USER MOD reduce.3.24.130724 H: found=0, std=0, add=2820, rem=0, adj=78 USER MOD reduce.3.24.130724 removed 2823 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= -1.99 K(o=-12,f=-21!) USER MOD Set 1.2: B 16 GLN : amide:sc= -3.38! C(o=-12!,f=-12!) USER MOD Set 1.3: C 110 GLN : amide:sc= -4.79! C(o=-12!,f=-12!) USER MOD Set 1.4: C 111 GLN : amide:sc= -1.6 K(o=-12,f=-15!) USER MOD Set 2.1: A 24 GLN : amide:sc= -2.05 K(o=-6,f=-11!) USER MOD Set 2.2: B 24 GLN : amide:sc= -1.95 K(o=-6,f=-11!) USER MOD Set 2.3: C 24 GLN : amide:sc= -2.02 K(o=-6,f=-11!) USER MOD Set 3.1: A 110 GLN : amide:sc= -5.68! C(o=-13!,f=-13!) USER MOD Set 3.2: A 111 GLN : amide:sc= -1.58 K(o=-13,f=-16!) USER MOD Set 3.3: C 13 GLN : amide:sc= -2.3 K(o=-13,f=-23!) USER MOD Set 3.4: C 16 GLN : amide:sc= -3.58! C(o=-13!,f=-13!) USER MOD Set 4.1: B 37 ASN :FLIP amide:sc= -3.09! C(o=-17!,f=-15!) USER MOD Set 4.2: C 82 ASN :FLIP amide:sc= -12! C(o=-21!,f=-15!) USER MOD Set 5.1: A 82 ASN :FLIP amide:sc= -12.2! C(o=-22!,f=-16!) USER MOD Set 5.2: C 37 ASN :FLIP amide:sc= -3.29! C(o=-18!,f=-16!) USER MOD Set 6.1: A 37 ASN :FLIP amide:sc= -3.15! C(o=-17!,f=-16!) USER MOD Set 6.2: B 82 ASN :FLIP amide:sc= -12.7! C(o=-21!,f=-16!) USER MOD Set 7.1: A 13 GLN : amide:sc= -2.34 K(o=-13,f=-22!) USER MOD Set 7.2: A 16 GLN : amide:sc= -3.45! C(o=-13!,f=-13!) USER MOD Set 7.3: B 110 GLN : amide:sc= -5.25! C(o=-13!,f=-12!) USER MOD Set 7.4: B 111 GLN : amide:sc= -1.66 K(o=-13,f=-16!) USER MOD Set 8.1: A 2 GLN : amide:sc= -2.14 K(o=-6,f=-6.7!) USER MOD Set 8.2: B 2 GLN : amide:sc= -2.05 K(o=-6,f=-7.1!) USER MOD Set 8.3: C 2 GLN : amide:sc= -1.85 K(o=-6,f=-6.8!) USER MOD Single : A 1 ALA N :NH3+ 168:sc= -0.0839 (180deg=-0.0893) USER MOD Single : A 3 SER OG : rot 170:sc= -1.05 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 14 GLN : amide:sc= -2.16 K(o=-2.2,f=-3.2!) USER MOD Single : A 15 GLN : amide:sc=-0.000824 K(o=-0.00082,f=-1.8!) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 GLN :FLIP amide:sc= -2.14! C(o=-5.2!,f=-2.1!) USER MOD Single : A 31 THR OG1 : rot -38:sc= 0.697 USER MOD Single : A 35 THR OG1 : rot 78:sc= 0.784 USER MOD Single : A 36 LYS NZ :NH3+ -128:sc= -1.02 (180deg=-2.75!) USER MOD Single : A 39 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 40 THR OG1 : rot -70:sc= 0.657 USER MOD Single : A 43 THR OG1 : rot -42:sc= 0.679 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 LYS NZ :NH3+ -133:sc= -5.03! (180deg=-9.49!) USER MOD Single : A 52 GLN :FLIP amide:sc= -8.28! C(o=-12!,f=-8.3!) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 56 ASN : amide:sc= -3.73! C(o=-3.7!,f=-12!) 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 74 ASN : amide:sc= -0.463 K(o=-0.46,f=-3.1!) USER MOD Single : A 76 SER OG : rot -42:sc= 1.26 USER MOD Single : A 78 THR OG1 : rot 90:sc= 0.0747 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 ASN :FLIP amide:sc= -3.11! C(o=-4.4!,f=-3.1!) USER MOD Single : A 85 THR OG1 : rot -17:sc= -0.147 USER MOD Single : A 87 GLN : amide:sc=-0.00768 K(o=-0.0077,f=-1.7!) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 ASN : amide:sc= -7.36! C(o=-7.4!,f=-13!) USER MOD Single : A 101 THR OG1 : rot -23:sc= -0.109 USER MOD Single : A 108 GLN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 113 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0723) USER MOD Single : A 114 ASN : amide:sc= -1.16 X(o=-1.2,f=-0.95) USER MOD Single : A 115 MET CE :methyl 152:sc= -0.27 (180deg=-1.23) USER MOD Single : A 116 TYR OH : rot 180:sc=-0.00442 USER MOD Single : A 119 GLN :FLIP amide:sc=-0.00152 F(o=-1.5!,f=-0.0015) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 ASN : amide:sc= -0.224 K(o=-0.22,f=-1.8!) USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : B 1 ALA N :NH3+ 177:sc= -0.155 (180deg=-0.161) USER MOD Single : B 3 SER OG : rot 170:sc= -1.02 USER MOD Single : B 5 THR OG1 : rot 180:sc= 0 USER MOD Single : B 12 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : B 14 GLN : amide:sc= -2.44 K(o=-2.4,f=-3.2!) USER MOD Single : B 15 GLN : amide:sc= 0 K(o=0,f=-1.9!) USER MOD Single : B 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 25 GLN :FLIP amide:sc= -2.21 F(o=-5.4!,f=-2.2) USER MOD Single : B 31 THR OG1 : rot -36:sc= 0.716 USER MOD Single : B 35 THR OG1 : rot 79:sc= 0.801 USER MOD Single : B 36 LYS NZ :NH3+ -121:sc= -1 (180deg=-2.65!) USER MOD Single : B 39 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : B 40 THR OG1 : rot -85:sc= 0.72 USER MOD Single : B 43 THR OG1 : rot -41:sc= 0.719 USER MOD Single : B 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 48 TYR OH : rot 180:sc= 0 USER MOD Single : B 50 LYS NZ :NH3+ -129:sc= -5.12! (180deg=-9.53!) USER MOD Single : B 52 GLN :FLIP amide:sc= -8.62! C(o=-12!,f=-8.6!) USER MOD Single : B 54 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : B 56 ASN : amide:sc= -3.62! C(o=-3.6!,f=-12!) 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 74 ASN : amide:sc= -0.416 K(o=-0.42,f=-2.9!) USER MOD Single : B 76 SER OG : rot -43:sc= 1.21 USER MOD Single : B 78 THR OG1 : rot 101:sc= 0.256 USER MOD Single : B 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 83 ASN :FLIP amide:sc= -3.02! C(o=-4.6!,f=-3!) USER MOD Single : B 85 THR OG1 : rot -14:sc= -0.141 USER MOD Single : B 87 GLN : amide:sc= -0.0109 K(o=-0.011,f=-1.8!) USER MOD Single : B 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 99 ASN : amide:sc= -6.42! C(o=-6.4!,f=-12!) USER MOD Single : B 101 THR OG1 : rot -18:sc= 0.016 USER MOD Single : B 108 GLN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : B 113 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0899) USER MOD Single : B 114 ASN : amide:sc= -1.19 X(o=-1.2,f=-0.92) USER MOD Single : B 115 MET CE :methyl 151:sc= -0.17 (180deg=-1.23!) USER MOD Single : B 116 TYR OH : rot 180:sc=-0.00422 USER MOD Single : B 119 GLN :FLIP amide:sc= 0 F(o=-1.4,f=0) USER MOD Single : B 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 122 ASN : amide:sc= -0.194 K(o=-0.19,f=-1.8!) USER MOD Single : B 123 SER OG : rot 180:sc= 0 USER MOD Single : C 1 ALA N :NH3+ 177:sc= -0.116 (180deg=-0.126) USER MOD Single : C 3 SER OG : rot 179:sc= -1.05 USER MOD Single : C 5 THR OG1 : rot 180:sc= 0 USER MOD Single : C 12 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : C 14 GLN : amide:sc= -2.24 K(o=-2.2,f=-3!) USER MOD Single : C 15 GLN : amide:sc= -0.0143 K(o=-0.014,f=-1.8!) USER MOD Single : C 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 25 GLN :FLIP amide:sc= -2.29 F(o=-5.3!,f=-2.3) USER MOD Single : C 31 THR OG1 : rot -45:sc= 0.638 USER MOD Single : C 35 THR OG1 : rot 79:sc= 0.773 USER MOD Single : C 36 LYS NZ :NH3+ -122:sc= -1.03 (180deg=-2.84!) USER MOD Single : C 39 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : C 40 THR OG1 : rot -74:sc= 0.787 USER MOD Single : C 43 THR OG1 : rot -35:sc= 0.699 USER MOD Single : C 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 48 TYR OH : rot 180:sc= 0 USER MOD Single : C 50 LYS NZ :NH3+ -129:sc= -5.08! (180deg=-9.56!) USER MOD Single : C 52 GLN :FLIP amide:sc= -8.61! C(o=-12!,f=-8.6!) USER MOD Single : C 54 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : C 56 ASN : amide:sc= -3.67! C(o=-3.7!,f=-12!) 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 74 ASN : amide:sc= -0.554 K(o=-0.55,f=-3.3!) USER MOD Single : C 76 SER OG : rot -68:sc= 1.18 USER MOD Single : C 78 THR OG1 : rot 71:sc= 0.0719 USER MOD Single : C 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 83 ASN :FLIP amide:sc= -3.15! C(o=-4.5!,f=-3.1!) USER MOD Single : C 85 THR OG1 : rot -17:sc= -0.186 USER MOD Single : C 87 GLN : amide:sc=-0.00894 K(o=-0.0089,f=-1.7!) USER MOD Single : C 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 99 ASN : amide:sc= -6.53! C(o=-6.5!,f=-12!) USER MOD Single : C 101 THR OG1 : rot -26:sc= -0.0581 USER MOD Single : C 108 GLN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : C 113 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0838) USER MOD Single : C 114 ASN : amide:sc= -1.14 X(o=-1.1,f=-0.87) USER MOD Single : C 115 MET CE :methyl 151:sc= -0.284 (180deg=-1.23!) USER MOD Single : C 116 TYR OH : rot 180:sc=-0.00319 USER MOD Single : C 119 GLN :FLIP amide:sc= 0 F(o=-1.4!,f=0) USER MOD Single : C 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 122 ASN : amide:sc= -0.21 K(o=-0.21,f=-1.7!) USER MOD Single : C 123 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 27.545 -41.788 -9.102 1.00 0.82 N ATOM 2 CA ALA A 1 28.432 -40.629 -9.410 1.00 0.80 C ATOM 3 C ALA A 1 27.627 -39.330 -9.327 1.00 0.71 C ATOM 4 O ALA A 1 28.109 -38.269 -9.672 1.00 0.70 O ATOM 5 CB ALA A 1 29.005 -40.787 -10.821 1.00 0.90 C ATOM 0 H1 ALA A 1 28.030 -42.673 -9.354 1.00 0.82 H new ATOM 0 H2 ALA A 1 27.320 -41.793 -8.087 1.00 0.82 H new ATOM 0 H3 ALA A 1 26.665 -41.707 -9.651 1.00 0.82 H new ATOM 0 HA ALA A 1 29.248 -40.595 -8.688 1.00 0.80 H new ATOM 0 HB1 ALA A 1 29.653 -39.941 -11.047 1.00 0.90 H new ATOM 0 HB2 ALA A 1 29.581 -41.711 -10.879 1.00 0.90 H new ATOM 0 HB3 ALA A 1 28.189 -40.822 -11.543 1.00 0.90 H new ATOM 13 N GLN A 2 26.405 -39.401 -8.875 1.00 0.67 N ATOM 14 CA GLN A 2 25.577 -38.165 -8.775 1.00 0.60 C ATOM 15 C GLN A 2 25.976 -37.380 -7.522 1.00 0.52 C ATOM 16 O GLN A 2 26.294 -37.949 -6.497 1.00 0.52 O ATOM 17 CB GLN A 2 24.099 -38.554 -8.678 1.00 0.62 C ATOM 18 CG GLN A 2 23.648 -39.198 -9.991 1.00 0.72 C ATOM 19 CD GLN A 2 23.652 -38.153 -11.106 1.00 1.27 C ATOM 20 OE1 GLN A 2 24.205 -38.380 -12.165 1.00 2.00 O ATOM 21 NE2 GLN A 2 23.056 -37.010 -10.912 1.00 1.87 N ATOM 0 H GLN A 2 25.945 -40.259 -8.571 1.00 0.67 H new ATOM 0 HA GLN A 2 25.739 -37.547 -9.658 1.00 0.60 H new ATOM 0 HB2 GLN A 2 23.949 -39.248 -7.851 1.00 0.62 H new ATOM 0 HB3 GLN A 2 23.494 -37.672 -8.468 1.00 0.62 H new ATOM 0 HG2 GLN A 2 24.312 -40.022 -10.250 1.00 0.72 H new ATOM 0 HG3 GLN A 2 22.649 -39.618 -9.877 1.00 0.72 H new ATOM 0 HE21 GLN A 2 22.593 -36.821 -10.023 1.00 1.87 H new ATOM 0 HE22 GLN A 2 23.053 -36.305 -11.649 1.00 1.87 H new ATOM 30 N SER A 3 25.954 -36.073 -7.594 1.00 0.47 N ATOM 31 CA SER A 3 26.323 -35.246 -6.405 1.00 0.41 C ATOM 32 C SER A 3 25.062 -34.909 -5.611 1.00 0.37 C ATOM 33 O SER A 3 24.710 -33.759 -5.441 1.00 0.34 O ATOM 34 CB SER A 3 27.002 -33.955 -6.872 1.00 0.40 C ATOM 35 OG SER A 3 27.784 -33.424 -5.809 1.00 1.37 O ATOM 0 H SER A 3 25.696 -35.542 -8.426 1.00 0.47 H new ATOM 0 HA SER A 3 27.011 -35.804 -5.770 1.00 0.41 H new ATOM 0 HB2 SER A 3 27.633 -34.155 -7.738 1.00 0.40 H new ATOM 0 HB3 SER A 3 26.252 -33.229 -7.185 1.00 0.40 H new ATOM 0 HG SER A 3 28.344 -32.694 -6.147 1.00 1.37 H new ATOM 41 N ARG A 4 24.387 -35.904 -5.110 1.00 0.41 N ATOM 42 CA ARG A 4 23.158 -35.642 -4.312 1.00 0.42 C ATOM 43 C ARG A 4 23.533 -34.863 -3.053 1.00 0.42 C ATOM 44 O ARG A 4 22.831 -33.962 -2.638 1.00 0.43 O ATOM 45 CB ARG A 4 22.493 -36.970 -3.938 1.00 0.51 C ATOM 46 CG ARG A 4 21.894 -37.603 -5.196 1.00 0.90 C ATOM 47 CD ARG A 4 21.251 -38.942 -4.839 1.00 1.03 C ATOM 48 NE ARG A 4 22.318 -39.910 -4.461 1.00 1.97 N ATOM 49 CZ ARG A 4 22.007 -41.013 -3.841 1.00 2.55 C ATOM 50 NH1 ARG A 4 20.763 -41.258 -3.535 1.00 2.53 N ATOM 51 NH2 ARG A 4 22.941 -41.864 -3.516 1.00 3.57 N ATOM 0 H ARG A 4 24.633 -36.888 -5.218 1.00 0.41 H new ATOM 0 HA ARG A 4 22.454 -35.053 -4.900 1.00 0.42 H new ATOM 0 HB2 ARG A 4 23.224 -37.643 -3.490 1.00 0.51 H new ATOM 0 HB3 ARG A 4 21.714 -36.804 -3.194 1.00 0.51 H new ATOM 0 HG2 ARG A 4 21.151 -36.936 -5.632 1.00 0.90 H new ATOM 0 HG3 ARG A 4 22.671 -37.750 -5.947 1.00 0.90 H new ATOM 0 HD2 ARG A 4 20.550 -38.814 -4.014 1.00 1.03 H new ATOM 0 HD3 ARG A 4 20.681 -39.323 -5.686 1.00 1.03 H new ATOM 0 HE ARG A 4 23.292 -39.709 -4.687 1.00 1.97 H new ATOM 0 HH11 ARG A 4 20.036 -40.587 -3.781 1.00 2.53 H new ATOM 0 HH12 ARG A 4 20.518 -42.121 -3.050 1.00 2.53 H new ATOM 0 HH21 ARG A 4 23.914 -41.666 -3.747 1.00 3.57 H new ATOM 0 HH22 ARG A 4 22.698 -42.727 -3.031 1.00 3.57 H new ATOM 65 N THR A 5 24.632 -35.201 -2.440 1.00 0.45 N ATOM 66 CA THR A 5 25.046 -34.472 -1.209 1.00 0.49 C ATOM 67 C THR A 5 25.241 -32.990 -1.534 1.00 0.44 C ATOM 68 O THR A 5 24.825 -32.123 -0.791 1.00 0.46 O ATOM 69 CB THR A 5 26.355 -35.057 -0.664 1.00 0.54 C ATOM 70 OG1 THR A 5 26.971 -34.108 0.194 1.00 0.68 O ATOM 71 CG2 THR A 5 27.305 -35.388 -1.816 1.00 0.57 C ATOM 0 H THR A 5 25.260 -35.948 -2.737 1.00 0.45 H new ATOM 0 HA THR A 5 24.269 -34.580 -0.453 1.00 0.49 H new ATOM 0 HB THR A 5 26.134 -35.970 -0.111 1.00 0.54 H new ATOM 0 HG1 THR A 5 27.807 -34.479 0.545 1.00 0.68 H new ATOM 0 HG21 THR A 5 28.231 -35.802 -1.417 1.00 0.57 H new ATOM 0 HG22 THR A 5 26.836 -36.117 -2.476 1.00 0.57 H new ATOM 0 HG23 THR A 5 27.526 -34.480 -2.377 1.00 0.57 H new ATOM 79 N LEU A 6 25.865 -32.686 -2.643 1.00 0.39 N ATOM 80 CA LEU A 6 26.072 -31.255 -3.006 1.00 0.36 C ATOM 81 C LEU A 6 24.710 -30.586 -3.200 1.00 0.32 C ATOM 82 O LEU A 6 24.481 -29.475 -2.763 1.00 0.33 O ATOM 83 CB LEU A 6 26.888 -31.164 -4.303 1.00 0.35 C ATOM 84 CG LEU A 6 27.111 -29.692 -4.690 1.00 0.35 C ATOM 85 CD1 LEU A 6 27.885 -28.959 -3.581 1.00 0.41 C ATOM 86 CD2 LEU A 6 27.907 -29.635 -5.998 1.00 0.36 C ATOM 0 H LEU A 6 26.238 -33.363 -3.308 1.00 0.39 H new ATOM 0 HA LEU A 6 26.616 -30.748 -2.209 1.00 0.36 H new ATOM 0 HB2 LEU A 6 27.848 -31.662 -4.172 1.00 0.35 H new ATOM 0 HB3 LEU A 6 26.366 -31.684 -5.107 1.00 0.35 H new ATOM 0 HG LEU A 6 26.145 -29.204 -4.821 1.00 0.35 H new ATOM 0 HD11 LEU A 6 28.035 -27.919 -3.869 1.00 0.41 H new ATOM 0 HD12 LEU A 6 27.316 -29.000 -2.652 1.00 0.41 H new ATOM 0 HD13 LEU A 6 28.853 -29.438 -3.435 1.00 0.41 H new ATOM 0 HD21 LEU A 6 28.070 -28.595 -6.280 1.00 0.36 H new ATOM 0 HD22 LEU A 6 28.869 -30.128 -5.860 1.00 0.36 H new ATOM 0 HD23 LEU A 6 27.349 -30.141 -6.786 1.00 0.36 H new ATOM 98 N LEU A 7 23.805 -31.264 -3.852 1.00 0.29 N ATOM 99 CA LEU A 7 22.445 -30.698 -4.084 1.00 0.26 C ATOM 100 C LEU A 7 21.761 -30.408 -2.750 1.00 0.30 C ATOM 101 O LEU A 7 21.086 -29.408 -2.594 1.00 0.29 O ATOM 102 CB LEU A 7 21.605 -31.683 -4.901 1.00 0.27 C ATOM 103 CG LEU A 7 22.135 -31.746 -6.346 1.00 0.24 C ATOM 104 CD1 LEU A 7 21.519 -32.959 -7.069 1.00 0.27 C ATOM 105 CD2 LEU A 7 21.775 -30.449 -7.110 1.00 0.23 C ATOM 0 H LEU A 7 23.952 -32.197 -4.238 1.00 0.29 H new ATOM 0 HA LEU A 7 22.540 -29.765 -4.639 1.00 0.26 H new ATOM 0 HB2 LEU A 7 21.644 -32.673 -4.446 1.00 0.27 H new ATOM 0 HB3 LEU A 7 20.560 -31.372 -4.900 1.00 0.27 H new ATOM 0 HG LEU A 7 23.220 -31.848 -6.318 1.00 0.24 H new ATOM 0 HD11 LEU A 7 21.895 -33.003 -8.091 1.00 0.27 H new ATOM 0 HD12 LEU A 7 21.792 -33.874 -6.543 1.00 0.27 H new ATOM 0 HD13 LEU A 7 20.434 -32.860 -7.085 1.00 0.27 H new ATOM 0 HD21 LEU A 7 22.157 -30.509 -8.129 1.00 0.23 H new ATOM 0 HD22 LEU A 7 20.692 -30.330 -7.134 1.00 0.23 H new ATOM 0 HD23 LEU A 7 22.223 -29.593 -6.605 1.00 0.23 H new ATOM 117 N ALA A 8 21.915 -31.269 -1.785 1.00 0.34 N ATOM 118 CA ALA A 8 21.255 -31.021 -0.475 1.00 0.39 C ATOM 119 C ALA A 8 21.767 -29.689 0.071 1.00 0.38 C ATOM 120 O ALA A 8 21.017 -28.897 0.608 1.00 0.38 O ATOM 121 CB ALA A 8 21.594 -32.153 0.501 1.00 0.45 C ATOM 0 H ALA A 8 22.464 -32.126 -1.845 1.00 0.34 H new ATOM 0 HA ALA A 8 20.173 -30.985 -0.598 1.00 0.39 H new ATOM 0 HB1 ALA A 8 21.108 -31.966 1.458 1.00 0.45 H new ATOM 0 HB2 ALA A 8 21.242 -33.101 0.095 1.00 0.45 H new ATOM 0 HB3 ALA A 8 22.674 -32.198 0.645 1.00 0.45 H new ATOM 127 N GLY A 9 23.034 -29.425 -0.085 1.00 0.38 N ATOM 128 CA GLY A 9 23.588 -28.132 0.397 1.00 0.38 C ATOM 129 C GLY A 9 23.016 -27.002 -0.460 1.00 0.34 C ATOM 130 O GLY A 9 22.515 -26.017 0.045 1.00 0.34 O ATOM 0 H GLY A 9 23.709 -30.050 -0.526 1.00 0.38 H new ATOM 0 HA2 GLY A 9 23.331 -27.978 1.445 1.00 0.38 H new ATOM 0 HA3 GLY A 9 24.676 -28.140 0.334 1.00 0.38 H new ATOM 134 N ILE A 10 23.077 -27.140 -1.759 1.00 0.30 N ATOM 135 CA ILE A 10 22.524 -26.078 -2.645 1.00 0.27 C ATOM 136 C ILE A 10 21.032 -25.908 -2.351 1.00 0.25 C ATOM 137 O ILE A 10 20.554 -24.812 -2.142 1.00 0.25 O ATOM 138 CB ILE A 10 22.722 -26.474 -4.110 1.00 0.24 C ATOM 139 CG1 ILE A 10 24.220 -26.519 -4.427 1.00 0.28 C ATOM 140 CG2 ILE A 10 22.045 -25.445 -5.017 1.00 0.25 C ATOM 141 CD1 ILE A 10 24.438 -27.148 -5.805 1.00 0.26 C ATOM 0 H ILE A 10 23.485 -27.941 -2.242 1.00 0.30 H new ATOM 0 HA ILE A 10 23.042 -25.137 -2.459 1.00 0.27 H new ATOM 0 HB ILE A 10 22.280 -27.456 -4.281 1.00 0.24 H new ATOM 0 HG12 ILE A 10 24.636 -25.512 -4.407 1.00 0.28 H new ATOM 0 HG13 ILE A 10 24.745 -27.096 -3.666 1.00 0.28 H new ATOM 0 HG21 ILE A 10 22.188 -25.729 -6.060 1.00 0.25 H new ATOM 0 HG22 ILE A 10 20.979 -25.408 -4.793 1.00 0.25 H new ATOM 0 HG23 ILE A 10 22.486 -24.463 -4.845 1.00 0.25 H new ATOM 0 HD11 ILE A 10 25.505 -27.178 -6.027 1.00 0.26 H new ATOM 0 HD12 ILE A 10 24.038 -28.162 -5.810 1.00 0.26 H new ATOM 0 HD13 ILE A 10 23.927 -26.553 -6.562 1.00 0.26 H new ATOM 153 N VAL A 11 20.290 -26.988 -2.322 1.00 0.25 N ATOM 154 CA VAL A 11 18.826 -26.878 -2.033 1.00 0.27 C ATOM 155 C VAL A 11 18.635 -26.252 -0.649 1.00 0.28 C ATOM 156 O VAL A 11 17.851 -25.340 -0.472 1.00 0.28 O ATOM 157 CB VAL A 11 18.194 -28.276 -2.053 1.00 0.30 C ATOM 158 CG1 VAL A 11 16.756 -28.218 -1.516 1.00 0.35 C ATOM 159 CG2 VAL A 11 18.177 -28.791 -3.490 1.00 0.29 C ATOM 0 H VAL A 11 20.632 -27.935 -2.485 1.00 0.25 H new ATOM 0 HA VAL A 11 18.348 -26.255 -2.789 1.00 0.27 H new ATOM 0 HB VAL A 11 18.779 -28.944 -1.421 1.00 0.30 H new ATOM 0 HG11 VAL A 11 16.320 -29.217 -1.536 1.00 0.35 H new ATOM 0 HG12 VAL A 11 16.765 -27.846 -0.491 1.00 0.35 H new ATOM 0 HG13 VAL A 11 16.162 -27.550 -2.139 1.00 0.35 H new ATOM 0 HG21 VAL A 11 17.730 -29.785 -3.515 1.00 0.29 H new