H new ATOM 4530 N LEU C 28 12.340 -0.985 -1.446 1.00 0.18 N ATOM 4531 CA LEU C 28 13.310 -0.248 -0.595 1.00 0.18 C ATOM 4532 C LEU C 28 13.346 1.207 -1.050 1.00 0.20 C ATOM 4533 O LEU C 28 13.396 2.117 -0.247 1.00 0.20 O ATOM 4534 CB LEU C 28 14.700 -0.888 -0.756 1.00 0.18 C ATOM 4535 CG LEU C 28 14.786 -2.183 0.078 1.00 0.18 C ATOM 4536 CD1 LEU C 28 15.904 -3.093 -0.464 1.00 0.21 C ATOM 4537 CD2 LEU C 28 15.089 -1.843 1.547 1.00 0.21 C ATOM 0 H LEU C 28 12.731 -1.764 -1.976 1.00 0.18 H new ATOM 0 HA LEU C 28 13.015 -0.293 0.453 1.00 0.18 H new ATOM 0 HB2 LEU C 28 14.888 -1.109 -1.807 1.00 0.18 H new ATOM 0 HB3 LEU C 28 15.471 -0.188 -0.435 1.00 0.18 H new ATOM 0 HG LEU C 28 13.829 -2.701 0.009 1.00 0.18 H new ATOM 0 HD11 LEU C 28 15.954 -4.003 0.133 1.00 0.21 H new ATOM 0 HD12 LEU C 28 15.692 -3.351 -1.502 1.00 0.21 H new ATOM 0 HD13 LEU C 28 16.858 -2.570 -0.408 1.00 0.21 H new ATOM 0 HD21 LEU C 28 15.148 -2.763 2.129 1.00 0.21 H new ATOM 0 HD22 LEU C 28 16.039 -1.313 1.609 1.00 0.21 H new ATOM 0 HD23 LEU C 28 14.295 -1.212 1.946 1.00 0.21 H new ATOM 4549 N ARG C 29 13.302 1.439 -2.331 1.00 0.22 N ATOM 4550 CA ARG C 29 13.311 2.841 -2.821 1.00 0.24 C ATOM 4551 C ARG C 29 12.083 3.580 -2.281 1.00 0.24 C ATOM 4552 O ARG C 29 12.160 4.732 -1.903 1.00 0.24 O ATOM 4553 CB ARG C 29 13.275 2.854 -4.349 1.00 0.28 C ATOM 4554 CG ARG C 29 14.607 2.344 -4.899 1.00 0.29 C ATOM 4555 CD ARG C 29 14.569 2.381 -6.427 1.00 0.33 C ATOM 4556 NE ARG C 29 15.772 1.692 -6.972 1.00 0.38 N ATOM 4557 CZ ARG C 29 15.805 1.339 -8.226 1.00 0.88 C ATOM 4558 NH1 ARG C 29 14.789 1.601 -9.004 1.00 1.82 N ATOM 4559 NH2 ARG C 29 16.856 0.730 -8.705 1.00 0.86 N ATOM 0 H ARG C 29 13.260 0.722 -3.055 1.00 0.22 H new ATOM 0 HA ARG C 29 14.219 3.335 -2.475 1.00 0.24 H new ATOM 0 HB2 ARG C 29 12.458 2.228 -4.709 1.00 0.28 H new ATOM 0 HB3 ARG C 29 13.085 3.865 -4.710 1.00 0.28 H new ATOM 0 HG2 ARG C 29 15.426 2.960 -4.529 1.00 0.29 H new ATOM 0 HG3 ARG C 29 14.791 1.327 -4.553 1.00 0.29 H new ATOM 0 HD2 ARG C 29 13.663 1.896 -6.790 1.00 0.33 H new ATOM 0 HD3 ARG C 29 14.539 3.413 -6.776 1.00 0.33 H new ATOM 0 HE ARG C 29 16.568 1.497 -6.365 1.00 0.38 H new ATOM 0 HH11 ARG C 29 13.971 2.082 -8.630 1.00 1.82 H new ATOM 0 HH12 ARG C 29 14.814 1.325 -9.986 1.00 1.82 H new ATOM 0 HH21 ARG C 29 17.651 0.531 -8.098 1.00 0.86 H new ATOM 0 HH22 ARG C 29 16.882 0.454 -9.686 1.00 0.86 H new ATOM 4573 N LEU C 30 10.946 2.931 -2.245 1.00 0.23 N ATOM 4574 CA LEU C 30 9.719 3.612 -1.735 1.00 0.23 C ATOM 4575 C LEU C 30 9.926 4.038 -0.277 1.00 0.21 C ATOM 4576 O LEU C 30 9.531 5.114 0.122 1.00 0.22 O ATOM 4577 CB LEU C 30 8.520 2.655 -1.797 1.00 0.24 C ATOM 4578 CG LEU C 30 8.257 2.201 -3.237 1.00 0.27 C ATOM 4579 CD1 LEU C 30 7.067 1.236 -3.242 1.00 0.29 C ATOM 4580 CD2 LEU C 30 7.944 3.413 -4.133 1.00 0.34 C ATOM 0 H LEU C 30 10.816 1.965 -2.545 1.00 0.23 H new ATOM 0 HA LEU C 30 9.527 4.487 -2.356 1.00 0.23 H new ATOM 0 HB2 LEU C 30 8.710 1.786 -1.166 1.00 0.24 H new ATOM 0 HB3 LEU C 30 7.634 3.150 -1.400 1.00 0.24 H new ATOM 0 HG LEU C 30 9.145 1.703 -3.626 1.00 0.27 H new ATOM 0 HD11 LEU C 30 6.870 0.906 -4.262 1.00 0.29 H new ATOM 0 HD12 LEU C 30 7.297 0.372 -2.619 1.00 0.29 H new ATOM 0 HD13 LEU C 30 6.186 1.743 -2.848 1.00 0.29 H new ATOM 0 HD21 LEU C 30 7.760 3.074 -5.152 1.00 0.34 H new ATOM 0 HD22 LEU C 30 7.059 3.926 -3.756 1.00 0.34 H new ATOM 0 HD23 LEU C 30 8.791 4.099 -4.126 1.00 0.34 H new ATOM 4592 N THR C 31 10.535 3.204 0.524 1.00 0.19 N ATOM 4593 CA THR C 31 10.748 3.578 1.951 1.00 0.18 C ATOM 4594 C THR C 31 11.678 4.785 2.028 1.00 0.18 C ATOM 4595 O THR C 31 11.479 5.690 2.814 1.00 0.18 O ATOM 4596 CB THR C 31 11.382 2.403 2.700 1.00 0.17 C ATOM 4597 OG1 THR C 31 12.615 2.064 2.082 1.00 0.18 O ATOM 4598 CG2 THR C 31 10.438 1.199 2.665 1.00 0.19 C ATOM 0 H THR C 31 10.891 2.287 0.254 1.00 0.19 H new ATOM 0 HA THR C 31 9.789 3.826 2.406 1.00 0.18 H new ATOM 0 HB THR C 31 11.560 2.685 3.738 1.00 0.17 H new ATOM 0 HG1 THR C 31 12.556 2.234 1.119 1.00 0.18 H new ATOM 0 HG21 THR C 31 10.893 0.365 3.199 1.00 0.19 H new ATOM 0 HG22 THR C 31 9.494 1.463 3.141 1.00 0.19 H new ATOM 0 HG23 THR C 31 10.254 0.911 1.630 1.00 0.19 H new ATOM 4606 N VAL C 32 12.688 4.814 1.205 1.00 0.18 N ATOM 4607 CA VAL C 32 13.624 5.968 1.218 1.00 0.19 C ATOM 4608 C VAL C 32 12.853 7.221 0.808 1.00 0.20 C ATOM 4609 O VAL C 32 13.028 8.288 1.361 1.00 0.21 O ATOM 4610 CB VAL C 32 14.751 5.697 0.216 1.00 0.22 C ATOM 4611 CG1 VAL C 32 15.657 6.926 0.105 1.00 0.23 C ATOM 4612 CG2 VAL C 32 15.571 4.488 0.682 1.00 0.22 C ATOM 0 H VAL C 32 12.905 4.087 0.524 1.00 0.18 H new ATOM 0 HA VAL C 32 14.050 6.110 2.211 1.00 0.19 H new ATOM 0 HB VAL C 32 14.319 5.486 -0.762 1.00 0.22 H new ATOM 0 HG11 VAL C 32 16.456 6.726 -0.609 1.00 0.23 H new ATOM 0 HG12 VAL C 32 15.072 7.780 -0.235 1.00 0.23 H new ATOM 0 HG13 VAL C 32 16.090 7.148 1.080 1.00 0.23 H new ATOM 0 HG21 VAL C 32 16.373 4.295 -0.031 1.00 0.22 H new ATOM 0 HG22 VAL C 32 16.000 4.695 1.663 1.00 0.22 H new ATOM 0 HG23 VAL C 32 14.925 3.613 0.746 1.00 0.22 H new ATOM 4622 N TRP C 33 11.994 7.085 -0.163 1.00 0.21 N ATOM 4623 CA TRP C 33 11.189 8.245 -0.632 1.00 0.23 C ATOM 4624 C TRP C 33 10.336 8.794 0.515 1.00 0.23 C ATOM 4625 O TRP C 33 10.324 9.982 0.772 1.00 0.23 O ATOM 4626 CB TRP C 33 10.287 7.791 -1.780 1.00 0.25 C ATOM 4627 CG TRP C 33 9.461 8.941 -2.255 1.00 0.27 C ATOM 4628 CD1 TRP C 33 9.869 9.879 -3.141 1.00 0.32 C ATOM 4629 CD2 TRP C 33 8.094 9.287 -1.891 1.00 0.27 C ATOM 4630 NE1 TRP C 33 8.838 10.779 -3.344 1.00 0.34 N ATOM 4631 CE2 TRP C 33 7.722 10.456 -2.596 1.00 0.31 C ATOM 4632 CE3 TRP C 33 7.151 8.704 -1.027 1.00 0.26 C ATOM 4633 CZ2 TRP C 33 6.457 11.026 -2.447 1.00 0.32 C ATOM 4634 CZ3 TRP C 33 5.877 9.275 -0.874 1.00 0.29 C ATOM 4635 CH2 TRP C 33 5.530 10.434 -1.584 1.00 0.31 C ATOM 0 H TRP C 33 11.814 6.210 -0.656 1.00 0.21 H new ATOM 0 HA TRP C 33 11.856 9.035 -0.977 1.00 0.23 H new ATOM 0 HB2 TRP C 33 10.892 7.402 -2.599 1.00 0.25 H new ATOM 0 HB3 TRP C 33 9.640 6.979 -1.448 1.00 0.25 H new ATOM 0 HD1 TRP C 33 10.840 9.919 -3.612 1.00 0.32 H new ATOM 0 HE1 TRP C 33 8.895 11.583 -3.969 1.00 0.34 H new ATOM 0 HE3 TRP C 33 7.408 7.811 -0.477 1.00 0.26 H new ATOM 0 HZ2 TRP C 33 6.196 11.919 -2.995 1.00 0.32 H new ATOM 0 HZ3 TRP C 33 5.161 8.819 -0.206 1.00 0.29 H new ATOM 0 HH2 TRP C 33 4.548 10.868 -1.464 1.00 0.31 H new ATOM 4646 N GLY C 34 9.611 7.951 1.204 1.00 0.22 N ATOM 4647 CA GLY C 34 8.765 8.450 2.317 1.00 0.23 C ATOM 4648 C GLY C 34 9.645 9.107 3.380 1.00 0.22 C ATOM 4649 O GLY C 34 9.419 10.230 3.773 1.00 0.23 O ATOM 0 H GLY C 34 9.571 6.945 1.042 1.00 0.22 H new ATOM 0 HA2 GLY C 34 8.037 9.168 1.939 1.00 0.23 H new ATOM 0 HA3 GLY C 34 8.202 7.626 2.756 1.00 0.23 H new ATOM 4653 N THR C 35 10.643 8.415 3.848 1.00 0.22 N ATOM 4654 CA THR C 35 11.526 9.000 4.895 1.00 0.24 C ATOM 4655 C THR C 35 12.187 10.277 4.370 1.00 0.24 C ATOM 4656 O THR C 35 12.175 11.307 5.020 1.00 0.24 O ATOM 4657 CB THR C 35 12.606 7.978 5.264 1.00 0.27 C ATOM 4658 OG1 THR C 35 11.988 6.799 5.758 1.00 0.30 O ATOM 4659 CG2 THR C 35 13.524 8.559 6.340 1.00 0.30 C ATOM 0 H THR C 35 10.887 7.470 3.552 1.00 0.22 H new ATOM 0 HA THR C 35 10.932 9.247 5.775 1.00 0.24 H new ATOM 0 HB THR C 35 13.196 7.741 4.378 1.00 0.27 H new ATOM 0 HG1 THR C 35 12.239 6.666 6.696 1.00 0.30 H new ATOM 0 HG21 THR C 35 14.290 7.828 6.598 1.00 0.30 H new ATOM 0 HG22 THR C 35 13.999 9.464 5.963 1.00 0.30 H new ATOM 0 HG23 THR C 35 12.938 8.799 7.227 1.00 0.30 H new ATOM 4667 N LYS C 36 12.769 10.224 3.205 1.00 0.25 N ATOM 4668 CA LYS C 36 13.434 11.437 2.656 1.00 0.28 C ATOM 4669 C LYS C 36 12.395 12.537 2.429 1.00 0.28 C ATOM 4670 O LYS C 36 12.637 13.698 2.694 1.00 0.30 O ATOM 4671 CB LYS C 36 14.112 11.084 1.333 1.00 0.32 C ATOM 4672 CG LYS C 36 15.036 12.227 0.921 1.00 0.47 C ATOM 4673 CD LYS C 36 15.740 11.867 -0.389 1.00 0.77 C ATOM 4674 CE LYS C 36 16.658 13.016 -0.808 1.00 1.44 C ATOM 4675 NZ LYS C 36 15.832 14.208 -1.145 1.00 2.00 N ATOM 0 H LYS C 36 12.813 9.396 2.611 1.00 0.25 H new ATOM 0 HA LYS C 36 14.182 11.796 3.363 1.00 0.28 H new ATOM 0 HB2 LYS C 36 14.681 10.160 1.438 1.00 0.32 H new ATOM 0 HB3 LYS C 36 13.362 10.911 0.561 1.00 0.32 H new ATOM 0 HG2 LYS C 36 14.463 13.146 0.798 1.00 0.47 H new ATOM 0 HG3 LYS C 36 15.772 12.413 1.703 1.00 0.47 H new ATOM 0 HD2 LYS C 36 16.319 10.952 -0.263 1.00 0.77 H new ATOM 0 HD3 LYS C 36 15.003 11.673 -1.169 1.00 0.77 H new ATOM 0 HE2 LYS C 36 17.351 13.256 -0.001 1.00 1.44 H new ATOM 0 HE3 LYS C 36 17.259 12.721 -1.668 1.00 1.44 H new ATOM 0 HZ1 LYS C 36 16.387 14.859 -1.737 1.00 2.00 H new ATOM 0 HZ2 LYS C 36 14.983 13.906 -1.664 1.00 2.00 H new ATOM 0 HZ3 LYS C 36 15.549 14.693 -0.270 1.00 2.00 H new ATOM 4689 N ASN C 37 11.234 12.180 1.948 1.00 0.27 N ATOM 4690 CA ASN C 37 10.176 13.202 1.713 1.00 0.30 C ATOM 4691 C ASN C 37 9.832 13.886 3.037 1.00 0.29 C ATOM 4692 O ASN C 37 9.628 15.082 3.099 1.00 0.33 O ATOM 4693 CB ASN C 37 8.930 12.531 1.144 1.00 0.32 C ATOM 4694 CG ASN C 37 7.861 13.594 0.877 1.00 0.37 C ATOM 4695 OD1 ASN C 37 6.650 13.414 1.324 1.00 0.74 O flip ATOM 4696 ND2 ASN C 37 8.135 14.600 0.254 1.00 0.48 N flip ATOM 0 H ASN C 37 10.974 11.224 1.708 1.00 0.27 H new ATOM 0 HA ASN C 37 10.539 13.944 1.002 1.00 0.30 H new ATOM 0 HB2 ASN C 37 9.175 12.005 0.221 1.00 0.32 H new ATOM 0 HB3 ASN C 37 8.552 11.786 1.844 1.00 0.32 H new ATOM 0 HD21 ASN C 37 9.083 14.741 -0.096 1.00 0.48 H new ATOM 0 HD22 ASN C 37 7.417 15.304 0.081 1.00 0.48 H new ATOM 4703 N LEU C 38 9.772 13.131 4.101 1.00 0.26 N ATOM 4704 CA LEU C 38 9.448 13.730 5.426 1.00 0.27 C ATOM 4705 C LEU C 38 10.497 14.776 5.773 1.00 0.26 C ATOM 4706 O LEU C 38 10.185 15.816 6.316 1.00 0.28 O ATOM 4707 CB LEU C 38 9.430 12.653 6.510 1.00 0.26 C ATOM 4708 CG LEU C 38 8.203 11.748 6.353 1.00 0.30 C ATOM 4709 CD1 LEU C 38 8.322 10.589 7.344 1.00 0.34 C ATOM 4710 CD2 LEU C 38 6.907 12.542 6.632 1.00 0.35 C ATOM 0 H LEU C 38 9.934 12.124 4.109 1.00 0.26 H new ATOM 0 HA LEU C 38 8.462 14.192 5.373 1.00 0.27 H new ATOM 0 HB2 LEU C 38 10.339 12.055 6.451 1.00 0.26 H new ATOM 0 HB3 LEU C 38 9.420 13.121 7.494 1.00 0.26 H new ATOM 0 HG LEU C 38 8.160 11.368 5.332 1.00 0.30 H new ATOM 0 HD11 LEU C 38 7.456 9.935 7.245 1.00 0.34 H new ATOM 0 HD12 LEU C 38 9.230 10.023 7.135 1.00 0.34 H new ATOM 0 HD13 LEU C 38 8.366 10.982 8.360 1.00 0.34 H new ATOM 0 HD21 LEU C 38 6.045 11.884 6.516 1.00 0.35 H new ATOM 0 HD22 LEU C 38 6.931 12.932 7.649 1.00 0.35 H new ATOM 0 HD23 LEU C 38 6.829 13.370 5.927 1.00 0.35 H new ATOM 4722 N GLN C 39 11.739 14.519 5.478 1.00 0.25 N ATOM 4723 CA GLN C 39 12.782 15.522 5.822 1.00 0.29 C ATOM 4724 C GLN C 39 12.456 16.827 5.096 1.00 0.33 C ATOM 4725 O GLN C 39 12.580 17.898 5.654 1.00 0.35 O ATOM 4726 CB GLN C 39 14.149 15.021 5.353 1.00 0.31 C ATOM 4727 CG GLN C 39 15.237 16.010 5.787 1.00 0.39 C ATOM 4728 CD GLN C 39 16.603 15.506 5.313 1.00 0.44 C ATOM 4729 OE1 GLN C 39 16.748 15.085 4.183 1.00 0.84 O ATOM 4730 NE2 GLN C 39 17.619 15.537 6.132 1.00 0.97 N ATOM 0 H GLN C 39 12.074 13.671 5.020 1.00 0.25 H new ATOM 0 HA GLN C 39 12.804 15.680 6.900 1.00 0.29 H new ATOM 0 HB2 GLN C 39 