ATOM 0 HG22 VAL A 11 17.592 -28.114 -4.112 1.00 0.29 H new ATOM 0 HG23 VAL A 11 19.197 -28.843 -3.870 1.00 0.29 H new ATOM 169 N GLN A 12 19.353 -26.737 0.327 1.00 0.31 N ATOM 170 CA GLN A 12 19.236 -26.176 1.703 1.00 0.34 C ATOM 171 C GLN A 12 19.624 -24.697 1.673 1.00 0.31 C ATOM 172 O GLN A 12 19.021 -23.869 2.329 1.00 0.32 O ATOM 173 CB GLN A 12 20.169 -26.943 2.646 1.00 0.39 C ATOM 174 CG GLN A 12 20.044 -26.391 4.069 1.00 1.19 C ATOM 175 CD GLN A 12 20.933 -27.210 5.009 1.00 1.63 C ATOM 176 OE1 GLN A 12 21.894 -27.817 4.579 1.00 1.99 O ATOM 177 NE2 GLN A 12 20.648 -27.260 6.281 1.00 2.40 N ATOM 0 H GLN A 12 20.020 -27.503 0.229 1.00 0.31 H new ATOM 0 HA GLN A 12 18.211 -26.274 2.060 1.00 0.34 H new ATOM 0 HB2 GLN A 12 19.919 -28.004 2.635 1.00 0.39 H new ATOM 0 HB3 GLN A 12 21.200 -26.855 2.302 1.00 0.39 H new ATOM 0 HG2 GLN A 12 20.340 -25.342 4.092 1.00 1.19 H new ATOM 0 HG3 GLN A 12 19.006 -26.437 4.399 1.00 1.19 H new ATOM 0 HE21 GLN A 12 19.842 -26.751 6.643 1.00 2.40 H new ATOM 0 HE22 GLN A 12 21.231 -27.808 6.913 1.00 2.40 H new ATOM 186 N GLN A 13 20.640 -24.362 0.923 1.00 0.29 N ATOM 187 CA GLN A 13 21.084 -22.943 0.849 1.00 0.28 C ATOM 188 C GLN A 13 19.936 -22.077 0.321 1.00 0.24 C ATOM 189 O GLN A 13 19.693 -20.993 0.810 1.00 0.25 O ATOM 190 CB GLN A 13 22.281 -22.852 -0.105 1.00 0.28 C ATOM 191 CG GLN A 13 22.845 -21.428 -0.135 1.00 0.30 C ATOM 192 CD GLN A 13 23.523 -21.112 1.199 1.00 0.38 C ATOM 193 OE1 GLN A 13 23.707 -21.986 2.024 1.00 0.84 O ATOM 194 NE2 GLN A 13 23.922 -19.893 1.440 1.00 0.63 N ATOM 0 H GLN A 13 21.183 -25.014 0.357 1.00 0.29 H new ATOM 0 HA GLN A 13 21.372 -22.588 1.839 1.00 0.28 H new ATOM 0 HB2 GLN A 13 23.057 -23.549 0.211 1.00 0.28 H new ATOM 0 HB3 GLN A 13 21.976 -23.148 -1.108 1.00 0.28 H new ATOM 0 HG2 GLN A 13 23.561 -21.328 -0.950 1.00 0.30 H new ATOM 0 HG3 GLN A 13 22.044 -20.714 -0.325 1.00 0.30 H new ATOM 0 HE21 GLN A 13 23.768 -19.160 0.748 1.00 0.63 H new ATOM 0 HE22 GLN A 13 24.388 -19.674 2.320 1.00 0.63 H new ATOM 203 N GLN A 14 19.219 -22.546 -0.666 1.00 0.22 N ATOM 204 CA GLN A 14 18.087 -21.739 -1.204 1.00 0.20 C ATOM 205 C GLN A 14 17.070 -21.502 -0.087 1.00 0.22 C ATOM 206 O GLN A 14 16.537 -20.421 0.065 1.00 0.21 O ATOM 207 CB GLN A 14 17.409 -22.497 -2.346 1.00 0.20 C ATOM 208 CG GLN A 14 18.345 -22.546 -3.554 1.00 0.18 C ATOM 209 CD GLN A 14 17.666 -23.305 -4.694 1.00 0.19 C ATOM 210 OE1 GLN A 14 17.397 -24.484 -4.581 1.00 0.29 O ATOM 211 NE2 GLN A 14 17.376 -22.675 -5.799 1.00 0.23 N ATOM 0 H GLN A 14 19.367 -23.447 -1.120 1.00 0.22 H new ATOM 0 HA GLN A 14 18.464 -20.786 -1.576 1.00 0.20 H new ATOM 0 HB2 GLN A 14 17.158 -23.508 -2.026 1.00 0.20 H new ATOM 0 HB3 GLN A 14 16.474 -22.007 -2.617 1.00 0.20 H new ATOM 0 HG2 GLN A 14 18.596 -21.535 -3.875 1.00 0.18 H new ATOM 0 HG3 GLN A 14 19.280 -23.036 -3.283 1.00 0.18 H new ATOM 0 HE21 GLN A 14 17.601 -21.685 -5.896 1.00 0.23 H new ATOM 0 HE22 GLN A 14 16.924 -23.173 -6.566 1.00 0.23 H new ATOM 220 N GLN A 15 16.806 -22.508 0.703 1.00 0.26 N ATOM 221 CA GLN A 15 15.838 -22.342 1.818 1.00 0.29 C ATOM 222 C GLN A 15 16.340 -21.249 2.758 1.00 0.28 C ATOM 223 O GLN A 15 15.595 -20.382 3.174 1.00 0.29 O ATOM 224 CB GLN A 15 15.708 -23.662 2.581 1.00 0.34 C ATOM 225 CG GLN A 15 14.718 -23.494 3.736 1.00 0.38 C ATOM 226 CD GLN A 15 14.446 -24.855 4.373 1.00 0.44 C ATOM 227 OE1 GLN A 15 14.794 -25.880 3.822 1.00 0.81 O ATOM 228 NE2 GLN A 15 13.846 -24.911 5.530 1.00 0.81 N ATOM 0 H GLN A 15 17.220 -23.436 0.622 1.00 0.26 H new ATOM 0 HA GLN A 15 14.863 -22.061 1.421 1.00 0.29 H new ATOM 0 HB2 GLN A 15 15.368 -24.450 1.909 1.00 0.34 H new ATOM 0 HB3 GLN A 15 16.681 -23.969 2.965 1.00 0.34 H new ATOM 0 HG2 GLN A 15 15.122 -22.807 4.479 1.00 0.38 H new ATOM 0 HG3 GLN A 15 13.788 -23.058 3.372 1.00 0.38 H new ATOM 0 HE21 GLN A 15 13.553 -24.052 5.995 1.00 0.81 H new ATOM 0 HE22 GLN A 15 13.670 -25.814 5.970 1.00 0.81 H new ATOM 237 N GLN A 16 17.599 -21.280 3.095 1.00 0.28 N ATOM 238 CA GLN A 16 18.140 -20.238 4.005 1.00 0.29 C ATOM 239 C GLN A 16 17.984 -18.866 3.346 1.00 0.25 C ATOM 240 O GLN A 16 17.605 -17.902 3.983 1.00 0.25 O ATOM 241 CB GLN A 16 19.616 -20.520 4.293 1.00 0.31 C ATOM 242 CG GLN A 16 19.720 -21.768 5.173 1.00 0.36 C ATOM 243 CD GLN A 16 21.186 -22.057 5.499 1.00 0.39 C ATOM 244 OE1 GLN A 16 21.539 -23.173 5.825 1.00 0.92 O ATOM 245 NE2 GLN A 16 22.059 -21.089 5.434 1.00 0.87 N ATOM 0 H GLN A 16 18.272 -21.979 2.781 1.00 0.28 H new ATOM 0 HA GLN A 16 17.591 -20.250 4.947 1.00 0.29 H new ATOM 0 HB2 GLN A 16 20.160 -20.670 3.360 1.00 0.31 H new ATOM 0 HB3 GLN A 16 20.072 -19.666 4.794 1.00 0.31 H new ATOM 0 HG2 GLN A 16 19.156 -21.622 6.094 1.00 0.36 H new ATOM 0 HG3 GLN A 16 19.277 -22.622 4.661 1.00 0.36 H new ATOM 0 HE21 GLN A 16 21.762 -20.152 5.160 1.00 0.87 H new ATOM 0 HE22 GLN A 16 23.038 -21.269 5.657 1.00 0.87 H new ATOM 254 N LEU A 17 18.250 -18.770 2.070 1.00 0.22 N ATOM 255 CA LEU A 17 18.089 -17.460 1.384 1.00 0.19 C ATOM 256 C LEU A 17 16.614 -17.070 1.415 1.00 0.18 C ATOM 257 O LEU A 17 16.262 -15.932 1.657 1.00 0.18 O ATOM 258 CB LEU A 17 18.556 -17.576 -0.070 1.00 0.16 C ATOM 259 CG LEU A 17 20.081 -17.741 -0.122 1.00 0.18 C ATOM 260 CD1 LEU A 17 20.494 -18.096 -1.553 1.00 0.18 C ATOM 261 CD2 LEU A 17 20.785 -16.437 0.312 1.00 0.20 C ATOM 0 H LEU A 17 18.569 -19.537 1.479 1.00 0.22 H new ATOM 0 HA LEU A 17 18.687 -16.702 1.890 1.00 0.19 H new ATOM 0 HB2 LEU A 17 18.074 -18.428 -0.548 1.00 0.16 H new ATOM 0 HB3 LEU A 17 18.259 -16.688 -0.628 1.00 0.16 H new ATOM 0 HG LEU A 17 20.377 -18.536 0.562 1.00 0.18 H new ATOM 0 HD11 LEU A 17 21.576 -18.215 -1.600 1.00 0.18 H new ATOM 0 HD12 LEU A 17 20.013 -19.028 -1.850 1.00 0.18 H new ATOM 0 HD13 LEU A 17 20.187 -17.298 -2.229 1.00 0.18 H new ATOM 0 HD21 LEU A 17 21.865 -16.575 0.268 1.00 0.20 H new ATOM 0 HD22 LEU A 17 20.495 -15.627 -0.357 1.00 0.20 H new ATOM 0 HD23 LEU A 17 20.492 -16.187 1.332 1.00 0.20 H new ATOM 273 N LEU A 18 15.745 -18.012 1.185 1.00 0.19 N ATOM 274 CA LEU A 18 14.295 -17.701 1.217 1.00 0.20 C ATOM 275 C LEU A 18 13.936 -17.192 2.616 1.00 0.22 C ATOM 276 O LEU A 18 13.197 -16.240 2.772 1.00 0.22 O ATOM 277 CB LEU A 18 13.499 -18.972 0.892 1.00 0.22 C ATOM 278 CG LEU A 18 11.989 -18.685 0.915 1.00 0.25 C ATOM 279 CD1 LEU A 18 11.628 -17.631 -0.145 1.00 0.26 C ATOM 280 CD2 LEU A 18 11.227 -19.981 0.618 1.00 0.29 C ATOM 0 H LEU A 18 15.978 -18.983 0.976 1.00 0.19 H new ATOM 0 HA LEU A 18 14.052 -16.936 0.480 1.00 0.20 H new ATOM 0 HB2 LEU A 18 13.788 -19.348 -0.089 1.00 0.22 H new ATOM 0 HB3 LEU A 18 13.738 -19.752 1.615 1.00 0.22 H new ATOM 0 HG LEU A 18 11.715 -18.305 1.899 1.00 0.25 H new ATOM 0 HD11 LEU A 18 10.555 -17.439 -0.116 1.00 0.26 H new ATOM 0 HD12 LEU A 18 12.168 -16.707 0.062 1.00 0.26 H new ATOM 0 HD13 LEU A 18 11.904 -17.999 -1.133 1.00 0.26 H new ATOM 0 HD21 LEU A 18 10.155 -19.784 0.633 1.00 0.29 H new ATOM 0 HD22 LEU A 18 11.514 -20.355 -0.365 1.00 0.29 H new ATOM 0 HD23 LEU A 18 11.469 -20.727 1.375 1.00 0.29 H new ATOM 292 N ASP A 19 14.461 -17.821 3.637 1.00 0.25 N ATOM 293 CA ASP A 19 14.155 -17.375 5.026 1.00 0.28 C ATOM 294 C ASP A 19 14.617 -15.925 5.211 1.00 0.26 C ATOM 295 O ASP A 19 13.875 -15.084 5.675 1.00 0.27 O ATOM 296 CB ASP A 19 14.888 -18.275 6.024 1.00 0.32 C ATOM 297 CG ASP A 19 14.545 -17.846 7.453 1.00 0.36 C ATOM 298 OD1 ASP A 19 14.033 -16.753 7.618 1.00 1.12 O ATOM 299 OD2 ASP A 19 14.799 -18.622 8.359 1.00 1.13 O ATOM 0 H ASP A 19 15.087 -18.623 3.567 1.00 0.25 H new ATOM 0 HA ASP A 19 13.081 -17.439 5.200 1.00 0.28 H new ATOM 0 HB2 ASP A 19 14.603 -19.315 5.868 1.00 0.32 H new ATOM 0 HB3 ASP A 19 15.964 -18.212 5.863 1.00 0.32 H new ATOM 304 N VAL A 20 15.837 -15.623 4.847 1.00 0.25 N ATOM 305 CA VAL A 20 16.328 -14.222 5.006 1.00 0.24 C ATOM 306 C VAL A 20 15.439 -13.296 4.182 1.00 0.21 C ATOM 307 O VAL A 20 15.023 -12.250 4.637 1.00 0.22 O ATOM 308 CB VAL A 20 17.772 -14.107 4.496 1.00 0.24 C ATOM 309 CG1 VAL A 20 18.187 -12.629 4.442 1.00 0.24 C ATOM 310 CG2 VAL A 20 18.711 -14.863 5.435 1.00 0.30 C ATOM 0 H VAL A 20 16.509 -16.280 4.450 1.00 0.25 H new ATOM 0 HA VAL A 20 16.297 -13.946 6.060 1.00 0.24 H new ATOM 0 HB VAL A 20 17.833 -14.537 3.496 1.00 0.24 H new ATOM 0 HG11 VAL A 20 19.212 -12.552 4.080 1.00 0.24 H new ATOM 0 HG12 VAL A 20 17.522 -12.089 3.768 1.00 0.24 H new ATOM 0 HG13 VAL A 20 18.121 -12.196 5.440 1.00 0.24 H new ATOM 0 HG21 VAL A 20 19.735 -14.780 5.070 1.00 0.30 H new ATOM 0 HG22 VAL A 20 18.646 -14.436 6.436 1.00 0.30 H new ATOM 0 HG23 VAL A 20 18.423 -15.914 5.470 1.00 0.30 H new ATOM 320 N VAL A 21 15.147 -13.672 2.970 1.00 0.18 N ATOM 321 CA VAL A 21 14.288 -12.811 2.120 1.00 0.17 C ATOM 322 C VAL A 21 12.940 -12.643 2.815 1.00 0.22 C ATOM 323 O VAL A 21 12.377 -11.567 2.850 1.00 0.21 O ATOM 324 CB VAL A 21 14.106 -13.480 0.755 1.00 0.17 C ATOM 325 CG1 VAL A 21 13.074 -12.719 -0.075 1.00 0.20 C ATOM 326 CG2 VAL A 21 15.443 -13.479 0.012 1.00 0.14 C ATOM 0 H VAL A 21 15.466 -14.537 2.534 1.00 0.18 H new ATOM 0 HA VAL A 21 14.745 -11.832 1.972 1.00 0.17 H new ATOM 0 HB VAL A 21 13.759 -14.502 0.905 1.00 0.17 H new ATOM 0 HG11 VAL A 21 12.955 -13.206 -1.043 1.00 0.20 H new ATOM 0 HG12 VAL A 21 12.118 -12.714 0.449 1.00 0.20 H new ATOM 0 HG13 VAL A 21 13.412 -11.693 -0.224 1.00 0.20 H new ATOM 0 HG21 VAL A 21 15.319 -13.954 -0.961 1.00 0.14 H new ATOM 0 HG22 VAL A 21 15.782 -12.452 -0.126 1.00 0.14 H new ATOM 0 HG23 VAL A 21 16.183 -14.030 0.593 1.00 0.14 H new ATOM 336 N LYS A 22 12.426 -13.700 3.388 1.00 0.27 N ATOM 337 CA LYS A 22 11.125 -13.598 4.102 1.00 0.32 C ATOM 338 C LYS A 22 11.292 -12.616 5.264 1.00 0.32 C ATOM 339 O LYS A 22 10.432 -11.802 5.536 1.00 0.33 O ATOM 340 CB LYS A 22 10.726 -14.984 4.637 1.00 0.39 C ATOM 341 CG LYS A 22 9.382 -14.924 5.385 1.00 0.46 C ATOM 342 CD LYS A 22 8.237 -14.664 4.398 1.00 0.75 C ATOM 343 CE LYS A 22 6.899 -15.002 5.059 1.00 1.12 C ATOM 344 NZ LYS A 22 5.782 -14.540 4.185 1.00 1.91 N ATOM 0 H LYS A 22 12.852 -14.627 3.391 1.00 0.27 H new ATOM 0 HA LYS A 22 10.345 -13.245 3.427 1.00 0.32 H new ATOM 0 HB2 LYS A 22 10.654 -15.690 3.809 1.00 0.39 H new ATOM 0 HB3 LYS A 22 11.502 -15.356 5.306 1.00 0.39 H new ATOM 0 HG2 LYS A 22 9.210 -15.861 5.914 1.00 0.46 H new ATOM 0 HG3 LYS A 22 9.411 -14.135 6.136 1.00 0.46 H new ATOM 0 HD2 LYS A 22 8.245 -13.620 4.084 1.00 0.75 H new ATOM 0 HD3 LYS A 22 8.373 -15.268 3.501 1.00 0.75 H new ATOM 0 HE2 LYS A 22 6.824 -16.077 5.225 1.00 1.12 H new ATOM 0 HE3 LYS A 22 6.833 -14.523 6.036 1.00 1.12 H new ATOM 0 HZ1 LYS A 22 4.872 -14.769 4.634 1.00 1.91 H new ATOM 0 HZ2 LYS A 22 5.851 -13.511 4.048 1.00 1.91 H new ATOM 0 HZ3 LYS A 22 5.843 -15.017 3.263 1.00 1.91 H new ATOM 358 N ARG A 23 12.406 -12.686 5.945 1.00 0.33 N ATOM 359 CA ARG A 23 12.646 -11.761 7.085 1.00 0.34 C ATOM 360 C ARG A 23 12.720 -10.332 6.552 1.00 0.29 C ATOM 361 O ARG A 23 12.204 -9.406 7.147 1.00 0.29 O ATOM 362 CB ARG A 23 13.977 -12.123 7.753 1.00 0.38 C ATOM 363 CG ARG A 23 13.881 -13.494 8.440 1.00 0.59 C ATOM 364 CD ARG A 23 13.180 -13.370 9.802 1.00 0.93 C ATOM 365 NE ARG A 23 13.260 -14.680 10.513 1.00 0.81 N ATOM 366 CZ ARG A 23 12.952 -14.761 11.779 1.00 1.05 C ATOM 367 NH1 ARG A 23 12.582 -13.690 12.434 1.00 1.68 N ATOM 368 NH2 ARG A 23 13.014 -15.915 12.388 1.00 1.08 N ATOM 0 H ARG A 23 13.160 -13.347 5.758 1.00 0.33 H new ATOM 0 HA ARG A 23 11.838 -11.844 7.812 1.00 0.34 H new ATOM 0 HB2 ARG A 23 14.772 -12.138 7.008 1.00 0.38 H new ATOM 0 HB3 ARG A 23 14.242 -11.361 8.486 1.00 0.38 H new ATOM 0 HG2 ARG A 23 13.331 -14.188 7.804 1.00 0.59 H new ATOM 0 HG3 ARG A 23 14.880 -13.909 8.576 1.00 0.59 H new ATOM 0 HD2 ARG A 23 13.652 -12.589 10.398 1.00 0.93 H new ATOM 0 HD3 ARG A 23 12.138 -13.080 9.664 1.00 0.93 H new ATOM 0 HE ARG A 23 13.556 -15.515 10.008 1.00 0.81 H new ATOM 0 HH11 ARG A 23 12.534 -12.791 11.955 1.00 1.68 H new ATOM 0 HH12 ARG A 23 12.342 -13.755 13.423 1.00 1.68 H new ATOM 0 HH21 ARG A 23 13.302 -16.748 11.874 1.00 1.08 H new ATOM 0 HH22 ARG A 23 12.774 -15.983 13.377 1.00 1.08 H new ATOM 382 N GLN A 24 13.349 -10.144 5.425 1.00 0.24 N ATOM 383 CA GLN A 24 13.440 -8.775 4.852 1.00 0.19 C ATOM 384 C GLN A 24 12.027 -8.270 4.574 1.00 0.19 C ATOM 385 O GLN A 24 11.705 -7.127 4.825 1.00 0.18 O ATOM 386 CB GLN A 24 14.252 -8.809 3.554 1.00 0.16 C ATOM 387 CG GLN A 24 15.723 -9.087 3.885 1.00 0.17 C ATOM 388 CD GLN A 24 16.525 -9.240 2.588 1.00 0.16 C ATOM 389 OE1 GLN A 24 16.027 -9.763 1.611 1.00 0.18 O ATOM 390 NE2 GLN A 24 17.757 -8.801 2.533 1.00 0.18 N ATOM 0 H GLN A 24 13.802 -10.877 4.879 1.00 0.24 H new ATOM 0 HA GLN A 24 13.938 -8.107 5.555 1.00 0.19 H new ATOM 0 HB2 GLN A 24 13.865 -9.581 2.889 1.00 0.16 H new ATOM 0 HB3 GLN A 24 14.159 -7.859 3.028 1.00 0.16 H new ATOM 0 HG2 GLN A 24 16.132 -8.272 4.482 1.00 0.17 H new ATOM 0 HG3 GLN A 24 15.806 -9.994 4.484 1.00 0.17 H new ATOM 0 HE21 GLN A 24 18.179 -8.361 3.351 1.00 0.18 H new ATOM 0 HE22 GLN A 24 18.295 -8.899 1.672 1.00 0.18 H new ATOM 399 N GLN A 25 11.171 -9.122 4.070 1.00 0.21 N ATOM 400 CA GLN A 25 9.776 -8.683 3.796 1.00 0.23 C ATOM 401 C GLN A 25 9.131 -8.223 5.105 1.00 0.25 C ATOM 402 O GLN A 25 8.584 -7.142 5.188 1.00 0.25 O ATOM 403 CB GLN A 25 8.983 -9.854 3.196 1.00 0.28 C ATOM 404 CG GLN A 25 7.510 -9.464 3.003 1.00 0.32 C ATOM 405 CD GLN A 25 7.403 -8.222 2.113 1.00 0.34 C ATOM 406 OE1 GLN A 25 7.038 -8.357 0.867 1.00 1.06 O flip ATOM 407 NE2 GLN A 25 7.645 -7.117 2.557 1.00 1.13 N flip ATOM 0 H GLN A 25 11.378 -10.094 3.839 1.00 0.21 H new ATOM 0 HA GLN A 25 9.776 -7.856 3.086 1.00 0.23 H new ATOM 0 HB2 GLN A 25 9.417 -10.142 2.239 1.00 0.28 H new ATOM 0 HB3 GLN A 25 9.053 -10.722 3.852 1.00 0.28 H new ATOM 0 HG2 GLN A 25 6.963 -10.292 2.551 1.00 0.32 H new ATOM 0 HG3 GLN A 25 7.049 -9.268 3.971 1.00 0.32 H new ATOM 0 HE21 GLN A 25 7.930 -7.010 3.530 1.00 1.13 H new ATOM 0 HE22 GLN A 25 7.563 -6.297 1.956 1.00 1.13 H new ATOM 416 N GLU A 26 9.213 -9.017 6.141 1.00 0.27 N ATOM 417 CA GLU A 26 8.620 -8.588 7.440 1.00 0.29 C ATOM 418 C GLU A 26 9.303 -7.301 7.899 1.00 0.26 C ATOM 419 O GLU A 26 8.657 -6.341 8.262 1.00 0.26 O ATOM 420 CB GLU A 26 8.810 -9.683 8.491 1.00 0.34 C ATOM 421 CG GLU A 26 7.916 -10.878 8.148 1.00 0.54 C ATOM 422 CD GLU A 26 8.197 -12.018 9.127 1.00 1.19 C ATOM 423 OE1 GLU A 26 8.985 -11.811 10.034 1.00 1.94 O ATOM 424 OE2 GLU A 26 7.614 -13.075 8.958 1.00 1.85 O ATOM 0 H GLU A 26 9.660 -9.934 6.144 1.00 0.27 H new ATOM 0 HA GLU A 26 7.552 -8.410 7.312 1.00 0.29 H new ATOM 0 HB2 GLU A 26 9.854 -9.994 8.524 1.00 0.34 H new ATOM 0 HB3 GLU A 26 8.560 -9.300 9.480 1.00 0.34 H new ATOM 0 HG2 GLU A 26 6.866 -10.588 8.201 1.00 0.54 H new ATOM 0 HG3 GLU A 26 8.105 -11.206 7.126 1.00 0.54 H new ATOM 431 N LEU A 27 10.609 -7.276 7.868 1.00 0.24 N ATOM 432 CA LEU A 27 11.355 -6.055 8.286 1.00 0.22 C ATOM 433 C LEU A 27 10.966 -4.889 7.377 1.00 0.19 C ATOM 434 O LEU A 27 10.796 -3.770 7.818 1.00 0.19 O ATOM 435 CB LEU A 27 12.860 -6.332 8.191 1.00 0.22 C ATOM 436 CG LEU A 27 13.667 -5.045 8.422 1.00 0.22 C ATOM 437 CD1 LEU A 27 13.238 -4.372 9.728 1.00 0.25 C ATOM 438 CD2 LEU A 27 15.155 -5.400 8.511 1.00 0.23 C ATOM 0 H LEU A 27 11.195 -8.056 7.569 1.00 0.24 H new ATOM 0 HA LEU A 27 11.106 -5.795 9.315 1.00 0.22 H new ATOM 0 HB2 LEU A 27 13.144 -7.082 8.929 1.00 0.22 H new ATOM 0 HB3 LEU A 27 13.097 -6.744 7.210 1.00 0.22 H new ATOM 0 HG LEU A 27 13.487 -4.360 7.594 1.00 0.22 H new ATOM 0 HD11 LEU A 27 13.819 -3.462 9.876 1.00 0.25 H new ATOM 0 HD12 LEU A 27 12.178 -4.121 9.677 1.00 0.25 H new ATOM 0 HD13 LEU A 27 13.410 -5.053 10.562 1.00 0.25 H new ATOM 0 HD21 LEU A 27 15.736 -4.493 8.675 1.00 0.23 H new ATOM 0 HD22 LEU A 27 15.316 -6.089 9.340 1.00 0.23 H new ATOM 0 HD23 LEU A 27 15.473 -5.871 7.581 1.00 0.23 H new ATOM 450 N LEU A 28 10.816 -5.138 6.106 1.00 0.18 N ATOM 451 CA LEU A 28 10.432 -4.035 5.186 1.00 0.18 C ATOM 452 C LEU A 28 9.087 -3.466 5.628 1.00 0.20 C ATOM 453 O LEU A 28 8.876 -2.270 5.615 1.00 0.20 O ATOM 454 CB LEU A 28 10.320 -4.580 3.754 1.00 0.18 C ATOM 455 CG LEU A 28 11.722 -4.727 3.134 1.00 0.18 C ATOM 456 CD1 LEU A 28 11.672 -5.714 1.958 1.00 0.21 C ATOM 457 CD2 LEU A 28 12.222 -3.363 2.623 1.00 0.22 C ATOM 0 H LEU A 28 10.942 -6.051 5.668 1.00 0.18 H new ATOM 0 HA LEU A 28 11.187 -3.250 5.212 1.00 0.18 H new ATOM 0 HB2 LEU A 28 9.814 -5.546 3.762 1.00 0.18 H new ATOM 0 HB3 LEU A 28 9.714 -3.908 3.147 1.00 0.18 H new ATOM 0 HG LEU A 28 12.403 -5.100 3.899 1.00 0.18 H new ATOM 0 HD11 LEU A 28 12.667 -5.813 1.524 1.00 0.21 H new ATOM 0 HD12 LEU A 28 11.332 -6.687 2.314 1.00 0.21 H new ATOM 0 HD13 LEU A 28 10.981 -5.343 1.201 1.00 0.21 H new ATOM 0 HD21 LEU A 28 13.214 -3.479 2.187 1.00 0.22 H new ATOM 0 HD22 LEU A 28 11.535 -2.984 1.866 1.00 0.22 H new ATOM 0 HD23 LEU A 28 12.271 -2.659 3.454 1.00 0.22 H new ATOM 469 N ARG A 29 8.176 -4.307 6.024 1.00 0.22 N ATOM 470 CA ARG A 29 6.854 -3.793 6.469 1.00 0.24 C ATOM 471 C ARG A 29 7.041 -2.871 7.678 1.00 0.24 C ATOM 472 O ARG A 29 6.396 -1.846 7.788 1.00 0.24 O ATOM 473 CB ARG A 29 5.949 -4.963 6.857 1.00 0.27 C ATOM 474 CG ARG A 29 5.560 -5.735 5.595 1.00 0.29 C ATOM 475 CD ARG A 29 4.644 -6.903 5.962 1.00 0.33 C ATOM 476 NE ARG A 29 4.394 -7.735 4.748 1.00 0.38 N ATOM 477 CZ ARG A 29 3.890 -8.933 4.872 1.00 0.88 C ATOM 478 NH1 ARG A 29 3.625 -9.405 6.057 1.00 1.83 N ATOM 479 NH2 ARG A 29 3.661 -9.663 3.811 1.00 0.86 N ATOM 0 H ARG A 29 8.288 -5.320 6.059 1.00 0.22 H new ATOM 0 HA ARG A 29 6.394 -3.235 5.654 1.00 0.24 H new ATOM 0 HB2 ARG A 29 6.464 -5.621 7.556 1.00 0.27 H new ATOM 0 HB3 ARG A 29 5.056 -4.596 7.363 1.00 0.27 H new ATOM 0 HG2 ARG A 29 5.055 -5.071 4.893 1.00 0.29 H new ATOM 0 HG3 ARG A 