14.350 14.036 5.774 1.00 0.31 H new ATOM 0 HB3 GLN C 39 14.155 14.912 4.269 1.00 0.31 H new ATOM 0 HG2 GLN C 39 15.036 16.996 5.368 1.00 0.39 H new ATOM 0 HG3 GLN C 39 15.234 16.118 6.872 1.00 0.39 H new ATOM 0 HE21 GLN C 39 17.498 15.890 7.081 1.00 0.97 H new ATOM 0 HE22 GLN C 39 18.534 15.208 5.823 1.00 0.97 H new ATOM 4739 N THR C 40 12.012 16.759 3.868 1.00 0.36 N ATOM 4740 CA THR C 40 11.663 18.019 3.158 1.00 0.42 C ATOM 4741 C THR C 40 10.555 18.720 3.946 1.00 0.41 C ATOM 4742 O THR C 40 10.584 19.919 4.144 1.00 0.43 O ATOM 4743 CB THR C 40 11.181 17.704 1.740 1.00 0.47 C ATOM 4744 OG1 THR C 40 9.929 17.038 1.801 1.00 0.46 O ATOM 4745 CG2 THR C 40 12.208 16.809 1.044 1.00 0.49 C ATOM 0 H THR C 40 11.878 15.899 3.335 1.00 0.36 H new ATOM 0 HA THR C 40 12.538 18.665 3.086 1.00 0.42 H new ATOM 0 HB THR C 40 11.067 18.631 1.178 1.00 0.47 H new ATOM 0 HG1 THR C 40 10.003 16.254 2.385 1.00 0.46 H new ATOM 0 HG21 THR C 40 11.868 16.583 0.034 1.00 0.49 H new ATOM 0 HG22 THR C 40 13.167 17.324 0.997 1.00 0.49 H new ATOM 0 HG23 THR C 40 12.322 15.881 1.605 1.00 0.49 H new ATOM 4753 N ARG C 41 9.593 17.976 4.429 1.00 0.39 N ATOM 4754 CA ARG C 41 8.512 18.601 5.239 1.00 0.39 C ATOM 4755 C ARG C 41 9.123 19.162 6.512 1.00 0.35 C ATOM 4756 O ARG C 41 8.768 20.230 6.964 1.00 0.37 O ATOM 4757 CB ARG C 41 7.426 17.582 5.590 1.00 0.43 C ATOM 4758 CG ARG C 41 6.637 17.225 4.331 1.00 0.55 C ATOM 4759 CD ARG C 41 5.409 16.398 4.710 1.00 0.66 C ATOM 4760 NE ARG C 41 4.560 16.196 3.497 1.00 0.89 N ATOM 4761 CZ ARG C 41 4.052 17.207 2.848 1.00 1.04 C ATOM 4762 NH1 ARG C 41 4.088 18.408 3.353 1.00 1.22 N ATOM 4763 NH2 ARG C 41 3.457 17.007 1.715 1.00 1.32 N ATOM 0 H ARG C 41 9.512 16.968 4.297 1.00 0.39 H new ATOM 0 HA ARG C 41 8.047 19.397 4.658 1.00 0.39 H new ATOM 0 HB2 ARG C 41 7.877 16.686 6.016 1.00 0.43 H new ATOM 0 HB3 ARG C 41 6.758 17.993 6.347 1.00 0.43 H new ATOM 0 HG2 ARG C 41 6.330 18.133 3.813 1.00 0.55 H new ATOM 0 HG3 ARG C 41 7.268 16.663 3.642 1.00 0.55 H new ATOM 0 HD2 ARG C 41 5.716 15.435 5.118 1.00 0.66 H new ATOM 0 HD3 ARG C 41 4.839 16.907 5.487 1.00 0.66 H new ATOM 0 HE ARG C 41 4.374 15.248 3.170 1.00 0.89 H new ATOM 0 HH11 ARG C 41 4.517 18.565 4.265 1.00 1.22 H new ATOM 0 HH12 ARG C 41 3.687 19.191 2.836 1.00 1.22 H new ATOM 0 HH21 ARG C 41 3.388 16.063 1.335 1.00 1.32 H new ATOM 0 HH22 ARG C 41 3.058 17.794 1.203 1.00 1.32 H new ATOM 4777 N VAL C 42 10.047 18.452 7.101 1.00 0.33 N ATOM 4778 CA VAL C 42 10.665 18.967 8.345 1.00 0.35 C ATOM 4779 C VAL C 42 11.327 20.307 8.032 1.00 0.37 C ATOM 4780 O VAL C 42 11.158 21.264 8.754 1.00 0.40 O ATOM 4781 CB VAL C 42 11.709 17.970 8.862 1.00 0.37 C ATOM 4782 CG1 VAL C 42 12.517 18.609 9.994 1.00 0.43 C ATOM 4783 CG2 VAL C 42 10.997 16.728 9.402 1.00 0.37 C ATOM 0 H VAL C 42 10.394 17.550 6.776 1.00 0.33 H new ATOM 0 HA VAL C 42 9.905 19.098 9.116 1.00 0.35 H new ATOM 0 HB VAL C 42 12.377 17.694 8.046 1.00 0.37 H new ATOM 0 HG11 VAL C 42 13.258 17.898 10.359 1.00 0.43 H new ATOM 0 HG12 VAL C 42 13.022 19.500 9.622 1.00 0.43 H new ATOM 0 HG13 VAL C 42 11.847 18.885 10.808 1.00 0.43 H new ATOM 0 HG21 VAL C 42 11.736 16.016 9.771 1.00 0.37 H new ATOM 0 HG22 VAL C 42 10.332 17.015 10.216 1.00 0.37 H new ATOM 0 HG23 VAL C 42 10.415 16.266 8.604 1.00 0.37 H new ATOM 4793 N THR C 43 12.045 20.405 6.945 1.00 0.39 N ATOM 4794 CA THR C 43 12.675 21.713 6.606 1.00 0.45 C ATOM 4795 C THR C 43 11.569 22.755 6.447 1.00 0.44 C ATOM 4796 O THR C 43 11.695 23.882 6.883 1.00 0.47 O ATOM 4797 CB THR C 43 13.457 21.592 5.293 1.00 0.50 C ATOM 4798 OG1 THR C 43 12.577 21.192 4.252 1.00 0.50 O ATOM 4799 CG2 THR C 43 14.577 20.559 5.448 1.00 0.51 C ATOM 0 H THR C 43 12.221 19.647 6.285 1.00 0.39 H new ATOM 0 HA THR C 43 13.363 22.009 7.398 1.00 0.45 H new ATOM 0 HB THR C 43 13.896 22.558 5.045 1.00 0.50 H new ATOM 0 HG1 THR C 43 11.847 20.657 4.628 1.00 0.50 H new ATOM 0 HG21 THR C 43 15.129 20.478 4.512 1.00 0.51 H new ATOM 0 HG22 THR C 43 15.254 20.873 6.242 1.00 0.51 H new ATOM 0 HG23 THR C 43 14.146 19.590 5.701 1.00 0.51 H new ATOM 4807 N ALA C 44 10.475 22.379 5.841 1.00 0.41 N ATOM 4808 CA ALA C 44 9.349 23.343 5.672 1.00 0.43 C ATOM 4809 C ALA C 44 8.787 23.680 7.058 1.00 0.39 C ATOM 4810 O ALA C 44 8.481 24.816 7.359 1.00 0.39 O ATOM 4811 CB ALA C 44 8.255 22.710 4.801 1.00 0.45 C ATOM 0 H ALA C 44 10.312 21.448 5.456 1.00 0.41 H new ATOM 0 HA ALA C 44 9.701 24.252 5.184 1.00 0.43 H new ATOM 0 HB1 ALA C 44 7.433 23.416 4.679 1.00 0.45 H new ATOM 0 HB2 ALA C 44 8.667 22.460 3.823 1.00 0.45 H new ATOM 0 HB3 ALA C 44 7.886 21.804 5.281 1.00 0.45 H new ATOM 4817 N ILE C 45 8.685 22.694 7.910 1.00 0.35 N ATOM 4818 CA ILE C 45 8.184 22.925 9.298 1.00 0.32 C ATOM 4819 C ILE C 45 9.146 23.853 10.041 1.00 0.32 C ATOM 4820 O ILE C 45 8.732 24.712 10.795 1.00 0.31 O ATOM 4821 CB ILE C 45 8.059 21.589 10.040 1.00 0.31 C ATOM 4822 CG1 ILE C 45 6.896 20.788 9.445 1.00 0.32 C ATOM 4823 CG2 ILE C 45 7.801 21.833 11.530 1.00 0.30 C ATOM 4824 CD1 ILE C 45 6.914 19.350 9.977 1.00 0.33 C ATOM 0 H ILE C 45 8.931 21.726 7.701 1.00 0.35 H new ATOM 0 HA ILE C 45 7.200 23.392 9.253 1.00 0.32 H new ATOM 0 HB ILE C 45 8.989 21.031 9.929 1.00 0.31 H new ATOM 0 HG12 ILE C 45 5.949 21.265 9.699 1.00 0.32 H new ATOM 0 HG13 ILE C 45 6.968 20.782 8.357 1.00 0.32 H new ATOM 0 HG21 ILE C 45 7.714 20.877 12.046 1.00 0.30 H new ATOM 0 HG22 ILE C 45 8.629 22.400 11.955 1.00 0.30 H new ATOM 0 HG23 ILE C 45 6.876 22.396 11.652 1.00 0.30 H new ATOM 0 HD11 ILE C 45 6.082 18.792 9.546 1.00 0.33 H new ATOM 0 HD12 ILE C 45 7.854 18.872 9.701 1.00 0.33 H new ATOM 0 HD13 ILE C 45 6.819 19.363 11.063 1.00 0.33 H new ATOM 4836 N GLU C 46 10.426 23.680 9.851 1.00 0.35 N ATOM 4837 CA GLU C 46 11.396 24.550 10.570 1.00 0.36 C ATOM 4838 C GLU C 46 11.134 25.992 10.172 1.00 0.38 C ATOM 4839 O GLU C 46 11.149 26.890 10.990 1.00 0.38 O ATOM 4840 CB GLU C 46 12.826 24.177 10.166 1.00 0.44 C ATOM 4841 CG GLU C 46 13.199 22.810 10.743 1.00 1.20 C ATOM 4842 CD GLU C 46 14.629 22.455 10.330 1.00 1.67 C ATOM 4843 OE1 GLU C 46 15.172 23.155 9.491 1.00 2.17 O ATOM 4844 OE2 GLU C 46 15.154 21.487 10.855 1.00 2.26 O ATOM 0 H GLU C 46 10.838 22.980 9.234 1.00 0.35 H new ATOM 0 HA GLU C 46 11.280 24.420 11.646 1.00 0.36 H new ATOM 0 HB2 GLU C 46 12.911 24.157 9.080 1.00 0.44 H new ATOM 0 HB3 GLU C 46 13.523 24.934 10.526 1.00 0.44 H new ATOM 0 HG2 GLU C 46 13.117 22.827 11.830 1.00 1.20 H new ATOM 0 HG3 GLU C 46 12.506 22.050 10.383 1.00 1.20 H new ATOM 4851 N LYS C 47 10.870 26.217 8.924 1.00 0.41 N ATOM 4852 CA LYS C 47 10.580 27.593 8.464 1.00 0.43 C ATOM 4853 C LYS C 47 9.351 28.136 9.199 1.00 0.41 C ATOM 4854 O LYS C 47 9.350 29.248 9.691 1.00 0.42 O ATOM 4855 CB LYS C 47 10.336 27.559 6.953 1.00 0.48 C ATOM 4856 CG LYS C 47 9.916 28.937 6.435 1.00 1.21 C ATOM 4857 CD LYS C 47 11.007 29.972 6.729 1.00 1.54 C ATOM 4858 CE LYS C 47 10.790 31.208 5.856 1.00 2.30 C ATOM 4859 NZ LYS C 47 11.728 32.283 6.281 1.00 2.87 N ATOM 0 H LYS C 47 10.842 25.502 8.197 1.00 0.41 H new ATOM 0 HA LYS C 47 11.422 28.250 8.680 1.00 0.43 H new ATOM 0 HB2 LYS C 47 11.242 27.235 6.442 1.00 0.48 H new ATOM 0 HB3 LYS C 47 9.561 26.828 6.722 1.00 0.48 H new ATOM 0 HG2 LYS C 47 9.731 28.889 5.362 1.00 1.21 H new ATOM 0 HG3 LYS C 47 8.981 29.240 6.906 1.00 1.21 H new ATOM 0 HD2 LYS C 47 10.984 30.250 7.783 1.00 1.54 H new ATOM 0 HD3 LYS C 47 11.990 29.544 6.533 1.00 1.54 H new ATOM 0 HE2 LYS C 47 10.955 30.960 4.807 1.00 2.30 H new ATOM 0 HE3 LYS C 47 9.760 31.553 5.944 1.00 2.30 H new ATOM 0 HZ1 LYS C 47 11.582 33.125 5.688 1.00 2.87 H new ATOM 0 HZ2 LYS C 47 11.550 32.525 7.277 1.00 2.87 H new ATOM 0 HZ3 LYS C 47 12.708 31.951 6.175 1.00 2.87 H new ATOM 4873 N TYR C 48 8.298 27.367 9.263 1.00 0.38 N ATOM 4874 CA TYR C 48 7.067 27.847 9.951 1.00 0.36 C ATOM 4875 C TYR C 48 7.357 28.119 11.429 1.00 0.32 C ATOM 4876 O TYR C 48 6.891 29.089 11.992 1.00 0.32 O ATOM 4877 CB TYR C 48 5.968 26.784 9.822 1.00 0.37 C ATOM 4878 CG TYR C 48 5.354 26.861 8.441 1.00 0.40 C ATOM 4879 CD1 TYR C 48 4.572 27.967 8.094 1.00 0.45 C ATOM 4880 CD2 TYR C 48 5.571 25.836 7.510 1.00 0.41 C ATOM 4881 CE1 TYR C 48 4.004 28.052 6.819 1.00 0.50 C ATOM 4882 CE2 TYR C 48 5.004 25.921 6.233 1.00 0.46 C ATOM 4883 CZ TYR C 48 4.220 27.029 5.887 1.00 0.50 C ATOM 4884 OH TYR C 48 3.661 27.117 4.630 1.00 0.56 O ATOM 0 H TYR C 48 8.238 26.428 8.869 1.00 0.38 H new ATOM 0 HA TYR C 48 6.735 28.775 9.486 1.00 0.36 H new ATOM 0 HB2 TYR C 48 6.385 25.791 9.992 1.00 0.37 H new ATOM 0 HB3 TYR C 48 5.203 26.942 10.582 1.00 0.37 H new ATOM 0 HD1 TYR C 48 4.406 28.757 8.812 1.00 0.45 H new ATOM 0 HD2 TYR C 48 6.175 24.982 7.778 1.00 0.41 H new ATOM 0 HE1 TYR C 48 3.399 28.906 6.553 1.00 0.50 H new ATOM 0 HE2 TYR C 48 5.171 25.132 5.514 1.00 0.46 H new ATOM 0 HH TYR C 48 4.350 26.952 3.953 1.00 0.56 H new ATOM 4894 N LEU C 49 8.122 27.279 12.066 1.00 0.30 N ATOM 4895 CA LEU C 49 8.428 27.508 13.506 1.00 0.29 C ATOM 4896 C LEU C 49 9.143 28.862 13.656 1.00 0.32 C ATOM 4897 O LEU C 49 8.877 29.618 14.572 1.00 0.32 O ATOM 4898 CB LEU C 49 9.321 26.368 14.018 1.00 0.29 C ATOM 4899 CG LEU C 49 8.531 25.047 14.082 1.00 0.25 C ATOM 4900 CD1 LEU C 49 9.507 23.897 14.348 1.00 0.27 C ATOM 4901 CD2 LEU C 49 7.492 25.086 15.220 1.00 0.25 C ATOM 0 H LEU C 49 8.547 26.448 11.655 1.00 0.30 H new ATOM 0 HA LEU C 49 7.509 27.525 14.092 1.00 0.29 H new ATOM 0 HB2 LEU C 49 10.183 26.251 13.361 1.00 0.29 H new ATOM 0 HB3 LEU C 49 9.706 26.616 15.007 1.00 0.29 H new ATOM 0 HG LEU C 49 8.013 24.903 13.134 1.00 0.25 H new ATOM 0 HD11 LEU C 49 8.957 22.957 14.395 1.00 0.27 H new ATOM 0 HD12 LEU C 49 10.240 23.849 13.543 1.00 0.27 H new ATOM 0 HD13 LEU C 49 10.019 24.066 15.295 1.00 0.27 H new ATOM 0 HD21 LEU C 49 6.946 24.143 15.247 1.00 0.25 H new ATOM 0 HD22 LEU C 49 8.001 25.238 16.172 1.00 0.25 H new ATOM 0 HD23 LEU C 49 6.794 25.905 15.047 1.00 0.25 H new ATOM 4913 N LYS C 50 10.032 29.181 12.750 1.00 0.35 N ATOM 4914 CA LYS C 50 10.753 30.489 12.822 1.00 0.39 C ATOM 4915 C LYS C 50 9.735 31.637 12.755 1.00 0.39 C ATOM 4916 O LYS C 50 9.847 32.636 13.447 1.00 0.41 O ATOM 4917 CB LYS C 50 11.743 30.589 11.657 1.00 0.44 C ATOM 4918 CG LYS C 50 12.610 31.842 11.819 1.00 1.03 C ATOM 4919 CD LYS C 50 13.610 31.927 10.662 1.00 1.21 C ATOM 4920 CE LYS C 50 14.510 33.152 10.849 1.00 1.58 C ATOM 4921 NZ LYS C 50 15.701 33.031 9.960 1.00 2.18 N ATOM 0 H LYS C 50 10.291 28.590 11.960 1.00 0.35 H new ATOM 0 HA LYS C 50 11.303 30.557 13.761 1.00 0.39 H new ATOM 0 HB2 LYS C 50 12.374 29.701 11.626 1.00 0.44 H new ATOM 0 HB3 LYS C 50 11.203 30.629 10.711 1.00 0.44 H new ATOM 0 HG2 LYS C 50 11.981 32.732 11.836 1.00 1.03 H new ATOM 0 HG3 LYS C 50 13.141 31.809 12.770 1.00 1.03 H new ATOM 0 HD2 LYS C 50 14.215 31.021 10.624 1.00 1.21 H new ATOM 0 HD3 LYS C 50 13.078 31.995 9.713 1.00 1.21 H new ATOM 0 HE2 LYS C 50 13.958 34.062 10.614 1.00 1.58 H new ATOM 0 HE3 LYS C 50 14.825 33.230 11.889 1.00 1.58 H new ATOM 0 HZ1 LYS C 50 16.314 33.862 10.085 1.00 2.18 H new ATOM 0 HZ2 LYS C 50 16.231 32.170 10.205 1.00 2.18 H new ATOM 0 HZ3 LYS C 50 15.390 32.976 8.969 1.00 2.18 H new ATOM 4935 N ASP C 51 8.738 31.496 11.926 1.00 0.38 