29 6.455 -6.106 5.095 1.00 0.29 H new ATOM 0 HD2 ARG A 29 5.103 -7.508 6.743 1.00 0.33 H new ATOM 0 HD3 ARG A 29 3.701 -6.529 6.361 1.00 0.33 H new ATOM 0 HE ARG A 29 4.617 -7.368 3.823 1.00 0.38 H new ATOM 0 HH11 ARG A 29 3.811 -8.839 6.885 1.00 1.83 H new ATOM 0 HH12 ARG A 29 3.231 -10.341 6.157 1.00 1.83 H new ATOM 0 HH21 ARG A 29 3.876 -9.297 2.884 1.00 0.86 H new ATOM 0 HH22 ARG A 29 3.267 -10.599 3.911 1.00 0.86 H new ATOM 493 N LEU A 30 7.915 -3.224 8.588 1.00 0.23 N ATOM 494 CA LEU A 30 8.129 -2.361 9.786 1.00 0.23 C ATOM 495 C LEU A 30 8.689 -1.010 9.344 1.00 0.21 C ATOM 496 O LEU A 30 8.307 0.026 9.853 1.00 0.22 O ATOM 497 CB LEU A 30 9.131 -3.025 10.739 1.00 0.24 C ATOM 498 CG LEU A 30 8.692 -4.454 11.079 1.00 0.27 C ATOM 499 CD1 LEU A 30 9.558 -4.985 12.218 1.00 0.29 C ATOM 500 CD2 LEU A 30 7.221 -4.479 11.506 1.00 0.33 C ATOM 0 H LEU A 30 8.486 -4.068 8.552 1.00 0.23 H new ATOM 0 HA LEU A 30 7.177 -2.223 10.298 1.00 0.23 H new ATOM 0 HB2 LEU A 30 10.120 -3.043 10.280 1.00 0.24 H new ATOM 0 HB3 LEU A 30 9.214 -2.438 11.654 1.00 0.24 H new ATOM 0 HG LEU A 30 8.809 -5.080 10.194 1.00 0.27 H new ATOM 0 HD11 LEU A 30 9.251 -6.001 12.465 1.00 0.29 H new ATOM 0 HD12 LEU A 30 10.604 -4.986 11.910 1.00 0.29 H new ATOM 0 HD13 LEU A 30 9.439 -4.347 13.094 1.00 0.29 H new ATOM 0 HD21 LEU A 30 6.928 -5.502 11.743 1.00 0.33 H new ATOM 0 HD22 LEU A 30 7.087 -3.850 12.386 1.00 0.33 H new ATOM 0 HD23 LEU A 30 6.600 -4.103 10.693 1.00 0.33 H new ATOM 512 N THR A 31 9.584 -1.003 8.397 1.00 0.19 N ATOM 513 CA THR A 31 10.145 0.295 7.936 1.00 0.17 C ATOM 514 C THR A 31 9.005 1.153 7.398 1.00 0.17 C ATOM 515 O THR A 31 8.935 2.341 7.641 1.00 0.17 O ATOM 516 CB THR A 31 11.182 0.048 6.839 1.00 0.17 C ATOM 517 OG1 THR A 31 10.562 -0.607 5.740 1.00 0.18 O ATOM 518 CG2 THR A 31 12.308 -0.827 7.394 1.00 0.19 C ATOM 0 H THR A 31 9.948 -1.831 7.926 1.00 0.19 H new ATOM 0 HA THR A 31 10.632 0.809 8.765 1.00 0.17 H new ATOM 0 HB THR A 31 11.595 0.999 6.504 1.00 0.17 H new ATOM 0 HG1 THR A 31 9.910 -1.258 6.073 1.00 0.18 H new ATOM 0 HG21 THR A 31 13.049 -1.005 6.614 1.00 0.19 H new ATOM 0 HG22 THR A 31 12.781 -0.321 8.235 1.00 0.19 H new ATOM 0 HG23 THR A 31 11.897 -1.780 7.728 1.00 0.19 H new ATOM 526 N VAL A 32 8.093 0.553 6.688 1.00 0.18 N ATOM 527 CA VAL A 32 6.942 1.325 6.159 1.00 0.19 C ATOM 528 C VAL A 32 6.091 1.799 7.338 1.00 0.20 C ATOM 529 O VAL A 32 5.592 2.906 7.353 1.00 0.20 O ATOM 530 CB VAL A 32 6.107 0.429 5.242 1.00 0.21 C ATOM 531 CG1 VAL A 32 4.819 1.154 4.840 1.00 0.23 C ATOM 532 CG2 VAL A 32 6.919 0.095 3.989 1.00 0.22 C ATOM 0 H VAL A 32 8.097 -0.439 6.452 1.00 0.18 H new ATOM 0 HA VAL A 32 7.294 2.185 5.589 1.00 0.19 H new ATOM 0 HB VAL A 32 5.850 -0.490 5.769 1.00 0.21 H new ATOM 0 HG11 VAL A 32 4.228 0.511 4.187 1.00 0.23 H new ATOM 0 HG12 VAL A 32 4.242 1.392 5.733 1.00 0.23 H new ATOM 0 HG13 VAL A 32 5.069 2.075 4.313 1.00 0.23 H new ATOM 0 HG21 VAL A 32 6.328 -0.543 3.332 1.00 0.22 H new ATOM 0 HG22 VAL A 32 7.175 1.016 3.465 1.00 0.22 H new ATOM 0 HG23 VAL A 32 7.833 -0.426 4.276 1.00 0.22 H new ATOM 542 N TRP A 33 5.918 0.960 8.326 1.00 0.21 N ATOM 543 CA TRP A 33 5.093 1.352 9.503 1.00 0.23 C ATOM 544 C TRP A 33 5.702 2.585 10.174 1.00 0.22 C ATOM 545 O TRP A 33 5.013 3.547 10.451 1.00 0.23 O ATOM 546 CB TRP A 33 5.043 0.198 10.506 1.00 0.25 C ATOM 547 CG TRP A 33 4.208 0.604 11.681 1.00 0.27 C ATOM 548 CD1 TRP A 33 2.866 0.449 11.766 1.00 0.32 C ATOM 549 CD2 TRP A 33 4.628 1.227 12.929 1.00 0.27 C ATOM 550 NE1 TRP A 33 2.435 0.942 12.985 1.00 0.33 N ATOM 551 CE2 TRP A 33 3.483 1.430 13.739 1.00 0.31 C ATOM 552 CE3 TRP A 33 5.877 1.634 13.433 1.00 0.26 C ATOM 553 CZ2 TRP A 33 3.576 2.016 15.002 1.00 0.32 C ATOM 554 CZ3 TRP A 33 5.974 2.223 14.706 1.00 0.28 C ATOM 555 CH2 TRP A 33 4.826 2.413 15.489 1.00 0.31 C ATOM 0 H TRP A 33 6.313 0.021 8.367 1.00 0.21 H new ATOM 0 HA TRP A 33 4.082 1.585 9.168 1.00 0.23 H new ATOM 0 HB2 TRP A 33 4.623 -0.691 10.035 1.00 0.25 H new ATOM 0 HB3 TRP A 33 6.050 -0.060 10.832 1.00 0.25 H new ATOM 0 HD1 TRP A 33 2.235 0.012 11.006 1.00 0.32 H new ATOM 0 HE1 TRP A 33 1.461 0.944 13.289 1.00 0.33 H new ATOM 0 HE3 TRP A 33 6.767 1.493 12.838 1.00 0.26 H new ATOM 0 HZ2 TRP A 33 2.689 2.162 15.600 1.00 0.32 H new ATOM 0 HZ3 TRP A 33 6.938 2.531 15.083 1.00 0.28 H new ATOM 0 HH2 TRP A 33 4.907 2.865 16.466 1.00 0.31 H new ATOM 566 N GLY A 34 6.985 2.579 10.434 1.00 0.22 N ATOM 567 CA GLY A 34 7.606 3.765 11.079 1.00 0.23 C ATOM 568 C GLY A 34 7.401 4.980 10.177 1.00 0.22 C ATOM 569 O GLY A 34 7.054 6.049 10.632 1.00 0.23 O ATOM 0 H GLY A 34 7.621 1.809 10.228 1.00 0.22 H new ATOM 0 HA2 GLY A 34 7.157 3.941 12.057 1.00 0.23 H new ATOM 0 HA3 GLY A 34 8.670 3.592 11.243 1.00 0.23 H new ATOM 573 N THR A 35 7.606 4.827 8.897 1.00 0.22 N ATOM 574 CA THR A 35 7.417 5.983 7.976 1.00 0.24 C ATOM 575 C THR A 35 5.968 6.472 8.074 1.00 0.23 C ATOM 576 O THR A 35 5.712 7.647 8.252 1.00 0.24 O ATOM 577 CB THR A 35 7.720 5.535 6.540 1.00 0.27 C ATOM 578 OG1 THR A 35 9.029 4.987 6.492 1.00 0.30 O ATOM 579 CG2 THR A 35 7.647 6.733 5.586 1.00 0.30 C ATOM 0 H THR A 35 7.895 3.956 8.451 1.00 0.22 H new ATOM 0 HA THR A 35 8.091 6.795 8.251 1.00 0.24 H new ATOM 0 HB THR A 35 6.986 4.789 6.236 1.00 0.27 H new ATOM 0 HG1 THR A 35 9.015 4.075 6.850 1.00 0.30 H new ATOM 0 HG21 THR A 35 7.864 6.403 4.570 1.00 0.30 H new ATOM 0 HG22 THR A 35 6.647 7.166 5.621 1.00 0.30 H new ATOM 0 HG23 THR A 35 8.378 7.483 5.887 1.00 0.30 H new ATOM 587 N LYS A 36 5.018 5.585 7.965 1.00 0.25 N ATOM 588 CA LYS A 36 3.591 6.009 8.061 1.00 0.28 C ATOM 589 C LYS A 36 3.331 6.614 9.442 1.00 0.28 C ATOM 590 O LYS A 36 2.669 7.622 9.578 1.00 0.30 O ATOM 591 CB LYS A 36 2.683 4.788 7.865 1.00 0.32 C ATOM 592 CG LYS A 36 2.733 4.305 6.402 1.00 0.46 C ATOM 593 CD LYS A 36 1.715 5.079 5.540 1.00 0.77 C ATOM 594 CE LYS A 36 0.269 4.738 5.958 1.00 1.44 C ATOM 595 NZ LYS A 36 -0.239 5.774 6.903 1.00 2.00 N ATOM 0 H LYS A 36 5.166 4.587 7.814 1.00 0.25 H new ATOM 0 HA LYS A 36 3.380 6.751 7.291 1.00 0.28 H new ATOM 0 HB2 LYS A 36 2.997 3.984 8.530 1.00 0.32 H new ATOM 0 HB3 LYS A 36 1.658 5.043 8.135 1.00 0.32 H new ATOM 0 HG2 LYS A 36 3.737 4.444 6.001 1.00 0.46 H new ATOM 0 HG3 LYS A 36 2.518 3.237 6.358 1.00 0.46 H new ATOM 0 HD2 LYS A 36 1.885 6.151 5.644 1.00 0.77 H new ATOM 0 HD3 LYS A 36 1.862 4.833 4.488 1.00 0.77 H new ATOM 0 HE2 LYS A 36 -0.372 4.689 5.078 1.00 1.44 H new ATOM 0 HE3 LYS A 36 0.239 3.756 6.429 1.00 1.44 H new ATOM 0 HZ1 LYS A 36 -0.615 5.312 7.755 1.00 2.00 H new ATOM 0 HZ2 LYS A 36 0.538 6.412 7.169 1.00 2.00 H new ATOM 0 HZ3 LYS A 36 -0.995 6.322 6.444 1.00 2.00 H new ATOM 609 N ASN A 37 3.856 5.996 10.463 1.00 0.27 N ATOM 610 CA ASN A 37 3.660 6.508 11.847 1.00 0.30 C ATOM 611 C ASN A 37 4.245 7.919 11.981 1.00 0.29 C ATOM 612 O ASN A 37 3.665 8.780 12.610 1.00 0.32 O ATOM 613 CB ASN A 37 4.340 5.562 12.825 1.00 0.32 C ATOM 614 CG ASN A 37 4.225 6.116 14.246 1.00 0.37 C ATOM 615 OD1 ASN A 37 3.087 6.033 14.878 1.00 0.74 O flip ATOM 616 ND2 ASN A 37 5.182 6.633 14.787 1.00 0.47 N flip ATOM 0 H ASN A 37 4.419 5.148 10.396 1.00 0.27 H new ATOM 0 HA ASN A 37 2.594 6.559 12.068 1.00 0.30 H new ATOM 0 HB2 ASN A 37 3.879 4.576 12.771 1.00 0.32 H new ATOM 0 HB3 ASN A 37 5.389 5.439 12.556 1.00 0.32 H new ATOM 0 HD21 ASN A 37 6.073 6.699 14.294 1.00 0.47 H new ATOM 0 HD22 ASN A 37 5.095 7.001 15.734 1.00 0.47 H new ATOM 623 N LEU A 38 5.380 8.174 11.388 1.00 0.26 N ATOM 624 CA LEU A 38 5.970 9.540 11.483 1.00 0.27 C ATOM 625 C LEU A 38 4.980 10.530 10.880 1.00 0.26 C ATOM 626 O LEU A 38 4.795 11.622 11.380 1.00 0.28 O ATOM 627 CB LEU A 38 7.301 9.605 10.728 1.00 0.26 C ATOM 628 CG LEU A 38 8.384 8.823 11.491 1.00 0.30 C ATOM 629 CD1 LEU A 38 9.617 8.670 10.593 1.00 0.33 C ATOM 630 CD2 LEU A 38 8.776 9.567 12.788 1.00 0.35 C ATOM 0 H LEU A 38 5.921 7.501 10.845 1.00 0.26 H new ATOM 0 HA LEU A 38 6.163 9.786 12.527 1.00 0.27 H new ATOM 0 HB2 LEU A 38 7.180 9.191 9.727 1.00 0.26 H new ATOM 0 HB3 LEU A 38 7.609 10.644 10.608 1.00 0.26 H new ATOM 0 HG LEU A 38 7.994 7.841 11.759 1.00 0.30 H new ATOM 0 HD11 LEU A 38 10.390 8.117 11.127 1.00 0.33 H new ATOM 0 HD12 LEU A 38 9.343 8.129 9.688 1.00 0.33 H new ATOM 0 HD13 LEU A 38 9.997 9.656 10.325 1.00 0.33 H new ATOM 0 HD21 LEU A 38 9.543 9.000 13.315 1.00 0.35 H new ATOM 0 HD22 LEU A 38 9.163 10.555 12.538 1.00 0.35 H new ATOM 0 HD23 LEU A 38 7.899 9.672 13.427 1.00 0.35 H new ATOM 642 N GLN A 39 4.329 10.157 9.815 1.00 0.25 N ATOM 643 CA GLN A 39 3.344 11.081 9.198 1.00 0.29 C ATOM 644 C GLN A 39 2.265 11.389 10.236 1.00 0.33 C ATOM 645 O GLN A 39 1.807 12.507 10.356 1.00 0.35 O ATOM 646 CB GLN A 39 2.697 10.428 7.978 1.00 0.32 C ATOM 647 CG GLN A 39 1.782 11.439 7.283 1.00 0.40 C ATOM 648 CD GLN A 39 1.158 10.792 6.046 1.00 0.45 C ATOM 649 OE1 GLN A 39 1.185 9.586 5.900 1.00 0.85 O ATOM 650 NE2 GLN A 39 0.594 11.547 5.142 1.00 0.97 N ATOM 0 H GLN A 39 4.437 9.256 9.348 1.00 0.25 H new ATOM 0 HA GLN A 39 3.846 11.995 8.879 1.00 0.29 H new ATOM 0 HB2 GLN A 39 3.466 10.082 7.287 1.00 0.32 H new ATOM 0 HB3 GLN A 39 2.124 9.552 8.282 1.00 0.32 H new ATOM 0 HG2 GLN A 39 1.001 11.770 7.967 1.00 0.40 H new ATOM 0 HG3 GLN A 39 2.350 12.324 6.997 1.00 0.40 H new ATOM 0 HE21 GLN A 39 0.571 12.559 5.265 1.00 0.97 H new ATOM 0 HE22 GLN A 39 0.176 11.124 4.313 1.00 0.97 H new ATOM 659 N THR A 40 1.851 10.411 10.997 1.00 0.36 N ATOM 660 CA THR A 40 0.807 10.681 12.023 1.00 0.42 C ATOM 661 C THR A 40 1.340 11.738 12.990 1.00 0.41 C ATOM 662 O THR A 40 0.627 12.638 13.387 1.00 0.43 O ATOM 663 CB THR A 40 0.471 9.401 12.796 1.00 0.47 C ATOM 664 OG1 THR A 40 1.571 9.038 13.616 1.00 0.46 O ATOM 665 CG2 THR A 40 0.159 8.269 11.815 1.00 0.49 C ATOM 0 H THR A 40 2.187 9.449 10.953 1.00 0.36 H new ATOM 0 HA THR A 40 -0.100 11.036 11.534 1.00 0.42 H new ATOM 0 HB THR A 40 -0.403 9.578 13.423 1.00 0.47 H new ATOM 0 HG1 THR A 40 2.313 8.733 13.052 1.00 0.46 H new ATOM 0 HG21 THR A 40 -0.079 7.362 12.370 1.00 0.49 H new ATOM 0 HG22 THR A 40 -0.693 8.549 11.195 1.00 0.49 H new ATOM 0 HG23 THR A 40 1.026 8.089 11.180 1.00 0.49 H new ATOM 673 N ARG A 41 2.596 11.667 13.355 1.00 0.39 N ATOM 674 CA ARG A 41 3.135 12.710 14.268 1.00 0.39 C ATOM 675 C ARG A 41 2.993 14.063 13.581 1.00 0.36 C ATOM 676 O ARG A 41 2.646 15.053 14.197 1.00 0.37 O ATOM 677 CB ARG A 41 4.624 12.469 14.550 1.00 0.43 C ATOM 678 CG ARG A 41 4.818 11.228 15.427 1.00 0.55 C ATOM 679 CD ARG A 41 6.280 11.181 15.899 1.00 0.66 C ATOM 680 NE ARG A 41 6.645 9.798 16.358 1.00 0.89 N ATOM 681 CZ ARG A 41 5.971 9.188 17.292 1.00 1.04 C ATOM 682 NH1 ARG A 41 5.030 9.810 17.943 1.00 1.22 N ATOM 683 NH2 ARG A 41 6.270 7.959 17.609 1.00 1.32 N ATOM 0 H ARG A 41 3.257 10.946 13.065 1.00 0.39 H new ATOM 0 HA ARG A 41 2.585 12.679 15.209 1.00 0.39 H new ATOM 0 HB2 ARG A 41 5.161 12.343 13.610 1.00 0.43 H new ATOM 0 HB3 ARG A 41 5.050 13.341 15.046 1.00 0.43 H new ATOM 0 HG2 ARG A 41 4.145 11.262 16.284 1.00 0.55 H new ATOM 0 HG3 ARG A 41 4.573 10.326 14.865 1.00 0.55 H new ATOM 0 HD2 ARG A 41 6.940 11.486 15.087 1.00 0.66 H new ATOM 0 HD3 ARG A 41 6.428 11.891 16.713 1.00 0.66 H new ATOM 0 HE ARG A 41 7.440 9.325 15.928 1.00 0.89 H new ATOM 0 HH11 ARG A 41 4.815 10.783 17.723 1.00 1.22 H new ATOM 0 HH12 ARG A 41 4.508 9.324 18.672 1.00 1.22 H new ATOM 0 HH21 ARG A 41 7.029 7.478 17.127 1.00 1.32 H new ATOM 0 HH22 ARG A 41 5.745 7.479 18.339 1.00 1.32 H new ATOM 697 N VAL A 42 3.262 14.110 12.303 1.00 0.33 N ATOM 698 CA VAL A 42 3.147 15.395 11.570 1.00 0.35 C ATOM 699 C VAL A 42 1.701 15.885 11.649 1.00 0.38 C ATOM 700 O VAL A 42 1.447 17.042 11.898 1.00 0.40 O ATOM 701 CB VAL A 42 3.560 15.199 10.106 1.00 0.37 C ATOM 702 CG1 VAL A 42 3.245 16.464 9.304 1.00 0.43 C ATOM 703 CG2 VAL A 42 5.063 14.914 10.035 1.00 0.38 C ATOM 0 H VAL A 42 3.556 13.312 11.739 1.00 0.33 H new ATOM 0 HA VAL A 42 3.807 16.137 12.020 1.00 0.35 H new ATOM 0 HB VAL A 42 3.006 14.359 9.686 1.00 0.37 H new ATOM 0 HG11 VAL A 42 3.540 16.319 8.265 1.00 0.43 H new ATOM 0 HG12 VAL A 42 2.175 16.668 9.352 1.00 0.43 H new ATOM 0 HG13 VAL A 42 3.795 17.307 9.723 1.00 0.43 H new ATOM 0 HG21 VAL A 42 5.358 14.774 8.995 1.00 0.38 H new ATOM 0 HG22 VAL A 42 5.613 15.754 10.459 1.00 0.38 H new ATOM 0 HG23 VAL A 42 5.289 14.010 10.601 1.00 0.38 H new ATOM 713 N THR A 43 0.744 15.015 11.446 1.00 0.39 N ATOM 714 CA THR A 43 -0.675 15.467 11.519 1.00 0.45 C ATOM 715 C THR A 43 -0.950 16.027 12.913 1.00 0.44 C ATOM 716 O THR A 43 -1.609 17.037 13.068 1.00 0.47 O ATOM 717 CB THR A 43 -1.614 14.288 11.256 1.00 0.50 C ATOM 718 OG1 THR A 43 -1.395 13.283 12.237 1.00 0.50 O ATOM 719 CG2 THR A 43 -1.347 13.719 9.862 1.00 0.51 C ATOM 0 H THR A 43 0.882 14.026 11.236 1.00 0.39 H new ATOM 0 HA THR A 43 -0.847 16.236 10.766 1.00 0.45 H new ATOM 0 HB THR A 43 -2.649 14.627 11.310 1.00 0.50 H new ATOM 0 HG1 THR A 43 -0.433 13.183 12.394 1.00 0.50 H new ATOM 0 HG21 THR A 43 -2.017 12.879 9.677 1.00 0.51 H new ATOM 0 HG22 THR A 43 -1.520 14.493 9.114 1.00 0.51 H new ATOM 0 HG23 THR A 43 -0.313 13.379 9.800 1.00 0.51 H new ATOM 727 N ALA A 44 -0.440 15.390 13.929 1.00 0.42 N ATOM 728 CA ALA A 44 -0.665 15.903 15.307 1.00 0.43 C ATOM 729 C ALA A 44 0.015 17.266 15.443 1.00 0.39 C ATOM 730 O ALA A 44 -0.545 18.207 15.970 1.00 0.39 O ATOM 731 CB ALA A 44 -0.073 14.922 16.320 1.00 0.45 C ATOM 0 H ALA A 44 0.120 14.540 13.865 1.00 0.42 H new ATOM 0 HA ALA A 44 -1.733 16.006 15.497 1.00 0.43 H new ATOM 0 HB1 ALA A 44 -0.238 15.298 17.330 1.00 0.45 H new ATOM 0 HB2 ALA A 44 -0.556 13.951 16.211 1.00 0.45 H new ATOM 0 HB3 ALA A 44 0.997 14.817 16.142 1.00 0.45 H new ATOM 737 N ILE A 45 1.214 17.379 14.941 1.00 0.35 N ATOM 738 CA ILE A 45 1.949 18.674 15.013 1.00 0.32 C ATOM 739 C ILE A 45 1.141 19.746 14.282 1.00 0.32 C ATOM 740 O ILE A 45 1.069 20.880 14.710 1.00 0.31 O ATOM 741 CB ILE A 45 3.337 18.523 14.371 1.00 0.31 C ATOM 742 CG1 ILE A 45 4.211 17.637 15.266 1.00 0.32 C ATOM 743 CG2 ILE A 45 3.992 19.904 14.232 1.00 0.30 C ATOM 744 CD1 ILE A 45 5.495 17.250 14.527 1.00 0.33 C ATOM 0 H ILE A 45 1.720 16.623 14.480 1.00 0.35 H new ATOM 0 HA ILE A 45 2.080 18.967 16.055 1.00 0.32 H new ATOM 0 HB ILE A 45 3.236 18.069 13.385 1.00 0.31 H new ATOM 0 HG12 ILE A 45 4.457 18.166 16.187 1.00 0.32 H new ATOM 0 HG13 ILE A 45 3.661 16.740 15.551 1.00 0.32 H new ATOM 0 HG21 ILE A 45 4.976 19.796 13.777 1.00 0.30 H new ATOM 0 HG22 ILE A 45 3.369 20.540 13.603 1.00 0.30 H new ATOM 0 HG23 ILE A 45 4.096 20.358 15.217 1.00 0.30 H new ATOM 0 HD11 ILE A 45 6.110 16.621 15.171 1.00 0.33 H new ATOM 0 HD12 ILE A 45 5.241 16.703 13.619 1.00 0.33 H new ATOM 0 HD13 ILE A 45 6.049 18.151 14.264 1.00 0.33 H new ATOM 756 N GLU A 46 0.552 19.408 13.171 1.00 0.35 N ATOM 757 CA GLU A 46 -0.228 20.422 12.412 1.00 0.37 C ATOM 758 C GLU A 46 -1.360 20.961 13.293 1.00 0.38 C ATOM 759 O GLU A 46 -1.631 22.143 13.304 1.00 0.38 O ATOM 760 CB GLU A 46 -0.826 19.754 11.174 1.00 0.44 C ATOM 761 CG GLU A 46 0.291 19.421 10.179 1.00 1.20 C ATOM 762 CD GLU A 46 0.765 20.688 9.468 1.00 1.67 C ATOM 763 OE1 GLU A 46 0.187 21.022 8.447 1.00 2.26 O ATOM 764 OE2 GLU A 46 1.702 21.299 9.954 1.00 2.17 O ATOM 0 H GLU A 46 0.577 18.476 12.757 1.00 0.35 H new ATOM 0 HA GLU A 46 0.422 21.245 12.116 1.00 0.37 H new ATOM 0 HB2 GLU A 46 -1.356 18.845 11.459 1.00 0.44 H new ATOM 0 HB3 GLU A 46 -1.556 20.416 10.708 1.00 0.44 H new ATOM 0 HG2 GLU A 46 1.126 18.956 10.702 1.00 1.20 H new ATOM 0 HG3 GLU A 46 -0.069 18.698 9.447 1.00 1.20 H new ATOM 771 N LYS A 47 -2.015 20.126 14.052 1.00 0.41 N ATOM 772 CA LYS A 47 -3.100 20.656 14.923 1.00 0.44 C ATOM 773 C LYS A 47 -2.511 21.658 15.921 1.00 0.41 C ATOM 774 O LYS A 47 -3.090 22.694 16.190 1.00 0.42 O ATOM 775 CB LYS A 47 -3.790 19.508 15.674 1.00 0.48 C ATOM 776 CG LYS A 47 -4.611 18.673 14.683 1.00 1.21 C ATOM 777 CD LYS A 47 -5.397 17.580 15.427 1.00 1.55 C ATOM 778 CE LYS A 47 -4.488 16.388 15.746 1.00 2.31 C ATOM 779 NZ LYS A 47 -5.308 15.282 16.317 1.00 2.88 N ATOM 0 H LYS A 47 -1.851 19.121 14.107 1.00 0.41 H new ATOM 0 HA LYS A 47 -3.842 21.158 14.302 1.00 0.44 H new ATOM 0 HB2 LYS A 47 -3.046 18.881 16.166 1.00 0.48 H new ATOM 0 HB3 LYS A 47 -4.438 19.907 16.455 1.00 0.48 H new ATOM 0 HG2 LYS A 47 -5.300 19.318 14.137 1.00 1.21 H new ATOM 0 HG3 LYS A 47 -3.950 18.217 13.946 1.00 1.21 H new ATOM 0 HD2 LYS A 47 -5.811 17.986 16.350 1.00 1.55 H new ATOM 0 HD3 LYS A 47 -6.239 17.250 14.818 1.00 1.55 H new ATOM 0 HE2 LYS A 47 -3.981 16.051 14.842 1.00 2.31 H new ATOM 0 HE3 LYS A 47 -3.714 16.685 16.454 1.00 2.31 H new ATOM 0 HZ1 LYS A 47 -4.694 14.471 16.535 1.00 2.88 H new ATOM 0 HZ2 LYS A 47 -5.772 15.608 17.188 1.00 2.88 H new ATOM 0 HZ3 LYS A 47 -6.031 14.994 15.627 1.00 2.88 H new ATOM 793 N TYR A 48 -1.356 21.374 16.460 1.00 0.38 N ATOM 794 CA TYR A 48 -0.739 22.328 17.423 1.00 0.36 C ATOM 795 C TYR A 48 -0.299 23.594 16.685 1.00 0.33 C ATOM 796 O TYR A 48 -0.447 24.690 17.182 1.00 0.33 O ATOM 797 CB TYR A 48 0.460 21.681 18.122 1.00 0.37 C ATOM 798 CG TYR A 48 -0.036 20.643 19.101 1.00 0.41 C ATOM 799 CD1 TYR A 48 -0.613 21.045 20.311 1.00 0.45 C ATOM 800 CD2 TYR A 48 0.078 19.283 18.801 1.00 0.41 C ATOM 801 CE1 TYR A 48 -1.075 20.084 21.221 1.00 0.51 C ATOM 802 CE2 TYR A 48 -0.384 18.323 19.709 1.00 0.46 C ATOM 803 CZ TYR A 48 -0.960 18.723 20.918 1.00 0.51 C ATOM 804 OH TYR A 48 -1.419 17.774 21.808 1.00 0.57 O ATOM 0 H TYR A 48 -0.817 20.528 16.276 1.00 0.38 H new ATOM 0 HA TYR A 48 -1.477 22.593 18.180 1.00 0.36 H new ATOM 0 HB2 TYR A 48 1.119 21.219 17.387 1.00 0.37 H new ATOM 0 HB3 TYR A 48 1.045 22.439 18.643 1.00 0.37 H new ATOM 0 HD1 TYR A 48 -0.702 22.096 20.544 1.00 0.45 H new ATOM 0 HD2 TYR A 48 0.523 