N ATOM 4936 CA ASP C 51 7.706 32.566 11.798 1.00 0.40 C ATOM 4937 C ASP C 51 7.040 32.768 13.159 1.00 0.38 C ATOM 4938 O ASP C 51 6.761 33.877 13.566 1.00 0.40 O ATOM 4939 CB ASP C 51 6.654 32.139 10.771 1.00 0.42 C ATOM 4940 CG ASP C 51 7.269 32.155 9.370 1.00 1.29 C ATOM 4941 OD1 ASP C 51 8.227 32.881 9.173 1.00 2.07 O ATOM 4942 OD2 ASP C 51 6.767 31.439 8.518 1.00 1.96 O ATOM 0 H ASP C 51 8.592 30.682 11.328 1.00 0.38 H new ATOM 0 HA ASP C 51 8.170 33.496 11.469 1.00 0.40 H new ATOM 0 HB2 ASP C 51 6.286 31.140 11.006 1.00 0.42 H new ATOM 0 HB3 ASP C 51 5.798 32.812 10.811 1.00 0.42 H new ATOM 4947 N GLN C 52 6.789 31.705 13.867 1.00 0.36 N ATOM 4948 CA GLN C 52 6.149 31.837 15.204 1.00 0.37 C ATOM 4949 C GLN C 52 7.053 32.692 16.103 1.00 0.38 C ATOM 4950 O GLN C 52 6.581 33.521 16.857 1.00 0.40 O ATOM 4951 CB GLN C 52 5.960 30.429 15.813 1.00 0.42 C ATOM 4952 CG GLN C 52 4.518 29.949 15.605 1.00 1.31 C ATOM 4953 CD GLN C 52 4.121 30.122 14.136 1.00 2.37 C ATOM 4954 OE1 GLN C 52 5.027 30.001 13.208 1.00 3.28 O flip ATOM 4955 NE2 GLN C 52 2.970 30.370 13.832 1.00 2.59 N flip ATOM 0 H GLN C 52 6.999 30.750 13.578 1.00 0.36 H new ATOM 0 HA GLN C 52 5.175 32.318 15.116 1.00 0.37 H new ATOM 0 HB2 GLN C 52 6.654 29.728 15.349 1.00 0.42 H new ATOM 0 HB3 GLN C 52 6.193 30.451 16.878 1.00 0.42 H new ATOM 0 HG2 GLN C 52 4.428 28.902 15.895 1.00 1.31 H new ATOM 0 HG3 GLN C 52 3.841 30.516 16.244 1.00 1.31 H new ATOM 0 HE21 GLN C 52 2.260 30.465 14.558 1.00 2.59 H new ATOM 0 HE22 GLN C 52 2.715 30.483 12.851 1.00 2.59 H new ATOM 4964 N ALA C 53 8.340 32.507 16.029 1.00 0.39 N ATOM 4965 CA ALA C 53 9.253 33.319 16.876 1.00 0.45 C ATOM 4966 C ALA C 53 9.019 34.799 16.591 1.00 0.47 C ATOM 4967 O ALA C 53 9.116 35.635 17.468 1.00 0.53 O ATOM 4968 CB ALA C 53 10.699 32.980 16.537 1.00 0.50 C ATOM 0 H ALA C 53 8.798 31.830 15.419 1.00 0.39 H new ATOM 0 HA ALA C 53 9.058 33.103 17.926 1.00 0.45 H new ATOM 0 HB1 ALA C 53 11.368 33.576 17.158 1.00 0.50 H new ATOM 0 HB2 ALA C 53 10.878 31.921 16.723 1.00 0.50 H new ATOM 0 HB3 ALA C 53 10.888 33.200 15.486 1.00 0.50 H new ATOM 4974 N GLN C 54 8.725 35.134 15.366 1.00 0.45 N ATOM 4975 CA GLN C 54 8.503 36.567 15.022 1.00 0.50 C ATOM 4976 C GLN C 54 7.340 37.117 15.854 1.00 0.55 C ATOM 4977 O GLN C 54 7.385 38.235 16.328 1.00 0.62 O ATOM 4978 CB GLN C 54 8.177 36.691 13.531 1.00 0.51 C ATOM 4979 CG GLN C 54 8.050 38.168 13.150 1.00 0.58 C ATOM 4980 CD GLN C 54 7.728 38.286 11.660 1.00 0.62 C ATOM 4981 OE1 GLN C 54 6.815 37.650 11.171 1.00 0.97 O ATOM 4982 NE2 GLN C 54 8.448 39.075 10.909 1.00 1.03 N ATOM 0 H GLN C 54 8.629 34.480 14.589 1.00 0.45 H new ATOM 0 HA GLN C 54 9.405 37.139 15.241 1.00 0.50 H new ATOM 0 HB2 GLN C 54 8.960 36.219 12.938 1.00 0.51 H new ATOM 0 HB3 GLN C 54 7.248 36.167 13.308 1.00 0.51 H new ATOM 0 HG2 GLN C 54 7.265 38.640 13.741 1.00 0.58 H new ATOM 0 HG3 GLN C 54 8.978 38.693 13.375 1.00 0.58 H new ATOM 0 HE21 GLN C 54 9.214 39.609 11.318 1.00 1.03 H new ATOM 0 HE22 GLN C 54 8.244 39.157 9.913 1.00 1.03 H new ATOM 4991 N LEU C 55 6.304 36.349 16.048 1.00 0.54 N ATOM 4992 CA LEU C 55 5.158 36.847 16.863 1.00 0.62 C ATOM 4993 C LEU C 55 5.562 36.854 18.341 1.00 0.65 C ATOM 4994 O LEU C 55 5.818 35.820 18.925 1.00 0.59 O ATOM 4995 CB LEU C 55 3.952 35.920 16.664 1.00 0.60 C ATOM 4996 CG LEU C 55 3.542 35.907 15.186 1.00 0.63 C ATOM 4997 CD1 LEU C 55 2.396 34.908 14.992 1.00 0.65 C ATOM 4998 CD2 LEU C 55 3.088 37.315 14.751 1.00 0.78 C ATOM 0 H LEU C 55 6.200 35.403 15.680 1.00 0.54 H new ATOM 0 HA LEU C 55 4.892 37.857 16.551 1.00 0.62 H new ATOM 0 HB2 LEU C 55 4.201 34.910 16.990 1.00 0.60 H new ATOM 0 HB3 LEU C 55 3.118 36.257 17.279 1.00 0.60 H new ATOM 0 HG LEU C 55 4.395 35.610 14.575 1.00 0.63 H new ATOM 0 HD11 LEU C 55 2.099 34.894 13.943 1.00 0.65 H new ATOM 0 HD12 LEU C 55 2.727 33.913 15.289 1.00 0.65 H new ATOM 0 HD13 LEU C 55 1.546 35.206 15.605 1.00 0.65 H new ATOM 0 HD21 LEU C 55 2.799 37.296 13.700 1.00 0.78 H new ATOM 0 HD22 LEU C 55 2.236 37.626 15.356 1.00 0.78 H new ATOM 0 HD23 LEU C 55 3.908 38.020 14.889 1.00 0.78 H new ATOM 5010 N ASN C 56 5.627 38.017 18.949 1.00 0.78 N ATOM 5011 CA ASN C 56 6.018 38.105 20.394 1.00 0.85 C ATOM 5012 C ASN C 56 5.046 39.029 21.130 1.00 0.97 C ATOM 5013 O ASN C 56 4.242 38.595 21.931 1.00 0.92 O ATOM 5014 CB ASN C 56 7.432 38.679 20.494 1.00 0.92 C ATOM 5015 CG ASN C 56 8.381 37.843 19.635 1.00 0.85 C ATOM 5016 OD1 ASN C 56 8.939 38.333 18.673 1.00 1.37 O ATOM 5017 ND2 ASN C 56 8.589 36.593 19.943 1.00 1.36 N ATOM 0 H ASN C 56 5.425 38.912 18.504 1.00 0.78 H new ATOM 0 HA ASN C 56 5.987 37.113 20.844 1.00 0.85 H new ATOM 0 HB2 ASN C 56 7.440 39.716 20.160 1.00 0.92 H new ATOM 0 HB3 ASN C 56 7.765 38.676 21.532 1.00 0.92 H new ATOM 0 HD21 ASN C 56 9.220 36.026 19.376 1.00 1.36 H new ATOM 0 HD22 ASN C 56 8.121 36.182 20.750 1.00 1.36 H new ATOM 5024 N ALA C 57 5.110 40.303 20.853 1.00 1.13 N ATOM 5025 CA ALA C 57 4.190 41.274 21.519 1.00 1.24 C ATOM 5026 C ALA C 57 3.879 42.407 20.535 1.00 1.36 C ATOM 5027 O ALA C 57 4.543 43.424 20.502 1.00 1.50 O ATOM 5028 CB ALA C 57 4.867 41.834 22.777 1.00 1.33 C ATOM 0 H ALA C 57 5.764 40.717 20.189 1.00 1.13 H new ATOM 0 HA ALA C 57 3.263 40.781 21.810 1.00 1.24 H new ATOM 0 HB1 ALA C 57 4.198 42.543 23.265 1.00 1.33 H new ATOM 0 HB2 ALA C 57 5.093 41.017 23.463 1.00 1.33 H new ATOM 0 HB3 ALA C 57 5.791 42.340 22.498 1.00 1.33 H new ATOM 5034 N TRP C 58 2.869 42.222 19.730 1.00 1.35 N ATOM 5035 CA TRP C 58 2.482 43.256 18.723 1.00 1.48 C ATOM 5036 C TRP C 58 1.293 44.072 19.232 1.00 1.33 C ATOM 5037 O TRP C 58 0.358 43.542 19.800 1.00 1.26 O ATOM 5038 CB TRP C 58 2.085 42.557 17.423 1.00 1.68 C ATOM 5039 CG TRP C 58 3.298 41.955 16.790 1.00 1.88 C ATOM 5040 CD1 TRP C 58 3.682 40.666 16.928 1.00 1.95 C ATOM 5041 CD2 TRP C 58 4.286 42.588 15.926 1.00 2.05 C ATOM 5042 NE1 TRP C 58 4.844 40.466 16.204 1.00 2.16 N ATOM 5043 CE2 TRP C 58 5.256 41.620 15.570 1.00 2.23 C ATOM 5044 CE3 TRP C 58 4.435 43.893 15.422 1.00 2.08 C ATOM 5045 CZ2 TRP C 58 6.334 41.936 14.744 1.00 2.44 C ATOM 5046 CZ3 TRP C 58 5.521 44.213 14.590 1.00 2.29 C ATOM 5047 CH2 TRP C 58 6.468 43.236 14.252 1.00 2.47 C ATOM 0 H TRP C 58 2.285 41.386 19.726 1.00 1.35 H new ATOM 0 HA TRP C 58 3.326 43.924 18.554 1.00 1.48 H new ATOM 0 HB2 TRP C 58 1.345 41.783 17.625 1.00 1.68 H new ATOM 0 HB3 TRP C 58 1.622 43.270 16.741 1.00 1.68 H new ATOM 0 HD1 TRP C 58 3.166 39.915 17.508 1.00 1.95 H new ATOM 0 HE1 TRP C 58 5.336 39.574 16.146 1.00 2.16 H new ATOM 0 HE3 TRP C 58 3.711 44.653 15.676 1.00 2.08 H new ATOM 0 HZ2 TRP C 58 7.061 41.180 14.486 1.00 2.44 H new ATOM 0 HZ3 TRP C 58 5.627 45.218 14.208 1.00 2.29 H new ATOM 0 HH2 TRP C 58 7.300 43.489 13.612 1.00 2.47 H new ATOM 5058 N GLY C 59 1.316 45.357 19.013 1.00 1.33 N ATOM 5059 CA GLY C 59 0.184 46.218 19.459 1.00 1.27 C ATOM 5060 C GLY C 59 -0.024 46.077 20.964 1.00 1.16 C ATOM 5061 O GLY C 59 -0.996 46.561 21.510 1.00 1.13 O ATOM 0 H GLY C 59 2.074 45.851 18.542 1.00 1.33 H new ATOM 0 HA2 GLY C 59 0.389 47.259 19.209 1.00 1.27 H new ATOM 0 HA3 GLY C 59 -0.727 45.936 18.931 1.00 1.27 H new ATOM 5065 N ALA C 60 0.876 45.426 21.644 1.00 1.14 N ATOM 5066 CA ALA C 60 0.709 45.261 23.109 1.00 1.11 C ATOM 5067 C ALA C 60 1.025 46.587 23.804 1.00 1.02 C ATOM 5068 O ALA C 60 1.349 46.619 24.972 1.00 1.05 O ATOM 5069 CB ALA C 60 1.675 44.163 23.591 1.00 1.19 C ATOM 0 H ALA C 60 1.716 45.003 21.249 1.00 1.14 H new ATOM 0 HA ALA C 60 -0.315 44.974 23.347 1.00 1.11 H new ATOM 0 HB1 ALA C 60 1.565 44.029 24.667 1.00 1.19 H new ATOM 0 HB2 ALA C 60 1.444 43.227 23.083 1.00 1.19 H new ATOM 0 HB3 ALA C 60 2.700 44.455 23.365 1.00 1.19 H new ATOM 5075 N ALA C 61 0.917 47.683 23.102 1.00 0.96 N ATOM 5076 CA ALA C 61 1.202 48.999 23.741 1.00 0.92 C ATOM 5077 C ALA C 61 0.502 50.122 22.966 1.00 1.17 C ATOM 5078 O ALA C 61 0.909 50.473 21.875 1.00 1.25 O ATOM 5079 CB ALA C 61 2.717 49.234 23.744 1.00 0.72 C ATOM 0 H ALA C 61 0.645 47.724 22.120 1.00 0.96 H new ATOM 0 HA ALA C 61 0.828 48.996 24.765 1.00 0.92 H new ATOM 0 HB1 ALA C 61 2.935 50.195 24.210 1.00 0.72 H new ATOM 0 HB2 ALA C 61 3.207 48.439 24.306 1.00 0.72 H new ATOM 0 HB3 ALA C 61 3.087 49.235 22.719 1.00 0.72 H new ATOM 5085 N PHE C 62 -0.534 50.704 23.530 1.00 1.49 N ATOM 5086 CA PHE C 62 -1.251 51.829 22.838 1.00 1.80 C ATOM 5087 C PHE C 62 -0.909 53.160 23.516 1.00 1.70 C ATOM 5088 O PHE C 62 -1.514 54.177 23.239 1.00 1.94 O ATOM 5089 CB PHE C 62 -2.771 51.584 22.876 1.00 2.32 C ATOM 5090 CG PHE C 62 -3.165 50.657 21.743 1.00 2.69 C ATOM 5091 CD1 PHE C 62 -3.167 49.268 21.920 1.00 2.93 C ATOM 5092 CD2 PHE C 62 -3.526 51.205 20.506 1.00 2.87 C ATOM 5093 CE1 PHE C 62 -3.530 48.430 20.852 1.00 3.28 C ATOM 5094 CE2 PHE C 62 -3.889 50.369 19.445 1.00 3.24 C ATOM 5095 CZ PHE C 62 -3.889 48.982 19.619 1.00 3.42 C ATOM 0 H PHE C 62 -0.915 50.448 24.441 1.00 1.49 H new ATOM 0 HA PHE C 62 -0.929 51.873 21.797 1.00 1.80 H new ATOM 0 HB2 PHE C 62 -3.055 51.146 23.833 1.00 2.32 H new ATOM 0 HB3 PHE C 62 -3.304 52.530 22.787 1.00 2.32 H new ATOM 0 HD1 PHE C 62 -2.891 48.842 22.873 1.00 2.93 H new ATOM 0 HD2 PHE C 62 -3.524 52.276 20.371 1.00 2.87 H new ATOM 0 HE1 PHE C 62 -3.532 47.358 20.984 1.00 3.28 H new ATOM 0 HE2 PHE C 62 -4.169 50.795 18.493 1.00 3.24 H new ATOM 0 HZ PHE C 62 -4.167 48.336 18.799 1.00 3.42 H new ATOM 5105 N ARG C 63 0.093 53.171 24.362 1.00 1.42 N ATOM 5106 CA ARG C 63 0.528 54.444 25.023 1.00 1.41 C ATOM 5107 C ARG C 63 2.001 54.659 24.678 1.00 1.25 C ATOM 5108 O ARG C 63 2.727 55.343 25.370 1.00 1.34 O ATOM 5109 CB ARG C 63 0.380 54.318 26.543 1.00 1.66 C ATOM 5110 CG ARG C 63 -1.094 54.087 26.908 1.00 2.30 C ATOM 5111 CD ARG C 63 -1.928 55.349 26.620 1.00 2.72 C ATOM 5112 NE ARG C 63 -2.436 55.297 25.222 1.00 3.14 N ATOM 5113 CZ ARG C 63 -3.400 56.093 24.849 1.00 3.66 C ATOM 5114 NH1 ARG C 63 -3.924 56.927 25.706 1.00 3.89 N ATOM 5115 NH2 ARG C 63 -3.840 56.051 23.622 1.00 4.35 N ATOM 0 H ARG C 63 0.633 52.347 24.625 1.00 1.42 H new ATOM 0 HA ARG C 63 -0.082 55.280 24.679 1.00 1.41 H new ATOM 0 HB2 ARG C 63 0.988 53.491 26.909 1.00 1.66 H new ATOM 0 HB3 ARG C 63 0.746 55.222 27.029 1.00 1.66 H new ATOM 0 HG2 ARG C 63 -1.488 53.246 26.337 1.00 2.30 H new ATOM 0 HG3 ARG C 63 -1.176 53.823 27.962 1.00 2.30 H new ATOM 0 HD2 ARG C 63 -2.761 55.415 27.319 1.00 2.72 H new ATOM 0 HD3 ARG C 63 -1.319 56.242 26.765 1.00 2.72 H new ATOM 0 HE ARG C 63 -2.031 54.639 24.556 1.00 3.14 H new ATOM 0 HH11 ARG C 63 -3.580 56.956 26.666 1.00 3.89 H new ATOM 0 HH12 ARG C 63 -4.678 57.550 25.416 1.00 3.89 H new ATOM 0 HH21 ARG C 63 -3.431 55.396 22.955 1.00 4.35 H new ATOM 0 HH22 ARG C 63 -4.594 56.673 23.329 1.00 4.35 H new ATOM 5129 N GLN C 64 2.434 54.067 23.598 1.00 1.12 N ATOM 5130 CA GLN C 64 3.852 54.206 23.159 1.00 1.12 C ATOM 5131 C GLN C 64 3.901 54.100 21.635 1.00 1.12 C ATOM 5132 O GLN C 64 3.066 53.454 21.033 1.00 1.09 O ATOM 5133 CB GLN C 64 4.709 53.089 23.774 1.00 1.17 C ATOM 5134 CG GLN C 64 4.847 53.293 25.295 1.00 1.37 C ATOM 5135 CD GLN C 64 3.628 52.719 26.030 1.00 1.77 C ATOM 5136 OE1 GLN C 64 2.651 52.181 25.351 1.00 2.43 O flip ATOM 5137 NE2 GLN C 64 3.566 52.762 27.243 