18.972 17.867 1.00 0.41 H new ATOM 0 HE1 TYR A 48 -1.519 20.394 22.155 1.00 0.51 H new ATOM 0 HE2 TYR A 48 -0.295 17.272 19.475 1.00 0.46 H new ATOM 0 HH TYR A 48 -1.263 16.879 21.441 1.00 0.57 H new ATOM 814 N LEU A 49 0.243 23.466 15.503 1.00 0.31 N ATOM 815 CA LEU A 49 0.677 24.686 14.766 1.00 0.29 C ATOM 816 C LEU A 49 -0.548 25.591 14.541 1.00 0.32 C ATOM 817 O LEU A 49 -0.478 26.795 14.676 1.00 0.32 O ATOM 818 CB LEU A 49 1.308 24.280 13.426 1.00 0.29 C ATOM 819 CG LEU A 49 2.667 23.589 13.657 1.00 0.25 C ATOM 820 CD1 LEU A 49 3.148 22.994 12.333 1.00 0.28 C ATOM 821 CD2 LEU A 49 3.711 24.599 14.169 1.00 0.25 C ATOM 0 H LEU A 49 0.402 22.581 15.022 1.00 0.31 H new ATOM 0 HA LEU A 49 1.423 25.232 15.344 1.00 0.29 H new ATOM 0 HB2 LEU A 49 0.638 23.608 12.890 1.00 0.29 H new ATOM 0 HB3 LEU A 49 1.443 25.161 12.799 1.00 0.29 H new ATOM 0 HG LEU A 49 2.545 22.806 14.405 1.00 0.25 H new ATOM 0 HD11 LEU A 49 4.109 22.502 12.483 1.00 0.28 H new ATOM 0 HD12 LEU A 49 2.420 22.266 11.975 1.00 0.28 H new ATOM 0 HD13 LEU A 49 3.259 23.789 11.596 1.00 0.28 H new ATOM 0 HD21 LEU A 49 4.663 24.091 14.326 1.00 0.25 H new ATOM 0 HD22 LEU A 49 3.840 25.393 13.434 1.00 0.25 H new ATOM 0 HD23 LEU A 49 3.370 25.029 15.111 1.00 0.25 H new ATOM 833 N LYS A 50 -1.679 25.024 14.225 1.00 0.35 N ATOM 834 CA LYS A 50 -2.898 25.863 14.029 1.00 0.39 C ATOM 835 C LYS A 50 -3.201 26.614 15.333 1.00 0.39 C ATOM 836 O LYS A 50 -3.569 27.777 15.334 1.00 0.41 O ATOM 837 CB LYS A 50 -4.080 24.965 13.665 1.00 0.44 C ATOM 838 CG LYS A 50 -3.871 24.397 12.261 1.00 1.03 C ATOM 839 CD LYS A 50 -5.054 23.499 11.895 1.00 1.21 C ATOM 840 CE LYS A 50 -4.850 22.929 10.490 1.00 1.58 C ATOM 841 NZ LYS A 50 -3.715 21.964 10.502 1.00 2.18 N ATOM 0 H LYS A 50 -1.814 24.021 14.094 1.00 0.35 H new ATOM 0 HA LYS A 50 -2.731 26.579 13.224 1.00 0.39 H new ATOM 0 HB2 LYS A 50 -4.171 24.154 14.388 1.00 0.44 H new ATOM 0 HB3 LYS A 50 -5.009 25.534 13.705 1.00 0.44 H new ATOM 0 HG2 LYS A 50 -3.779 25.208 11.539 1.00 1.03 H new ATOM 0 HG3 LYS A 50 -2.942 23.828 12.222 1.00 1.03 H new ATOM 0 HD2 LYS A 50 -5.145 22.688 12.618 1.00 1.21 H new ATOM 0 HD3 LYS A 50 -5.982 24.069 11.936 1.00 1.21 H new ATOM 0 HE2 LYS A 50 -5.760 22.432 10.153 1.00 1.58 H new ATOM 0 HE3 LYS A 50 -4.647 23.736 9.785 1.00 1.58 H new ATOM 0 HZ1 LYS A 50 -3.082 22.162 9.701 1.00 2.18 H new ATOM 0 HZ2 LYS A 50 -3.187 22.060 11.393 1.00 2.18 H new ATOM 0 HZ3 LYS A 50 -4.083 20.995 10.421 1.00 2.18 H new ATOM 855 N ASP A 51 -3.036 25.951 16.447 1.00 0.38 N ATOM 856 CA ASP A 51 -3.297 26.605 17.762 1.00 0.40 C ATOM 857 C ASP A 51 -2.373 27.811 17.904 1.00 0.38 C ATOM 858 O ASP A 51 -2.763 28.851 18.397 1.00 0.40 O ATOM 859 CB ASP A 51 -3.048 25.616 18.902 1.00 0.42 C ATOM 860 CG ASP A 51 -4.149 24.553 18.903 1.00 1.29 C ATOM 861 OD1 ASP A 51 -5.205 24.824 18.356 1.00 1.96 O ATOM 862 OD2 ASP A 51 -3.917 23.489 19.451 1.00 2.07 O ATOM 0 H ASP A 51 -2.730 24.980 16.502 1.00 0.38 H new ATOM 0 HA ASP A 51 -4.336 26.930 17.810 1.00 0.40 H new ATOM 0 HB2 ASP A 51 -2.072 25.145 18.783 1.00 0.42 H new ATOM 0 HB3 ASP A 51 -3.034 26.141 19.857 1.00 0.42 H new ATOM 867 N GLN A 52 -1.154 27.683 17.467 1.00 0.36 N ATOM 868 CA GLN A 52 -0.206 28.824 17.567 1.00 0.38 C ATOM 869 C GLN A 52 -0.796 30.016 16.809 1.00 0.38 C ATOM 870 O GLN A 52 -0.699 31.147 17.242 1.00 0.40 O ATOM 871 CB GLN A 52 1.150 28.407 16.967 1.00 0.42 C ATOM 872 CG GLN A 52 2.021 29.635 16.665 1.00 1.31 C ATOM 873 CD GLN A 52 1.602 30.297 15.343 1.00 2.37 C ATOM 874 OE1 GLN A 52 0.766 29.691 14.541 1.00 3.28 O flip ATOM 875 NE2 GLN A 52 2.044 31.387 15.039 1.00 2.59 N flip ATOM 0 H GLN A 52 -0.773 26.837 17.044 1.00 0.36 H new ATOM 0 HA GLN A 52 -0.050 29.108 18.608 1.00 0.38 H new ATOM 0 HB2 GLN A 52 1.672 27.749 17.662 1.00 0.42 H new ATOM 0 HB3 GLN A 52 0.987 27.839 16.051 1.00 0.42 H new ATOM 0 HG2 GLN A 52 1.936 30.355 17.479 1.00 1.31 H new ATOM 0 HG3 GLN A 52 3.068 29.338 16.611 1.00 1.31 H new ATOM 0 HE21 GLN A 52 2.697 31.864 15.661 1.00 2.59 H new ATOM 0 HE22 GLN A 52 1.763 31.825 14.162 1.00 2.59 H new ATOM 884 N ALA A 53 -1.407 29.776 15.682 1.00 0.39 N ATOM 885 CA ALA A 53 -2.000 30.894 14.904 1.00 0.45 C ATOM 886 C ALA A 53 -3.056 31.602 15.752 1.00 0.47 C ATOM 887 O ALA A 53 -3.216 32.805 15.684 1.00 0.53 O ATOM 888 CB ALA A 53 -2.661 30.337 13.650 1.00 0.49 C ATOM 0 H ALA A 53 -1.520 28.851 15.267 1.00 0.39 H new ATOM 0 HA ALA A 53 -1.217 31.601 14.629 1.00 0.45 H new ATOM 0 HB1 ALA A 53 -3.098 31.154 13.076 1.00 0.49 H new ATOM 0 HB2 ALA A 53 -1.915 29.824 13.043 1.00 0.49 H new ATOM 0 HB3 ALA A 53 -3.444 29.633 13.933 1.00 0.49 H new ATOM 894 N GLN A 54 -3.791 30.870 16.540 1.00 0.45 N ATOM 895 CA GLN A 54 -4.844 31.512 17.374 1.00 0.50 C ATOM 896 C GLN A 54 -4.199 32.540 18.306 1.00 0.55 C ATOM 897 O GLN A 54 -4.734 33.609 18.521 1.00 0.62 O ATOM 898 CB GLN A 54 -5.571 30.443 18.198 1.00 0.51 C ATOM 899 CG GLN A 54 -6.664 31.092 19.056 1.00 0.58 C ATOM 900 CD GLN A 54 -7.379 30.014 19.871 1.00 0.62 C ATOM 901 OE1 GLN A 54 -6.744 29.166 20.466 1.00 0.97 O ATOM 902 NE2 GLN A 54 -8.684 30.012 19.927 1.00 1.03 N ATOM 0 H GLN A 54 -3.709 29.859 16.643 1.00 0.45 H new ATOM 0 HA GLN A 54 -5.564 32.015 16.729 1.00 0.50 H new ATOM 0 HB2 GLN A 54 -6.012 29.699 17.535 1.00 0.51 H new ATOM 0 HB3 GLN A 54 -4.860 29.919 18.836 1.00 0.51 H new ATOM 0 HG2 GLN A 54 -6.225 31.835 19.722 1.00 0.58 H new ATOM 0 HG3 GLN A 54 -7.378 31.616 18.420 1.00 0.58 H new ATOM 0 HE21 GLN A 54 -9.217 30.724 19.428 1.00 1.03 H new ATOM 0 HE22 GLN A 54 -9.170 29.299 20.470 1.00 1.03 H new ATOM 911 N LEU A 55 -3.060 32.236 18.861 1.00 0.54 N ATOM 912 CA LEU A 55 -2.403 33.214 19.769 1.00 0.62 C ATOM 913 C LEU A 55 -1.886 34.388 18.939 1.00 0.66 C ATOM 914 O LEU A 55 -1.026 34.230 18.095 1.00 0.60 O ATOM 915 CB LEU A 55 -1.222 32.544 20.478 1.00 0.60 C ATOM 916 CG LEU A 55 -1.695 31.268 21.184 1.00 0.63 C ATOM 917 CD1 LEU A 55 -0.503 30.599 21.880 1.00 0.65 C ATOM 918 CD2 LEU A 55 -2.775 31.607 22.226 1.00 0.78 C ATOM 0 H LEU A 55 -2.558 31.358 18.726 1.00 0.54 H new ATOM 0 HA LEU A 55 -3.120 33.565 20.511 1.00 0.62 H new ATOM 0 HB2 LEU A 55 -0.442 32.303 19.756 1.00 0.60 H new ATOM 0 HB3 LEU A 55 -0.784 33.230 21.203 1.00 0.60 H new ATOM 0 HG LEU A 55 -2.118 30.588 20.445 1.00 0.63 H new ATOM 0 HD11 LEU A 55 -0.838 29.691 22.383 1.00 0.65 H new ATOM 0 HD12 LEU A 55 0.255 30.345 21.139 1.00 0.65 H new ATOM 0 HD13 LEU A 55 -0.078 31.284 22.614 1.00 0.65 H new ATOM 0 HD21 LEU A 55 -3.103 30.693 22.721 1.00 0.78 H new ATOM 0 HD22 LEU A 55 -2.364 32.293 22.967 1.00 0.78 H new ATOM 0 HD23 LEU A 55 -3.625 32.076 21.730 1.00 0.78 H new ATOM 930 N ASN A 56 -2.407 35.566 19.173 1.00 0.78 N ATOM 931 CA ASN A 56 -1.959 36.769 18.405 1.00 0.86 C ATOM 932 C ASN A 56 -1.697 37.926 19.370 1.00 0.97 C ATOM 933 O ASN A 56 -0.574 38.344 19.566 1.00 0.92 O ATOM 934 CB ASN A 56 -3.057 37.164 17.418 1.00 0.92 C ATOM 935 CG ASN A 56 -3.280 36.025 16.420 1.00 0.85 C ATOM 936 OD1 ASN A 56 -4.360 35.474 16.341 1.00 1.37 O ATOM 937 ND2 ASN A 56 -2.301 35.650 15.643 1.00 1.36 N ATOM 0 H ASN A 56 -3.130 35.748 19.869 1.00 0.78 H new ATOM 0 HA ASN A 56 -1.041 36.540 17.864 1.00 0.86 H new ATOM 0 HB2 ASN A 56 -3.982 37.379 17.953 1.00 0.92 H new ATOM 0 HB3 ASN A 56 -2.775 38.075 16.890 1.00 0.92 H new ATOM 0 HD21 ASN A 56 -2.443 34.896 14.971 1.00 1.36 H new ATOM 0 HD22 ASN A 56 -1.393 36.111 15.707 1.00 1.36 H new ATOM 1109 N THR A 68 -8.246 41.301 19.548 1.00 1.01 N ATOM 1110 CA THR A 68 -7.904 41.019 18.117 1.00 1.12 C ATOM 1111 C THR A 68 -7.410 39.580 17.968 1.00 0.99 C ATOM 1112 O THR A 68 -6.402 39.194 18.525 1.00 0.86 O ATOM 1113 CB THR A 68 -6.809 41.991 17.654 1.00 1.20 C ATOM 1114 OG1 THR A 68 -6.480 41.717 16.299 1.00 1.39 O ATOM 1115 CG2 THR A 68 -5.557 41.835 18.525 1.00 1.09 C ATOM 0 HA THR A 68 -8.795 41.151 17.503 1.00 1.12 H new ATOM 0 HB THR A 68 -7.178 43.012 17.746 1.00 1.20 H new ATOM 0 HG1 THR A 68 -5.782 42.337 16.000 1.00 1.39 H new ATOM 0 HG21 THR A 68 -4.789 42.530 18.186 1.00 1.09 H new ATOM 0 HG22 THR A 68 -5.807 42.050 19.564 1.00 1.09 H new ATOM 0 HG23 THR A 68 -5.183 40.814 18.446 1.00 1.09 H new ATOM 1123 N THR A 69 -8.129 38.786 17.211 1.00 1.06 N ATOM 1124 CA THR A 69 -7.741 37.358 16.994 1.00 0.95 C ATOM 1125 C THR A 69 -7.362 37.161 15.524 1.00 0.99 C ATOM 1126 O THR A 69 -8.153 37.403 14.634 1.00 1.16 O ATOM 1127 CB THR A 69 -8.928 36.449 17.340 1.00 1.05 C ATOM 1128 OG1 THR A 69 -8.514 35.092 17.262 1.00 1.09 O ATOM 1129 CG2 THR A 69 -10.081 36.688 16.357 1.00 1.28 C ATOM 0 H THR A 69 -8.980 39.072 16.728 1.00 1.06 H new ATOM 0 HA THR A 69 -6.893 37.106 17.631 1.00 0.95 H new ATOM 0 HB THR A 69 -9.271 36.676 18.349 1.00 1.05 H new ATOM 0 HG1 THR A 69 -9.268 34.507 17.484 1.00 1.09 H new ATOM 0 HG21 THR A 69 -10.918 36.038 16.612 1.00 1.28 H new ATOM 0 HG22 THR A 69 -10.399 37.729 16.416 1.00 1.28 H new ATOM 0 HG23 THR A 69 -9.746 36.468 15.343 1.00 1.28 H new ATOM 1137 N VAL A 70 -6.153 36.726 15.267 1.00 0.89 N ATOM 1138 CA VAL A 70 -5.696 36.504 13.859 1.00 0.97 C ATOM 1139 C VAL A 70 -5.159 35.071 13.738 1.00 0.85 C ATOM 1140 O VAL A 70 -3.986 34.831 13.944 1.00 0.80 O ATOM 1141 CB VAL A 70 -4.569 37.491 13.542 1.00 1.07 C ATOM 1142 CG1 VAL A 70 -4.056 37.243 12.124 1.00 1.24 C ATOM 1143 CG2 VAL A 70 -5.101 38.921 13.640 1.00 1.18 C ATOM 0 H VAL A 70 -5.456 36.513 15.980 1.00 0.89 H new ATOM 0 HA VAL A 70 -6.523 36.653 13.165 1.00 0.97 H new ATOM 0 HB VAL A 70 -3.757 37.352 14.255 1.00 1.07 H new ATOM 0 HG11 VAL A 70 -3.254 37.946 11.899 1.00 1.24 H new ATOM 0 HG12 VAL A 70 -3.677 36.224 12.047 1.00 1.24 H new ATOM 0 HG13 VAL A 70 -4.870 37.382 11.413 1.00 1.24 H new ATOM 0 HG21 VAL A 70 -4.299 39.624 13.414 1.00 1.18 H new ATOM 0 HG22 VAL A 70 -5.914 39.057 12.926 1.00 1.18 H new ATOM 0 HG23 VAL A 70 -5.470 39.104 14.649 1.00 1.18 H new ATOM 1153 N PRO A 71 -6.010 34.118 13.421 1.00 0.84 N ATOM 1154 CA PRO A 71 -5.609 32.688 13.295 1.00 0.75 C ATOM 1155 C PRO A 71 -5.054 32.348 11.907 1.00 0.74 C ATOM 1156 O PRO A 71 -5.607 31.541 11.186 1.00 0.78 O ATOM 1157 CB PRO A 71 -6.923 31.948 13.555 1.00 0.83 C ATOM 1158 CG PRO A 71 -7.984 32.856 13.010 1.00 0.99 C ATOM 1159 CD PRO A 71 -7.450 34.294 13.149 1.00 0.98 C ATOM 0 HA PRO A 71 -4.804 32.421 13.979 1.00 0.75 H new ATOM 0 HB2 PRO A 71 -6.937 30.979 13.057 1.00 0.83 H new ATOM 0 HB3 PRO A 71 -7.069 31.762 14.619 1.00 0.83 H new ATOM 0 HG2 PRO A 71 -8.196 32.621 11.967 1.00 0.99 H new ATOM 0 HG3 PRO A 71 -8.917 32.735 13.560 1.00 0.99 H new ATOM 0 HD2 PRO A 71 -7.616 34.871 12.239 1.00 0.98 H new ATOM 0 HD3 PRO A 71 -7.947 34.827 13.960 1.00 0.98 H new ATOM 1167 N TRP A 72 -3.954 32.940 11.538 1.00 0.72 N ATOM 1168 CA TRP A 72 -3.354 32.630 10.213 1.00 0.75 C ATOM 1169 C TRP A 72 -2.803 31.199 10.266 1.00 0.67 C ATOM 1170 O TRP A 72 -1.912 30.929 11.042 1.00 0.60 O ATOM 1171 CB TRP A 72 -2.201 33.598 9.957 1.00 0.78 C ATOM 1172 CG TRP A 72 -1.731 33.451 8.549 1.00 0.84 C ATOM 1173 CD1 TRP A 72 -2.365 33.950 7.463 1.00 0.94 C ATOM 1174 CD2 TRP A 72 -0.541 32.772 8.055 1.00 0.84 C ATOM 1175 NE1 TRP A 72 -1.642 33.615 6.332 1.00 0.99 N ATOM 1176 CE2 TRP A 72 -0.508 32.889 6.646 1.00 0.93 C ATOM 1177 CE3 TRP A 72 0.502 32.072 8.689 1.00 0.79 C ATOM 1178 CZ2 TRP A 72 0.525 32.329 5.890 1.00 0.97 C ATOM 1179 CZ3 TRP A 72 1.542 31.508 7.934 1.00 0.84 C ATOM 1180 CH2 TRP A 72 1.554 31.636 6.537 1.00 0.92 C ATOM 0 H TRP A 72 -3.445 33.625 12.097 1.00 0.72 H new ATOM 0 HA TRP A 72 -4.097 32.724 9.421 1.00 0.75 H new ATOM 0 HB2 TRP A 72 -2.525 34.623 10.138 1.00 0.78 H new ATOM 0 HB3 TRP A 72 -1.382 33.396 10.648 1.00 0.78 H new ATOM 0 HD1 TRP A 72 -3.284 34.517 7.477 1.00 0.94 H new ATOM 0 HE1 TRP A 72 -1.912 33.872 5.383 1.00 0.99 H new ATOM 0 HE3 TRP A 72 0.502 31.968 9.764 1.00 0.79 H new ATOM 0 HZ2 TRP A 72 0.529 32.430 4.815 1.00 0.97 H new ATOM 0 HZ3 TRP A 72 2.337 30.973 8.431 1.00 0.84 H new ATOM 0 HH2 TRP A 72 2.357 31.200 5.961 1.00 0.92 H new ATOM 1191 N PRO A 73 -3.314 30.273 9.483 1.00 0.71 N ATOM 1192 CA PRO A 73 -2.823 28.871 9.530 1.00 0.66 C ATOM 1193 C PRO A 73 -1.303 28.807 9.669 1.00 0.58 C ATOM 1194 O PRO A 73 -0.582 29.613 9.116 1.00 0.61 O ATOM 1195 CB PRO A 73 -3.283 28.293 8.189 1.00 0.75 C ATOM 1196 CG PRO A 73 -4.543 29.037 7.871 1.00 0.84 C ATOM 1197 CD PRO A 73 -4.384 30.440 8.480 1.00 0.82 C ATOM 0 HA PRO A 73 -3.206 28.320 10.389 1.00 0.66 H new ATOM 0 HB2 PRO A 73 -2.530 28.439 7.415 1.00 0.75 H new ATOM 0 HB3 PRO A 73 -3.463 27.220 8.260 1.00 0.75 H new ATOM 0 HG2 PRO A 73 -4.698 29.096 6.794 1.00 0.84 H new ATOM 0 HG3 PRO A 73 -5.411 28.528 8.290 1.00 0.84 H new ATOM 0 HD2 PRO A 73 -4.111 31.175 7.723 1.00 0.82 H new ATOM 0 HD3 PRO A 73 -5.311 30.784 8.939 1.00 0.82 H new ATOM 1205 N ASN A 74 -0.817 27.843 10.402 1.00 0.52 N ATOM 1206 CA ASN A 74 0.658 27.689 10.591 1.00 0.48 C ATOM 1207 C ASN A 74 1.004 26.222 10.376 1.00 0.50 C ATOM 1208 O ASN A 74 2.132 25.795 10.520 1.00 0.80 O ATOM 1209 CB ASN A 74 1.034 28.126 12.010 1.00 0.47 C ATOM 1210 CG ASN A 74 2.540 28.393 12.085 1.00 0.53 C ATOM 1211 OD1 ASN A 74 3.288 27.584 12.592 1.00 1.17 O ATOM 1212 ND2 ASN A 74 3.022 29.503 11.594 1.00 1.26 N ATOM 0 H ASN A 74 -1.384 27.146 10.885 1.00 0.52 H new ATOM 0 HA ASN A 74 1.210 28.307 9.883 1.00 0.48 H new ATOM 0 HB2 ASN A 74 0.481 29.025 12.283 1.00 0.47 H new ATOM 0 HB3 ASN A 74 0.756 27.352 12.725 1.00 0.47 H new ATOM 0 HD21 ASN A 74 4.024 29.687 11.638 1.00 1.26 H new ATOM 0 HD22 ASN A 74 2.396 30.186 11.167 1.00 1.26 H new ATOM 1219 N ALA A 75 0.012 25.457 10.030 1.00 0.47 N ATOM 1220 CA ALA A 75 0.186 24.008 9.785 1.00 0.47 C ATOM 1221 C ALA A 75 0.439 23.805 8.298 1.00 0.46 C ATOM 1222 O ALA A 75 -0.301 24.295 7.469 1.00 0.47 O ATOM 1223 CB ALA A 75 -1.100 23.279 10.208 1.00 0.53 C ATOM 0 H ALA A 75 -0.943 25.791 9.903 1.00 0.47 H new ATOM 0 HA ALA A 75 1.025 23.612 10.357 1.00 0.47 H new ATOM 0 HB1 ALA A 75 -0.986 22.209 10.033 1.00 0.53 H new ATOM 0 HB2 ALA A 75 -1.287 23.455 11.267 1.00 0.53 H new ATOM 0 HB3 ALA A 75 -1.940 23.655 9.624 1.00 0.53 H new ATOM 1229 N SER A 76 1.471 23.102 7.939 1.00 0.47 N ATOM 1230 CA SER A 76 1.727 22.906 6.494 1.00 0.48 C ATOM 1231 C SER A 76 0.797 21.807 6.002 1.00 0.48 C ATOM 1232 O SER A 76 1.092 20.631 6.084 1.00 0.49 O ATOM 1233 CB SER A 76 3.181 22.481 6.291 1.00 0.54 C ATOM 1234 OG SER A 76 4.003 23.181 7.208 1.00 1.38 O ATOM 0 H SER A 76 2.138 22.662 8.573 1.00 0.47 H new ATOM 0 HA SER A 76 1.549 23.829 5.941 1.00 0.48 H new ATOM 0 HB2 SER A 76 3.282 21.406 6.440 1.00 0.54 H new ATOM 0 HB3 SER A 76 3.495 22.692 5.269 1.00 0.54 H new ATOM 0 HG SER A 76 3.714 24.116 7.259 1.00 1.38 H new ATOM 1240 N LEU A 77 -0.338 22.198 5.497 1.00 0.50 N ATOM 1241 CA LEU A 77 -1.317 21.204 4.998 1.00 0.53 C ATOM 1242 C LEU A 77 -0.855 20.716 3.630 1.00 0.52 C ATOM 1243 O LEU A 77 -0.394 21.480 2.810 1.00 0.55 O ATOM 1244 CB LEU A 77 -2.698 21.863 4.894 1.00 0.61 C ATOM 1245 CG LEU A 77 -3.099 22.439 6.261 1.00 0.65 C ATOM 1246 CD1 LEU A 77 -4.401 23.234 6.118 1.00 0.75 C ATOM 1247 CD2 LEU A 77 -3.296 21.302 7.281 1.00 0.66 C ATOM 0 H LEU A 77 -0.629 23.172 5.409 1.00 0.50 H new ATOM 0 HA LEU A 77 -1.386 20.357 5.680 1.00 0.53 H new ATOM 0 HB2 LEU A 77 -2.678 22.655 4.146 1.00 0.61 H new ATOM 0 HB3 LEU A 77 -3.437 21.132 4.565 1.00 0.61 H new ATOM 0 HG LEU A 77 -2.306 23.097 6.616 1.00 0.65 H new ATOM 0 HD11 LEU A 77 -4.686 23.643 7.087 1.00 0.75 H new ATOM 0 HD12 LEU A 77 -4.254 24.049 5.410 1.00 0.75 H new ATOM 0 HD13 LEU A 77 -5.191 22.576 5.755 1.00 0.75 H new ATOM 0 HD21 LEU A 77 -3.580 21.723 8.245 1.00 0.66 H new ATOM 0 HD22 LEU A 77 -4.082 20.632 6.932 1.00 0.66 H new ATOM 0 HD23 LEU A 77 -2.366 20.744 7.388 1.00 0.66 H new ATOM 1259 N THR A 78 -0.962 19.445 3.386 1.00 0.51 N ATOM 1260 CA THR A 78 -0.518 18.887 2.076 1.00 0.51 C ATOM 1261 C THR A 78 -1.489 17.779 1.660 1.00 0.57 C ATOM 1262 O THR A 78 -1.264 16.619 1.931 1.00 0.66 O ATOM 1263 CB THR A 78 0.883 18.290 2.265 1.00 0.54 C ATOM 1264 OG1 THR A 78 1.330 17.745 1.032 1.00 0.61 O ATOM 1265 CG2 THR A 78 0.847 17.185 3.342 1.00 0.63 C ATOM 0 H THR A 78 -1.340 18.760 4.040 1.00 0.51 H new ATOM 0 HA THR A 78 -0.498 19.662 1.310 1.00 0.51 H new ATOM 0 HB THR A 78 1.568 19.073 2.589 1.00 0.54 H new ATOM 0 HG1 THR A 78 1.814 18.431 0.527 1.00 0.61 H new ATOM 0 HG21 THR A 78 1.846 16.768 3.469 1.00 0.63 H new ATOM 0 HG22 THR A 78 0.508 17.609 4.287 1.00 0.63 H new ATOM 0 HG23 THR A 78 0.161 16.397 3.032 1.00 0.63 H new ATOM 1273 N PRO A 79 -2.564 18.134 1.010 1.00 0.65 N ATOM 1274 CA PRO A 79 -3.590 17.169 0.549 1.00 0.77 C ATOM 1275 C PRO A 79 -3.491 16.815 -0.941 1.00 0.67 C ATOM 1276 O PRO A 79 -3.629 15.674 -1.335 1.00 0.70 O ATOM 1277 CB PRO A 79 -4.865 17.969 0.793 1.00 0.98 C ATOM 1278 CG PRO A 79 -4.488 19.389 0.452 1.00 0.96 C ATOM 1279 CD PRO A 79 -2.960 19.505 0.657 1.00 0.75 C ATOM 0 HA PRO A 79 -3.509 16.208 1.057 1.00 0.77 H new ATOM 0 HB2 PRO A 79 -5.683 17.614 0.166 1.00 0.98 H new ATOM 0 HB3 PRO A 79 -5.196 17.883 1.828 1.00 0.98 H new ATOM 0 HG2 PRO A 79 -4.759 19.625 -0.577 1.00 0.96 H new ATOM 0 HG3 PRO A 79 -5.019 20.094 1.091 1.00 0.96 H new ATOM 0 HD2 PRO A 79 -2.457 19.849 -0.247 1.00 0.75 H new ATOM 0 HD3 PRO A 79 -2.712 20.212 1.449 1.00 0.75 H new ATOM 1287 N LYS A 80 -3.325 17.801 -1.768 1.00 0.66 N ATOM 1288 CA LYS A 80 -3.298 17.561 -3.240 1.00 0.66 C ATOM 1289 C LYS A 80 -1.944 17.047 -3.744 1.00 0.63 C ATOM 1290 O LYS A 80 -1.896 16.164 -4.578 1.00 0.65 O ATOM 1291 CB LYS A 80 -3.619 18.877 -3.949 1.00 0.79 C ATOM 1292 CG LYS A 80 -3.665 18.653 -5.462 1.00 1.31 C ATOM 1293 CD LYS A 80 -4.224 19.904 -6.149 1.00 1.46 C ATOM 1294 CE LYS A 80 -3.219 21.058 -6.041 1.00 2.32 C ATOM 1295 NZ LYS A 80 -3.577 22.120 -7.025 1.00 2.96 N ATOM 0 H LYS A 80 -3.205 18.775 -1.489 1.00 0.66 H new ATOM 0 HA LYS A 80 -4.035 16.788 -3.459 1.00 0.66 H new ATOM 0 HB2 LYS A 80 -4.576 19.264 -3.600 1.00 0.79 H new ATOM 0 HB3 LYS A 80 -2.865 19.625 -3.706 1.00 0.79 H new ATOM 0 HG2 LYS A 80 -2.666 18.435 -5.838 1.00 1.31 H new ATOM 0 HG3 LYS A 80 -4.288 17.789 -5.693 1.00 1.31 H new ATOM 0 HD2 LYS A 80 -4.433 19.690 -7.197 1.00 1.46 H new ATOM 0 HD3 LYS A 80 -5.169 20.190 -5.688 1.00 1.46 H new ATOM 0 HE2 LYS A 80 -3.225 21.466 -5.030 1.00 2.32 H new ATOM 0 HE3 LYS A 80 -2.209 20.695 -6.232 1.00 2.32 H new ATOM 0 HZ1 LYS A 80 -2.897 22.903 -6.953 1.00 2.96 H new ATOM 0 HZ2 LYS A 80 -3.550 21.725 -7.987 1.00 2.96 H new ATOM 0 HZ3 LYS A 80 -4.534 22.473 -6.822 1.00 2.96 H new ATOM 1309 N TRP A 81 -0.847 17.621 -3.316 1.00 0.64 N ATOM 1310 CA TRP A 81 0.481 17.175 -3.870 1.00 0.67 C ATOM 1311 C TRP A 81 1.125 16.017 -3.089 1.00 0.62 C ATOM 1312 O TRP A 81 1.288 14.937 -3.619 1.00 0.63 O ATOM 1313 CB TRP A 81 1.448 18.371 -3.963 1.00 0.72 C ATOM 1314 CG TRP A 81 1.817 18.898 -2.612 1.00 0.68 C ATOM 1315 CD1 TRP A 81 2.881 18.494 -1.881 1.00 0.69 C ATOM 1316 CD2 TRP A 81 1.168 19.950 -1.839 1.00 0.67 C ATOM 1317 NE1 TRP A 81 2.906 19.201 -0.692 1.00 0.68 N ATOM 1318 CE2 TRP A 81 1.876 20.121 -0.626 1.00 0.65 C ATOM 1319 CE3 TRP A 81 0.039 20.757 -2.067 1.00 0.70 C ATOM 1320 CZ2 TRP A 81 1.479 21.063 0.325 1.00 0.65 C ATOM 1321 CZ3 TRP A 81 -0.362 21.708 -1.113 1.00 0.71 C ATOM 1322 CH2 TRP A 81 0.358 21.860 0.080 1.00 0.67 C ATOM 0 H TRP A 81 -0.806 18.366 -2.620 1.00 0.64 H new ATOM 0 HA TRP A 81 0.279 16.784 -4.867 1.00 0.67 H new ATOM 0 HB2 TRP A 81 2.351 18.067 -4.493 1.00 0.72 H new ATOM 0 HB3 TRP A 81 0.987 19.166 -4.549 1.00 0.72 H new ATOM 0 HD1 TRP A 81 3.596 17.741 -2.178 1.00 0.69 H new ATOM 0 HE1 TRP A 81 3.598 19.061 0.044 1.00 0.68 H new ATOM 0 HE3 TRP A 81 -0.524 20.645 -2.982 1.00 0.70 H new ATOM 0 HZ2 TRP A 81 2.035 21.175 1.244 1.00 0.65 H new ATOM 0 HZ3 TRP A 81 -1.229 22.324 -1.300 1.00 0.71 H new ATOM 0 HH2 TRP A 81 0.046 22.593 0.809 1.00 0.67 H new ATOM 1333 N ASN A 82 1.561 16.226 -1.881 1.00 0.59 N ATOM 1334 CA ASN A 82 2.263 15.121 -1.162 1.00 0.59 C ATOM 1335 C ASN A 82 1.311 13.969 -0.805 1.00 0.53 C ATOM 1336 O ASN A 82 1.645 12.814 -0.987 1.00 0.49 O ATOM 1337 CB ASN A 82 2.929 15.674 0.113 1.00 0.69 C ATOM 1338 CG ASN A 82 4.206 14.880 0.414 1.00 1.07 C ATOM 1339 OD1 ASN A 82 5.077 15.362 1.257 1.00 0.96 O flip ATOM 1340 ND2 ASN A 82 4.412 13.813 -0.128 1.00 1.86 N flip ATOM 0 H ASN A 82 1.466 17.099 -1.363 1.00 0.59 H new ATOM 0 HA ASN A 82 3.023 14.717 -1.831 1.00 0.59 H new ATOM 0 HB2 ASN A 82 3.168 16.729 -0.018 1.00 0.69 H new ATOM 0 HB3 ASN A 82 2.239 15.605 0.954 1.00 0.69 H new ATOM 0 HD21 ASN A 82 3.731 13.436 -0.787 1.00 1.86 H new ATOM 0 HD22 ASN A 82 5.266 13.294 0.076 1.00 1.86 H new ATOM 1347 N ASN A 83 0.147 14.246 -0.285 1.00 0.56 N ATOM 1348 CA ASN A 83 -0.768 13.121 0.082 1.00 0.57 C ATOM 1349 C ASN A 83 -1.198 12.366 -1.175 1.00 0.52 C ATOM 1350 O ASN A 83 -1.236 11.151 -1.192 1.00 0.51 O ATOM 1351 CB ASN A 83 -2.001 13.659 0.806 1.00 0.66 C ATOM 1352 CG ASN A 83 -1.630 14.063 2.238 1.00 1.21 C ATOM 1353 OD1 ASN A 83 -0.411 13.874 2.669 1.00 1.99 O flip ATOM 1354 ND2 ASN A 83 -2.461 14.558 2.973 1.00 1.83 N flip ATOM 0 H ASN A 83 -0.208 15.184 -0.100 1.00 0.56 H new ATOM 0 HA ASN A 83 -0.235 12.440 0.745 1.00 0.57 H new ATOM 0 HB2 ASN A 83 -2.403 14.518 0.269 1.00 0.66 H new ATOM 0 HB3 ASN A 83 -2.783 12.900 0.824 1.00 0.66 H new ATOM 0 HD21 ASN A 83 -3.413 14.707 2.639 1.00 1.83 H new ATOM 0 HD22 ASN A 83 -2.206 14.825 3.924 1.00 1.83 H new ATOM 1361 N GLU A 84 -1.511 13.058 -2.235 1.00 0.52 N ATOM 1362 CA GLU A 84 -1.912 12.338 -3.474 1.00 0.52 C ATOM 1363 C GLU A 84 -0.748 11.450 -3.897 1.00 0.46 C ATOM 1364 O GLU A 84 -0.913 10.290 -4.221 1.00 0.47 O ATOM 1365 CB GLU A 84 -2.236 13.336 -4.582 1.00 0.55 C ATOM 1366 CG GLU A 84 -2.739 12.580 -5.811 1.00 1.26 C ATOM 1367 CD GLU A 84 -3.157 13.583 -6.884 1.00 1.71 C ATOM 1368 OE1 GLU A 84 -3.103 14.770 -6.608 1.00 2.23 O ATOM 1369 OE2 GLU A 84 -3.527 13.149 -7.962 1.00 2.29 O ATOM 0 H GLU A 84 -1.507 14.076 -2.297 1.00 0.52 H new ATOM 0 HA GLU A 84 -2.802 11.736 -3.289 1.00 0.52 H new ATOM 0 HB2 GLU A 84 -2.992 14.043 -4.241 1.00 0.55 H new ATOM 0 HB3 GLU A 84 -1.349 13.916 -4.836 1.00 0.55 H new ATOM 0 HG2 GLU A 84 -1.957 11.925 -6.194 1.00 1.26 H new ATOM 0 HG3 GLU A 84 -3.583 11.945 -5.542 1.00 1.26 H new ATOM 1376 N THR A 85 0.438 11.989 -3.863 1.00 0.44 N ATOM 1377 CA THR A 85 1.630 11.187 -4.227 1.00 0.42 C ATOM 1378 C THR A 85 1.850 10.144 -3.140 1.00 0.38 C ATOM 1379 O THR A 85 2.254 9.030 -3.407 1.00 0.39 O ATOM 1380 CB THR A 85 2.865 12.089 -4.319 1.00 0.44 C ATOM 1381 OG1 THR A 85 3.055 12.752 -3.076 1.00 0.43 O ATOM 1382 CG2 THR A 85 2.679 13.122 -5.432 1.00 0.49 C ATOM 0 H THR A 85 0.630 12.955 -3.597 1.00 0.44 H new ATOM 0 HA THR A 85 1.473 10.709 -5.194 1.00 0.42 H new ATOM 0 HB THR A 85 3.740 11.480 -4.547 1.00 0.44 H new ATOM 0 HG1 THR A 85 2.230 12.703 -2.550 1.00 0.43 H new ATOM 0 HG21 THR A 85 3.562 13.758 -5.489 1.00 0.49 H new ATOM 0 HG22 THR A 85 2.538 12.610 -6.384 1.00 0.49 H new ATOM 0 HG23 THR A 85 1.804 13.735 -5.217 1.00 0.49 H new ATOM 1390 N TRP A 86 1.597 10.498 -1.905 1.00 0.36 N ATOM 1391 CA TRP A 86 1.813 9.513 -0.817 1.00 0.34 C ATOM 1392 C TRP A 86 0.925 8.302 -1.068 1.00 0.34 C ATOM 1393 O TRP A 86 1.343 7.173 -0.909 1.00 0.34 O ATOM 1394 CB TRP A 86 1.463 10.110 0.551 1.00 0.34 C ATOM 1395 CG TRP A 86 2.060 9.223 1.598 1.00 0.32 C ATOM 1396 CD1 TRP A 86 1.434 8.200 2.226 1.00 0.34 C ATOM 1397 CD2 TRP A 86 3.412 9.252 2.112 1.00 0.29 C ATOM 1398 NE1 TRP A 86 2.330 7.601 3.097 1.00 0.33 N ATOM 1399 CE2 TRP A 86 3.565 8.218 3.061 1.00 0.29 C ATOM 1400 CE3 TRP A 86 4.511 10.076 1.844 1.00 0.27 C ATOM 1401 CZ2 TRP A 86 4.778 8.010 3.720 1.00 0.28 C ATOM 1402 CZ3 TRP A 86 5.725 9.872 2.503 1.00 0.26 C ATOM 1403 CH2 TRP A 86 5.863 8.842 3.437 1.00 0.27 C ATOM 0 H TRP A 86 1.256 11.413 -1.612 1.00 0.36 H new ATOM 0 HA TRP A 86 2.865 9.229 -0.810 1.00 0.34 H new ATOM 0 HB2 TRP A 86 1.855 11.123 0.638 1.00 0.34 H new ATOM 0 HB3 TRP A 86 0.382 10.175 0.675 1.00 0.34 H new ATOM 0 HD1 TRP A 86 0.408 7.901 2.074 1.00 0.34 H new ATOM 0 HE1 TRP A 86 2.105 6.803 3.691 1.00 0.33 H new ATOM 0 HE3 TRP A 86 4.420 10.875 1.123 1.00 0.27 H new ATOM 0 HZ2 TRP A 86 4.876 7.213 4.442 1.00 0.28 H new ATOM 0 HZ3 TRP A 86 6.565 10.516 2.289 1.00 0.26 H new ATOM 0 HH2 TRP A 86 6.807 8.690 3.939 1.00 0.27 H new ATOM 1414 N GLN A 87 -0.295 8.517 -1.477 1.00 0.37 N ATOM 1415 CA GLN A 87 -1.173 7.355 -1.746 1.00 0.39 C ATOM 1416 C GLN A 87 -0.513 6.520 -2.843 1.00 0.37 C ATOM 1417 O GLN A 87 -0.444 5.313 -2.759 1.00 0.38 O ATOM 1418 CB GLN A 87 -2.549 7.840 -2.208 1.00 0.43 C ATOM 1419 CG GLN A 87 -3.279 8.491 -1.030 1.00 0.46 C ATOM 1420 CD GLN A 87 -4.585 9.117 -1.523 1.00 0.53 C ATOM 1421 OE1 GLN A 87 -4.736 9.387 -2.699 1.00 1.21 O ATOM 1422 NE2 GLN A 87 -5.541 9.357 -0.669 1.00 1.03 N ATOM 0 H GLN A 87 -0.713 9.434 -1.633 1.00 0.37 H new ATOM 0 HA GLN A 87 -1.308 6.758 -0.844 1.00 0.39 H new ATOM 0 HB2 GLN A 87 -2.440 8.555 -3.023 1.00 0.43 H new ATOM 0 HB3 GLN A 87 -3.131 7.003 -2.594 1.00 0.43 H new ATOM 0 HG2 GLN A 87 -3.487 7.747 -0.261 1.00 0.46 H new ATOM 0 HG3 GLN A 87 -2.648 9.253 -0.573 1.00 0.46 H new ATOM 0 HE21 GLN A 87 -5.413 9.130 0.317 1.00 1.03 H new ATOM 0 HE22 GLN A 87 -6.417 9.772 -0.987 1.00 1.03 H new ATOM 1431 N GLU A 88 0.010 7.157 -3.859 1.00 0.37 N ATOM 1432 CA GLU A 88 0.698 6.383 -4.928 1.00 0.37 C ATOM 1433 C GLU A 88 1.871 5.635 -4.298 1.00 0.34 C ATOM 1434 O GLU A 88 2.082 4.465 -4.539 1.00 0.35 O ATOM 1435 CB GLU A 88 1.220 7.332 -6.007 1.00 0.39 C ATOM 1436 CG GLU A 88 0.043 7.917 -6.788 1.00 1.18 C ATOM 1437 CD GLU A 88 0.567 8.890 -7.846 1.00 1.42 C ATOM 1438 OE1 GLU A 88 1.768 9.094 -7.891 1.00 1.93 O ATOM 1439 OE2 GLU A 88 -0.243 9.413 -8.594 1.00 1.96 O ATOM 0 H GLU A 88 -0.010 8.168 -3.992 1.00 0.37 H new ATOM 0 HA GLU A 88 0.001 5.682 -5.386 1.00 0.37 H new ATOM 0 HB2 GLU A 88 1.801 8.133 -5.551 1.00 0.39 H new ATOM 0 HB3 GLU A 88 1.889 6.798 -6.683 1.00 0.39 H new ATOM 0 HG2 GLU A 88 -0.525 7.118 -7.263 1.00 1.18 H new ATOM 0 HG3 GLU A 88 -0.637 8.432 -6.110 1.00 1.18 H new ATOM 1446 N TRP A 89 2.631 6.310 -3.478 1.00 0.32 N ATOM 1447 CA TRP A 89 3.790 5.655 -2.815 1.00 0.30 C ATOM 1448 C TRP A 89 3.295 4.480 -1.970 1.00 0.30 C ATOM 1449 O TRP A 89 3.804 3.382 -2.064 1.00 0.30 O ATOM 1450 CB TRP A 89 4.487 6.680 -1.917 1.00 0.28 C ATOM 1451 CG TRP A 89 5.513 6.014 -1.056 1.00 0.25 C ATOM 1452 CD1 TRP A 89 6.751 5.652 -1.458 1.00 0.25 C ATOM 1453 CD2 TRP A 89 5.412 5.644 0.349 1.00 0.24 C ATOM 1454 NE1 TRP A 89 7.416 5.080 -0.388 1.00 0.23 N ATOM 1455 CE2 TRP A 89 6.632 5.052 0.747 1.00 0.23 C ATOM 1456 CE3 TRP A 89 4.390 5.761 1.307 1.00 0.26 C ATOM 1457 CZ2 TRP A 89 6.833 4.595 2.050 1.00 0.23 C ATOM 1458 CZ3 TRP A 89 4.589 5.301 2.619 1.00 0.26 C ATOM 1459 CH2 TRP A 89 5.808 4.720 2.989 1.00 0.25 C ATOM 0 H TRP A 89 2.496 7.292 -3.239 1.00 0.32 H new ATOM 0 HA TRP A 89 4.490 5.285 -3.564 1.00 0.30 H new ATOM 0 HB2 TRP A 89 4.961 7.446 -2.530 1.00 0.28 H new ATOM 0 HB3 TRP A 89 3.750 7.184 -1.291 1.00 0.28 H new ATOM 0 HD1 TRP A 89 7.155 5.787 -2.451 1.00 0.25 H new ATOM 0 HE1 TRP A 89 8.370 4.722 -0.433 1.00 0.23 H new ATOM 0 HE3 TRP A 89 3.446 6.207 1.032 1.00 0.26 H new ATOM 0 HZ2 TRP A 89 7.775 4.148 2.330 1.00 0.23 H new ATOM 0 HZ3 TRP A 89 3.797 5.396 3.347 1.00 0.26 H new ATOM 0 HH2 TRP A 89 5.955 4.369 4.000 1.00 0.25 H new ATOM 1470 N GLU A 90 2.306 4.700 -1.147 1.00 0.31 N ATOM 1471 CA GLU A 90 1.787 3.588 -0.309 1.00 0.33 C ATOM 1472 C GLU A 90 1.203 2.515 -1.227 1.00 0.33 C ATOM 1473 O GLU A 90 1.422 1.334 -1.038 1.00 0.34 O ATOM 1474 CB GLU A 90 0.701 4.112 0.638 1.00 0.37 C ATOM 1475 CG GLU A 90 0.170 2.966 1.508 1.00 0.85 C ATOM 1476 CD GLU A 90 -0.899 3.504 2.462 1.00 1.16 C ATOM 1477 OE1 GLU A 90 -1.094 4.707 2.483 1.00 1.81 O ATOM 1478 OE2 GLU A 90 -1.501 2.703 3.157 1.00 1.68 O ATOM 0 H GLU A 90 1.839 5.598 -1.021 1.00 0.31 H new ATOM 0 HA GLU A 90 2.595 3.165 0.288 1.00 0.33 H new ATOM 0 HB2 GLU A 90 1.107 4.902 1.270 1.00 0.37 H new ATOM 0 HB3 GLU A 90 -0.114 4.552 0.063 1.00 0.37 H new ATOM 0 HG2 GLU A 90 -0.250 2.182 0.878 1.00 0.85 H new ATOM 0 HG3 GLU A 90 0.986 2.517 2.075 1.00 0.85 H new ATOM 1485 N ARG A 91 0.461 2.918 -2.227 1.00 0.34 N ATOM 1486 CA ARG A 91 -0.131 1.915 -3.156 1.00 0.36 C ATOM 1487 C ARG A 91 0.983 1.170 -3.889 1.00 0.34 C ATOM 1488 O ARG A 91 0.915 -0.028 -4.074 1.00 0.35 O ATOM 1489 CB ARG A 91 -1.038 2.611 -4.181 1.00 0.40 C ATOM 1490 CG ARG A 91 -2.343 3.078 -3.513 1.00 0.44 C ATOM 1491 CD ARG A 91 -3.166 1.872 -3.020 1.00 1.07 C ATOM 1492 NE ARG A 91 -2.992 1.748 -1.546 1.00 1.68 N ATOM 1493 CZ ARG A 91 -3.780 0.972 -0.855 1.00 2.31 C ATOM 1494 NH1 ARG A 91 -4.709 0.283 -1.456 1.00 2.62 N ATOM 1495 NH2 ARG A 91 -3.637 0.884 0.439 1.00 3.18 N ATOM 0 H ARG A 91 0.242 3.892 -2.438 1.00 0.34 H new ATOM 0 HA ARG A 91 -0.724 1.208 -2.576 1.00 0.36 H new ATOM 0 HB2 ARG A 91 -0.518 3.465 -4.615 1.00 0.40 H new ATOM 0 HB3 ARG A 91 -1.265 1.927 -4.999 1.00 0.40 H new ATOM 0 HG2 ARG A 91 -2.113 3.735 -2.674 1.00 0.44 H new ATOM 0 HG3 ARG A 91 -2.932 3.661 -4.222 1.00 0.44 H new ATOM 0 HD2 ARG A 91 -4.219 2.007 -3.266 1.00 1.07 H new ATOM 0 HD3 ARG A 91 -2.836 0.960 -3.518 1.00 1.07 H new ATOM 0 HE ARG A 91 -2.254 2.272 -1.075 1.00 1.68 H new ATOM 0 HH11 ARG A 91 -4.820 0.350 -2.468 1.00 2.62 H new ATOM 0 HH12 ARG A 91 -5.325 -0.324 -0.915 1.00 2.62 H new ATOM 0 HH21 ARG A 91 -2.909 1.422 0.909 1.00 3.18 H new ATOM 0 HH22 ARG A 91 -4.253 0.277 0.980 1.00 3.18 H new ATOM 1509 N LYS A 92 2.018 1.855 -4.299 1.00 0.34 N ATOM 1510 CA LYS A 92 3.123 1.148 -5.001 1.00 0.34 C ATOM 1511 C LYS A 92 3.693 0.096 -4.056 1.00 0.31 C ATOM 1512 O LYS A 92 3.995 -1.013 -4.446 1.00 0.32 O ATOM 1513 CB LYS A 92 4.215 2.146 -5.394 1.00 0.34 C ATOM 1514 CG LYS A 92 3.743 2.977 -6.598 1.00 0.68 C ATOM 1515 CD LYS A 92 4.625 4.223 -6.771 1.00 1.08 C ATOM 1516 CE LYS A 92 5.970 3.821 -7.374 1.00 1.41 C ATOM 1517 NZ LYS A 92 6.807 5.036 -7.577 1.00 2.14 N ATOM 0 H LYS A 92 2.144 2.860 -4.179 1.00 0.34 H new ATOM 0 HA LYS A 92 2.749 0.673 -5.908 1.00 0.34 H new ATOM 0 HB2 LYS A 92 4.443 2.801 -4.553 1.00 0.34 H new ATOM 0 HB3 LYS A 92 5.134 1.616 -5.643 1.00 0.34 H new ATOM 0 HG2 LYS A 92 3.779 2.370 -7.503 1.00 0.68 H new ATOM 0 HG3 LYS A 92 2.705 3.276 -6.456 1.00 0.68 H new ATOM 0 HD2 LYS A 92 4.127 4.946 -7.417 1.00 1.08 H new ATOM 0 HD3 LYS A 92 4.778 4.709 -5.807 1.00 1.08 H new ATOM 0 HE2 LYS A 92 6.481 3.120 -6.714 1.00 1.41 H new ATOM 0 HE3 LYS A 92 5.816 3.310 -8.324 1.00 1.41 H new ATOM 0 HZ1 LYS A 92 7.723 4.762 -7.987 1.00 2.14 H new ATOM 0 HZ2 LYS A 92 6.320 5.689 -8.223 1.00 2.14 H new ATOM 0 HZ3 LYS A 92 6.964 5.506 -6.663 1.00 2.14 H new ATOM 1531 N VAL A 93 3.820 0.432 -2.804 1.00 0.29 N ATOM 1532 CA VAL A 93 4.347 -0.546 -1.820 1.00 0.28 C ATOM 1533 C VAL A 93 3.383 -1.729 -1.717 1.00 0.29 C ATOM 1534 O VAL A 93 3.791 -2.870 -1.628 1.00 0.29 O ATOM 1535 CB VAL A 93 4.470 0.140 -0.452 1.00 0.28 C ATOM 1536 CG1 VAL A 93 4.768 -0.905 0.639 1.00 0.29 C ATOM 1537 CG2 VAL A 93 5.604 1.169 -0.509 1.00 0.28 C ATOM 0 H VAL A 93 3.580 1.346 -2.420 1.00 0.29 H new ATOM 0 HA VAL A 93 5.325 -0.905 -2.139 1.00 0.28 H new ATOM 0 HB VAL A 93 3.532 0.639 -0.210 1.00 0.28 H new ATOM 0 HG11 VAL A 93 4.853 -0.408 1.605 1.00 0.29 H new ATOM 0 HG12 VAL A 93 3.958 -1.634 0.676 1.00 0.29 H new ATOM 0 HG13 VAL A 93 5.704 -1.414 0.409 1.00 0.29 H new ATOM 0 HG21 VAL A 93 5.698 1.661 0.459 1.00 0.28 H new ATOM 0 HG22 VAL A 93 6.540 0.666 -0.753 1.00 0.28 H new ATOM 0 HG23 VAL A 93 5.382 1.913 -1.274 1.00 0.28 H new ATOM 1547 N ASP A 94 2.105 -1.465 -1.720 1.00 0.30 N ATOM 1548 CA ASP A 94 1.117 -2.574 -1.612 1.00 0.32 C ATOM 1549 C ASP A 94 1.253 -3.532 -2.799 1.00 0.33 C ATOM 1550 O ASP A 94 1.158 -4.733 -2.639 1.00 0.35 O ATOM 1551 CB ASP A 94 -0.299 -1.996 -1.580 1.00 0.35 C ATOM 1552 CG ASP A 94 -0.527 -1.277 -0.248 1.00 1.26 C ATOM 1553 OD1 ASP A 94 0.202 -1.563 0.689 1.00 2.03 O ATOM 1554 OD2 ASP A 94 -1.428 -0.457 -0.185 1.00 1.96 O ATOM 0 H ASP A 94 1.703 -0.530 -1.793 1.00 0.30 H new ATOM 0 HA ASP A 94 1.310 -3.127 -0.693 1.00 0.32 H new ATOM 0 HB2 ASP A 94 -0.439 -1.302 -2.409 1.00 0.35 H new ATOM 0 HB3 ASP A 94 -1.032 -2.793 -1.705 1.00 0.35 H new ATOM 1559 N PHE A 95 1.466 -3.027 -3.987 1.00 0.34 N ATOM 1560 CA PHE A 95 1.599 -3.946 -5.152 1.00 0.36 C ATOM 1561 C PHE A 95 2.906 -4.727 -5.049 1.00 0.34 C ATOM 1562 O PHE A 95 2.955 -5.908 -5.324 1.00 0.35 O ATOM 1563 CB PHE A 95 1.591 -3.150 -6.461 1.00 0.39 C ATOM 1564 CG PHE A 95 0.206 -2.599 -6.728 1.00 0.43 C ATOM 1565 CD1 PHE A 95 -0.835 -3.469 -7.076 1.00 0.47 C ATOM 1566 CD2 PHE A 95 -0.039 -1.222 -6.631 1.00 0.43 C ATOM 1567 CE1 PHE A 95 -2.117 -2.967 -7.326 1.00 0.51 C ATOM 1568 CE2 PHE A 95 -1.322 -0.719 -6.881 1.00 0.47 C ATOM 1569 CZ PHE A 95 -2.361 -1.593 -7.228 1.00 0.51 C ATOM 0 H PHE A 95 1.552 -2.033 -4.197 1.00 0.34 H new ATOM 0 HA PHE A 95 0.756 -4.637 -5.147 1.00 0.36 H new ATOM 0 HB2 PHE A 95 2.311 -2.333 -6.403 1.00 0.39 H new ATOM 0 HB3 PHE A 95 1.901 -3.790 -7.287 1.00 0.39 H new ATOM 0 HD1 PHE A 95 -0.648 -4.530 -7.152 1.00 0.47 H new ATOM 0 HD2 PHE A 95 0.762 -0.549 -6.363 1.00 0.43 H new ATOM 0 HE1 PHE A 95 -2.918 -3.640 -7.595 1.00 0.51 H new ATOM 0 HE2 PHE A 95 -1.510 0.342 -6.806 1.00 0.47 H new ATOM 0 HZ PHE A 95 -3.351 -1.206 -7.420 1.00 0.51 H new ATOM 1579 N LEU A 96 3.965 -4.088 -4.643 1.00 0.33 N ATOM 1580 CA LEU A 96 5.248 -4.825 -4.523 1.00 0.32 C ATOM 1581 C LEU A 96 5.137 -5.802 -3.356 1.00 0.31 C ATOM 1582 O LEU A 96 5.578 -6.931 -3.429 1.00 0.32 O ATOM 1583 CB LEU A 96 6.390 -3.838 -4.259 1.00 0.32 C ATOM 1584 CG LEU A 96 6.510 -2.843 -5.425 1.00 0.33 C ATOM 1585 CD1 LEU A 96 7.606 -1.820 -5.106 1.00 0.35 C ATOM 1586 CD2 LEU A 96 6.868 -3.586 -6.724 1.00 0.36 C ATOM 0 H LEU A 96 3.998 -3.100 -4.392 1.00 0.33 H new ATOM 0 HA LEU A 96 5.455 -5.365 -5.447 1.00 0.32 H new ATOM 0 HB2 LEU A 96 6.208 -3.300 -3.329 1.00 0.32 H new ATOM 0 HB3 LEU A 96 7.328 -4.380 -4.135 1.00 0.32 H new ATOM 0 HG LEU A 96 5.555 -2.335 -5.559 1.00 0.33 H new ATOM 0 HD11 LEU A 96 7.694 -1.112 -5.930 1.00 0.35 H new ATOM 0 HD12 LEU A 96 7.348 -1.283 -4.193 1.00 0.35 H new ATOM 0 HD13 LEU A 96 8.556 -2.336 -4.967 1.00 0.35 H new ATOM 0 HD21 LEU A 96 6.950 -2.870 -7.542 1.00 0.36 H new ATOM 0 HD22 LEU A 96 7.819 -4.103 -6.597 1.00 0.36 H new ATOM 0 HD23 LEU A 96 6.089 -4.312 -6.954 1.00 0.36 H new ATOM 1598 N GLU A 97 4.526 -5.380 -2.283 1.00 0.31 N ATOM 1599 CA GLU A 97 4.363 -6.290 -1.118 1.00 0.32 C ATOM 1600 C GLU A 97 3.558 -7.514 -1.552 1.00 0.34 C ATOM 1601 O GLU A 97 3.937 -8.643 -1.307 1.00 0.36 O ATOM 1602 CB GLU A 97 3.637 -5.550 0.010 1.00 0.34 C ATOM 1603 CG GLU A 97 3.509 -6.461 1.234 1.00 0.95 C ATOM 1604 CD GLU A 97 2.782 -5.710 2.351 1.00 1.22 C ATOM 1605 OE1 GLU A 97 2.576 -4.518 2.198 1.00 1.69 O ATOM 1606 OE2 GLU A 97 2.449 -6.338 3.342 1.00 1.86 O ATOM 0 H GLU A 97 4.134 -4.446 -2.164 1.00 0.31 H new ATOM 0 HA GLU A 97 5.339 -6.612 -0.755 1.00 0.32 H new ATOM 0 HB2 GLU A 97 4.185 -4.646 0.275 1.00 0.34 H new ATOM 0 HB3 GLU A 97 2.648 -5.237 -0.326 1.00 0.34 H new ATOM 0 HG2 GLU A 97 2.961 -7.366 0.972 1.00 0.95 H new ATOM 0 HG3 GLU A 97 4.496 -6.774 1.573 1.00 0.95 H new ATOM 1613 N GLU A 98 2.441 -7.295 -2.197 1.00 0.35 N ATOM 1614 CA GLU A 98 1.605 -8.436 -2.656 1.00 0.37 C ATOM 1615 C GLU A 98 2.412 -9.293 -3.629 1.00 0.36 C ATOM 1616 O GLU A 98 2.393 -10.505 -3.566 1.00 0.38 O ATOM 1617 CB GLU A 98 0.353 -7.901 -3.353 1.00 0.41 C ATOM 1618 CG GLU A 98 -0.533 -9.073 -3.779 1.00 1.18 C ATOM 1619 CD GLU A 98 -1.832 -8.541 -4.385 1.00 1.32 C ATOM 1620 OE1 GLU A 98 -2.032 -7.338 -4.348 1.00 1.77 O ATOM 1621 OE2 GLU A 98 -2.605 -9.346 -4.877 1.00 1.85 O ATOM 0 H GLU A 98 2.074 -6.371 -2.425 1.00 0.35 H new ATOM 0 HA GLU A 98 1.308 -9.043 -1.800 1.00 0.37 H new ATOM 0 HB2 GLU A 98 -0.196 -7.241 -2.681 1.00 0.41 H new ATOM 0 HB3 GLU A 98 0.634 -7.308 -4.223 1.00 0.41 H new ATOM 0 HG2 GLU A 98 -0.008 -9.693 -4.506 1.00 1.18 H new ATOM 0 HG3 GLU A 98 -0.754 -9.706 -2.920 1.00 1.18 H new ATOM 1628 N ASN A 99 3.125 -8.671 -4.531 1.00 0.35 N ATOM 1629 CA ASN A 99 3.931 -9.458 -5.502 1.00 0.36 C ATOM 1630 C ASN A 99 4.940 -10.302 -4.729 1.00 0.34 C ATOM 1631 O ASN A 99 5.098 -11.480 -4.977 1.00 0.35 O ATOM 1632 CB ASN A 99 4.670 -8.509 -6.450 1.00 0.37 C ATOM 1633 CG ASN A 99 5.497 -9.319 -7.450 1.00 1.26 C ATOM 1634 OD1 ASN A 99 6.672 -9.545 -7.247 1.00 2.16 O ATOM 1635 ND2 ASN A 99 4.924 -9.769 -8.532 1.00 1.83 N ATOM 0 H ASN A 99 3.182 -7.658 -4.635 1.00 0.35 H new ATOM 0 HA ASN A 99 3.278 -10.104 -6.088 1.00 0.36 H new ATOM 0 HB2 ASN A 99 3.955 -7.880 -6.980 1.00 0.37 H new ATOM 0 HB3 ASN A 99 5.319 -7.844 -5.881 1.00 0.37 H new ATOM 0 HD21 ASN A 99 5.463 -10.311 -9.207 1.00 1.83 H new ATOM 0 HD22 ASN A 99 3.936 -9.579 -8.703 1.00 1.83 H new ATOM 1642 N ILE A 100 5.619 -9.709 -3.785 1.00 0.32 N ATOM 1643 CA ILE A 100 6.610 -10.479 -2.990 1.00 0.30 C ATOM 1644 C ILE A 100 5.900 -11.630 -2.274 1.00 0.32 C ATOM 1645 O ILE A 100 6.326 -12.765 -2.335 1.00 0.33 O ATOM 1646 CB ILE A 100 7.275 -9.547 -1.969 1.00 0.29 C ATOM 1647 CG1 ILE A 100 8.179 -8.556 -2.713 1.00 0.29 C ATOM 1648 CG2 ILE A 100 8.112 -10.369 -0.978 1.00 0.29 C ATOM 1649 CD1 ILE A 100 8.601 -7.430 -1.766 1.00 0.30 C ATOM 0 H ILE A 100 5.528 -8.725 -3.532 1.00 0.32 H new ATOM 0 HA ILE A 100 7.376 -10.890 -3.647 1.00 0.30 H new ATOM 0 HB ILE A 100 6.508 -9.004 -1.416 1.00 0.29 H new ATOM 0 HG12 ILE A 100 9.060 -9.070 -3.097 1.00 0.29 H new ATOM 0 HG13 ILE A 100 7.651 -8.143 -3.573 1.00 0.29 H new ATOM 0 HG21 ILE A 100 8.581 -9.701 -0.256 1.00 0.29 H new ATOM 0 HG22 ILE A 100 7.467 -11.074 -0.454 1.00 0.29 H new ATOM 0 HG23 ILE A 100 8.883 -10.917 -1.520 1.00 0.29 H new ATOM 0 HD11 ILE A 100 9.243 -6.728 -2.298 1.00 0.30 H new ATOM 0 HD12 ILE A 100 7.715 -6.908 -1.404 1.00 0.30 H new ATOM 0 HD13 ILE A 100 9.146 -7.851 -0.921 1.00 0.30 H new ATOM 1661 N THR A 101 4.815 -11.356 -1.601 1.00 0.33 N ATOM 1662 CA THR A 101 4.092 -12.450 -0.892 1.00 0.36 C ATOM 1663 C THR A 101 3.654 -13.498 -1.911 1.00 0.38 C ATOM 1664 O THR A 101 3.786 -14.685 -1.690 1.00 0.40 O ATOM 1665 CB THR A 101 2.855 -11.878 -0.192 1.00 0.39 C ATOM 1666 OG1 THR A 101 2.058 -11.179 -1.139 1.00 0.40 O ATOM 1667 CG2 THR A 101 3.285 -10.920 0.919 1.00 0.39 C ATOM 0 H THR A 101 4.400 -10.428 -1.512 1.00 0.33 H new ATOM 0 HA THR A 101 4.750 -12.904 -0.151 1.00 0.36 H new ATOM 0 HB THR A 101 2.277 -12.694 0.242 1.00 0.39 H new ATOM 0 HG1 THR A 101 2.616 -10.904 -1.896 1.00 0.40 H new ATOM 0 HG21 THR A 101 2.401 -10.516 1.413 1.00 0.39 H new ATOM 0 HG22 THR A 101 3.894 -11.456 1.646 1.00 0.39 H new ATOM 0 HG23 THR A 101 3.866 -10.103 0.491 1.00 0.39 H new ATOM 1675 N ALA A 102 3.142 -13.073 -3.031 1.00 0.39 N ATOM 1676 CA ALA A 102 2.713 -14.055 -4.061 1.00 0.42 C ATOM 1677 C ALA A 102 3.927 -14.868 -4.520 1.00 0.41 C ATOM 1678 O ALA A 102 3.878 -16.078 -4.609 1.00 0.43 O ATOM 1679 CB ALA A 102 2.108 -13.313 -5.252 1.00 0.44 C ATOM 0 H ALA A 102 3.003 -12.093 -3.276 1.00 0.39 H new ATOM 0 HA ALA A 102 1.965 -14.727 -3.640 1.00 0.42 H new ATOM 0 HB1 ALA A 102 1.793 -14.033 -6.008 1.00 0.44 H new ATOM 0 HB2 ALA A 102 1.246 -12.735 -4.920 1.00 0.44 H new ATOM 0 HB3 ALA A 102 2.853 -12.641 -5.679 1.00 0.44 H new ATOM 1685 N LEU A 103 5.019 -14.209 -4.810 1.00 0.38 N ATOM 1686 CA LEU A 103 6.231 -14.946 -5.259 1.00 0.37 C ATOM 1687 C LEU A 103 6.737 -15.832 -4.117 1.00 0.35 C ATOM 1688 O LEU A 103 7.137 -16.959 -4.326 1.00 0.37 O ATOM 1689 CB LEU A 103 7.321 -13.942 -5.636 1.00 0.35 C ATOM 1690 CG LEU A 103 6.955 -13.184 -6.921 1.00 0.36 C ATOM 1691 CD1 LEU A 103 8.008 -12.100 -7.170 1.00 0.38 C ATOM 1692 CD2 LEU A 103 6.905 -14.147 -8.124 1.00 0.44 C ATOM 0 H LEU A 103 5.121 -13.196 -4.755 1.00 0.38 H new ATOM 0 HA LEU A 103 5.985 -15.564 -6.122 1.00 0.37 H new ATOM 0 HB2 LEU A 103 7.465 -13.233 -4.820 1.00 0.35 H new ATOM 0 HB3 LEU A 103 8.268 -14.464 -5.775 1.00 0.35 H new ATOM 0 HG LEU A 103 5.970 -12.732 -6.804 1.00 0.36 H new ATOM 0 HD11 LEU A 103 7.760 -11.554 -8.080 1.00 0.38 H new ATOM 0 HD12 LEU A 103 8.026 -11.410 -6.326 1.00 0.38 H new ATOM 0 HD13 LEU A 103 8.988 -12.564 -7.281 1.00 0.38 H new ATOM 0 HD21 LEU A 103 6.644 -13.591 -9.025 1.00 0.44 H new ATOM 0 HD22 LEU A 103 7.881 -14.615 -8.256 1.00 0.44 H new ATOM 0 HD23 LEU A 103 6.155 -14.917 -7.943 1.00 0.44 H new ATOM 1704 N LEU A 104 6.714 -15.341 -2.903 1.00 0.33 N ATOM 1705 CA LEU A 104 7.187 -16.181 -1.766 1.00 0.33 C ATOM 1706 C LEU A 104 6.298 -17.414 -1.644 1.00 0.38 C ATOM 1707 O LEU A 104 6.772 -18.503 -1.405 1.00 0.39 O ATOM 1708 CB LEU A 104 7.129 -15.388 -0.455 1.00 0.33 C ATOM 1709 CG LEU A 104 8.221 -14.309 -0.430 1.00 0.29 C ATOM 1710 CD1 LEU A 104 7.951 -13.351 0.737 1.00 0.31 C ATOM 1711 CD2 LEU A 104 9.610 -14.960 -0.253 1.00 0.27 C ATOM 0 H LEU A 104 6.392 -14.406 -2.654 1.00 0.33 H new ATOM 0 HA LEU A 104 8.218 -16.480 -1.955 1.00 0.33 H new ATOM 0 HB2 LEU A 104 6.149 -14.924 -0.347 1.00 0.33 H new ATOM 0 HB3 LEU A 104 7.257 -16.063 0.391 1.00 0.33 H new ATOM 0 HG LEU A 104 8.208 -13.761 -1.372 1.00 0.29 H new ATOM 0 HD11 LEU A 104 8.722 -12.581 0.762 1.00 0.31 H new ATOM 0 HD12 LEU A 104 6.975 -12.883 0.605 1.00 0.31 H new ATOM 0 HD13 LEU A 104 7.963 -13.907 1.674 1.00 0.31 H new ATOM 0 HD21 LEU A 104 10.376 -14.185 -0.237 1.00 0.27 H new ATOM 0 HD22 LEU A 104 9.635 -15.514 0.685 1.00 0.27 H new ATOM 0 HD23 LEU A 104 9.801 -15.641 -1.082 1.00 0.27 H new ATOM 1723 N GLU A 105 5.013 -17.262 -1.813 1.00 0.41 N ATOM 1724 CA GLU A 105 4.122 -18.448 -1.706 1.00 0.45 C ATOM 1725 C GLU A 105 4.537 -19.472 -2.762 1.00 0.46 C ATOM 1726 O GLU A 105 4.615 -20.655 -2.495 1.00 0.48 O ATOM 1727 CB GLU A 105 2.666 -18.023 -1.927 1.00 0.49 C ATOM 1728 CG GLU A 105 1.747 -19.244 -1.812 1.00 0.54 C ATOM 1729 CD GLU A 105 0.292 -18.808 -1.994 1.00 1.15 C ATOM 1730 OE1 GLU A 105 0.051 -17.613 -2.016 1.00 1.82 O ATOM 1731 OE2 GLU A 105 -0.555 -19.677 -2.111 1.00 1.84 O ATOM 0 H GLU A 105 4.547 -16.378 -2.018 1.00 0.41 H new ATOM 0 HA GLU A 105 4.209 -18.891 -0.714 1.00 0.45 H new ATOM 0 HB2 GLU A 105 2.381 -17.271 -1.191 1.00 0.49 H new ATOM 0 HB3 GLU A 105 2.556 -17.565 -2.910 1.00 0.49 H new ATOM 0 HG2 GLU A 105 2.013 -19.984 -2.566 1.00 0.54 H new ATOM 0 HG3 GLU A 105 1.876 -19.719 -0.840 1.00 0.54 H new ATOM 1738 N GLU A 106 4.821 -19.027 -3.958 1.00 0.46 N ATOM 1739 CA GLU A 106 5.247 -19.986 -5.012 1.00 0.48 C ATOM 1740 C GLU A 106 6.638 -20.509 -4.655 1.00 0.44 C ATOM 1741 O GLU A 106 6.936 -21.676 -4.812 1.00 0.46 O ATOM 1742 CB GLU A 106 5.310 -19.274 -6.369 1.00 0.49 C ATOM 1743 CG GLU A 106 3.895 -18.927 -6.840 1.00 1.17 C ATOM 1744 CD GLU A 106 3.136 -20.209 -7.185 1.00 1.67 C ATOM 1745 OE1 GLU A 106 3.786 -21.208 -7.441 1.00 2.26 O ATOM 1746 OE2 GLU A 106 1.917 -20.169 -7.184 1.00 2.27 O ATOM 0 H GLU A 106 4.776 -18.050 -4.246 1.00 0.46 H new ATOM 0 HA GLU A 106 4.534 -20.808 -5.074 1.00 0.48 H new ATOM 0 HB2 GLU A 106 5.908 -18.367 -6.286 1.00 0.49 H new ATOM 0 HB3 GLU A 106 5.801 -19.913 -7.103 1.00 0.49 H new ATOM 0 HG2 GLU A 106 3.366 -18.379 -6.060 1.00 1.17 H new ATOM 0 HG3 GLU A 106 3.942 -18.275 -7.712 1.00 1.17 H new ATOM 1753 N ALA A 107 7.489 -19.647 -4.165 1.00 0.40 N ATOM 1754 CA ALA A 107 8.861 -20.082 -3.785 1.00 0.38 C ATOM 1755 C ALA A 107 8.774 -21.120 -2.667 1.00 0.40 C ATOM 1756 O ALA A 107 9.417 -22.150 -2.713 1.00 0.41 O ATOM 1757 CB ALA A 107 9.669 -18.870 -3.309 1.00 0.34 C ATOM 0 H ALA A 107 7.291 -18.658 -4.012 1.00 0.40 H new ATOM 0 HA ALA A 107 9.356 -20.525 -4.649 1.00 0.38 H new ATOM 0 HB1 ALA A 107 10.674 -19.189 -3.031 1.00 0.34 H new ATOM 0 HB2 ALA A 107 9.731 -18.136 -4.112 1.00 0.34 H new ATOM 0 HB3 ALA A 107 9.178 -18.422 -2.445 1.00 0.34 H new ATOM 1763 N GLN A 108 7.981 -20.866 -1.660 1.00 0.42 N ATOM 1764 CA GLN A 108 7.863 -21.854 -0.556 1.00 0.46 C ATOM 1765 C GLN A 108 7.352 -23.175 -1.119 1.00 0.51 C ATOM 1766 O GLN A 108 7.884 -24.231 -0.838 1.00 0.53 O ATOM 1767 CB GLN A 108 6.877 -21.336 0.493 1.00 0.50 C ATOM 1768 CG GLN A 108 7.486 -20.144 1.235 1.00 0.48 C ATOM 1769 CD GLN A 108 6.486 -19.637 2.274 1.00 0.98 C ATOM 1770 OE1 GLN A 108 5.847 -20.419 2.948 1.00 1.69 O ATOM 1771 NE2 GLN A 108 6.307 -18.352 2.425 1.00 1.58 N ATOM 0 H GLN A 108 7.415 -20.023 -1.557 1.00 0.42 H new ATOM 0 HA GLN A 108 8.839 -22.002 -0.094 1.00 0.46 H new ATOM 0 HB2 GLN A 108 5.944 -21.039 0.013 1.00 0.50 H new ATOM 0 HB3 GLN A 108 6.633 -22.130 1.199 1.00 0.50 H new ATOM 0 HG2 GLN A 108 8.416 -20.439 1.721 1.00 0.48 H new ATOM 0 HG3 GLN A 108 7.732 -19.349 0.531 1.00 0.48 H new ATOM 0 HE21 GLN A 108 6.842 -17.693 1.860 1.00 1.58 H new ATOM 0 HE22 GLN A 108 5.632 -18.008 3.108 1.00 1.58 H new ATOM 1780 N ILE A 109 6.318 -23.127 -1.912 1.00 0.53 N ATOM 1781 CA ILE A 109 5.776 -24.384 -2.489 1.00 0.58 C ATOM 1782 C ILE A 109 6.857 -25.069 -3.330 1.00 0.56 C ATOM 1783 O ILE A 109 7.121 -26.243 -3.176 1.00 0.58 O ATOM 1784 CB ILE A 109 4.566 -24.048 -3.361 1.00 0.61 C ATOM 1785 CG1 ILE A 109 3.425 -23.564 -2.465 1.00 0.64 C ATOM 1786 CG2 ILE A 109 4.116 -25.295 -4.123 1.00 0.67 C ATOM 1787 CD1 ILE A 109 2.325 -22.945 -3.328 1.00 0.67 C ATOM 0 H ILE A 109 5.828 -22.275 -2.183 1.00 0.53 H new ATOM 0 HA ILE A 109 5.471 -25.060 -1.690 1.00 0.58 H new ATOM 0 HB ILE A 109 4.836 -23.269 -4.074 1.00 0.61 H new ATOM 0 HG12 ILE A 109 3.023 -24.397 -1.888 1.00 0.64 H new ATOM 0 HG13 ILE A 109 3.797 -22.830 -1.750 1.00 0.64 H new ATOM 0 HG21 ILE A 109 3.253 -25.051 -4.743 1.00 0.67 H new ATOM 0 HG22 ILE A 109 4.930 -25.648 -4.756 1.00 0.67 H new ATOM 0 HG23 ILE A 109 3.843 -26.076 -3.414 1.00 0.67 H new ATOM 0 HD11 ILE A 109 1.512 -22.600 -2.689 1.00 0.67 H new ATOM 0 HD12 ILE A 109 2.731 -22.101 -3.885 1.00 0.67 H new ATOM 0 HD13 ILE A 109 1.946 -23.692 -4.026 1.00 0.67 H new ATOM 1799 N GLN A 110 7.485 -24.341 -4.217 1.00 0.53 N ATOM 1800 CA GLN A 110 8.547 -24.950 -5.070 1.00 0.52 C ATOM 1801 C GLN A 110 9.729 -25.391 -4.202 1.00 0.48 C ATOM 1802 O GLN A 110 10.311 -26.437 -4.415 1.00 0.50 O ATOM 1803 CB GLN A 110 9.021 -23.913 -6.095 1.00 0.51 C ATOM 1804 CG GLN A 110 10.113 -24.514 -6.985 1.00 1.18 C ATOM 1805 CD GLN A 110 10.529 -23.491 -8.042 1.00 1.47 C ATOM 1806 OE1 GLN A 110 9.865 -22.492 -8.232 1.00 2.12 O ATOM 1807 NE2 GLN A 110 11.617 -23.690 -8.730 1.00 1.93 N ATOM 0 H GLN A 110 7.308 -23.351 -4.387 1.00 0.53 H new ATOM 0 HA GLN A 110 8.143 -25.822 -5.584 1.00 0.52 H new ATOM 0 HB2 GLN A 110 8.181 -23.585 -6.708 1.00 0.51 H new ATOM 0 HB3 GLN A 110 9.404 -23.031 -5.581 1.00 0.51 H new ATOM 0 HG2 GLN A 110 10.974 -24.799 -6.380 1.00 1.18 H new ATOM 0 HG3 GLN A 110 9.747 -25.421 -7.466 1.00 1.18 H new ATOM 0 HE21 GLN A 110 12.175 -24.529 -8.571 1.00 1.93 H new ATOM 0 HE22 GLN A 110 11.911 -23.007 -9.428 1.00 1.93 H new ATOM 1816 N GLN A 111 10.093 -24.600 -3.231 1.00 0.45 N ATOM 1817 CA GLN A 111 11.242 -24.973 -2.363 1.00 0.43 C ATOM 1818 C GLN A 111 10.951 -26.300 -1.662 1.00 0.49 C ATOM 1819 O GLN A 111 11.771 -27.195 -1.642 1.00 0.49 O ATOM 1820 CB GLN A 111 11.464 -23.880 -1.316 1.00 0.42 C ATOM 1821 CG GLN A 111 12.783 -24.132 -0.580 1.00 0.42 C ATOM 1822 CD GLN A 111 13.957 -23.899 -1.537 1.00 0.37 C ATOM 1823 OE1 GLN A 111 13.966 -22.937 -2.278 1.00 0.37 O ATOM 1824 NE2 GLN A 111 14.955 -24.743 -1.551 1.00 0.40 N ATOM 0 H GLN A 111 9.645 -23.713 -3.002 1.00 0.45 H new ATOM 0 HA GLN A 111 12.137 -25.079 -2.976 1.00 0.43 H new ATOM 0 HB2 GLN A 111 11.485 -22.902 -1.796 1.00 0.42 H new ATOM 0 HB3 GLN A 111 10.637 -23.869 -0.606 1.00 0.42 H new ATOM 0 HG2 GLN A 111 12.864 -23.467 0.280 1.00 0.42 H new ATOM 0 HG3 GLN A 111 12.809 -25.152 -0.198 1.00 0.42 H new ATOM 0 HE21 GLN A 111 14.948 -25.551 -0.929 1.00 0.40 H new ATOM 0 HE22 GLN A 111 15.741 -24.593 -2.184 1.00 0.40 H new ATOM 1833 N GLU A 112 9.791 -26.435 -1.079 1.00 0.53 N ATOM 1834 CA GLU A 112 9.460 -27.708 -0.379 1.00 0.60 C ATOM 1835 C GLU A 112 9.513 -28.867 -1.373 1.00 0.62 C ATOM 1836 O GLU A 112 10.011 -29.933 -1.069 1.00 0.64 O ATOM 1837 CB GLU A 112 8.057 -27.615 0.223 1.00 0.66 C ATOM 1838 CG GLU A 112 7.816 -28.820 1.134 1.00 1.29 C ATOM 1839 CD GLU A 112 6.414 -28.732 1.738 1.00 1.72 C ATOM 1840 OE1 GLU A 112 5.779 -27.703 1.569 1.00 2.24 O ATOM 1841 OE2 GLU A 112 5.995 -29.696 2.357 1.00 2.27 O ATOM 0 H GLU A 112 9.062 -25.722 -1.057 1.00 0.53 H new ATOM 0 HA GLU A 112 10.184 -27.880 0.418 1.00 0.60 H new ATOM 0 HB2 GLU A 112 7.953 -26.690 0.790 1.00 0.66 H new ATOM 0 HB3 GLU A 112 7.310 -27.589 -0.570 1.00 0.66 H new ATOM 0 HG2 GLU A 112 7.921 -29.745 0.567 1.00 1.29 H new ATOM 0 HG3 GLU A 112 8.564 -28.845 1.927 1.00 1.29 H new ATOM 1848 N LYS A 113 9.001 -28.672 -2.561 1.00 0.62 N ATOM 1849 CA LYS A 113 9.025 -29.769 -3.565 1.00 0.65 C ATOM 1850 C LYS A 113 10.471 -30.161 -3.872 1.00 0.60 C ATOM 1851 O LYS A 113 10.792 -31.325 -4.010 1.00 0.63 O ATOM 1852 CB LYS A 113 8.341 -29.308 -4.855 1.00 0.68 C ATOM 1853 CG LYS A 113 6.836 -29.167 -4.613 1.00 0.75 C ATOM 1854 CD LYS A 113 6.151 -28.713 -5.905 1.00 1.27 C ATOM 1855 CE LYS A 113 4.645 -28.567 -5.666 1.00 1.52 C ATOM 1856 NZ LYS A 113 4.017 -29.915 -5.586 1.00 2.10 N ATOM 0 H LYS A 113 8.570 -27.803 -2.875 1.00 0.62 H new ATOM 0 HA LYS A 113 8.494 -30.630 -3.160 1.00 0.65 H new ATOM 0 HB2 LYS A 113 8.759 -28.355 -5.180 1.00 0.68 H new ATOM 0 HB3 LYS A 113 8.526 -30.026 -5.654 1.00 0.68 H new ATOM 0 HG2 LYS A 113 6.419 -30.119 -4.283 1.00 0.75 H new ATOM 0 HG3 LYS A 113 6.651 -28.445 -3.818 1.00 0.75 H new ATOM 0 HD2 LYS A 113 6.570 -27.763 -6.236 1.00 1.27 H new ATOM 0 HD3 LYS A 113 6.335 -29.437 -6.699 1.00 1.27 H new ATOM 0 HE2 LYS A 113 4.465 -28.016 -4.743 1.00 1.52 H new ATOM 0 HE3 LYS A 113 4.193 -27.992 -6.474 1.00 1.52 H new ATOM 0 HZ1 LYS A 113 2.982 -29.816 -5.577 1.00 2.10 H new ATOM 0 HZ2 LYS A 113 4.303 -30.481 -6.410 1.00 2.10 H new ATOM 0 HZ3 LYS A 113 4.327 -30.391 -4.715 1.00 2.10 H new ATOM 1870 N ASN A 114 11.349 -29.205 -3.987 1.00 0.53 N ATOM 1871 CA ASN A 114 12.765 -29.546 -4.285 1.00 0.48 C ATOM 1872 C ASN A 114 13.330 -30.433 -3.181 1.00 0.49 C ATOM 1873 O ASN A 114 13.921 -31.461 -3.443 1.00 0.50 O ATOM 1874 CB ASN A 114 13.591 -28.265 -4.391 1.00 0.44 C ATOM 1875 CG ASN A 114 13.221 -27.523 -5.676 1.00 0.46 C ATOM 1876 OD1 ASN A 114 12.825 -26.376 -5.637 1.00 1.19 O ATOM 1877 ND2 ASN A 114 13.330 -28.139 -6.823 1.00 1.18 N ATOM 0 H ASN A 114 11.149 -28.210 -3.888 1.00 0.53 H new ATOM 0 HA ASN A 114 12.811 -30.084 -5.232 1.00 0.48 H new ATOM 0 HB2 ASN A 114 13.407 -27.629 -3.525 1.00 0.44 H new ATOM 0 HB3 ASN A 114 14.654 -28.504 -4.390 1.00 0.44 H new ATOM 0 HD21 ASN A 114 13.082 -27.656 -7.687 1.00 1.18 H new ATOM 0 HD22 ASN A 114 13.663 -29.103 -6.855 1.00 1.18 H new ATOM 1884 N MET A 115 13.153 -30.054 -1.944 1.00 0.50 N ATOM 1885 CA MET A 115 13.684 -30.897 -0.842 1.00 0.53 C ATOM 1886 C MET A 115 12.932 -32.227 -0.836 1.00 0.60 C ATOM 1887 O MET A 115 13.509 -33.278 -0.651 1.00 0.63 O ATOM 1888 CB MET A 115 13.475 -30.179 0.492 1.00 0.56 C ATOM 1889 CG MET A 115 14.092 -31.006 1.622 1.00 0.71 C ATOM 1890 SD MET A 115 13.817 -30.170 3.205 1.00 0.94 S ATOM 1891 CE MET A 115 12.017 -30.358 3.270 1.00 1.45 C ATOM 0 H MET A 115 12.668 -29.205 -1.653 1.00 0.50 H new ATOM 0 HA MET A 115 14.749 -31.077 -0.987 1.00 0.53 H new ATOM 0 HB2 MET A 115 13.932 -29.190 0.460 1.00 0.56 H new ATOM 0 HB3 MET A 115 12.411 -30.032 0.675 1.00 0.56 H new ATOM 0 HG2 MET A 115 13.648 -32.001 1.643 1.00 0.71 H new ATOM 0 HG3 MET A 115 15.160 -31.137 1.449 1.00 0.71 H new ATOM 0 HE1 MET A 115 11.691 -30.381 4.310 1.00 1.45 H new ATOM 0 HE2 MET A 115 11.545 -29.518 2.760 1.00 1.45 H new ATOM 0 HE3 MET A 115 11.730 -31.288 2.780 1.00 1.45 H new ATOM 1901 N TYR A 116 11.644 -32.185 -1.047 1.00 0.65 N ATOM 1902 CA TYR A 116 10.845 -33.442 -1.060 1.00 0.73 C ATOM 1903 C TYR A 116 11.365 -34.361 -2.163 1.00 0.71 C ATOM 1904 O TYR A 116 11.605 -35.533 -1.947 1.00 0.76 O ATOM 1905 CB TYR A 116 9.373 -33.108 -1.318 1.00 0.78 C ATOM 1906 CG TYR A 116 8.549 -34.373 -1.317 1.00 0.87 C ATOM 1907 CD1 TYR A 116 7.994 -34.846 -0.121 1.00 0.95 C ATOM 1908 CD2 TYR A 116 8.330 -35.066 -2.513 1.00 0.91 C ATOM 1909 CE1 TYR A 116 7.223 -36.014 -0.121 1.00 1.04 C ATOM 1910 CE2 TYR A 116 7.558 -36.233 -2.513 1.00 1.01 C ATOM 1911 CZ TYR A 116 7.005 -36.707 -1.318 1.00 1.07 C ATOM 1912 OH TYR A 116 6.246 -37.860 -1.319 1.00 1.18 O ATOM 0 H TYR A 116 11.110 -31.331 -1.211 1.00 0.65 H new ATOM 0 HA TYR A 116 10.937 -33.944 -0.097 1.00 0.73 H new ATOM 0 HB2 TYR A 116 9.007 -32.425 -0.552 1.00 0.78 H new ATOM 0 HB3 TYR A 116 9.270 -32.598 -2.276 1.00 0.78 H new ATOM 0 HD1 TYR A 116 8.161 -34.309 0.801 1.00 0.95 H new ATOM 0 HD2 TYR A 116 8.757 -34.700 -3.435 1.00 0.91 H new ATOM 0 HE1 TYR A 116 6.797 -36.380 0.801 1.00 1.04 H new ATOM 0 HE2 TYR A 116 7.389 -36.768 -3.436 1.00 1.01 H new ATOM 0 HH TYR A 116 6.192 -38.215 -2.231 1.00 1.18 H new ATOM 1922 N GLU A 117 11.538 -33.846 -3.350 1.00 0.67 N ATOM 1923 CA GLU A 117 12.037 -34.706 -4.455 1.00 0.68 C ATOM 1924 C GLU A 117 13.438 -35.212 -4.104 1.00 0.64 C ATOM 1925 O GLU A 117 13.778 -36.353 -4.349 1.00 