1.00 1.84 N flip ATOM 0 H GLN C 64 1.856 53.484 22.992 1.00 1.12 H new ATOM 0 HA GLN C 64 4.243 55.169 23.486 1.00 1.12 H new ATOM 0 HB2 GLN C 64 4.254 52.119 23.571 1.00 1.17 H new ATOM 0 HB3 GLN C 64 5.696 53.082 23.311 1.00 1.17 H new ATOM 0 HG2 GLN C 64 5.755 52.807 25.652 1.00 1.37 H new ATOM 0 HG3 GLN C 64 4.945 54.356 25.517 1.00 1.37 H new ATOM 0 HE21 GLN C 64 4.327 53.181 27.778 1.00 1.84 H new ATOM 0 HE22 GLN C 64 2.753 52.379 27.726 1.00 1.84 H new ATOM 5146 N VAL C 65 4.870 54.711 21.003 1.00 1.28 N ATOM 5147 CA VAL C 65 4.969 54.626 19.510 1.00 1.44 C ATOM 5148 C VAL C 65 6.138 53.710 19.141 1.00 1.49 C ATOM 5149 O VAL C 65 7.056 54.102 18.448 1.00 1.72 O ATOM 5150 CB VAL C 65 5.218 56.025 18.940 1.00 1.71 C ATOM 5151 CG1 VAL C 65 4.946 56.026 17.433 1.00 1.93 C ATOM 5152 CG2 VAL C 65 4.280 57.022 19.625 1.00 1.67 C ATOM 0 H VAL C 65 5.598 55.265 21.454 1.00 1.28 H new ATOM 0 HA VAL C 65 4.043 54.226 19.098 1.00 1.44 H new ATOM 0 HB VAL C 65 6.255 56.310 19.119 1.00 1.71 H new ATOM 0 HG11 VAL C 65 5.124 57.024 17.032 1.00 1.93 H new ATOM 0 HG12 VAL C 65 5.610 55.314 16.943 1.00 1.93 H new ATOM 0 HG13 VAL C 65 3.910 55.741 17.250 1.00 1.93 H new ATOM 0 HG21 VAL C 65 4.453 58.020 19.223 1.00 1.67 H new ATOM 0 HG22 VAL C 65 3.245 56.732 19.443 1.00 1.67 H new ATOM 0 HG23 VAL C 65 4.473 57.025 20.698 1.00 1.67 H new ATOM 5162 N ALA C 66 6.101 52.484 19.596 1.00 1.30 N ATOM 5163 CA ALA C 66 7.196 51.523 19.273 1.00 1.38 C ATOM 5164 C ALA C 66 6.632 50.098 19.245 1.00 1.17 C ATOM 5165 O ALA C 66 5.618 49.811 19.848 1.00 1.01 O ATOM 5166 CB ALA C 66 8.285 51.614 20.342 1.00 1.51 C ATOM 0 H ALA C 66 5.355 52.106 20.180 1.00 1.30 H new ATOM 0 HA ALA C 66 7.619 51.769 18.299 1.00 1.38 H new ATOM 0 HB1 ALA C 66 9.085 50.912 20.107 1.00 1.51 H new ATOM 0 HB2 ALA C 66 8.686 52.627 20.367 1.00 1.51 H new ATOM 0 HB3 ALA C 66 7.861 51.368 21.315 1.00 1.51 H new ATOM 5172 N HIS C 67 7.299 49.204 18.560 1.00 1.22 N ATOM 5173 CA HIS C 67 6.840 47.778 18.488 1.00 1.06 C ATOM 5174 C HIS C 67 8.017 46.872 18.850 1.00 1.10 C ATOM 5175 O HIS C 67 9.117 47.058 18.370 1.00 1.27 O ATOM 5176 CB HIS C 67 6.341 47.463 17.072 1.00 1.11 C ATOM 5177 CG HIS C 67 4.955 48.030 16.882 1.00 1.12 C ATOM 5178 ND1 HIS C 67 4.572 48.673 15.713 1.00 1.35 N ATOM 5179 CD2 HIS C 67 3.848 48.057 17.702 1.00 1.02 C ATOM 5180 CE1 HIS C 67 3.289 49.056 15.860 1.00 1.38 C ATOM 5181 NE2 HIS C 67 2.805 48.704 17.052 1.00 1.19 N ATOM 0 H HIS C 67 8.154 49.402 18.040 1.00 1.22 H new ATOM 0 HA HIS C 67 6.019 47.611 19.186 1.00 1.06 H new ATOM 0 HB2 HIS C 67 7.022 47.887 16.334 1.00 1.11 H new ATOM 0 HB3 HIS C 67 6.328 46.385 16.912 1.00 1.11 H new ATOM 0 HD2 HIS C 67 3.799 47.639 18.697 1.00 1.02 H new ATOM 0 HE1 HIS C 67 2.723 49.583 15.106 1.00 1.38 H new ATOM 0 HE2 HIS C 67 1.866 48.874 17.411 1.00 1.19 H new ATOM 5189 N THR C 68 7.809 45.907 19.714 1.00 1.01 N ATOM 5190 CA THR C 68 8.939 45.013 20.123 1.00 1.12 C ATOM 5191 C THR C 68 8.891 43.707 19.326 1.00 0.99 C ATOM 5192 O THR C 68 7.934 42.962 19.384 1.00 0.86 O ATOM 5193 CB THR C 68 8.821 44.711 21.624 1.00 1.21 C ATOM 5194 OG1 THR C 68 10.012 44.081 22.070 1.00 1.39 O ATOM 5195 CG2 THR C 68 7.625 43.789 21.890 1.00 1.09 C ATOM 0 H THR C 68 6.911 45.700 20.152 1.00 1.01 H new ATOM 0 HA THR C 68 9.887 45.511 19.921 1.00 1.12 H new ATOM 0 HB THR C 68 8.671 45.646 22.164 1.00 1.21 H new ATOM 0 HG1 THR C 68 9.941 43.888 23.028 1.00 1.39 H new ATOM 0 HG21 THR C 68 7.554 43.584 22.958 1.00 1.09 H new ATOM 0 HG22 THR C 68 6.709 44.274 21.552 1.00 1.09 H new ATOM 0 HG23 THR C 68 7.760 42.853 21.349 1.00 1.09 H new ATOM 5203 N THR C 69 9.932 43.434 18.577 1.00 1.06 N ATOM 5204 CA THR C 69 9.993 42.183 17.757 1.00 0.95 C ATOM 5205 C THR C 69 11.112 41.284 18.290 1.00 1.00 C ATOM 5206 O THR C 69 12.261 41.674 18.342 1.00 1.16 O ATOM 5207 CB THR C 69 10.275 42.548 16.295 1.00 1.05 C ATOM 5208 OG1 THR C 69 10.794 41.413 15.617 1.00 1.09 O ATOM 5209 CG2 THR C 69 11.284 43.697 16.228 1.00 1.28 C ATOM 0 H THR C 69 10.753 44.034 18.498 1.00 1.06 H new ATOM 0 HA THR C 69 9.042 41.654 17.820 1.00 0.95 H new ATOM 0 HB THR C 69 9.347 42.864 15.818 1.00 1.05 H new ATOM 0 HG1 THR C 69 10.973 41.644 14.682 1.00 1.09 H new ATOM 0 HG21 THR C 69 11.479 43.950 15.186 1.00 1.28 H new ATOM 0 HG22 THR C 69 10.878 44.568 16.743 1.00 1.28 H new ATOM 0 HG23 THR C 69 12.214 43.393 16.707 1.00 1.28 H new ATOM 5217 N VAL C 70 10.778 40.084 18.696 1.00 0.89 N ATOM 5218 CA VAL C 70 11.809 39.146 19.242 1.00 0.98 C ATOM 5219 C VAL C 70 11.693 37.792 18.528 1.00 0.85 C ATOM 5220 O VAL C 70 10.978 36.914 18.971 1.00 0.80 O ATOM 5221 CB VAL C 70 11.553 38.946 20.736 1.00 1.08 C ATOM 5222 CG1 VAL C 70 12.616 38.011 21.314 1.00 1.24 C ATOM 5223 CG2 VAL C 70 11.629 40.299 21.446 1.00 1.18 C ATOM 0 H VAL C 70 9.829 39.711 18.673 1.00 0.89 H new ATOM 0 HA VAL C 70 12.805 39.559 19.084 1.00 0.98 H new ATOM 0 HB VAL C 70 10.565 38.509 20.882 1.00 1.08 H new ATOM 0 HG11 VAL C 70 12.434 37.868 22.379 1.00 1.24 H new ATOM 0 HG12 VAL C 70 12.569 37.048 20.805 1.00 1.24 H new ATOM 0 HG13 VAL C 70 13.603 38.450 21.170 1.00 1.24 H new ATOM 0 HG21 VAL C 70 11.447 40.161 22.512 1.00 1.18 H new ATOM 0 HG22 VAL C 70 12.619 40.732 21.300 1.00 1.18 H new ATOM 0 HG23 VAL C 70 10.875 40.969 21.033 1.00 1.18 H new ATOM 5233 N PRO C 71 12.389 37.619 17.427 1.00 0.84 N ATOM 5234 CA PRO C 71 12.356 36.351 16.649 1.00 0.75 C ATOM 5235 C PRO C 71 13.352 35.319 17.189 1.00 0.74 C ATOM 5236 O PRO C 71 14.297 34.939 16.525 1.00 0.78 O ATOM 5237 CB PRO C 71 12.737 36.807 15.238 1.00 0.84 C ATOM 5238 CG PRO C 71 13.670 37.963 15.449 1.00 0.99 C ATOM 5239 CD PRO C 71 13.282 38.608 16.794 1.00 0.99 C ATOM 0 HA PRO C 71 11.389 35.851 16.698 1.00 0.75 H new ATOM 0 HB2 PRO C 71 13.220 36.005 14.680 1.00 0.84 H new ATOM 0 HB3 PRO C 71 11.858 37.107 14.668 1.00 0.84 H new ATOM 0 HG2 PRO C 71 14.706 37.625 15.467 1.00 0.99 H new ATOM 0 HG3 PRO C 71 13.583 38.683 14.635 1.00 0.99 H new ATOM 0 HD2 PRO C 71 14.160 38.803 17.410 1.00 0.99 H new ATOM 0 HD3 PRO C 71 12.777 39.563 16.647 1.00 0.99 H new ATOM 5247 N TRP C 72 13.138 34.859 18.391 1.00 0.72 N ATOM 5248 CA TRP C 72 14.056 33.848 18.987 1.00 0.75 C ATOM 5249 C TRP C 72 13.889 32.530 18.226 1.00 0.67 C ATOM 5250 O TRP C 72 12.781 32.064 18.074 1.00 0.60 O ATOM 5251 CB TRP C 72 13.651 33.619 20.441 1.00 0.78 C ATOM 5252 CG TRP C 72 14.584 32.638 21.074 1.00 0.84 C ATOM 5253 CD1 TRP C 72 15.871 32.893 21.404 1.00 0.94 C ATOM 5254 CD2 TRP C 72 14.329 31.254 21.460 1.00 0.84 C ATOM 5255 NE1 TRP C 72 16.423 31.755 21.965 1.00 0.99 N ATOM 5256 CE2 TRP C 72 15.511 30.719 22.023 1.00 0.93 C ATOM 5257 CE3 TRP C 72 13.198 30.420 21.377 1.00 0.79 C ATOM 5258 CZ2 TRP C 72 15.572 29.404 22.485 1.00 0.97 C ATOM 5259 CZ3 TRP C 72 13.256 29.096 21.844 1.00 0.84 C ATOM 5260 CH2 TRP C 72 14.440 28.589 22.396 1.00 0.92 C ATOM 0 H TRP C 72 12.362 35.142 18.989 1.00 0.72 H new ATOM 0 HA TRP C 72 15.088 34.194 18.929 1.00 0.75 H new ATOM 0 HB2 TRP C 72 13.673 34.562 20.988 1.00 0.78 H new ATOM 0 HB3 TRP C 72 12.628 33.246 20.489 1.00 0.78 H new ATOM 0 HD1 TRP C 72 16.384 33.832 21.254 1.00 0.94 H new ATOM 0 HE1 TRP C 72 17.386 31.689 22.295 1.00 0.99 H new ATOM 0 HE3 TRP C 72 12.281 30.800 20.952 1.00 0.79 H new ATOM 0 HZ2 TRP C 72 16.488 29.018 22.909 1.00 0.97 H new ATOM 0 HZ3 TRP C 72 12.382 28.465 21.777 1.00 0.84 H new ATOM 0 HH2 TRP C 72 14.478 27.570 22.752 1.00 0.92 H new ATOM 5271 N PRO C 73 14.947 31.915 17.745 1.00 0.71 N ATOM 5272 CA PRO C 73 14.817 30.640 16.996 1.00 0.65 C ATOM 5273 C PRO C 73 13.761 29.727 17.618 1.00 0.58 C ATOM 5274 O PRO C 73 13.585 29.694 18.820 1.00 0.61 O ATOM 5275 CB PRO C 73 16.215 30.031 17.108 1.00 0.74 C ATOM 5276 CG PRO C 73 17.133 31.211 17.147 1.00 0.84 C ATOM 5277 CD PRO C 73 16.357 32.338 17.852 1.00 0.82 C ATOM 0 HA PRO C 73 14.492 30.783 15.966 1.00 0.65 H new ATOM 0 HB2 PRO C 73 16.312 29.422 18.007 1.00 0.74 H new ATOM 0 HB3 PRO C 73 16.436 29.384 16.259 1.00 0.74 H new ATOM 0 HG2 PRO C 73 18.049 30.973 17.687 1.00 0.84 H new ATOM 0 HG3 PRO C 73 17.425 31.510 16.140 1.00 0.84 H new ATOM 0 HD2 PRO C 73 16.665 32.445 18.892 1.00 0.82 H new ATOM 0 HD3 PRO C 73 16.523 33.301 17.369 1.00 0.82 H new ATOM 5285 N ASN C 74 13.062 28.990 16.803 1.00 0.52 N ATOM 5286 CA ASN C 74 12.005 28.070 17.318 1.00 0.48 C ATOM 5287 C ASN C 74 12.215 26.702 16.682 1.00 0.50 C ATOM 5288 O ASN C 74 11.397 25.810 16.784 1.00 0.80 O ATOM 5289 CB ASN C 74 10.635 28.629 16.937 1.00 0.47 C ATOM 5290 CG ASN C 74 9.538 27.831 17.642 1.00 0.53 C ATOM 5291 OD1 ASN C 74 8.368 27.717 17.077 1.00 1.17 O flip ATOM 5292 ND2 ASN C 74 9.748 27.306 18.717 1.00 1.26 N flip ATOM 0 H ASN C 74 13.177 28.984 15.790 1.00 0.52 H new ATOM 0 HA ASN C 74 12.059 27.980 18.403 1.00 0.48 H new ATOM 0 HB2 ASN C 74 10.570 29.680 17.217 1.00 0.47 H new ATOM 0 HB3 ASN C 74 10.498 28.578 15.857 1.00 0.47 H new ATOM 0 HD21 ASN C 74 10.663 27.396 19.158 1.00 1.26 H new ATOM 0 HD22 ASN C 74 9.009 26.776 19.179 1.00 1.26 H new ATOM 5299 N ALA C 75 13.320 26.548 16.018 1.00 0.47 N ATOM 5300 CA ALA C 75 13.642 25.265 15.344 1.00 0.47 C ATOM 5301 C ALA C 75 15.160 25.134 15.275 1.00 0.46 C ATOM 5302 O ALA C 75 15.834 25.993 14.740 1.00 0.47 O ATOM 5303 CB ALA C 75 13.059 25.271 13.927 1.00 0.53 C ATOM 0 H ALA C 75 14.029 27.273 15.911 1.00 0.47 H new ATOM 0 HA ALA C 75 13.216 24.428 15.896 1.00 0.47 H new ATOM 0 HB1 ALA C 75 13.296 24.329 13.432 1.00 0.53 H new ATOM 0 HB2 ALA C 75 11.977 25.392 13.979 1.00 0.53 H new ATOM 0 HB3 ALA C 75 13.489 26.097 13.360 1.00 0.53 H new ATOM 5309 N SER C 76 15.719 24.079 15.796 1.00 0.47 N ATOM 5310 CA SER C 76 17.196 23.949 15.723 1.00 0.48 C ATOM 5311 C SER C 76 17.528 23.449 14.329 1.00 0.48 C ATOM 5312 O SER C 76 17.294 22.308 13.984 1.00 0.49 O ATOM 5313 CB SER C 76 17.689 22.942 16.764 1.00 0.54 C ATOM 5314 OG SER C 76 19.068 22.675 16.540 1.00 1.38 O ATOM 0 H SER C 76 15.227 23.316 16.260 1.00 0.47 H new ATOM 0 HA SER C 76 17.678 24.906 15.924 1.00 0.48 H new ATOM 0 HB2 SER C 76 17.541 23.338 17.769 1.00 0.54 H new ATOM 0 HB3 SER C 76 17.112 22.020 16.697 1.00 0.54 H new ATOM 0 HG SER C 76 19.389 22.031 17.206 1.00 1.38 H new ATOM 5320 N LEU C 77 18.042 24.322 13.517 1.00 0.50 N ATOM 5321 CA LEU C 77 18.367 23.944 12.124 1.00 0.53 C ATOM 5322 C LEU C 77 19.644 23.124 12.122 1.00 0.52 C ATOM 5323 O LEU C 77 20.603 23.458 12.785 1.00 0.55 O ATOM 5324 CB LEU C 77 18.574 25.221 11.306 1.00 0.62 C ATOM 5325 CG LEU C 77 17.340 26.129 11.435 1.00 0.65 C ATOM 5326 CD1 LEU C 77 17.664 27.519 10.882 1.00 0.75 C ATOM 5327 CD2 LEU C 77 16.160 25.534 10.655 1.00 0.66 C ATOM 0 H LEU C 77 18.252 25.289 13.763 1.00 0.50 H new ATOM 0 HA LEU C 77 17.558 23.357 11.690 1.00 0.53 H new ATOM 0 HB2 LEU C 77 19.462 25.747 11.655 1.00 0.62 H new ATOM 0 HB3 LEU C 77 18.744 24.969 10.259 1.00 0.62 H new ATOM 0 HG LEU C 77 17.069 26.207 12.488 1.00 0.65 H new ATOM 0 HD11 LEU C 77 16.788 28.161 10.975 1.00 0.75 H new ATOM 0 HD12 LEU C 77 18.491 27.951 11.445 1.00 0.75 H new ATOM 0 HD13 LEU C 77 17.944 27.437 9.832 1.00 0.75 H new ATOM 0 HD21 LEU C 77 15.292 26.186 10.754 1.00 0.66 H new ATOM 0 HD22 LEU C 77 16.428 25.444 