0.68 O ATOM 1926 CB GLU A 117 12.092 -33.894 -5.750 1.00 0.65 C ATOM 1927 CG GLU A 117 10.669 -33.597 -6.229 1.00 0.72 C ATOM 1928 CD GLU A 117 10.725 -32.647 -7.427 1.00 0.73 C ATOM 1929 OE1 GLU A 117 11.822 -32.290 -7.824 1.00 1.29 O ATOM 1930 OE2 GLU A 117 9.669 -32.296 -7.930 1.00 1.28 O ATOM 0 H GLU A 117 11.356 -32.874 -3.599 1.00 0.67 H new ATOM 0 HA GLU A 117 11.366 -35.554 -4.592 1.00 0.68 H new ATOM 0 HB2 GLU A 117 12.633 -32.962 -5.584 1.00 0.65 H new ATOM 0 HB3 GLU A 117 12.636 -34.447 -6.515 1.00 0.65 H new ATOM 0 HG2 GLU A 117 10.167 -34.523 -6.508 1.00 0.72 H new ATOM 0 HG3 GLU A 117 10.088 -33.150 -5.423 1.00 0.72 H new ATOM 1937 N LEU A 118 14.253 -34.369 -3.530 1.00 0.58 N ATOM 1938 CA LEU A 118 15.632 -34.795 -3.161 1.00 0.55 C ATOM 1939 C LEU A 118 15.559 -35.964 -2.173 1.00 0.64 C ATOM 1940 O LEU A 118 16.315 -36.912 -2.265 1.00 0.66 O ATOM 1941 CB LEU A 118 16.375 -33.615 -2.520 1.00 0.51 C ATOM 1942 CG LEU A 118 17.805 -34.024 -2.126 1.00 0.51 C ATOM 1943 CD1 LEU A 118 18.595 -34.473 -3.368 1.00 0.53 C ATOM 1944 CD2 LEU A 118 18.505 -32.825 -1.477 1.00 0.53 C ATOM 0 H LEU A 118 14.022 -33.402 -3.301 1.00 0.58 H new ATOM 0 HA LEU A 118 16.168 -35.115 -4.054 1.00 0.55 H new ATOM 0 HB2 LEU A 118 16.410 -32.778 -3.218 1.00 0.51 H new ATOM 0 HB3 LEU A 118 15.833 -33.273 -1.638 1.00 0.51 H new ATOM 0 HG LEU A 118 17.760 -34.856 -1.423 1.00 0.51 H new ATOM 0 HD11 LEU A 118 19.605 -34.759 -3.073 1.00 0.53 H new ATOM 0 HD12 LEU A 118 18.096 -35.326 -3.828 1.00 0.53 H new ATOM 0 HD13 LEU A 118 18.645 -33.652 -4.084 1.00 0.53 H new ATOM 0 HD21 LEU A 118 19.520 -33.105 -1.194 1.00 0.53 H new ATOM 0 HD22 LEU A 118 18.541 -31.998 -2.186 1.00 0.53 H new ATOM 0 HD23 LEU A 118 17.953 -32.518 -0.589 1.00 0.53 H new ATOM 1956 N GLN A 119 14.653 -35.914 -1.232 1.00 0.70 N ATOM 1957 CA GLN A 119 14.543 -37.033 -0.255 1.00 0.81 C ATOM 1958 C GLN A 119 14.235 -38.328 -1.007 1.00 0.86 C ATOM 1959 O GLN A 119 14.766 -39.377 -0.699 1.00 0.92 O ATOM 1960 CB GLN A 119 13.414 -36.730 0.734 1.00 0.88 C ATOM 1961 CG GLN A 119 13.840 -35.589 1.659 1.00 0.87 C ATOM 1962 CD GLN A 119 12.705 -35.279 2.635 1.00 0.95 C ATOM 1963 OE1 GLN A 119 11.506 -35.725 2.378 1.00 1.28 O flip ATOM 1964 NE2 GLN A 119 12.908 -34.622 3.637 1.00 1.46 N flip ATOM 0 H GLN A 119 13.989 -35.151 -1.099 1.00 0.70 H new ATOM 0 HA GLN A 119 15.481 -37.144 0.289 1.00 0.81 H new ATOM 0 HB2 GLN A 119 12.507 -36.456 0.195 1.00 0.88 H new ATOM 0 HB3 GLN A 119 13.180 -37.619 1.319 1.00 0.88 H new ATOM 0 HG2 GLN A 119 14.740 -35.867 2.207 1.00 0.87 H new ATOM 0 HG3 GLN A 119 14.084 -34.703 1.073 1.00 0.87 H new ATOM 0 HE21 GLN A 119 13.846 -34.274 3.837 1.00 1.46 H new ATOM 0 HE22 GLN A 119 12.141 -34.419 4.278 1.00 1.46 H new ATOM 1973 N LYS A 120 13.390 -38.261 -2.000 1.00 0.85 N ATOM 1974 CA LYS A 120 13.054 -39.487 -2.779 1.00 0.93 C ATOM 1975 C LYS A 120 14.319 -40.022 -3.451 1.00 0.90 C ATOM 1976 O LYS A 120 14.551 -41.213 -3.498 1.00 0.98 O ATOM 1977 CB LYS A 120 12.000 -39.157 -3.844 1.00 0.95 C ATOM 1978 CG LYS A 120 10.654 -38.813 -3.182 1.00 1.01 C ATOM 1979 CD LYS A 120 9.917 -40.090 -2.751 1.00 1.57 C ATOM 1980 CE LYS A 120 8.489 -39.733 -2.330 1.00 1.88 C ATOM 1981 NZ LYS A 120 7.776 -40.973 -1.918 1.00 2.44 N ATOM 0 H LYS A 120 12.918 -37.410 -2.305 1.00 0.85 H new ATOM 0 HA LYS A 120 12.651 -40.244 -2.106 1.00 0.93 H new ATOM 0 HB2 LYS A 120 12.338 -38.317 -4.451 1.00 0.95 H new ATOM 0 HB3 LYS A 120 11.875 -40.006 -4.516 1.00 0.95 H new ATOM 0 HG2 LYS A 120 10.823 -38.175 -2.315 1.00 1.01 H new ATOM 0 HG3 LYS A 120 10.035 -38.248 -3.878 1.00 1.01 H new ATOM 0 HD2 LYS A 120 9.898 -40.807 -3.572 1.00 1.57 H new ATOM 0 HD3 LYS A 120 10.444 -40.566 -1.924 1.00 1.57 H new ATOM 0 HE2 LYS A 120 8.508 -39.019 -1.506 1.00 1.88 H new ATOM 0 HE3 LYS A 120 7.963 -39.254 -3.155 1.00 1.88 H new ATOM 0 HZ1 LYS A 120 6.805 -40.736 -1.631 1.00 2.44 H new ATOM 0 HZ2 LYS A 120 7.748 -41.639 -2.716 1.00 2.44 H new ATOM 0 HZ3 LYS A 120 8.276 -41.412 -1.119 1.00 2.44 H new ATOM 1995 N LEU A 121 15.149 -39.156 -3.961 1.00 0.79 N ATOM 1996 CA LEU A 121 16.395 -39.635 -4.611 1.00 0.78 C ATOM 1997 C LEU A 121 17.204 -40.400 -3.565 1.00 0.86 C ATOM 1998 O LEU A 121 17.694 -41.482 -3.819 1.00 0.95 O ATOM 1999 CB LEU A 121 17.204 -38.440 -5.127 1.00 0.67 C ATOM 2000 CG LEU A 121 16.383 -37.655 -6.160 1.00 0.66 C ATOM 2001 CD1 LEU A 121 17.195 -36.444 -6.626 1.00 0.61 C ATOM 2002 CD2 LEU A 121 16.058 -38.551 -7.371 1.00 0.76 C ATOM 0 H LEU A 121 15.018 -38.144 -3.955 1.00 0.79 H new ATOM 0 HA LEU A 121 16.160 -40.282 -5.456 1.00 0.78 H new ATOM 0 HB2 LEU A 121 17.476 -37.789 -4.296 1.00 0.67 H new ATOM 0 HB3 LEU A 121 18.134 -38.787 -5.578 1.00 0.67 H new ATOM 0 HG LEU A 121 15.449 -37.326 -5.704 1.00 0.66 H new ATOM 0 HD11 LEU A 121 16.619 -35.881 -7.360 1.00 0.61 H new ATOM 0 HD12 LEU A 121 17.418 -35.805 -5.772 1.00 0.61 H new ATOM 0 HD13 LEU A 121 18.127 -36.783 -7.078 1.00 0.61 H new ATOM 0 HD21 LEU A 121 15.476 -37.984 -8.097 1.00 0.76 H new ATOM 0 HD22 LEU A 121 16.986 -38.888 -7.834 1.00 0.76 H new ATOM 0 HD23 LEU A 121 15.483 -39.416 -7.040 1.00 0.76 H new ATOM 2014 N ASN A 122 17.330 -39.850 -2.384 1.00 0.88 N ATOM 2015 CA ASN A 122 18.087 -40.538 -1.293 1.00 1.02 C ATOM 2016 C ASN A 122 17.187 -40.663 -0.062 1.00 1.08 C ATOM 2017 O ASN A 122 17.489 -40.143 0.994 1.00 1.15 O ATOM 2018 CB ASN A 122 19.324 -39.711 -0.938 1.00 1.10 C ATOM 2019 CG ASN A 122 20.192 -40.492 0.050 1.00 1.31 C ATOM 2020 OD1 ASN A 122 20.145 -41.706 0.086 1.00 1.78 O ATOM 2021 ND2 ASN A 122 20.988 -39.846 0.860 1.00 1.70 N ATOM 0 H ASN A 122 16.937 -38.945 -2.126 1.00 0.88 H new ATOM 0 HA ASN A 122 18.395 -41.530 -1.624 1.00 1.02 H new ATOM 0 HB2 ASN A 122 19.894 -39.484 -1.839 1.00 1.10 H new ATOM 0 HB3 ASN A 122 19.025 -38.758 -0.502 1.00 1.10 H new ATOM 0 HD21 ASN A 122 21.569 -40.360 1.522 1.00 1.70 H new ATOM 0 HD22 ASN A 122 21.028 -38.827 0.831 1.00 1.70 H new ATOM 2028 N SER A 123 16.082 -41.356 -0.185 1.00 1.09 N ATOM 2029 CA SER A 123 15.167 -41.519 0.981 1.00 1.18 C ATOM 2030 C SER A 123 15.586 -42.756 1.779 1.00 1.37 C ATOM 2031 O SER A 123 15.614 -43.829 1.198 1.00 1.92 O ATOM 2032 CB SER A 123 13.731 -41.708 0.478 1.00 1.16 C ATOM 2033 OG SER A 123 13.023 -42.555 1.375 1.00 1.83 O ATOM 2034 OXT SER A 123 15.867 -42.611 2.957 1.00 1.65 O ATOM 0 H SER A 123 15.776 -41.815 -1.043 1.00 1.09 H new ATOM 0 HA SER A 123 15.220 -40.634 1.615 1.00 1.18 H new ATOM 0 HB2 SER A 123 13.231 -40.742 0.401 1.00 1.16 H new ATOM 0 HB3 SER A 123 13.738 -42.143 -0.521 1.00 1.16 H new ATOM 0 HG SER A 123 12.105 -42.675 1.055 1.00 1.83 H new ATOM 2041 N ALA B 1 29.467 -37.451 -17.263 1.00 0.82 N ATOM 2042 CA ALA B 1 28.118 -36.958 -17.669 1.00 0.80 C ATOM 2043 C ALA B 1 27.554 -36.040 -16.580 1.00 0.71 C ATOM 2044 O ALA B 1 26.413 -35.630 -16.634 1.00 0.71 O ATOM 2045 CB ALA B 1 27.180 -38.151 -17.876 1.00 0.91 C ATOM 0 H1 ALA B 1 29.825 -38.113 -17.980 1.00 0.82 H new ATOM 0 H2 ALA B 1 30.120 -36.646 -17.179 1.00 0.82 H new ATOM 0 H3 ALA B 1 29.397 -37.938 -16.347 1.00 0.82 H new ATOM 0 HA ALA B 1 28.202 -36.398 -18.600 1.00 0.80 H new ATOM 0 HB1 ALA B 1 26.195 -37.792 -18.173 1.00 0.91 H new ATOM 0 HB2 ALA B 1 27.581 -38.798 -18.657 1.00 0.91 H new ATOM 0 HB3 ALA B 1 27.096 -38.714 -16.946 1.00 0.91 H new ATOM 2053 N GLN B 2 28.345 -35.712 -15.594 1.00 0.67 N ATOM 2054 CA GLN B 2 27.848 -34.818 -14.507 1.00 0.60 C ATOM 2055 C GLN B 2 27.880 -33.363 -14.984 1.00 0.52 C ATOM 2056 O GLN B 2 28.764 -32.957 -15.711 1.00 0.52 O ATOM 2057 CB GLN B 2 28.751 -34.966 -13.280 1.00 0.62 C ATOM 2058 CG GLN B 2 28.605 -36.375 -12.702 1.00 0.72 C ATOM 2059 CD GLN B 2 27.203 -36.545 -12.117 1.00 1.27 C ATOM 2060 OE1 GLN B 2 26.522 -37.507 -12.410 1.00 2.00 O ATOM 2061 NE2 GLN B 2 26.739 -35.643 -11.297 1.00 1.88 N ATOM 0 H GLN B 2 29.311 -36.023 -15.494 1.00 0.67 H new ATOM 0 HA GLN B 2 26.825 -35.094 -14.249 1.00 0.60 H new ATOM 0 HB2 GLN B 2 29.789 -34.781 -13.556 1.00 0.62 H new ATOM 0 HB3 GLN B 2 28.484 -34.224 -12.528 1.00 0.62 H new ATOM 0 HG2 GLN B 2 28.778 -37.118 -13.480 1.00 0.72 H new ATOM 0 HG3 GLN B 2 29.355 -36.542 -11.929 1.00 0.72 H new ATOM 0 HE21 GLN B 2 27.311 -34.835 -11.051 1.00 1.88 H new ATOM 0 HE22 GLN B 2 25.804 -35.746 -10.902 1.00 1.88 H new ATOM 2070 N SER B 3 26.919 -32.573 -14.576 1.00 0.47 N ATOM 2071 CA SER B 3 26.889 -31.142 -14.999 1.00 0.41 C ATOM 2072 C SER B 3 27.605 -30.287 -13.952 1.00 0.37 C ATOM 2073 O SER B 3 27.023 -29.406 -13.350 1.00 0.34 O ATOM 2074 CB SER B 3 25.436 -30.683 -15.135 1.00 0.41 C ATOM 2075 OG SER B 3 25.387 -29.543 -15.981 1.00 1.37 O ATOM 0 H SER B 3 26.153 -32.859 -13.967 1.00 0.47 H new ATOM 0 HA SER B 3 27.393 -31.033 -15.959 1.00 0.41 H new ATOM 0 HB2 SER B 3 24.825 -31.485 -15.549 1.00 0.41 H new ATOM 0 HB3 SER B 3 25.024 -30.442 -14.155 1.00 0.41 H new ATOM 0 HG SER B 3 24.454 -29.340 -16.203 1.00 1.37 H new ATOM 2081 N ARG B 4 28.866 -30.534 -13.741 1.00 0.41 N ATOM 2082 CA ARG B 4 29.625 -29.731 -12.745 1.00 0.42 C ATOM 2083 C ARG B 4 29.674 -28.276 -13.204 1.00 0.42 C ATOM 2084 O ARG B 4 29.548 -27.361 -12.414 1.00 0.43 O ATOM 2085 CB ARG B 4 31.041 -30.288 -12.609 1.00 0.51 C ATOM 2086 CG ARG B 4 30.981 -31.646 -11.904 1.00 0.91 C ATOM 2087 CD ARG B 4 32.392 -32.225 -11.784 1.00 1.03 C ATOM 2088 NE ARG B 4 32.894 -32.584 -13.138 1.00 1.97 N ATOM 2089 CZ ARG B 4 34.166 -32.810 -13.325 1.00 2.55 C ATOM 2090 NH1 ARG B 4 35.002 -32.710 -12.326 1.00 2.53 N ATOM 2091 NH2 ARG B 4 34.599 -33.130 -14.511 1.00 3.56 N ATOM 0 H ARG B 4 29.405 -31.258 -14.216 1.00 0.41 H new ATOM 0 HA ARG B 4 29.131 -29.785 -11.775 1.00 0.42 H new ATOM 0 HB2 ARG B 4 31.499 -30.395 -13.592 1.00 0.51 H new ATOM 0 HB3 ARG B 4 31.664 -29.597 -12.041 1.00 0.51 H new ATOM 0 HG2 ARG B 4 30.538 -31.534 -10.915 1.00 0.91 H new ATOM 0 HG3 ARG B 4 30.343 -32.330 -12.464 1.00 0.91 H new ATOM 0 HD2 ARG B 4 33.057 -31.498 -11.318 1.00 1.03 H new ATOM 0 HD3 ARG B 4 32.383 -33.106 -11.142 1.00 1.03 H new ATOM 0 HE ARG B 4 32.244 -32.654 -13.921 1.00 1.97 H new ATOM 0 HH11 ARG B 4 34.661 -32.455 -11.399 1.00 2.53 H new ATOM 0 HH12 ARG B 4 35.996 -32.887 -12.473 1.00 2.53 H new ATOM 0 HH21 ARG B 4 33.945 -33.203 -15.290 1.00 3.56 H new ATOM 0 HH22 ARG B 4 35.592 -33.307 -14.661 1.00 3.56 H new ATOM 2105 N THR B 5 29.854 -28.050 -14.476 1.00 0.45 N ATOM 2106 CA THR B 5 29.904 -26.649 -14.974 1.00 0.49 C ATOM 2107 C THR B 5 28.582 -25.947 -14.650 1.00 0.44 C ATOM 2108 O THR B 5 28.565 -24.813 -14.218 1.00 0.46 O ATOM 2109 CB THR B 5 30.133 -26.636 -16.491 1.00 0.54 C ATOM 2110 OG1 THR B 5 29.727 -25.380 -17.014 1.00 0.68 O ATOM 2111 CG2 THR B 5 29.321 -27.748 -17.158 1.00 0.57 C ATOM 0 H THR B 5 29.968 -28.771 -15.188 1.00 0.45 H new ATOM 0 HA THR B 5 30.727 -26.126 -14.487 1.00 0.49 H new ATOM 0 HB THR B 5 31.192 -26.800 -16.693 1.00 0.54 H new ATOM 0 HG1 THR B 5 29.873 -25.367 -17.983 1.00 0.68 H new ATOM 0 HG21 THR B 5 29.492 -27.728 -18.234 1.00 0.57 H new ATOM 0 HG22 THR B 5 29.631 -28.714 -16.759 1.00 0.57 H new ATOM 0 HG23 THR B 5 28.261 -27.595 -16.956 1.00 0.57 H new ATOM 2119 N LEU B 6 27.471 -26.610 -14.848 1.00 0.39 N ATOM 2120 CA LEU B 6 26.160 -25.962 -14.539 1.00 0.36 C ATOM 2121 C LEU B 6 26.099 -25.650 -13.040 1.00 0.32 C ATOM 2122 O LEU B 6 25.661 -24.594 -12.627 1.00 0.33 O ATOM 2123 CB LEU B 6 25.014 -26.906 -14.922 1.00 0.35 C ATOM 2124 CG LEU B 6 23.654 -26.256 -14.611 1.00 0.35 C ATOM 2125 CD1 LEU B 6 23.490 -24.951 -15.414 1.00 0.41 C ATOM 2126 CD2 LEU B 6 22.539 -27.238 -14.986 1.00 0.37 C ATOM 0 H LEU B 6 27.414 -27.563 -15.207 1.00 0.39 H new ATOM 0 HA LEU B 6 26.062 -25.038 -15.109 1.00 0.36 H new ATOM 0 HB2 LEU B 6 25.074 -27.148 -15.983 1.00 0.35 H new ATOM 0 HB3 LEU B 6 25.109 -27.844 -14.375 1.00 0.35 H new ATOM 0 HG LEU B 6 23.600 -26.019 -13.549 1.00 0.35 H new ATOM 0 HD11 LEU B 6 22.524 -24.502 -15.185 1.00 0.41 H new ATOM 0 HD12 LEU B 6 24.286 -24.256 -15.146 1.00 0.41 H new ATOM 0 HD13 LEU B 6 23.544 -25.171 -16.480 1.00 0.41 H new ATOM 0 HD21 LEU B 6 21.570 -26.788 -14.770 1.00 0.37 H new ATOM 0 HD22 LEU B 6 22.602 -27.471 -16.049 1.00 0.37 H new ATOM 0 HD23 LEU B 6 22.651 -28.154 -14.406 1.00 0.37 H new ATOM 2138 N LEU B 7 26.544 -26.567 -12.225 1.00 0.29 N ATOM 2139 CA LEU B 7 26.531 -26.350 -10.749 1.00 0.27 C ATOM 2140 C LEU B 7 27.374 -25.131 -10.391 1.00 0.30 C ATOM 2141 O LEU B 7 27.019 -24.356 -9.526 1.00 0.29 O ATOM 2142 CB LEU B 7 27.074 -27.590 -10.040 1.00 0.27 C ATOM 2143 CG LEU B 7 26.062 -28.745 -10.164 1.00 0.24 C ATOM 2144 CD1 LEU B 7 26.730 -30.068 -9.750 1.00 0.28 C ATOM 2145 CD2 LEU B 7 24.832 -28.483 -9.263 1.00 0.23 C ATOM 0 H LEU B 7 26.920 -27.467 -12.522 1.00 0.29 H new ATOM 0 HA LEU B 7 25.506 -26.174 -10.424 1.00 0.27 H new ATOM 0 HB2 LEU B 7 28.029 -27.882 -10.478 1.00 0.27 H new ATOM 0 HB3 LEU B 7 27.260 -27.368 -8.989 1.00 0.27 H new ATOM 0 HG LEU B 7 25.733 -28.811 -11.201 1.00 0.24 H new ATOM 0 HD11 LEU B 7 26.011 -30.882 -9.839 1.00 0.28 H new ATOM 0 HD12 LEU B 7 27.583 -30.264 -10.400 1.00 0.28 H new ATOM 0 HD13 LEU B 7 27.070 -29.996 -8.717 1.00 0.28 H new ATOM 0 HD21 LEU B 7 24.126 -29.308 -9.362 1.00 0.23 H new ATOM 0 HD22 LEU B 7 25.152 -28.402 -8.224 1.00 0.23 H new ATOM 0 HD23 LEU B 7 24.349 -27.554 -9.567 1.00 0.23 H new ATOM 2157 N ALA B 8 28.493 -24.952 -11.032 1.00 0.35 N ATOM 2158 CA ALA B 8 29.340 -23.779 -10.697 1.00 0.39 C ATOM 2159 C ALA B 8 28.522 -22.513 -10.938 1.00 0.38 C ATOM 2160 O ALA B 8 28.567 -21.574 -10.167 1.00 0.38 O ATOM 2161 CB ALA B 8 30.586 -23.767 -11.587 1.00 0.45 C ATOM 0 H ALA B 8 28.854 -25.561 -11.766 1.00 0.35 H new ATOM 0 HA ALA B 8 29.656 -23.830 -9.655 1.00 0.39 H new ATOM 0 HB1 ALA B 8 31.204 -22.904 -11.337 1.00 0.45 H new ATOM 0 HB2 ALA B 8 31.157 -24.681 -11.426 1.00 0.45 H new ATOM 0 HB3 ALA B 8 30.285 -23.707 -12.633 1.00 0.45 H new ATOM 2167 N GLY B 9 27.757 -22.489 -11.992 1.00 0.38 N ATOM 2168 CA GLY B 9 26.918 -21.294 -12.267 1.00 0.39 C ATOM 2169 C GLY B 9 25.826 -21.204 -11.197 1.00 0.34 C ATOM 2170 O GLY B 9 25.614 -20.167 -10.600 1.00 0.34 O ATOM 0 H GLY B 9 27.677 -23.244 -12.673 1.00 0.38 H new ATOM 0 HA2 GLY B 9 27.530 -20.392 -12.259 1.00 0.39 H new ATOM 0 HA3 GLY B 9 26.471 -21.366 -13.258 1.00 0.39 H new ATOM 2174 N ILE B 10 25.138 -22.290 -10.941 1.00 0.30 N ATOM 2175 CA ILE B 10 24.074 -22.272 -9.896 1.00 0.27 C ATOM 2176 C ILE B 10 24.700 -21.901 -8.548 1.00 0.26 C ATOM 2177 O ILE B 10 24.224 -21.025 -7.853 1.00 0.25 O ATOM 2178 CB ILE B 10 23.415 -23.651 -9.803 1.00 0.25 C ATOM 2179 CG1 ILE B 10 22.681 -23.952 -11.114 1.00 0.28 C ATOM 2180 CG2 ILE B 10 22.412 -23.664 -8.648 1.00 0.26 C ATOM 2181 CD1 ILE B 10 22.228 -25.414 -11.132 1.00 0.26 C ATOM 0 H ILE B 10 25.269 -23.186 -11.411 1.00 0.30 H new ATOM 0 HA ILE B 10 23.315 -21.536 -10.160 1.00 0.27 H new ATOM 0 HB ILE B 10 24.180 -24.407 -9.628 1.00 0.25 H new ATOM 0 HG12 ILE B 10 21.819 -23.293 -11.218 1.00 0.28 H new ATOM 0 HG13 ILE B 10 23.337 -23.755 -11.962 1.00 0.28 H new ATOM 0 HG21 ILE B 10 21.944 -24.646 -8.584 1.00 0.26 H new ATOM 0 HG22 ILE B 10 22.930 -23.447 -7.714 1.00 0.26 H new ATOM 0 HG23 ILE B 10 21.646 -22.908 -8.823 1.00 0.26 H new ATOM 0 HD11 ILE B 10 21.707 -25.622 -12.066 1.00 0.26 H new ATOM 0 HD12 ILE B 10 23.098 -26.066 -11.049 1.00 0.26 H new ATOM 0 HD13 ILE B 10 21.556 -25.597 -10.293 1.00 0.26 H new ATOM 2193 N VAL B 11 25.768 -22.559 -8.178 1.00 0.26 N ATOM 2194 CA VAL B 11 26.428 -22.238 -6.877 1.00 0.27 C ATOM 2195 C VAL B 11 26.873 -20.776 -6.888 1.00 0.29 C ATOM 2196 O VAL B 11 26.630 -20.035 -5.955 1.00 0.28 O ATOM 2197 CB VAL B 11 27.649 -23.149 -6.686 1.00 0.30 C ATOM 2198 CG1 VAL B 11 28.477 -22.669 -5.487 1.00 0.35 C ATOM 2199 CG2 VAL B 11 27.172 -24.580 -6.431 1.00 0.29 C ATOM 0 H VAL B 11 26.211 -23.302 -8.718 1.00 0.26 H new ATOM 0 HA VAL B 11 25.727 -22.399 -6.058 1.00 0.27 H new ATOM 0 HB VAL B 11 28.267 -23.117 -7.583 1.00 0.30 H new ATOM 0 HG11 VAL B 11 29.341 -23.320 -5.358 1.00 0.35 H new ATOM 0 HG12 VAL B 11 28.815 -21.648 -5.664 1.00 0.35 H new ATOM 0 HG13 VAL B 11 27.864 -22.697 -4.586 1.00 0.35 H new ATOM 0 HG21 VAL B 11 28.035 -25.232 -6.295 1.00 0.29 H new ATOM 0 HG22 VAL B 11 26.554 -24.603 -5.533 1.00 0.29 H new ATOM 0 HG23 VAL B 11 26.587 -24.926 -7.283 1.00 0.29 H new ATOM 2209 N GLN B 12 27.517 -20.361 -7.944 1.00 0.32 N ATOM 2210 CA GLN B 12 27.977 -18.947 -8.043 1.00 0.34 C ATOM 2211 C GLN B 12 26.761 -18.019 -7.973 1.00 0.32 C ATOM 2212 O GLN B 12 26.797 -16.971 -7.359 1.00 0.32 O ATOM 2213 CB GLN B 12 28.717 -18.746 -9.369 1.00 0.39 C ATOM 2214 CG GLN B 12 29.209 -17.298 -9.477 1.00 1.18 C ATOM 2215 CD GLN B 12 30.000 -17.124 -10.776 1.00 1.63 C ATOM 2216 OE1 GLN B 12 29.804 -17.861 -11.722 1.00 1.99 O ATOM 2217 NE2 GLN B 12 30.897 -16.179 -10.861 1.00 2.40 N ATOM 0 H GLN B 12 27.746 -20.945 -8.748 1.00 0.32 H new ATOM 0 HA GLN B 12 28.654 -18.716 -7.220 1.00 0.34 H new ATOM 0 HB2 GLN B 12 29.562 -19.432 -9.432 1.00 0.39 H new ATOM 0 HB3 GLN B 12 28.055 -18.978 -10.204 1.00 0.39 H new ATOM 0 HG2 GLN B 12 28.362 -16.612 -9.460 1.00 1.18 H new ATOM 0 HG3 GLN B 12 29.836 -17.051 -8.621 1.00 1.18 H new ATOM 0 HE21 GLN B 12 31.062 -15.560 -10.067 1.00 2.40 H new ATOM 0 HE22 GLN B 12 31.432 -16.060 -11.721 1.00 2.40 H new ATOM 2226 N GLN B 13 25.688 -18.396 -8.614 1.00 0.30 N ATOM 2227 CA GLN B 13 24.464 -17.545 -8.605 1.00 0.28 C ATOM 2228 C GLN B 13 23.982 -17.362 -7.163 1.00 0.25 C ATOM 2229 O GLN B 13 23.591 -16.282 -6.765 1.00 0.25 O ATOM 2230 CB GLN B 13 23.376 -18.241 -9.434 1.00 0.28 C ATOM 2231 CG GLN B 13 22.128 -17.358 -9.543 1.00 0.30 C ATOM 2232 CD GLN B 13 22.425 -16.145 -10.426 1.00 0.38 C ATOM 2233 OE1 GLN B 13 23.462 -16.077 -11.056 