9.602 1.00 0.66 H new ATOM 0 HD23 LEU C 77 15.920 24.548 11.054 1.00 0.66 H new ATOM 5339 N THR C 78 19.666 22.054 11.381 1.00 0.51 N ATOM 5340 CA THR C 78 20.886 21.203 11.323 1.00 0.51 C ATOM 5341 C THR C 78 21.679 21.557 10.053 1.00 0.57 C ATOM 5342 O THR C 78 21.256 21.242 8.959 1.00 0.66 O ATOM 5343 CB THR C 78 20.453 19.736 11.278 1.00 0.55 C ATOM 5344 OG1 THR C 78 21.609 18.919 11.366 1.00 0.61 O ATOM 5345 CG2 THR C 78 19.692 19.431 9.973 1.00 0.64 C ATOM 0 H THR C 78 18.886 21.730 10.809 1.00 0.51 H new ATOM 0 HA THR C 78 21.515 21.371 12.197 1.00 0.51 H new ATOM 0 HB THR C 78 19.784 19.532 12.114 1.00 0.55 H new ATOM 0 HG1 THR C 78 22.099 19.134 12.187 1.00 0.61 H new ATOM 0 HG21 THR C 78 19.394 18.383 9.962 1.00 0.64 H new ATOM 0 HG22 THR C 78 18.805 20.061 9.913 1.00 0.64 H new ATOM 0 HG23 THR C 78 20.339 19.633 9.119 1.00 0.64 H new ATOM 5353 N PRO C 79 22.818 22.212 10.159 1.00 0.65 N ATOM 5354 CA PRO C 79 23.620 22.580 8.972 1.00 0.77 C ATOM 5355 C PRO C 79 24.792 21.631 8.715 1.00 0.67 C ATOM 5356 O PRO C 79 25.047 21.235 7.596 1.00 0.70 O ATOM 5357 CB PRO C 79 24.150 23.945 9.387 1.00 0.98 C ATOM 5358 CG PRO C 79 24.459 23.783 10.848 1.00 0.96 C ATOM 5359 CD PRO C 79 23.479 22.714 11.384 1.00 0.75 C ATOM 0 HA PRO C 79 23.039 22.552 8.050 1.00 0.77 H new ATOM 0 HB2 PRO C 79 25.039 24.218 8.818 1.00 0.98 H new ATOM 0 HB3 PRO C 79 23.411 24.729 9.219 1.00 0.98 H new ATOM 0 HG2 PRO C 79 25.493 23.470 10.994 1.00 0.96 H new ATOM 0 HG3 PRO C 79 24.333 24.727 11.379 1.00 0.96 H new ATOM 0 HD2 PRO C 79 24.003 21.918 11.913 1.00 0.75 H new ATOM 0 HD3 PRO C 79 22.760 23.142 12.082 1.00 0.75 H new ATOM 5367 N LYS C 80 25.543 21.317 9.739 1.00 0.66 N ATOM 5368 CA LYS C 80 26.749 20.447 9.565 1.00 0.66 C ATOM 5369 C LYS C 80 26.553 19.021 10.097 1.00 0.63 C ATOM 5370 O LYS C 80 27.034 18.077 9.508 1.00 0.65 O ATOM 5371 CB LYS C 80 27.915 21.085 10.318 1.00 0.79 C ATOM 5372 CG LYS C 80 28.331 22.376 9.611 1.00 1.30 C ATOM 5373 CD LYS C 80 29.499 23.020 10.361 1.00 1.45 C ATOM 5374 CE LYS C 80 29.908 24.309 9.648 1.00 2.31 C ATOM 5375 NZ LYS C 80 30.888 25.054 10.488 1.00 2.95 N ATOM 0 H LYS C 80 25.373 21.627 10.696 1.00 0.66 H new ATOM 0 HA LYS C 80 26.939 20.369 8.495 1.00 0.66 H new ATOM 0 HB2 LYS C 80 27.625 21.298 11.347 1.00 0.79 H new ATOM 0 HB3 LYS C 80 28.756 20.393 10.361 1.00 0.79 H new ATOM 0 HG2 LYS C 80 28.620 22.162 8.582 1.00 1.30 H new ATOM 0 HG3 LYS C 80 27.489 23.066 9.568 1.00 1.30 H new ATOM 0 HD2 LYS C 80 29.211 23.236 11.390 1.00 1.45 H new ATOM 0 HD3 LYS C 80 30.343 22.331 10.404 1.00 1.45 H new ATOM 0 HE2 LYS C 80 30.347 24.077 8.678 1.00 2.31 H new ATOM 0 HE3 LYS C 80 29.030 24.927 9.460 1.00 2.31 H new ATOM 0 HZ1 LYS C 80 31.166 25.931 10.002 1.00 2.95 H new ATOM 0 HZ2 LYS C 80 30.453 25.288 11.403 1.00 2.95 H new ATOM 0 HZ3 LYS C 80 31.730 24.464 10.645 1.00 2.95 H new ATOM 5389 N TRP C 81 25.947 18.841 11.242 1.00 0.65 N ATOM 5390 CA TRP C 81 25.864 17.452 11.799 1.00 0.67 C ATOM 5391 C TRP C 81 24.858 16.551 11.057 1.00 0.62 C ATOM 5392 O TRP C 81 25.235 15.523 10.527 1.00 0.63 O ATOM 5393 CB TRP C 81 25.554 17.502 13.311 1.00 0.72 C ATOM 5394 CG TRP C 81 24.092 17.683 13.596 1.00 0.68 C ATOM 5395 CD1 TRP C 81 23.178 16.687 13.601 1.00 0.69 C ATOM 5396 CD2 TRP C 81 23.373 18.896 13.980 1.00 0.67 C ATOM 5397 NE1 TRP C 81 21.944 17.209 13.938 1.00 0.68 N ATOM 5398 CE2 TRP C 81 22.010 18.564 14.183 1.00 0.65 C ATOM 5399 CE3 TRP C 81 23.758 20.238 14.160 1.00 0.70 C ATOM 5400 CZ2 TRP C 81 21.066 19.522 14.554 1.00 0.65 C ATOM 5401 CZ3 TRP C 81 22.810 21.206 14.535 1.00 0.71 C ATOM 5402 CH2 TRP C 81 21.468 20.847 14.733 1.00 0.67 C ATOM 0 H TRP C 81 25.515 19.573 11.806 1.00 0.65 H new ATOM 0 HA TRP C 81 26.841 16.994 11.645 1.00 0.67 H new ATOM 0 HB2 TRP C 81 25.900 16.581 13.779 1.00 0.72 H new ATOM 0 HB3 TRP C 81 26.113 18.320 13.766 1.00 0.72 H new ATOM 0 HD1 TRP C 81 23.380 15.650 13.377 1.00 0.69 H new ATOM 0 HE1 TRP C 81 21.088 16.658 13.998 1.00 0.68 H new ATOM 0 HE3 TRP C 81 24.788 20.526 14.009 1.00 0.70 H new ATOM 0 HZ2 TRP C 81 20.034 19.241 14.701 1.00 0.65 H new ATOM 0 HZ3 TRP C 81 23.117 22.233 14.672 1.00 0.71 H new ATOM 0 HH2 TRP C 81 20.746 21.596 15.024 1.00 0.67 H new ATOM 5413 N ASN C 82 23.593 16.873 11.022 1.00 0.59 N ATOM 5414 CA ASN C 82 22.632 15.951 10.329 1.00 0.59 C ATOM 5415 C ASN C 82 22.709 16.097 8.811 1.00 0.53 C ATOM 5416 O ASN C 82 22.614 15.127 8.089 1.00 0.49 O ATOM 5417 CB ASN C 82 21.198 16.217 10.783 1.00 0.70 C ATOM 5418 CG ASN C 82 20.316 15.015 10.428 1.00 1.07 C ATOM 5419 OD1 ASN C 82 19.175 15.213 9.829 1.00 0.96 O flip ATOM 5420 ND2 ASN C 82 20.672 13.885 10.699 1.00 1.86 N flip ATOM 0 H ASN C 82 23.185 17.713 11.431 1.00 0.59 H new ATOM 0 HA ASN C 82 22.918 14.934 10.600 1.00 0.59 H new ATOM 0 HB2 ASN C 82 21.173 16.394 11.858 1.00 0.70 H new ATOM 0 HB3 ASN C 82 20.815 17.117 10.302 1.00 0.70 H new ATOM 0 HD21 ASN C 82 21.565 13.730 11.168 1.00 1.86 H new ATOM 0 HD22 ASN C 82 20.078 13.092 10.458 1.00 1.86 H new ATOM 5427 N ASN C 83 22.842 17.290 8.309 1.00 0.56 N ATOM 5428 CA ASN C 83 22.879 17.446 6.831 1.00 0.57 C ATOM 5429 C ASN C 83 24.056 16.658 6.261 1.00 0.52 C ATOM 5430 O ASN C 83 23.904 15.906 5.320 1.00 0.51 O ATOM 5431 CB ASN C 83 23.032 18.922 6.468 1.00 0.66 C ATOM 5432 CG ASN C 83 23.069 19.070 4.945 1.00 1.22 C ATOM 5433 OD1 ASN C 83 23.954 19.704 4.407 1.00 1.99 O ATOM 5434 ND2 ASN C 83 22.139 18.506 4.222 1.00 1.83 N ATOM 0 H ASN C 83 22.926 18.152 8.848 1.00 0.56 H new ATOM 0 HA ASN C 83 21.948 17.066 6.409 1.00 0.57 H new ATOM 0 HB2 ASN C 83 22.203 19.497 6.880 1.00 0.66 H new ATOM 0 HB3 ASN C 83 23.946 19.323 6.906 1.00 0.66 H new ATOM 0 HD21 ASN C 83 22.156 18.598 3.206 1.00 1.83 H new ATOM 0 HD22 ASN C 83 21.395 17.973 4.673 1.00 1.83 H new ATOM 5441 N GLU C 84 25.225 16.804 6.818 1.00 0.52 N ATOM 5442 CA GLU C 84 26.376 16.032 6.279 1.00 0.52 C ATOM 5443 C GLU C 84 26.076 14.542 6.403 1.00 0.47 C ATOM 5444 O GLU C 84 26.298 13.777 5.486 1.00 0.47 O ATOM 5445 CB GLU C 84 27.648 16.358 7.057 1.00 0.55 C ATOM 5446 CG GLU C 84 28.088 17.786 6.737 1.00 1.26 C ATOM 5447 CD GLU C 84 29.363 18.110 7.517 1.00 1.70 C ATOM 5448 OE1 GLU C 84 29.723 17.324 8.377 1.00 2.23 O ATOM 5449 OE2 GLU C 84 29.959 19.137 7.239 1.00 2.29 O ATOM 0 H GLU C 84 25.431 17.414 7.609 1.00 0.52 H new ATOM 0 HA GLU C 84 26.527 16.300 5.233 1.00 0.52 H new ATOM 0 HB2 GLU C 84 27.470 16.252 8.127 1.00 0.55 H new ATOM 0 HB3 GLU C 84 28.438 15.655 6.794 1.00 0.55 H new ATOM 0 HG2 GLU C 84 28.266 17.893 5.667 1.00 1.26 H new ATOM 0 HG3 GLU C 84 27.298 18.490 7.000 1.00 1.26 H new ATOM 5456 N THR C 85 25.559 14.120 7.526 1.00 0.44 N ATOM 5457 CA THR C 85 25.239 12.677 7.679 1.00 0.42 C ATOM 5458 C THR C 85 24.064 12.340 6.762 1.00 0.38 C ATOM 5459 O THR C 85 24.028 11.291 6.149 1.00 0.38 O ATOM 5460 CB THR C 85 24.861 12.363 9.133 1.00 0.44 C ATOM 5461 OG1 THR C 85 23.667 13.051 9.468 1.00 0.43 O ATOM 5462 CG2 THR C 85 25.989 12.794 10.082 1.00 0.49 C ATOM 0 H THR C 85 25.348 14.706 8.333 1.00 0.44 H new ATOM 0 HA THR C 85 26.112 12.081 7.412 1.00 0.42 H new ATOM 0 HB THR C 85 24.707 11.289 9.236 1.00 0.44 H new ATOM 0 HG1 THR C 85 23.579 13.847 8.903 1.00 0.43 H new ATOM 0 HG21 THR C 85 25.707 12.565 11.110 1.00 0.49 H new ATOM 0 HG22 THR C 85 26.903 12.257 9.828 1.00 0.49 H new ATOM 0 HG23 THR C 85 26.159 13.866 9.982 1.00 0.49 H new ATOM 5470 N TRP C 86 23.091 13.211 6.669 1.00 0.36 N ATOM 5471 CA TRP C 86 21.927 12.906 5.795 1.00 0.33 C ATOM 5472 C TRP C 86 22.379 12.826 4.336 1.00 0.34 C ATOM 5473 O TRP C 86 21.988 11.938 3.607 1.00 0.33 O ATOM 5474 CB TRP C 86 20.837 13.979 5.928 1.00 0.34 C ATOM 5475 CG TRP C 86 19.554 13.401 5.426 1.00 0.32 C ATOM 5476 CD1 TRP C 86 19.104 13.466 4.152 1.00 0.34 C ATOM 5477 CD2 TRP C 86 18.569 12.640 6.171 1.00 0.29 C ATOM 5478 NE1 TRP C 86 17.899 12.786 4.070 1.00 0.33 N ATOM 5479 CE2 TRP C 86 17.529 12.261 5.294 1.00 0.29 C ATOM 5480 CE3 TRP C 86 18.483 12.249 7.514 1.00 0.28 C ATOM 5481 CZ2 TRP C 86 16.437 11.512 5.740 1.00 0.28 C ATOM 5482 CZ3 TRP C 86 17.389 11.503 7.968 1.00 0.26 C ATOM 5483 CH2 TRP C 86 16.366 11.132 7.083 1.00 0.27 C ATOM 0 H TRP C 86 23.055 14.107 7.155 1.00 0.36 H new ATOM 0 HA TRP C 86 21.513 11.948 6.109 1.00 0.33 H new ATOM 0 HB2 TRP C 86 20.734 14.290 6.968 1.00 0.34 H new ATOM 0 HB3 TRP C 86 21.105 14.867 5.355 1.00 0.34 H new ATOM 0 HD1 TRP C 86 19.602 13.965 3.334 1.00 0.34 H new ATOM 0 HE1 TRP C 86 17.354 12.686 3.214 1.00 0.33 H new ATOM 0 HE3 TRP C 86 19.267 12.525 8.204 1.00 0.28 H new ATOM 0 HZ2 TRP C 86 15.654 11.229 5.052 1.00 0.28 H new ATOM 0 HZ3 TRP C 86 17.332 11.211 9.006 1.00 0.26 H new ATOM 0 HH2 TRP C 86 15.526 10.554 7.438 1.00 0.27 H new ATOM 5494 N GLN C 87 23.207 13.732 3.893 1.00 0.37 N ATOM 5495 CA GLN C 87 23.664 13.649 2.481 1.00 0.39 C ATOM 5496 C GLN C 87 24.381 12.317 2.314 1.00 0.37 C ATOM 5497 O GLN C 87 24.226 11.622 1.331 1.00 0.38 O ATOM 5498 CB GLN C 87 24.614 14.804 2.171 1.00 0.42 C ATOM 5499 CG GLN C 87 23.824 16.112 2.147 1.00 0.46 C ATOM 5500 CD GLN C 87 24.785 17.290 1.992 1.00 0.53 C ATOM 5501 OE1 GLN C 87 25.907 17.239 2.456 1.00 1.21 O ATOM 5502 NE2 GLN C 87 24.389 18.357 1.354 1.00 1.03 N ATOM 0 H GLN C 87 23.580 14.511 4.436 1.00 0.37 H new ATOM 0 HA GLN C 87 22.819 13.717 1.796 1.00 0.39 H new ATOM 0 HB2 GLN C 87 25.402 14.855 2.923 1.00 0.42 H new ATOM 0 HB3 GLN C 87 25.101 14.642 1.210 1.00 0.42 H new ATOM 0 HG2 GLN C 87 23.110 16.102 1.324 1.00 0.46 H new ATOM 0 HG3 GLN C 87 23.249 16.218 3.067 1.00 0.46 H new ATOM 0 HE21 GLN C 87 23.447 18.398 0.965 1.00 1.03 H new ATOM 0 HE22 GLN C 87 25.021 19.150 1.244 1.00 1.03 H new ATOM 5511 N GLU C 88 25.143 11.947 3.299 1.00 0.37 N ATOM 5512 CA GLU C 88 25.859 10.649 3.255 1.00 0.37 C ATOM 5513 C GLU C 88 24.825 9.520 3.245 1.00 0.34 C ATOM 5514 O GLU C 88 24.986 8.519 2.580 1.00 0.34 O ATOM 5515 CB GLU C 88 26.765 10.522 4.484 1.00 0.39 C ATOM 5516 CG GLU C 88 27.536 9.203 4.416 1.00 1.18 C ATOM 5517 CD GLU C 88 28.465 9.088 5.626 1.00 1.42 C ATOM 5518 OE1 GLU C 88 28.603 10.068 6.338 1.00 1.92 O ATOM 5519 OE2 GLU C 88 29.023 8.019 5.819 1.00 1.96 O ATOM 0 H GLU C 88 25.302 12.496 4.144 1.00 0.37 H new ATOM 0 HA GLU C 88 26.475 10.589 2.358 1.00 0.37 H new ATOM 0 HB2 GLU C 88 27.461 11.360 4.524 1.00 0.39 H new ATOM 0 HB3 GLU C 88 26.167 10.560 5.395 1.00 0.39 H new ATOM 0 HG2 GLU C 88 26.840 8.364 4.398 1.00 1.18 H new ATOM 0 HG3 GLU C 88 28.116 9.156 3.494 1.00 1.18 H new ATOM 5526 N TRP C 89 23.770 9.672 4.003 1.00 0.32 N ATOM 5527 CA TRP C 89 22.728 8.608 4.076 1.00 0.29 C ATOM 5528 C TRP C 89 22.129 8.358 2.690 1.00 0.30 C ATOM 5529 O TRP C 89 22.051 7.231 2.247 1.00 0.30 O ATOM 5530 CB TRP C 89 21.638 9.074 5.048 1.00 0.28 C ATOM 5531 CG TRP C 89 20.446 8.173 5.004 1.00 0.25 C ATOM 5532 CD1 TRP C 89 20.373 6.950 5.570 1.00 0.25 C ATOM 5533 CD2 TRP C 89 19.143 8.426 4.403 1.00 0.24 C ATOM 5534 NE1 TRP C 89 19.113 6.427 5.343 1.00 0.23 N ATOM 5535 CE2 TRP C 89 18.318 7.301 4.629 1.00 0.23 C ATOM 5536 CE3 TRP C 89 18.605 9.510 3.686 1.00 0.26 C ATOM 5537 CZ2 TRP C 89 17.004 7.252 4.163 1.00 0.23 C ATOM 5538 CZ3 TRP C 89 17.283 9.465 3.216 1.00 0.27 C ATOM 5539 CH2 TRP C 89 16.484 8.339 3.454 1.00 0.25 C ATOM 0 H TRP C 89 23.586 10.494 4.578 1.00 0.32 H new ATOM 0 HA TRP C 89 23.169 7.675 4.426 1.00 0.29 H new ATOM 0 HB2 TRP C 89 22.039 9.100 6.061 1.00 0.28 H new ATOM 0 HB3 TRP C 89 21.336 10.091 4.798 1.00 0.28 H new ATOM 0 HD1 TRP C 89 21.168 6.460 6.112 1.00 0.25 H new ATOM 0 HE1 TRP C 89 18.808 5.508 5.664 1.00 0.23 H new ATOM 0 HE3 TRP C 89 19.213 10.382 3.496 1.00 0.26 H new ATOM 0 HZ2 TRP C 89 16.393 6.381 4.349 1.00 0.23 H new ATOM 0 HZ3 TRP C 89 16.879 10.303 2.668 1.00 0.27 H new ATOM 0 HH2 TRP C 89 15.468 8.311 3.090 1.00 0.25 H new ATOM 5550 N GLU C 90 21.713 9.376 1.989 1.00 0.31 N ATOM 5551 CA GLU C 90 21.139 9.128 0.636 1.00 0.33 C ATOM 5552 C GLU C 90 22.245 8.634 -0.298 1.00 0.33 C ATOM 5553 O GLU C 90 22.041 7.741 -1.096 1.00 0.34 O ATOM 5554 CB GLU C 90 20.510 10.410 0.085 1.00 0.37 C ATOM 5555 CG GLU C 90 21.534 11.542 0.106 1.00 0.85 C ATOM 5556 CD GLU C 90 20.870 12.837 -0.365 1.00 1.16 C ATOM 5557 OE1 GLU C 90 19.767 12.759 -0.879 1.00 1.82 O ATOM 5558 OE2 GLU C 90 21.475 13.884 -0.200 1.00 1.67 O ATOM 0 H GLU C 90 21.744 10.351 2.286 1.00 0.31 H new ATOM 0 HA GLU C 90 20.361 8.368 0.706 1.00 0.33 H new ATOM 0 HB2 GLU C 90 20.159 10.244 -0.934 1.00 0.37 H new ATOM 0 HB3 GLU C 90 19.640 10.684 0.682 1.00 0.37 H new ATOM 0 HG2 GLU C 90 21.931 11.669 1.113 1.00 0.85 H new ATOM 0 HG3 GLU C 90 22.377 11.297 -0.540 1.00 0.85 H new ATOM 5565 N ARG C 91 23.422 9.193 -0.202 1.00 0.34 N ATOM 5566 CA ARG C 91 24.526 8.729 -1.085 1.00 0.36 C ATOM 5567 C ARG C 91 24.827 7.258 -0.796 1.00 0.34 C ATOM 5568 O ARG C 91 25.044 6.477 -1.701 1.00 0.34 O ATOM 5569 CB ARG C 91 25.774 9.577 -0.840 1.00 0.40 C ATOM 5570 CG ARG C 91 25.549 10.987 -1.391 1.00 0.44 C ATOM 5571 CD ARG C 91 26.758 11.862 -1.061 1.00 1.07 C ATOM 5572 NE ARG C 91 26.853 12.030 0.416 1.00 1.67 N ATOM 5573 CZ ARG C 91 27.954 12.477 0.952 1.00 2.30 C ATOM 5574 NH1 ARG C 91 28.969 12.791 0.195 1.00 2.61 N ATOM 5575 NH2 ARG C 91 28.042 12.609 2.248 1.00 3.18 N ATOM 0 H ARG C 91 23.664 9.944 0.444 1.00 0.34 H new ATOM 0 HA ARG C 91 24.226 8.835 -2.128 1.00 0.36 H new ATOM 0 HB2 ARG C 91 25.992 9.622 0.227 1.00 0.40 H new ATOM 0 HB3 ARG C 91 26.638 9.120 -1.323 1.00 0.40 H new ATOM 0 HG2 ARG C 91 25.399 10.948 -2.470 1.00 0.44 H new ATOM 0 HG3 ARG C 91 24.646 11.418 -0.959 1.00 0.44 H new ATOM 0 HD2 ARG C 91 27.669 11.404 -1.446 1.00 1.07 H new ATOM 0 HD3 ARG C 91 26.661 12.834 -1.544 1.00 1.07 H new ATOM 0 HE ARG C 91 26.056 11.795 1.008 1.00 1.67 H new ATOM 0 HH11 ARG C 91 28.902 12.687 -0.817 1.00 2.61 H new ATOM 0 HH12 ARG C 91 29.830 13.141 0.616 1.00 2.61 H new ATOM 0 HH21 ARG C 91 27.249 12.362 2.841 1.00 3.18 H new ATOM 0 HH22 ARG C 91 28.903 12.959 2.668 1.00 3.18 H new ATOM 5589 N LYS C 92 24.822 6.856 0.451 1.00 0.33 N ATOM 5590 CA LYS C 92 25.090 5.421 0.745 1.00 0.33 C ATOM 5591 C LYS C 92 24.022 4.584 0.045 1.00 0.31 C ATOM 5592 O LYS C 92 24.308 3.570 -0.557 1.00 0.32 O ATOM 5593 CB LYS C 92 25.053 5.171 2.257 1.00 0.34 C ATOM 5594 CG LYS C 92 26.352 5.679 2.897 1.00 0.68 C ATOM 5595 CD LYS C 92 26.313 5.471 4.420 1.00 1.08 C ATOM 5596 CE LYS C 92 26.671 4.024 4.772 1.00 1.41 C ATOM 5597 NZ LYS C 92 26.712 3.877 6.254 1.00 2.13 N ATOM 0 H LYS C 92 24.647 7.449 1.262 1.00 0.33 H new ATOM 0 HA LYS C 92 26.080 5.144 0.383 1.00 0.33 H new ATOM 0 HB2 LYS C 92 24.196 5.679 2.699 1.00 0.34 H new ATOM 0 HB3 LYS C 92 24.930 4.106 2.456 1.00 0.34 H new ATOM 0 HG2 LYS C 92 27.206 5.150 2.473 1.00 0.68 H new ATOM 0 HG3 LYS C 92 26.488 6.737 2.671 1.00 0.68 H new ATOM 0 HD2 LYS C 92 27.012 6.153 4.904 1.00 1.08 H new ATOM 0 HD3 LYS C 92 25.320 5.709 4.800 1.00 1.08 H new ATOM 0 HE2 LYS C 92 25.936 3.341 4.347 1.00 1.41 H new ATOM 0 HE3 LYS C 92 27.637 3.761 4.341 1.00 1.41 H new ATOM 0 HZ1 LYS C 92 26.955 2.896 6.499 1.00 2.13 H new ATOM 0 HZ2 LYS C 92 27.429 4.520 6.647 1.00 2.13 H new ATOM 0 HZ3 LYS C 92 25.781 4.113 6.652 1.00 2.13 H new ATOM 5611 N VAL C 93 22.793 5.017 0.096 1.00 0.29 N ATOM 5612 CA VAL C 93 21.714 4.262 -0.593 1.00 0.28 C ATOM 5613 C VAL C 93 22.046 4.204 -2.084 1.00 0.29 C ATOM 5614 O VAL C 93 21.898 3.186 -2.730 1.00 0.29 O ATOM 5615 CB VAL C 93 20.370 4.985 -0.399 1.00 0.28 C ATOM 5616 CG1 VAL C 93 19.303 4.352 -1.304 1.00 0.30 C ATOM 5617 CG2 VAL C 93 19.932 4.902 1.075 1.00 0.28 C ATOM 0 H VAL C 93 22.491 5.860 0.585 1.00 0.29 H new ATOM 0 HA VAL C 93 21.640 3.256 -0.180 1.00 0.28 H new ATOM 0 HB VAL C 93 20.488 6.034 -0.670 1.00 0.28 H new ATOM 0 HG11 VAL C 93 18.353 4.868 -1.163 1.00 0.30 H new ATOM 0 HG12 VAL C 93 19.611 4.439 -2.346 1.00 0.30 H new ATOM 0 HG13 VAL C 93 19.186 3.299 -1.047 1.00 0.30 H new ATOM 0 HG21 VAL C 93 18.980 5.417 1.201 1.00 0.28 H new ATOM 0 HG22 VAL C 93 19.820 3.857 1.363 1.00 0.28 H new ATOM 0 HG23 VAL C 93 20.686 5.374 1.706 1.00 0.28 H new ATOM 5627 N ASP C 94 22.491 5.301 -2.633 1.00 0.30 N ATOM 5628 CA ASP C 94 22.831 5.327 -4.079 1.00 0.32 C ATOM 5629 C ASP C 94 23.932 4.300 -4.358 1.00 0.33 C ATOM 5630 O ASP C 94 23.822 3.493 -5.259 1.00 0.35 O ATOM 5631 CB ASP C 94 23.315 6.730 -4.459 1.00 0.35 C ATOM 5632 CG ASP C 94 23.599 6.791 -5.961 1.00 1.27 C ATOM 5633 OD1 ASP C 94 23.748 5.740 -6.561 1.00 1.96 O ATOM 5634 OD2 ASP C 94 23.660 7.891 -6.488 1.00 2.04 O ATOM 0 H ASP C 94 22.633 6.182 -2.139 1.00 0.30 H new ATOM 0 HA ASP C 94 21.951 5.078 -4.672 1.00 0.32 H new ATOM 0 HB2 ASP C 94 22.560 7.470 -4.192 1.00 0.35 H new ATOM 0 HB3 ASP C 94 24.217 6.978 -3.899 1.00 0.35 H new ATOM 5639 N PHE C 95 24.993 4.317 -3.593 1.00 0.33 N ATOM 5640 CA PHE C 95 26.084 3.327 -3.828 1.00 0.35 C ATOM 5641 C PHE C 95 25.541 1.911 -3.650 1.00 0.34 C ATOM 5642 O PHE C 95 25.745 1.053 -4.485 1.00 0.34 O ATOM 5643 CB PHE C 95 27.234 3.562 -2.843 1.00 0.39 C ATOM 5644 CG PHE C 95 27.998 4.799 -3.253 1.00 0.42 C ATOM 5645 CD1 PHE C 95 28.772 4.786 -4.420 1.00 0.46 C ATOM 5646 CD2 PHE C 95 27.927 5.959 -2.474 1.00 0.42 C ATOM 5647 CE1 PHE C 95 29.475 5.932 -4.807 1.00 0.51 C ATOM 5648 CE2 PHE C 95 28.630 7.106 -2.861 1.00 0.46 C ATOM 5649 CZ PHE C 95 29.404 7.092 -4.028 1.00 0.51 C ATOM 0 H PHE C 95 25.150 4.967 -2.823 1.00 0.33 H new ATOM 0 HA PHE C 95 26.457 3.449 -4.845 1.00 0.35 H new ATOM 0 HB2 PHE C 95 26.844 3.680 -1.832 1.00 0.39 H new ATOM 0 HB3 PHE C 95 27.899 2.698 -2.829 1.00 0.39 H new ATOM 0 HD1 PHE C 95 28.826 3.891 -5.022 1.00 0.46 H new ATOM 0 HD2 PHE C 95 27.330 5.970 -1.574 1.00 0.42 H new ATOM 0 HE1 PHE C 95 30.072 5.921 -5.707 1.00 0.51 H new ATOM 0 HE2 PHE C 95 28.575 8.001 -2.260 1.00 0.46 H new ATOM 0 HZ PHE C 95 29.946 7.977 -4.327 1.00 0.51 H new ATOM 5659 N LEU C 96 24.847 1.651 -2.573 1.00 0.32 N ATOM 5660 CA LEU C 96 24.301 0.282 -2.374 1.00 0.32 C ATOM 5661 C LEU C 96 23.269 0.008 -3.461 1.00 0.31 C ATOM 5662 O LEU C 96 23.212 -1.069 -4.022 1.00 0.32 O ATOM 5663 CB LEU C 96 23.633 0.183 -1.001 1.00 0.32 C ATOM 5664 CG LEU C 96 24.655 0.460 0.110 1.00 0.33 C ATOM 5665 CD1 LEU C 96 23.935 0.449 1.462 1.00 0.35 C ATOM 5666 CD2 LEU C 96 25.753 -0.619 0.103 1.00 0.36 C ATOM 0 H LEU C 96 24.638 2.320 -1.832 1.00 0.32 H new ATOM 0 HA LEU C 96 25.108 -0.449 -2.428 1.00 0.32 H new ATOM 0 HB2 LEU C 96 22.812 0.897 -0.936 1.00 0.32 H new ATOM 0 HB3 LEU C 96 23.203 -0.810 -0.869 1.00 0.32 H new ATOM 0 HG LEU C 96 25.118 1.432 -0.059 1.00 0.33 H new ATOM 0 HD11 LEU C 96 24.653 0.645 2.258 1.00 0.35 H new ATOM 0 HD12 LEU C 96 23.165 1.220 1.470 1.00 0.35 H new ATOM 0 HD13 LEU C 96 23.474 -0.526 1.621 1.00 0.35 H new ATOM 0 HD21 LEU C 96 26.472 -0.412 0.896 1.00 0.36 H new ATOM 0 HD22 LEU C 96 25.303 -1.598 0.269 1.00 0.36 H new ATOM 0 HD23 LEU C 96 26.263 -0.613 -0.860 1.00 0.36 H new ATOM 5678 N GLU C 97 22.459 0.980 -3.775 1.00 0.31 N ATOM 5679 CA GLU C 97 21.443 0.777 -4.838 1.00 0.32 C ATOM 5680 C GLU C 97 22.157 0.455 -6.150 1.00 0.33 C ATOM 5681 O GLU C 97 21.785 -0.455 -6.865 1.00 0.36 O ATOM 5682 CB GLU C 97 20.608 2.049 -4.995 1.00 0.34 C ATOM 5683 CG GLU C 97 19.555 1.839 -6.084 1.00 0.95 C ATOM 5684 CD GLU C 97 18.645 3.066 -6.159 1.00 1.22 C ATOM 5685 OE1 GLU C 97 18.792 3.939 -5.318 1.00 1.86 O ATOM 5686 OE2 GLU C 97 17.819 3.113 -7.055 1.00 1.69 O ATOM 0 H GLU C 97 22.458 1.903 -3.341 1.00 0.31 H new ATOM 0 HA GLU C 97 20.783 -0.048 -4.571 1.00 0.32 H new ATOM 0 HB2 GLU C 97 20.124 2.298 -4.050 1.00 0.34 H new ATOM 0 HB3 GLU C 97 21.252 2.889 -5.255 1.00 0.34 H new ATOM 0 HG2 GLU C 97 20.040 1.674 -7.046 1.00 0.95 H new ATOM 0 HG3 GLU C 97 18.965 0.949 -5.867 1.00 0.95 H new ATOM 5693 N GLU C 98 23.184 1.198 -6.473 1.00 0.34 N ATOM 5694 CA GLU C 98 23.923 0.935 -7.739 1.00 0.37 C ATOM 5695 C GLU C 98 24.533 -0.466 -7.691 1.00 0.36 C ATOM 5696 O GLU C 98 24.486 -1.206 -8.652 1.00 0.37 O ATOM 5697 CB GLU C 98 25.037 1.973 -7.913 1.00 0.40 C ATOM 5698 CG GLU C 98 25.753 1.741 -9.249 1.00 1.19 C ATOM 5699 CD GLU C 98 26.854 2.785 -9.426 1.00 1.33 C ATOM 5700 OE1 GLU C 98 26.935 3.679 -8.599 1.00 1.77 O ATOM 5701 OE2 GLU C 98 27.601 2.673 -10.384 1.00 1.86 O ATOM 0 H GLU C 98 23.541 1.973 -5.915 1.00 0.34 H new ATOM 0 HA GLU C 98 23.233 1.003 -8.580 1.00 0.37 H new ATOM 0 HB2 GLU C 98 24.618 2.979 -7.883 1.00 0.40 H new ATOM 0 HB3 GLU C 98 25.748 1.899 -7.090 1.00 0.40 H new ATOM 0 HG2 GLU C 98 26.180 0.739 -9.275 1.00 1.19 H new ATOM 0 HG3 GLU C 98 25.041 1.806 -10.071 1.00 1.19 H new ATOM 5708 N ASN C 99 25.109 -0.835 -6.579 1.00 0.35 N ATOM 5709 CA ASN C 99 25.720 -2.189 -6.481 1.00 0.35 C ATOM 5710 C ASN C 99 24.630 -3.243 -6.626 1.00 0.33 C ATOM 5711 O ASN C 99 24.812 -4.258 -7.269 1.00 0.35 O ATOM 5712 CB ASN C 99 26.405 -2.346 -5.122 1.00 0.37 C ATOM 5713 CG ASN C 99 27.648 -1.457 -5.076 1.00 1.25 C ATOM 5714 OD1 ASN C 99 28.418 -1.388 -6.126 1.00 2.16 O flip ATOM 5715 ND2 ASN C 99 27.919 -0.820 -4.078 1.00 1.83 N flip ATOM 0 H ASN C 99 25.182 -0.260 -5.739 1.00 0.35 H new ATOM 0 HA ASN C 99 26.459 -2.314 -7.273 1.00 0.35 H new ATOM 0 HB2 ASN C 99 25.718 -2.071 -4.322 1.00 0.37 H new ATOM 0 HB3 ASN C 99 26.683 -3.388 -4.960 1.00 0.37 H new ATOM 0 HD21 ASN C 99 27.315 -0.876 -3.258 1.00 1.83 H new ATOM 0 HD22 ASN C 99 28.750 -0.229 -4.060 1.00 1.83 H new ATOM 5722 N ILE C 100 23.494 -3.010 -6.036 1.00 0.31 N ATOM 5723 CA ILE C 100 22.392 -3.997 -6.143 1.00 0.30 C ATOM 5724 C ILE C 100 21.880 -4.026 -7.584 1.00 0.31 C ATOM 5725 O ILE C 100 21.614 -5.072 -8.134 1.00 0.33 O ATOM 5726 CB ILE C 100 21.264 -3.590 -5.192 1.00 0.29 C ATOM 5727 CG1 ILE C 100 21.734 -3.787 -3.747 1.00 0.29 C ATOM 5728 CG2 ILE C 100 20.025 -4.454 -5.453 1.00 0.29 C ATOM 5729 CD1 ILE C 100 20.742 -3.132 -2.785 1.00 0.30 C ATOM 0 H ILE C 100 23.282 -2.178 -5.485 1.00 0.31 H new ATOM 0 HA ILE C 100 22.750 -4.990 -5.872 1.00 0.30 H new ATOM 0 HB ILE C 100 21.007 -2.544 -5.357 1.00 0.29 H new ATOM 0 HG12 ILE C 100 21.821 -4.851 -3.525 1.00 0.29 H new ATOM 0 HG13 ILE C 100 22.724 -3.352 -3.615 1.00 0.29 H new ATOM 0 HG21 ILE C 100 19.226 -4.159 -4.773 1.00 0.29 H new ATOM 0 HG22 ILE C 100 19.695 -4.315 -6.482 1.00 0.29 H new ATOM 0 HG23 ILE C 100 20.272 -5.503 -5.290 1.00 0.29 H new ATOM 0 HD11 ILE C 100 21.081 -3.275 -1.759 1.00 0.30 H new ATOM 0 HD12 ILE C 100 20.677 -2.065 -3.000 1.00 0.30 H new ATOM 0 HD13 ILE C 100 19.760 -3.588 -2.909 1.00 0.30 H new ATOM 5741 N THR C 101 21.750 -2.889 -8.208 1.00 0.33 N ATOM 5742 CA THR C 101 21.261 -2.879 -9.613 1.00 0.36 C ATOM 5743 C THR C 101 22.257 -3.619 -10.503 1.00 0.38 C ATOM 5744 O THR C 101 21.882 -4.397 -11.357 1.00 0.40 O ATOM 5745 CB THR C 101 21.118 -1.433 -10.096 1.00 0.39 C ATOM 5746 OG1 THR C 101 22.333 -0.737 -9.860 1.00 0.40 O ATOM 5747 CG2 THR C 101 19.975 -0.744 -9.347 1.00 0.39 C ATOM 0 H THR C 101 21.959 -1.974 -7.810 1.00 0.33 H new ATOM 0 HA THR C 101 20.291 -3.374 -9.663 1.00 0.36 H new ATOM 0 HB THR C 101 20.896 -1.429 -11.163 1.00 0.39 H new ATOM 0 HG1 THR C 101 22.906 -1.270 -9.271 1.00 0.40 H new ATOM 0 HG21 THR C 101 19.879 0.284 -9.696 1.00 0.39 H new ATOM 0 HG22 THR C 101 19.044 -1.279 -9.533 1.00 0.39 H new ATOM 0 HG23 THR C 101 20.187 -0.746 -8.278 1.00 0.39 H new ATOM 5755 N ALA C 102 23.527 -3.386 -10.309 1.00 0.38 N ATOM 5756 CA ALA C 102 24.542 -4.081 -11.145 1.00 0.42 C ATOM 5757 C ALA C 102 24.430 -5.593 -10.944 1.00 0.40 C ATOM 5758 O ALA C 102 24.417 -6.354 -11.892 1.00 0.42 O ATOM 5759 CB ALA C 102 25.940 -3.609 -10.747 1.00 0.44 C ATOM 0 H ALA C 102 23.903 -2.746 -9.609 1.00 0.38 H new ATOM 0 HA ALA C 102 24.367 -3.847 -12.195 1.00 0.42 H new ATOM 0 HB1 ALA C 102 26.684 -4.118 -11.360 1.00 0.44 H new ATOM 0 HB2 ALA C 102 26.018 -2.533 -10.901 1.00 0.44 H new ATOM 0 HB3 ALA C 102 26.116 -3.839 -9.696 1.00 0.44 H new ATOM 5765 N LEU C 103 24.357 -6.038 -9.718 1.00 0.37 N ATOM 5766 CA LEU C 103 24.257 -7.503 -9.473 1.00 0.36 C ATOM 5767 C LEU C 103 22.952 -8.036 -10.065 1.00 0.34 C ATOM 5768 O LEU C 103 22.922 -9.094 -10.661 1.00 0.36 O ATOM 5769 CB LEU C 103 24.287 -7.774 -7.966 1.00 0.34 C ATOM 5770 CG LEU C 103 25.651 -7.366 -7.390 1.00 0.36 C ATOM 5771 CD1 LEU C 103 25.600 -7.465 -5.861 1.00 0.38 C ATOM 5772 CD2 LEU C 103 26.765 -8.283 -7.938 1.00 0.43 C ATOM 0 H LEU C 103 24.362 -5.454 -8.882 1.00 0.37 H new ATOM 0 HA LEU C 103 25.099 -8.007 -9.948 1.00 0.36 H new ATOM 0 HB2 LEU C 103 23.492 -7.216 -7.471 1.00 0.34 H new ATOM 0 HB3 LEU C 103 24.102 -8.831 -7.774 1.00 0.34 H new ATOM 0 HG LEU C 103 25.872 -6.341 -7.686 1.00 0.36 H new ATOM 0 HD11 LEU C 103 26.565 -7.177 -5.445 1.00 0.38 H new ATOM 0 HD12 LEU C 103 24.827 -6.799 -5.479 1.00 0.38 H new ATOM 0 HD13 LEU C 103 25.371 -8.490 -5.570 1.00 0.38 H new ATOM 0 HD21 LEU C 103 27.725 -7.980 -7.520 1.00 0.43 H new ATOM 0 HD22 LEU C 103 26.557 -9.316 -7.658 1.00 0.43 H new ATOM 0 HD23 LEU C 103 26.801 -8.202 -9.024 1.00 0.43 H new ATOM 5784 N LEU C 104 21.871 -7.314 -9.926 1.00 0.33 N ATOM 5785 CA LEU C 104 20.591 -7.802 -10.507 1.00 0.33 C ATOM 5786 C LEU C 104 20.753 -7.939 -12.016 1.00 0.37 C ATOM 5787 O LEU C 104 20.336 -8.911 -12.609 1.00 0.39 O ATOM 5788 CB LEU C 104 19.455 -6.821 -10.201 1.00 0.33 C ATOM 5789 CG LEU C 104 19.115 -6.861 -8.705 1.00 0.29 C ATOM 5790 CD1 LEU C 104 18.155 -5.712 -8.379 1.00 0.31 C ATOM 5791 CD2 LEU C 104 18.462 -8.211 -8.337 1.00 0.27 C ATOM 0 H LEU C 104 21.821 -6.418 -9.441 1.00 0.33 H new ATOM 0 HA LEU C 104 20.344 -8.768 -10.067 1.00 0.33 H new ATOM 0 HB2 LEU C 104 19.748 -5.811 -10.489 1.00 0.33 H new ATOM 0 HB3 LEU C 104 18.574 -7.077 -10.789 1.00 0.33 H new ATOM 0 HG LEU C 104 20.032 -6.752 -8.125 1.00 0.29 H new ATOM 0 HD11 LEU C 104 17.909 -5.734 -7.317 1.00 0.31 H new ATOM 0 HD12 LEU C 104 18.630 -4.761 -8.622 1.00 0.31 H new ATOM 0 HD13 LEU C 104 17.243 -5.822 -8.965 1.00 0.31 H new ATOM 0 HD21 LEU C 104 18.227 -8.223 -7.273 1.00 0.27 H new ATOM 0 HD22 LEU C 104 17.545 -8.341 -8.913 1.00 0.27 H new ATOM 0 HD23 LEU C 104 19.152 -9.023 -8.566 1.00 0.27 H new ATOM 5803 N GLU C 105 21.371 -6.979 -12.647 1.00 0.40 N ATOM 5804 CA GLU C 105 21.562 -7.077 -14.117 1.00 0.45 C ATOM 5805 C GLU C 105 22.378 -8.335 -14.414 1.00 0.46 C ATOM 5806 O GLU C 105 22.009 -9.146 -15.240 1.00 0.48 O ATOM 5807 CB GLU C 105 22.297 -5.832 -14.621 1.00 0.49 C ATOM 5808 CG GLU C 105 22.484 -5.913 -16.136 1.00 0.53 C ATOM 5809 CD GLU C 105 23.217 -4.662 -16.624 1.00 1.15 C ATOM 5810 OE1 GLU C 105 23.369 -3.745 -15.834 1.00 1.85 O ATOM 5811 OE2 GLU C 105 23.607 -4.642 -17.779 1.00 1.83 O ATOM 0 H GLU C 105 21.749 -6.138 -12.211 1.00 0.40 H new ATOM 0 HA GLU C 105 20.599 -7.138 -14.624 1.00 0.45 H new ATOM 0 HB2 GLU C 105 21.731 -4.937 -14.363 1.00 0.49 H new ATOM 0 HB3 GLU C 105 23.267 -5.749 -14.130 1.00 0.49 H new ATOM 0 HG2 GLU C 105 23.052 -6.806 -16.396 1.00 0.53 H new ATOM 0 HG3 GLU C 105 21.516 -5.996 -16.629 1.00 0.53 H new ATOM 5818 N GLU C 106 23.478 -8.512 -13.733 1.00 0.45 N ATOM 5819 CA GLU C 106 24.303 -9.729 -13.965 1.00 0.47 C ATOM 5820 C GLU C 106 23.497 -10.961 -13.553 1.00 0.44 C ATOM 5821 O GLU C 106 23.517 -11.980 -14.213 1.00 0.46 O ATOM 5822 CB GLU C 106 25.577 -9.644 -13.119 1.00 0.49 C ATOM 5823 CG GLU C 106 26.444 -10.885 -13.357 1.00 1.17 C ATOM 5824 CD GLU C 106 27.717 -10.788 -12.515 1.00 1.66 C ATOM 5825 OE1 GLU C 106 27.851 -9.818 -11.788 1.00 2.27 O ATOM 5826 OE2 GLU C 106 28.533 -11.689 -12.607 1.00 2.25 O ATOM 0 H GLU C 106 23.839 -7.868 -13.029 1.00 0.45 H new ATOM 0 HA GLU C 106 24.572 -9.801 -15.019 1.00 0.47 H new ATOM 0 HB2 GLU C 106 26.136 -8.744 -13.377 1.00 0.49 H new ATOM 0 HB3 GLU C 106 25.318 -9.567 -12.063 1.00 0.49 H new ATOM 0 HG2 GLU C 106 25.889 -11.785 -13.094 1.00 1.17 H new ATOM 0 HG3 GLU C 106 26.700 -10.966 -14.414 1.00 1.17 H new ATOM 5833 N ALA C 107 22.788 -10.872 -12.459 1.00 0.40 N ATOM 5834 CA ALA C 107 21.979 -12.035 -11.999 1.00 0.37 C ATOM 5835 C ALA C 107 20.915 -12.362 -13.048 1.00 0.40 C ATOM 5836 O ALA C 107 20.717 -13.506 -13.404 1.00 0.41 O ATOM 5837 CB ALA C 107 21.305 -11.697 -10.668 1.00 0.34 C ATOM 0 H ALA C 107 22.735 -10.044 -11.865 1.00 0.40 H new ATOM 0 HA ALA C 107 22.629 -12.899 -11.862 1.00 0.37 H new ATOM 0 HB1 ALA C 107 20.714 -12.549 -10.333 1.00 0.34 H new ATOM 0 HB2 ALA C 107 22.066 -11.468 -9.922 1.00 0.34 H new ATOM 0 HB3 ALA C 107 20.654 -10.833 -10.799 1.00 0.34 H new ATOM 5843 N GLN C 108 20.231 -11.368 -13.556 1.00 0.42 N ATOM 5844 CA GLN C 108 19.195 -11.650 -14.588 1.00 0.46 C ATOM 5845 C GLN C 108 19.862 -12.317 -15.789 1.00 0.50 C ATOM 5846 O GLN C 108 19.410 -13.334 -16.274 1.00 0.53 O ATOM 5847 CB GLN C 108 18.514 -10.346 -15.022 1.00 0.49 C ATOM 5848 CG GLN C 108 17.628 -9.826 -13.888 1.00 0.47 C ATOM 5849 CD GLN C 108 17.102 -8.434 -14.245 1.00 0.98 C ATOM 5850 OE1 GLN C 108 17.810 -7.637 -14.829 1.00 1.68 O ATOM 5851 NE2 GLN C 108 15.882 -8.107 -13.918 1.00 1.58 N ATOM 0 H GLN C 108 20.345 -10.386 -13.303 1.00 0.42 H new ATOM 0 HA GLN C 108 18.437 -12.314 -14.173 1.00 0.46 H new ATOM 0 HB2 GLN C 108 19.266 -9.600 -15.281 1.00 0.49 H new ATOM 0 HB3 GLN C 108 17.914 -10.517 -15.916 1.00 0.49 H new ATOM 0 HG2 GLN C 108 16.795 -10.509 -13.721 1.00 0.47 H new ATOM 0 HG3 GLN C 108 18.196 -9.784 -12.959 1.00 0.47 H new ATOM 0 HE21 GLN C 108 15.289 -8.776 -13.428 1.00 1.58 H new ATOM 0 HE22 GLN C 108 15.522 -7.182 -14.152 1.00 1.58 H new ATOM 5860 N ILE C 109 20.946 -11.765 -16.264 1.00 0.52 N ATOM 5861 CA ILE C 109 21.643 -12.393 -17.418 1.00 0.57 C ATOM 5862 C ILE C 109 22.072 -13.809 -17.026 1.00 0.56 C ATOM 5863 O ILE C 109 21.826 -14.764 -17.734 1.00 0.58 O ATOM 5864 CB ILE C 109 22.872 -11.562 -17.788 1.00 0.61 C ATOM 5865 CG1 ILE C 109 22.424 -10.171 -18.244 1.00 0.64 C ATOM 5866 CG2 ILE C 109 23.625 -12.250 -18.930 1.00 0.67 C ATOM 5867 CD1 ILE C 109 23.642 -9.254 -18.371 1.00 0.67 C ATOM 0 H ILE C 109 21.375 -10.912 -15.904 1.00 0.52 H new ATOM 0 HA ILE C 109 20.974 -12.437 -18.277 1.00 0.57 H new ATOM 0 HB ILE C 109 23.526 -11.471 -16.921 1.00 0.61 H new ATOM 0 HG12 ILE C 109 21.907 -10.240 -19.201 1.00 0.64 H new ATOM 0 HG13 ILE C 109 21.715 -9.754 -17.529 1.00 0.64 H new ATOM 0 HG21 ILE C 109 24.502 -11.659 -19.196 1.00 0.67 H new ATOM 0 HG22 ILE C 109 23.940 -13.244 -18.612 1.00 0.67 H new ATOM 0 HG23 ILE C 109 22.970 -12.337 -19.797 1.00 0.67 H new ATOM 0 HD11 ILE C 109 23.320 -8.265 -18.696 1.00 0.67 H new ATOM 0 HD12 ILE C 109 24.140 -9.175 -17.405 1.00 0.67 H new ATOM 0 HD13 ILE C 109 24.335 -9.669 -19.103 1.00 0.67 H new ATOM 5879 N GLN C 110 22.719 -13.944 -15.896 1.00 0.53 N ATOM 5880 CA GLN C 110 23.173 -15.292 -15.449 1.00 0.52 C ATOM 5881 C GLN C 110 21.958 -16.193 -15.211 1.00 0.48 C ATOM 5882 O GLN C 110 21.964 -17.360 -15.548 1.00 0.50 O ATOM 5883 CB GLN C 110 23.970 -15.153 -14.148 1.00 0.50 C ATOM 5884 CG GLN C 110 24.451 -16.532 -13.687 1.00 1.18 C ATOM 5885 CD GLN C 110 25.349 -16.376 -12.458 1.00 1.46 C ATOM 5886 OE1 GLN C 110 25.728 -15.277 -12.105 1.00 2.12 O ATOM 5887 NE2 GLN C 110 25.708 -17.436 -11.787 1.00 1.93 N ATOM 0 H GLN C 110 22.952 -13.177 -15.265 1.00 0.53 H new ATOM 0 HA GLN C 110 23.804 -15.736 -16.219 1.00 0.52 H new ATOM 0 HB2 GLN C 110 24.823 -14.492 -14.302 1.00 0.50 H new ATOM 0 HB3 GLN C 110 23.349 -14.697 -13.377 1.00 0.50 H new ATOM 0 HG2 GLN C 110 23.597 -17.165 -13.448 1.00 1.18 H new ATOM 0 HG3 GLN C 110 24.999 -17.025 -14.490 1.00 1.18 H new ATOM 0 HE21 GLN C 110 25.390 -18.359 -12.083 1.00 1.93 H new ATOM 0 HE22 GLN C 110 26.307 -17.342 -10.966 1.00 1.93 H new ATOM 5896 N GLN C 111 20.917 -15.661 -14.630 1.00 0.45 N ATOM 5897 CA GLN C 111 19.706 -16.490 -14.370 1.00 0.43 C ATOM 5898 C GLN C 111 19.163 -17.019 -15.697 1.00 0.49 C ATOM 5899 O GLN C 111 18.835 -18.182 -15.828 1.00 0.49 O ATOM 5900 CB GLN C 111 18.639 -15.629 -13.688 1.00 0.42 C ATOM 5901 CG GLN C 111 17.483 -16.510 -13.207 1.00 0.42 C ATOM 5902 CD GLN C 111 17.944 -17.366 -12.025 1.00 0.37 C ATOM 5903 OE1 GLN C 111 18.669 -16.899 -11.168 1.00 0.37 O ATOM 5904 NE2 GLN C 111 17.542 -18.605 -11.937 1.00 0.40 N ATOM 0 H GLN C 111 20.853 -14.690 -14.325 1.00 0.45 H new ATOM 0 HA GLN C 111 19.966 -17.327 -13.722 1.00 0.43 H new ATOM 0 HB2 GLN C 111 19.076 -15.095 -12.844 1.00 0.42 H new ATOM 0 HB3 GLN C 111 18.268 -14.876 -14.384 1.00 0.42 H new ATOM 0 HG2 GLN C 111 16.638 -15.888 -12.911 1.00 0.42 H new ATOM 0 HG3 GLN C 111 17.138 -17.150 -14.019 1.00 0.42 H new ATOM 0 HE21 GLN C 111 16.934 -18.996 -12.656 1.00 0.40 H new ATOM 0 HE22 GLN C 111 17.836 -19.182 -11.149 1.00 0.40 H new ATOM 5913 N GLU C 112 19.072 -16.173 -16.685 1.00 0.54 N ATOM 5914 CA GLU C 112 18.555 -16.627 -18.003 1.00 0.60 C ATOM 5915 C GLU C 112 19.549 -17.612 -18.618 1.00 0.62 C ATOM 5916 O GLU C 112 19.173 -18.603 -19.213 1.00 0.65 O ATOM 5917 CB GLU C 112 18.398 -15.421 -18.932 1.00 0.66 C ATOM 5918 CG GLU C 112 17.239 -14.549 -18.448 1.00 1.29 C ATOM 5919 CD GLU C 112 15.916 -15.278 -18.687 1.00 1.72 C ATOM 5920 OE1 GLU C 112 15.900 -16.175 -19.514 1.00 2.27 O ATOM 5921 OE2 GLU C 112 14.943 -14.928 -18.039 1.00 2.25 O ATOM 0 H GLU C 112 19.333 -15.188 -16.636 1.00 0.54 H new ATOM 0 HA GLU C 112 17.588 -17.112 -17.870 1.00 0.60 H new ATOM 0 HB2 GLU C 112 19.320 -14.840 -18.950 1.00 0.66 H new ATOM 0 HB3 GLU C 112 18.213 -15.757 -19.952 1.00 0.66 H new ATOM 0 HG2 GLU C 112 17.357 -14.325 -17.388 1.00 1.29 H new ATOM 0 HG3 GLU C 112 17.242 -13.596 -18.977 1.00 1.29 H new ATOM 5928 N LYS C 113 20.819 -17.341 -18.480 1.00 0.62 N ATOM 5929 CA LYS C 113 21.843 -18.254 -19.059 1.00 0.65 C ATOM 5930 C LYS C 113 21.771 -19.614 -18.358 1.00 0.60 C ATOM 5931 O LYS C 113 21.884 -20.648 -18.984 1.00 0.63 O ATOM 5932 CB LYS C 113 23.235 -17.646 -18.849 1.00 0.68 C ATOM 5933 CG LYS C 113 23.419 -16.400 -19.735 1.00 0.75 C ATOM 5934 CD LYS C 113 23.771 -16.801 -21.175 1.00 1.27 C ATOM 5935 CE LYS C 113 24.158 -15.550 -21.970 1.00 1.53 C ATOM 5936 NZ LYS C 113 25.451 -15.011 -21.460 1.00 2.10 N ATOM 0 H LYS C 113 21.190 -16.527 -17.991 1.00 0.62 H new ATOM 0 HA LYS C 113 21.655 -18.386 -20.125 1.00 0.65 H new ATOM 0 HB2 LYS C 113 23.366 -17.377 -17.801 1.00 0.68 H new ATOM 0 HB3 LYS C 113 24.001 -18.385 -19.087 1.00 0.68 H new ATOM 0 HG2 LYS C 113 22.504 -15.807 -19.731 1.00 0.75 H new ATOM 0 HG3 LYS C 113 24.208 -15.770 -19.325 1.00 0.75 H new ATOM 0 HD2 LYS C 113 24.595 -17.515 -21.175 1.00 1.27 H new ATOM 0 HD3 LYS C 113 22.921 -17.296 -21.645 1.00 1.27 H new ATOM 0 HE2 LYS C 113 24.247 -15.793 -23.029 1.00 1.53 H new ATOM 0 HE3 LYS C 113 23.377 -14.795 -21.881 1.00 1.53 H new ATOM 0 HZ1 LYS C 113 25.912 -14.452 -22.206 1.00 2.10 H new ATOM 0 HZ2 LYS C 113 25.273 -14.406 -20.633 1.00 2.10 H new ATOM 0 HZ3 LYS C 113 26.071 -15.799 -21.185 1.00 2.10 H new ATOM 5950 N ASN C 114 21.576 -19.627 -17.064 1.00 0.53 N ATOM 5951 CA ASN C 114 21.492 -20.931 -16.349 1.00 0.49 C ATOM 5952 C ASN C 114 20.287 -21.711 -16.865 1.00 0.49 C ATOM 5953 O ASN C 114 20.358 -22.901 -17.097 1.00 0.51 O ATOM 5954 CB ASN C 114 21.333 -20.691 -14.845 1.00 0.44 C ATOM 5955 CG ASN C 114 22.638 -20.137 -14.274 1.00 0.46 C ATOM 5956 OD1 ASN C 114 23.700 -20.376 -14.814 1.00 1.19 O ATOM 5957 ND2 ASN C 114 22.605 -19.406 -13.194 1.00 1.18 N ATOM 0 H ASN C 114 21.472 -18.798 -16.478 1.00 0.53 H new ATOM 0 HA ASN C 114 22.405 -21.499 -16.528 1.00 0.49 H new ATOM 0 HB2 ASN C 114 20.518 -19.991 -14.662 1.00 0.44 H new ATOM 0 HB3 ASN C 114 21.071 -21.623 -14.343 1.00 0.44 H new ATOM 0 HD21 ASN C 114 23.471 -19.035 -12.803 1.00 1.18 H new ATOM 0 HD22 ASN C 114 21.713 -19.206 -12.741 1.00 1.18 H new ATOM 5964 N MET C 115 19.182 -21.046 -17.057 1.00 0.50 N ATOM 5965 CA MET C 115 17.980 -21.751 -17.569 1.00 0.54 C ATOM 5966 C MET C 115 18.241 -22.194 -19.009 1.00 0.61 C ATOM 5967 O MET C 115 17.876 -23.282 -19.411 1.00 0.63 O ATOM 5968 CB MET C 115 16.780 -20.803 -17.519 1.00 0.57 C ATOM 5969 CG MET C 115 15.512 -21.555 -17.923 1.00 0.72 C ATOM 5970 SD MET C 115 14.093 -20.436 -17.818 1.00 0.94 S ATOM 5971 CE MET C 115 12.881 -21.537 -18.588 1.00 1.46 C ATOM 0 H MET C 115 19.062 -20.048 -16.882 1.00 0.50 H new ATOM 0 HA MET C 115 17.767 -22.626 -16.955 1.00 0.54 H new ATOM 0 HB2 MET C 115 16.668 -20.395 -16.514 1.00 0.57 H new ATOM 0 HB3 MET C 115 16.943 -19.959 -18.189 1.00 0.57 H new ATOM 0 HG2 MET C 115 15.612 -21.940 -18.938 1.00 0.72 H new ATOM 0 HG3 MET C 115 15.361 -22.414 -17.269 1.00 0.72 H new ATOM 0 HE1 MET C 115 11.912 -21.040 -18.628 1.00 1.46 H new ATOM 0 HE2 MET C 115 13.204 -21.784 -19.599 1.00 1.46 H new ATOM 0 HE3 MET C 115 12.796 -22.452 -18.001 1.00 1.46 H new ATOM 5981 N TYR C 116 18.882 -21.363 -19.787 1.00 0.65 N ATOM 5982 CA TYR C 116 19.179 -21.740 -21.195 1.00 0.73 C ATOM 5983 C TYR C 116 20.043 -23.005 -21.207 1.00 0.72 C ATOM 5984 O TYR C 116 19.802 -23.924 -21.963 1.00 0.76 O ATOM 5985 CB TYR C 116 19.929 -20.601 -21.888 1.00 0.78 C ATOM 5986 CG TYR C 116 20.223 -20.987 -23.318 1.00 0.87 C ATOM 5987 CD1 TYR C 116 19.298 -20.680 -24.323 1.00 0.95 C ATOM 5988 CD2 TYR C 116 21.417 -21.648 -23.644 1.00 0.91 C ATOM 5989 CE1 TYR C 116 19.562 -21.031 -25.651 1.00 1.05 C ATOM 5990 CE2 TYR C 116 21.680 -21.999 -24.975 1.00 1.01 C ATOM 5991 CZ TYR C 116 20.752 -21.691 -25.977 1.00 1.07 C ATOM 5992 OH TYR C 116 21.010 -22.038 -27.288 1.00 1.18 O ATOM 0 H TYR C 116 19.212 -20.440 -19.506 1.00 0.65 H new ATOM 0 HA TYR C 116 18.246 -21.928 -21.725 1.00 0.73 H new ATOM 0 HB2 TYR C 116 19.332 -19.689 -21.862 1.00 0.78 H new ATOM 0 HB3 TYR C 116 20.858 -20.389 -21.359 1.00 0.78 H new ATOM 0 HD1 TYR C 116 18.379 -20.171 -24.072 1.00 0.95 H new ATOM 0 HD2 TYR C 116 22.132 -21.886 -22.870 1.00 0.91 H new ATOM 0 HE1 TYR C 116 18.847 -20.793 -26.425 1.00 1.05 H new ATOM 0 HE2 TYR C 116 22.599 -22.507 -25.228 1.00 1.01 H new ATOM 0 HH TYR C 116 21.879 -22.488 -27.342 1.00 1.18 H new ATOM 6002 N GLU C 117 21.053 -23.055 -20.376 1.00 0.68 N ATOM 6003 CA GLU C 117 21.929 -24.262 -20.346 1.00 0.68 C ATOM 6004 C GLU C 117 21.093 -25.486 -19.977 1.00 0.65 C ATOM 6005 O GLU C 117 21.263 -26.557 -20.527 1.00 0.69 O ATOM 6006 CB GLU C 117 23.032 -24.069 -19.304 1.00 0.66 C ATOM 6007 CG GLU C 117 24.016 -23.004 -19.791 1.00 0.73 C ATOM 6008 CD GLU C 117 25.119 -22.810 -18.749 1.00 0.73 C ATOM 6009 OE1 GLU C 117 24.992 -23.361 -17.669 1.00 1.29 O ATOM 6010 OE2 GLU C 117 26.076 -22.117 -19.052 1.00 1.28 O ATOM 0 H GLU C 117 21.307 -22.316 -19.721 1.00 0.68 H new ATOM 0 HA GLU C 117 22.379 -24.408 -21.328 1.00 0.68 H new ATOM 0 HB2 GLU C 117 22.597 -23.768 -18.351 1.00 0.66 H new ATOM 0 HB3 GLU C 117 23.554 -25.010 -19.133 1.00 0.66 H new ATOM 0 HG2 GLU C 117 24.451 -23.305 -20.744 1.00 0.73 H new ATOM 0 HG3 GLU C 117 23.494 -22.063 -19.962 1.00 0.73 H new ATOM 6017 N LEU C 118 20.191 -25.335 -19.047 1.00 0.58 N ATOM 6018 CA LEU C 118 19.341 -26.485 -18.639 1.00 0.56 C ATOM 6019 C LEU C 118 18.540 -26.966 -19.852 1.00 0.65 C ATOM 6020 O LEU C 118 18.410 -28.150 -20.097 1.00 0.67 O ATOM 6021 CB LEU C 118 18.389 -26.038 -17.522 1.00 0.51 C ATOM 6022 CG LEU C 118 17.496 -27.205 -17.078 1.00 0.52 C ATOM 6023 CD1 LEU C 118 18.360 -28.352 -16.523 1.00 0.54 C ATOM 6024 CD2 LEU C 118 16.538 -26.711 -15.989 1.00 0.53 C ATOM 0 H LEU C 118 20.007 -24.462 -18.552 1.00 0.58 H new ATOM 0 HA LEU C 118 19.963 -27.301 -18.271 1.00 0.56 H new ATOM 0 HB2 LEU C 118 18.964 -25.668 -16.673 1.00 0.51 H new ATOM 0 HB3 LEU C 118 17.770 -25.212 -17.872 1.00 0.51 H new ATOM 0 HG LEU C 118 16.930 -27.574 -17.933 1.00 0.52 H new ATOM 0 HD11 LEU C 118 17.716 -29.174 -16.211 1.00 0.54 H new ATOM 0 HD12 LEU C 118 19.044 -28.700 -17.297 1.00 0.54 H new ATOM 0 HD13 LEU C 118 18.933 -27.995 -15.667 1.00 0.54 H new ATOM 0 HD21 LEU C 118 15.899 -27.533 -15.667 1.00 0.53 H new ATOM 0 HD22 LEU C 118 17.112 -26.343 -15.139 1.00 0.53 H new ATOM 0 HD23 LEU C 118 15.920 -25.905 -16.386 1.00 0.53 H new ATOM 6036 N GLN C 119 18.001 -26.051 -20.614 1.00 0.71 N ATOM 6037 CA GLN C 119 17.209 -26.443 -21.814 1.00 0.82 C ATOM 6038 C GLN C 119 18.101 -27.211 -22.791 1.00 0.87 C ATOM 6039 O GLN C 119 17.687 -28.179 -23.396 1.00 0.92 O ATOM 6040 CB GLN C 119 16.665 -25.186 -22.496 1.00 0.88 C ATOM 6041 CG GLN C 119 15.582 -24.560 -21.616 1.00 0.87 C ATOM 6042 CD GLN C 119 15.049 -23.288 -22.280 1.00 0.95 C ATOM 6043 OE1 GLN C 119 15.798 -22.545 -22.885 1.00 1.29 O ATOM 6044 NE2 GLN C 119 13.779 -23.003 -22.191 1.00 1.46 N ATOM 0 H GLN C 119 18.076 -25.046 -20.455 1.00 0.71 H new ATOM 0 HA GLN C 119 16.379 -27.080 -21.509 1.00 0.82 H new ATOM 0 HB2 GLN C 119 17.471 -24.472 -22.663 1.00 0.88 H new ATOM 0 HB3 GLN C 119 16.254 -25.438 -23.474 1.00 0.88 H new ATOM 0 HG2 GLN C 119 14.769 -25.270 -21.463 1.00 0.87 H new ATOM 0 HG3 GLN C 119 15.990 -24.325 -20.633 1.00 0.87 H new ATOM 0 HE21 GLN C 119 13.151 -23.626 -21.684 1.00 1.46 H new ATOM 0 HE22 GLN C 119 13.414 -22.157 -22.629 1.00 1.46 H new ATOM 6053 N LYS C 120 19.323 -26.784 -22.951 1.00 0.86 N ATOM 6054 CA LYS C 120 20.243 -27.485 -23.889 1.00 0.93 C ATOM 6055 C LYS C 120 20.414 -28.935 -23.440 1.00 0.91 C ATOM 6056 O LYS C 120 20.445 -29.841 -24.249 1.00 0.99 O ATOM 6057 CB LYS C 120 21.606 -26.778 -23.909 1.00 0.95 C ATOM 6058 CG LYS C 120 21.476 -25.394 -24.573 1.00 1.02 C ATOM 6059 CD LYS C 120 21.532 -25.515 -26.115 1.00 1.58 C ATOM 6060 CE LYS C 120 22.973 -25.339 -26.612 1.00 1.89 C ATOM 6061 NZ LYS C 120 23.910 -26.057 -25.702 1.00 2.45 N ATOM 0 H LYS C 120 19.725 -25.978 -22.471 1.00 0.86 H new ATOM 0 HA LYS C 120 19.822 -27.465 -24.894 1.00 0.93 H new ATOM 0 HB2 LYS C 120 21.982 -26.668 -22.892 1.00 0.95 H new ATOM 0 HB3 LYS C 120 22.331 -27.384 -24.453 1.00 0.95 H new ATOM 0 HG2 LYS C 120 20.536 -24.930 -24.274 1.00 1.02 H new ATOM 0 HG3 LYS C 120 22.278 -24.743 -24.226 1.00 1.02 H new ATOM 0 HD2 LYS C 120 21.150 -26.488 -26.424 1.00 1.58 H new ATOM 0 HD3 LYS C 120 20.889 -24.761 -26.569 1.00 1.58 H new ATOM 0 HE2 LYS C 120 23.068 -25.726 -27.626 1.00 1.89 H new ATOM 0 HE3 LYS C 120 23.228 -24.280 -26.650 1.00 1.89 H new ATOM 0 HZ1 LYS C 120 24.885 -25.936 -26.042 1.00 2.45 H new ATOM 0 HZ2 LYS C 120 23.827 -25.668 -24.741 1.00 2.45 H new ATOM 0 HZ3 LYS C 120 23.672 -27.069 -25.687 1.00 2.45 H new ATOM 6075 N LEU C 121 20.518 -29.171 -22.162 1.00 0.80 N ATOM 6076 CA LEU C 121 20.673 -30.575 -21.696 1.00 0.79 C ATOM 6077 C LEU C 121 19.451 -31.359 -22.158 1.00 0.87 C ATOM 6078 O LEU C 121 19.566 -32.441 -22.698 1.00 0.96 O ATOM 6079 CB LEU C 121 20.753 -30.608 -20.166 1.00 0.68 C ATOM 6080 CG LEU C 121 21.982 -29.826 -19.682 1.00 0.67 C ATOM 6081 CD1 LEU C 121 21.972 -29.768 -18.151 1.00 0.62 C ATOM 6082 CD2 LEU C 121 23.272 -30.522 -20.157 1.00 0.77 C ATOM 0 H LEU C 121 20.503 -28.462 -21.429 1.00 0.80 H new ATOM 0 HA LEU C 121 21.585 -31.011 -22.104 1.00 0.79 H new ATOM 0 HB2 LEU C 121 19.848 -30.178 -19.738 1.00 0.68 H new ATOM 0 HB3 LEU C 121 20.810 -31.640 -19.820 1.00 0.68 H new ATOM 0 HG LEU C 121 21.949 -28.817 -20.093 1.00 0.67 H new ATOM 0 HD11 LEU C 121 22.843 -29.213 -17.802 1.00 0.62 H new ATOM 0 HD12 LEU C 121 21.064 -29.269 -17.812 1.00 0.62 H new ATOM 0 HD13 LEU C 121 22.001 -30.780 -17.748 1.00 0.62 H new ATOM 0 HD21 LEU C 121 24.138 -29.960 -19.809 1.00 0.77 H new ATOM 0 HD22 LEU C 121 23.310 -31.534 -19.753 1.00 0.77 H new ATOM 0 HD23 LEU C 121 23.282 -30.566 -21.246 1.00 0.77 H new ATOM 6094 N ASN C 122 18.280 -30.800 -21.976 1.00 0.88 N ATOM 6095 CA ASN C 122 17.027 -31.481 -22.426 1.00 1.03 C ATOM 6096 C ASN C 122 16.273 -30.542 -23.369 1.00 1.08 C ATOM 6097 O ASN C 122 15.157 -30.143 -23.102 1.00 1.15 O ATOM 6098 CB ASN C 122 16.148 -31.790 -21.210 1.00 1.11 C ATOM 6099 CG ASN C 122 14.901 -32.556 -21.661 1.00 1.31 C ATOM 6100 OD1 ASN C 122 13.839 -31.982 -21.799 1.00 1.78 O ATOM 6101 ND2 ASN C 122 14.985 -33.837 -21.898 1.00 1.70 N ATOM 0 H ASN C 122 18.138 -29.893 -21.531 1.00 0.88 H new ATOM 0 HA ASN C 122 17.272 -32.411 -22.939 1.00 1.03 H new ATOM 0 HB2 ASN C 122 16.708 -32.380 -20.484 1.00 1.11 H new ATOM 0 HB3 ASN C 122 15.859 -30.864 -20.713 1.00 1.11 H new ATOM 0 HD21 ASN C 122 14.160 -34.355 -22.199 1.00 1.70 H new ATOM 0 HD22 ASN C 122 15.876 -34.320 -21.782 1.00 1.70 H new ATOM 6108 N SER C 123 16.877 -30.183 -24.474 1.00 1.09 N ATOM 6109 CA SER C 123 16.199 -29.266 -25.437 1.00 1.18 C ATOM 6110 C SER C 123 15.386 -30.095 -26.436 1.00 1.37 C ATOM 6111 O SER C 123 15.600 -31.295 -26.491 1.00 1.92 O ATOM 6112 CB SER C 123 17.254 -28.453 -26.193 1.00 1.16 C ATOM 6113 OG SER C 123 16.761 -28.126 -27.487 1.00 1.84 O ATOM 6114 OXT SER C 123 14.565 -29.515 -27.126 1.00 1.66 O ATOM 0 H SER C 123 17.811 -30.486 -24.750 1.00 1.09 H new ATOM 0 HA SER C 123 15.537 -28.590 -24.896 1.00 1.18 H new ATOM 0 HB2 SER C 123 17.492 -27.543 -25.642 1.00 1.16 H new ATOM 0 HB3 SER C 123 18.178 -29.025 -26.278 1.00 1.16 H new ATOM 0 HG SER C 123 15.783 -28.188 -27.490 1.00 1.84 H new TER 6120 SER C 123