1.00 0.84 O ATOM 2234 NE2 GLN B 13 21.544 -15.187 -10.514 1.00 0.64 N ATOM 0 H GLN B 13 25.606 -19.262 -9.147 1.00 0.30 H new ATOM 0 HA GLN B 13 24.683 -16.567 -9.033 1.00 0.28 H new ATOM 0 HB2 GLN B 13 23.758 -18.464 -10.430 1.00 0.28 H new ATOM 0 HB3 GLN B 13 23.114 -19.193 -8.973 1.00 0.28 H new ATOM 0 HG2 GLN B 13 21.302 -17.931 -9.963 1.00 0.30 H new ATOM 0 HG3 GLN B 13 21.816 -17.030 -8.551 1.00 0.30 H new ATOM 0 HE21 GLN B 13 20.674 -15.244 -9.985 1.00 0.64 H new ATOM 0 HE22 GLN B 13 21.725 -14.381 -11.112 1.00 0.64 H new ATOM 2243 N GLN B 14 24.009 -18.406 -6.375 1.00 0.22 N ATOM 2244 CA GLN B 14 23.556 -18.277 -4.960 1.00 0.20 C ATOM 2245 C GLN B 14 24.438 -17.251 -4.251 1.00 0.22 C ATOM 2246 O GLN B 14 23.967 -16.422 -3.499 1.00 0.21 O ATOM 2247 CB GLN B 14 23.681 -19.627 -4.251 1.00 0.20 C ATOM 2248 CG GLN B 14 22.644 -20.599 -4.814 1.00 0.18 C ATOM 2249 CD GLN B 14 22.775 -21.944 -4.102 1.00 0.20 C ATOM 2250 OE1 GLN B 14 23.787 -22.607 -4.211 1.00 0.29 O ATOM 2251 NE2 GLN B 14 21.787 -22.373 -3.368 1.00 0.24 N ATOM 0 H GLN B 14 24.323 -19.337 -6.649 1.00 0.22 H new ATOM 0 HA GLN B 14 22.515 -17.956 -4.937 1.00 0.20 H new ATOM 0 HB2 GLN B 14 24.684 -20.030 -4.388 1.00 0.20 H new ATOM 0 HB3 GLN B 14 23.532 -19.501 -3.179 1.00 0.20 H new ATOM 0 HG2 GLN B 14 21.640 -20.198 -4.676 1.00 0.18 H new ATOM 0 HG3 GLN B 14 22.792 -20.726 -5.886 1.00 0.18 H new ATOM 0 HE21 GLN B 14 20.938 -21.814 -3.278 1.00 0.24 H new ATOM 0 HE22 GLN B 14 21.863 -23.267 -2.883 1.00 0.24 H new ATOM 2260 N GLN B 15 25.721 -17.294 -4.499 1.00 0.26 N ATOM 2261 CA GLN B 15 26.636 -16.314 -3.855 1.00 0.29 C ATOM 2262 C GLN B 15 26.226 -14.901 -4.261 1.00 0.28 C ATOM 2263 O GLN B 15 26.152 -14.007 -3.442 1.00 0.29 O ATOM 2264 CB GLN B 15 28.070 -16.583 -4.311 1.00 0.34 C ATOM 2265 CG GLN B 15 29.013 -15.572 -3.654 1.00 0.38 C ATOM 2266 CD GLN B 15 30.463 -15.957 -3.958 1.00 0.44 C ATOM 2267 OE1 GLN B 15 30.729 -17.048 -4.422 1.00 0.82 O ATOM 2268 NE2 GLN B 15 31.417 -15.099 -3.724 1.00 0.81 N ATOM 0 H GLN B 15 26.172 -17.966 -5.120 1.00 0.26 H new ATOM 0 HA GLN B 15 26.577 -16.413 -2.771 1.00 0.29 H new ATOM 0 HB2 GLN B 15 28.364 -17.598 -4.043 1.00 0.34 H new ATOM 0 HB3 GLN B 15 28.138 -16.508 -5.396 1.00 0.34 H new ATOM 0 HG2 GLN B 15 28.806 -14.569 -4.027 1.00 0.38 H new ATOM 0 HG3 GLN B 15 28.849 -15.552 -2.577 1.00 0.38 H new ATOM 0 HE21 GLN B 15 31.195 -14.183 -3.335 1.00 0.81 H new ATOM 0 HE22 GLN B 15 32.385 -15.344 -3.931 1.00 0.81 H new ATOM 2277 N GLN B 16 25.952 -14.691 -5.520 1.00 0.28 N ATOM 2278 CA GLN B 16 25.541 -13.334 -5.963 1.00 0.29 C ATOM 2279 C GLN B 16 24.243 -12.946 -5.261 1.00 0.25 C ATOM 2280 O GLN B 16 24.083 -11.830 -4.808 1.00 0.26 O ATOM 2281 CB GLN B 16 25.343 -13.327 -7.479 1.00 0.31 C ATOM 2282 CG GLN B 16 26.707 -13.464 -8.160 1.00 0.36 C ATOM 2283 CD GLN B 16 26.537 -13.430 -9.680 1.00 0.39 C ATOM 2284 OE1 GLN B 16 27.380 -13.914 -10.408 1.00 0.93 O ATOM 2285 NE2 GLN B 16 25.477 -12.870 -10.194 1.00 0.87 N ATOM 0 H GLN B 16 25.995 -15.397 -6.255 1.00 0.28 H new ATOM 0 HA GLN B 16 26.316 -12.612 -5.706 1.00 0.29 H new ATOM 0 HB2 GLN B 16 24.689 -14.147 -7.777 1.00 0.31 H new ATOM 0 HB3 GLN B 16 24.857 -12.402 -7.791 1.00 0.31 H new ATOM 0 HG2 GLN B 16 27.365 -12.656 -7.841 1.00 0.36 H new ATOM 0 HG3 GLN B 16 27.181 -14.398 -7.859 1.00 0.36 H new ATOM 0 HE21 GLN B 16 24.768 -12.463 -9.584 1.00 0.87 H new ATOM 0 HE22 GLN B 16 25.357 -12.839 -11.206 1.00 0.87 H new ATOM 2294 N LEU B 17 23.322 -13.863 -5.143 1.00 0.22 N ATOM 2295 CA LEU B 17 22.050 -13.537 -4.443 1.00 0.19 C ATOM 2296 C LEU B 17 22.363 -13.226 -2.982 1.00 0.18 C ATOM 2297 O LEU B 17 21.837 -12.293 -2.408 1.00 0.18 O ATOM 2298 CB LEU B 17 21.092 -14.732 -4.521 1.00 0.16 C ATOM 2299 CG LEU B 17 20.585 -14.912 -5.960 1.00 0.18 C ATOM 2300 CD1 LEU B 17 19.831 -16.243 -6.064 1.00 0.18 C ATOM 2301 CD2 LEU B 17 19.649 -13.746 -6.350 1.00 0.20 C ATOM 0 H LEU B 17 23.395 -14.816 -5.498 1.00 0.22 H new ATOM 0 HA LEU B 17 21.578 -12.676 -4.916 1.00 0.19 H new ATOM 0 HB2 LEU B 17 21.601 -15.638 -4.191 1.00 0.16 H new ATOM 0 HB3 LEU B 17 20.249 -14.576 -3.847 1.00 0.16 H new ATOM 0 HG LEU B 17 21.435 -14.916 -6.643 1.00 0.18 H new ATOM 0 HD11 LEU B 17 19.468 -16.377 -7.083 1.00 0.18 H new ATOM 0 HD12 LEU B 17 20.502 -17.062 -5.807 1.00 0.18 H new ATOM 0 HD13 LEU B 17 18.986 -16.237 -5.376 1.00 0.18 H new ATOM 0 HD21 LEU B 17 19.298 -13.888 -7.372 1.00 0.20 H new ATOM 0 HD22 LEU B 17 18.795 -13.723 -5.673 1.00 0.20 H new ATOM 0 HD23 LEU B 17 20.193 -12.804 -6.280 1.00 0.20 H new ATOM 2313 N LEU B 18 23.226 -13.997 -2.380 1.00 0.19 N ATOM 2314 CA LEU B 18 23.583 -13.742 -0.960 1.00 0.20 C ATOM 2315 C LEU B 18 24.186 -12.337 -0.855 1.00 0.22 C ATOM 2316 O LEU B 18 23.888 -11.588 0.055 1.00 0.22 O ATOM 2317 CB LEU B 18 24.602 -14.794 -0.498 1.00 0.22 C ATOM 2318 CG LEU B 18 24.992 -14.559 0.970 1.00 0.25 C ATOM 2319 CD1 LEU B 18 23.752 -14.681 1.875 1.00 0.26 C ATOM 2320 CD2 LEU B 18 26.033 -15.609 1.377 1.00 0.29 C ATOM 0 H LEU B 18 23.698 -14.792 -2.811 1.00 0.19 H new ATOM 0 HA LEU B 18 22.699 -13.807 -0.326 1.00 0.20 H new ATOM 0 HB2 LEU B 18 24.180 -15.792 -0.613 1.00 0.22 H new ATOM 0 HB3 LEU B 18 25.490 -14.749 -1.128 1.00 0.22 H new ATOM 0 HG LEU B 18 25.407 -13.557 1.081 1.00 0.25 H new ATOM 0 HD11 LEU B 18 24.041 -14.513 2.912 1.00 0.26 H new ATOM 0 HD12 LEU B 18 23.011 -13.938 1.579 1.00 0.26 H new ATOM 0 HD13 LEU B 18 23.325 -15.679 1.775 1.00 0.26 H new ATOM 0 HD21 LEU B 18 26.319 -15.454 2.417 1.00 0.29 H new ATOM 0 HD22 LEU B 18 25.608 -16.606 1.262 1.00 0.29 H new ATOM 0 HD23 LEU B 18 26.913 -15.514 0.741 1.00 0.29 H new ATOM 2332 N ASP B 19 25.032 -11.975 -1.786 1.00 0.25 N ATOM 2333 CA ASP B 19 25.652 -10.619 -1.749 1.00 0.28 C ATOM 2334 C ASP B 19 24.553 -9.553 -1.816 1.00 0.26 C ATOM 2335 O ASP B 19 24.518 -8.638 -1.018 1.00 0.27 O ATOM 2336 CB ASP B 19 26.600 -10.456 -2.941 1.00 0.32 C ATOM 2337 CG ASP B 19 27.273 -9.083 -2.881 1.00 0.35 C ATOM 2338 OD1 ASP B 19 26.792 -8.239 -2.142 1.00 1.12 O ATOM 2339 OD2 ASP B 19 28.259 -8.898 -3.576 1.00 1.13 O ATOM 0 H ASP B 19 25.319 -12.561 -2.570 1.00 0.25 H new ATOM 0 HA ASP B 19 26.214 -10.502 -0.823 1.00 0.28 H new ATOM 0 HB2 ASP B 19 27.355 -11.242 -2.928 1.00 0.32 H new ATOM 0 HB3 ASP B 19 26.047 -10.560 -3.875 1.00 0.32 H new ATOM 2344 N VAL B 20 23.651 -9.662 -2.760 1.00 0.25 N ATOM 2345 CA VAL B 20 22.560 -8.649 -2.860 1.00 0.24 C ATOM 2346 C VAL B 20 21.760 -8.659 -1.562 1.00 0.21 C ATOM 2347 O VAL B 20 21.443 -7.627 -1.006 1.00 0.23 O ATOM 2348 CB VAL B 20 21.624 -8.991 -4.026 1.00 0.24 C ATOM 2349 CG1 VAL B 20 20.387 -8.084 -3.977 1.00 0.24 C ATOM 2350 CG2 VAL B 20 22.358 -8.779 -5.350 1.00 0.30 C ATOM 0 H VAL B 20 23.624 -10.403 -3.460 1.00 0.25 H new ATOM 0 HA VAL B 20 22.997 -7.665 -3.031 1.00 0.24 H new ATOM 0 HB VAL B 20 21.313 -10.033 -3.945 1.00 0.24 H new ATOM 0 HG11 VAL B 20 19.723 -8.329 -4.806 1.00 0.24 H new ATOM 0 HG12 VAL B 20 19.861 -8.236 -3.034 1.00 0.24 H new ATOM 0 HG13 VAL B 20 20.697 -7.042 -4.055 1.00 0.24 H new ATOM 0 HG21 VAL B 20 21.692 -9.022 -6.178 1.00 0.30 H new ATOM 0 HG22 VAL B 20 22.671 -7.738 -5.430 1.00 0.30 H new ATOM 0 HG23 VAL B 20 23.235 -9.425 -5.387 1.00 0.30 H new ATOM 2360 N VAL B 21 21.429 -9.821 -1.077 1.00 0.18 N ATOM 2361 CA VAL B 21 20.649 -9.896 0.180 1.00 0.18 C ATOM 2362 C VAL B 21 21.462 -9.229 1.289 1.00 0.22 C ATOM 2363 O VAL B 21 20.937 -8.497 2.104 1.00 0.21 O ATOM 2364 CB VAL B 21 20.388 -11.367 0.518 1.00 0.18 C ATOM 2365 CG1 VAL B 21 19.763 -11.486 1.906 1.00 0.21 C ATOM 2366 CG2 VAL B 21 19.431 -11.963 -0.517 1.00 0.15 C ATOM 0 H VAL B 21 21.666 -10.719 -1.498 1.00 0.18 H new ATOM 0 HA VAL B 21 19.692 -9.386 0.075 1.00 0.18 H new ATOM 0 HB VAL B 21 21.335 -11.907 0.505 1.00 0.18 H new ATOM 0 HG11 VAL B 21 19.582 -12.536 2.135 1.00 0.21 H new ATOM 0 HG12 VAL B 21 20.441 -11.065 2.648 1.00 0.21 H new ATOM 0 HG13 VAL B 21 18.819 -10.942 1.928 1.00 0.21 H new ATOM 0 HG21 VAL B 21 19.244 -13.010 -0.279 1.00 0.15 H new ATOM 0 HG22 VAL B 21 18.490 -11.413 -0.501 1.00 0.15 H new ATOM 0 HG23 VAL B 21 19.877 -11.891 -1.509 1.00 0.15 H new ATOM 2376 N LYS B 22 22.748 -9.462 1.315 1.00 0.27 N ATOM 2377 CA LYS B 22 23.595 -8.823 2.357 1.00 0.32 C ATOM 2378 C LYS B 22 23.515 -7.306 2.174 1.00 0.32 C ATOM 2379 O LYS B 22 23.421 -6.555 3.125 1.00 0.33 O ATOM 2380 CB LYS B 22 25.047 -9.299 2.189 1.00 0.38 C ATOM 2381 CG LYS B 22 25.966 -8.670 3.252 1.00 0.45 C ATOM 2382 CD LYS B 22 25.641 -9.234 4.642 1.00 0.75 C ATOM 2383 CE LYS B 22 26.787 -8.915 5.606 1.00 1.12 C ATOM 2384 NZ LYS B 22 26.379 -9.267 6.995 1.00 1.91 N ATOM 0 H LYS B 22 23.245 -10.066 0.660 1.00 0.27 H new ATOM 0 HA LYS B 22 23.249 -9.094 3.354 1.00 0.32 H new ATOM 0 HB2 LYS B 22 25.087 -10.385 2.267 1.00 0.38 H new ATOM 0 HB3 LYS B 22 25.405 -9.037 1.194 1.00 0.38 H new ATOM 0 HG2 LYS B 22 27.009 -8.871 3.006 1.00 0.45 H new ATOM 0 HG3 LYS B 22 25.842 -7.587 3.254 1.00 0.45 H new ATOM 0 HD2 LYS B 22 24.711 -8.803 5.012 1.00 0.75 H new ATOM 0 HD3 LYS B 22 25.492 -10.312 4.582 1.00 0.75 H new ATOM 0 HE2 LYS B 22 27.679 -9.474 5.325 1.00 1.12 H new ATOM 0 HE3 LYS B 22 27.042 -7.857 5.547 1.00 1.12 H new ATOM 0 HZ1 LYS B 22 27.157 -9.051 7.651 1.00 1.91 H new ATOM 0 HZ2 LYS B 22 25.539 -8.715 7.260 1.00 1.91 H new ATOM 0 HZ3 LYS B 22 26.156 -10.282 7.045 1.00 1.91 H new ATOM 2398 N ARG B 23 23.543 -6.856 0.946 1.00 0.32 N ATOM 2399 CA ARG B 23 23.462 -5.393 0.684 1.00 0.34 C ATOM 2400 C ARG B 23 22.102 -4.881 1.156 1.00 0.28 C ATOM 2401 O ARG B 23 21.995 -3.823 1.744 1.00 0.29 O ATOM 2402 CB ARG B 23 23.605 -5.146 -0.823 1.00 0.38 C ATOM 2403 CG ARG B 23 25.022 -5.504 -1.298 1.00 0.59 C ATOM 2404 CD ARG B 23 26.004 -4.372 -0.976 1.00 0.93 C ATOM 2405 NE ARG B 23 27.317 -4.680 -1.611 1.00 0.81 N ATOM 2406 CZ ARG B 23 28.242 -3.762 -1.682 1.00 1.05 C ATOM 2407 NH1 ARG B 23 28.012 -2.564 -1.212 1.00 1.67 N ATOM 2408 NH2 ARG B 23 29.392 -4.046 -2.229 1.00 1.08 N ATOM 0 H ARG B 23 23.619 -7.441 0.114 1.00 0.32 H new ATOM 0 HA ARG B 23 24.257 -4.872 1.217 1.00 0.34 H new ATOM 0 HB2 ARG B 23 22.872 -5.743 -1.366 1.00 0.38 H new ATOM 0 HB3 ARG B 23 23.394 -4.100 -1.047 1.00 0.38 H new ATOM 0 HG2 ARG B 23 25.350 -6.425 -0.816 1.00 0.59 H new ATOM 0 HG3 ARG B 23 25.014 -5.691 -2.372 1.00 0.59 H new ATOM 0 HD2 ARG B 23 25.619 -3.422 -1.346 1.00 0.93 H new ATOM 0 HD3 ARG B 23 26.121 -4.270 0.103 1.00 0.93 H new ATOM 0 HE ARG B 23 27.493 -5.610 -1.991 1.00 0.81 H new ATOM 0 HH11 ARG B 23 27.109 -2.346 -0.790 1.00 1.67 H new ATOM 0 HH12 ARG B 23 28.735 -1.847 -1.268 1.00 1.67 H new ATOM 0 HH21 ARG B 23 29.564 -4.981 -2.598 1.00 1.08 H new ATOM 0 HH22 ARG B 23 30.119 -3.333 -2.287 1.00 1.08 H new ATOM 2422 N GLN B 24 21.062 -5.631 0.923 1.00 0.24 N ATOM 2423 CA GLN B 24 19.723 -5.188 1.383 1.00 0.19 C ATOM 2424 C GLN B 24 19.747 -5.044 2.903 1.00 0.19 C ATOM 2425 O GLN B 24 19.208 -4.109 3.457 1.00 0.19 O ATOM 2426 CB GLN B 24 18.672 -6.218 0.965 1.00 0.16 C ATOM 2427 CG GLN B 24 18.495 -6.169 -0.555 1.00 0.17 C ATOM 2428 CD GLN B 24 17.528 -7.272 -0.996 1.00 0.16 C ATOM 2429 OE1 GLN B 24 17.514 -8.344 -0.426 1.00 0.19 O ATOM 2430 NE2 GLN B 24 16.714 -7.054 -1.996 1.00 0.18 N ATOM 0 H GLN B 24 21.083 -6.527 0.436 1.00 0.24 H new ATOM 0 HA GLN B 24 19.470 -4.228 0.932 1.00 0.19 H new ATOM 0 HB2 GLN B 24 18.981 -7.216 1.275 1.00 0.16 H new ATOM 0 HB3 GLN B 24 17.724 -6.009 1.460 1.00 0.16 H new ATOM 0 HG2 GLN B 24 18.111 -5.194 -0.855 1.00 0.17 H new ATOM 0 HG3 GLN B 24 19.459 -6.298 -1.048 1.00 0.17 H new ATOM 0 HE21 GLN B 24 16.725 -6.154 -2.476 1.00 0.18 H new ATOM 0 HE22 GLN B 24 16.068 -7.784 -2.296 1.00 0.18 H new ATOM 2439 N GLN B 25 20.385 -5.959 3.586 1.00 0.21 N ATOM 2440 CA GLN B 25 20.451 -5.853 5.068 1.00 0.23 C ATOM 2441 C GLN B 25 21.141 -4.543 5.448 1.00 0.25 C ATOM 2442 O GLN B 25 20.633 -3.768 6.232 1.00 0.25 O ATOM 2443 CB GLN B 25 21.230 -7.051 5.625 1.00 0.28 C ATOM 2444 CG GLN B 25 21.408 -6.920 7.145 1.00 0.32 C ATOM 2445 CD GLN B 25 20.044 -6.794 7.827 1.00 0.34 C ATOM 2446 OE1 GLN B 25 19.545 -7.824 8.454 1.00 1.06 O flip ATOM 2447 NE2 GLN B 25 19.429 -5.747 7.795 1.00 1.13 N flip ATOM 0 H GLN B 25 20.859 -6.768 3.183 1.00 0.21 H new ATOM 0 HA GLN B 25 19.446 -5.858 5.490 1.00 0.23 H new ATOM 0 HB2 GLN B 25 20.701 -7.975 5.394 1.00 0.28 H new ATOM 0 HB3 GLN B 25 22.206 -7.113 5.143 1.00 0.28 H new ATOM 0 HG2 GLN B 25 21.938 -7.790 7.533 1.00 0.32 H new ATOM 0 HG3 GLN B 25 22.019 -6.047 7.373 1.00 0.32 H new ATOM 0 HE21 GLN B 25 19.818 -4.942 7.305 1.00 1.13 H new ATOM 0 HE22 GLN B 25 18.523 -5.673 8.258 1.00 1.13 H new ATOM 2456 N GLU B 26 22.284 -4.269 4.876 1.00 0.27 N ATOM 2457 CA GLU B 26 22.970 -2.989 5.198 1.00 0.29 C ATOM 2458 C GLU B 26 22.065 -1.825 4.806 1.00 0.26 C ATOM 2459 O GLU B 26 21.845 -0.912 5.573 1.00 0.26 O ATOM 2460 CB GLU B 26 24.295 -2.897 4.437 1.00 0.33 C ATOM 2461 CG GLU B 26 25.287 -3.907 5.016 1.00 0.53 C ATOM 2462 CD GLU B 26 26.571 -3.902 4.181 1.00 1.19 C ATOM 2463 OE1 GLU B 26 26.661 -3.092 3.273 1.00 1.94 O ATOM 2464 OE2 GLU B 26 27.443 -4.705 4.468 1.00 1.85 O ATOM 0 H GLU B 26 22.766 -4.870 4.208 1.00 0.27 H new ATOM 0 HA GLU B 26 23.178 -2.948 6.267 1.00 0.29 H new ATOM 0 HB2 GLU B 26 24.133 -3.097 3.378 1.00 0.33 H new ATOM 0 HB3 GLU B 26 24.701 -1.888 4.513 1.00 0.33 H new ATOM 0 HG2 GLU B 26 25.514 -3.656 6.052 1.00 0.53 H new ATOM 0 HG3 GLU B 26 24.847 -4.904 5.019 1.00 0.53 H new ATOM 2471 N LEU B 27 21.529 -1.860 3.618 1.00 0.24 N ATOM 2472 CA LEU B 27 20.627 -0.766 3.167 1.00 0.22 C ATOM 2473 C LEU B 27 19.415 -0.692 4.097 1.00 0.19 C ATOM 2474 O LEU B 27 18.955 0.374 4.457 1.00 0.19 O ATOM 2475 CB LEU B 27 20.183 -1.047 1.726 1.00 0.21 C ATOM 2476 CG LEU B 27 19.093 -0.060 1.287 1.00 0.21 C ATOM 2477 CD1 LEU B 27 19.553 1.379 1.532 1.00 0.25 C ATOM 2478 CD2 LEU B 27 18.823 -0.250 -0.211 1.00 0.23 C ATOM 0 H LEU B 27 21.678 -2.604 2.937 1.00 0.24 H new ATOM 0 HA LEU B 27 21.150 0.190 3.198 1.00 0.22 H new ATOM 0 HB2 LEU B 27 21.039 -0.971 1.056 1.00 0.21 H new ATOM 0 HB3 LEU B 27 19.808 -2.067 1.649 1.00 0.21 H new ATOM 0 HG LEU B 27 18.187 -0.248 1.863 1.00 0.21 H new ATOM 0 HD11 LEU B 27 18.771 2.070 1.216 1.00 0.25 H new ATOM 0 HD12 LEU B 27 19.755 1.521 2.594 1.00 0.25 H new ATOM 0 HD13 LEU B 27 20.461 1.573 0.961 1.00 0.25 H new ATOM 0 HD21 LEU B 27 18.049 0.447 -0.533 1.00 0.23 H new ATOM 0 HD22 LEU B 27 19.738 -0.061 -0.772 1.00 0.23 H new ATOM 0 HD23 LEU B 27 18.489 -1.271 -0.394 1.00 0.23 H new ATOM 2490 N LEU B 28 18.897 -1.818 4.500 1.00 0.18 N ATOM 2491 CA LEU B 28 17.719 -1.805 5.408 1.00 0.18 C ATOM 2492 C LEU B 28 18.093 -1.076 6.698 1.00 0.20 C ATOM 2493 O LEU B 28 17.317 -0.311 7.236 1.00 0.21 O ATOM 2494 CB LEU B 28 17.305 -3.254 5.731 1.00 0.19 C ATOM 2495 CG LEU B 28 16.500 -3.853 4.559 1.00 0.19 C ATOM 2496 CD1 LEU B 28 16.525 -5.388 4.638 1.00 0.21 C ATOM 2497 CD2 LEU B 28 15.038 -3.379 4.623 1.00 0.22 C ATOM 0 H LEU B 28 19.238 -2.744 4.240 1.00 0.18 H new ATOM 0 HA LEU B 28 16.886 -1.293 4.927 1.00 0.18 H new ATOM 0 HB2 LEU B 28 18.191 -3.860 5.920 1.00 0.19 H new ATOM 0 HB3 LEU B 28 16.706 -3.274 6.641 1.00 0.19 H new ATOM 0 HG LEU B 28 16.952 -3.522 3.624 1.00 0.19 H new ATOM 0 HD11 LEU B 28 15.955 -5.804 3.808 1.00 0.21 H new ATOM 0 HD12 LEU B 28 17.556 -5.738 4.582 1.00 0.21 H new ATOM 0 HD13 LEU B 28 16.082 -5.711 5.580 1.00 0.21 H new ATOM 0 HD21 LEU B 28 14.480 -3.808 3.791 1.00 0.22 H new ATOM 0 HD22 LEU B 28 14.592 -3.701 5.564 1.00 0.22 H new ATOM 0 HD23 LEU B 28 15.005 -2.291 4.560 1.00 0.22 H new ATOM 2509 N ARG B 29 19.276 -1.294 7.196 1.00 0.22 N ATOM 2510 CA ARG B 29 19.684 -0.601 8.443 1.00 0.24 C ATOM 2511 C ARG B 29 19.673 0.913 8.208 1.00 0.24 C ATOM 2512 O ARG B 29 19.265 1.677 9.060 1.00 0.25 O ATOM 2513 CB ARG B 29 21.090 -1.047 8.842 1.00 0.28 C ATOM 2514 CG ARG B 29 21.042 -2.500 9.313 1.00 0.29 C ATOM 2515 CD ARG B 29 22.442 -2.951 9.726 1.00 0.33 C ATOM 2516 NE ARG B 29 22.414 -4.406 10.045 1.00 0.38 N ATOM 2517 CZ ARG B 29 23.529 -5.074 10.139 1.00 0.88 C ATOM 2518 NH1 ARG B 29 24.667 -4.469 9.936 1.00 1.82 N ATOM 2519 NH2 ARG B 29 23.506 -6.348 10.426 1.00 0.86 N ATOM 0 H ARG B 29 19.974 -1.920 6.794 1.00 0.22 H new ATOM 0 HA ARG B 29 18.987 -0.851 9.243 1.00 0.24 H new ATOM 0 HB2 ARG B 29 21.769 -0.949 7.995 1.00 0.28 H new ATOM 0 HB3 ARG B 29 21.476 -0.407 9.636 1.00 0.28 H new ATOM 0 HG2 ARG B 29 20.355 -2.598 10.153 1.00 0.29 H new ATOM 0 HG3 ARG B 29 20.663 -3.139 8.515 1.00 0.29 H new ATOM 0 HD2 ARG B 29 23.152 -2.756 8.922 1.00 0.33 H new ATOM 0 HD3 ARG B 29 22.779 -2.383 10.593 1.00 0.33 H new ATOM 0 HE ARG B 29 21.522 -4.879 10.190 1.00 0.38 H new ATOM 0 HH11 ARG B 29 24.682 -3.476 9.704 1.00 1.82 H new ATOM 0 HH12 ARG B 29 25.541 -4.989 10.009 1.00 1.82 H new ATOM 0 HH21 ARG B 29 22.615 -6.821 10.577 1.00 0.86 H new ATOM 0 HH22 ARG B 29 24.379 -6.870 10.499 1.00 0.86 H new ATOM 2533 N LEU B 30 20.119 1.358 7.059 1.00 0.23 N ATOM 2534 CA LEU B 30 20.131 2.826 6.788 1.00 0.23 C ATOM 2535 C LEU B 30 18.697 3.352 6.771 1.00 0.21 C ATOM 2536 O LEU B 30 18.414 4.419 7.278 1.00 0.22 O ATOM 2537 CB LEU B 30 20.778 3.102 5.425 1.00 0.24 C ATOM 2538 CG LEU B 30 22.161 2.450 5.339 1.00 0.27 C ATOM 2539 CD1 LEU B 30 22.876 2.959 4.089 1.00 0.29 C ATOM 2540 CD2 LEU B 30 22.996 2.789 6.580 1.00 0.33 C ATOM 0 H LEU B 30 20.473 0.772 6.303 1.00 0.23 H new ATOM 0 HA LEU B 30 20.703 3.326 7.570 1.00 0.23 H new ATOM 0 HB2 LEU B 30 20.139 2.718 4.630 1.00 0.24 H new ATOM 0 HB3 LEU B 30 20.867 4.177 5.271 1.00 0.24 H new ATOM 0 HG LEU B 30 22.040 1.368 5.287 1.00 0.27 H new ATOM 0 HD11 LEU B 30 23.862 2.499 4.021 1.00 0.29 H new ATOM 0 HD12 LEU B 30 22.293 2.700 3.205 1.00 0.29 H new ATOM 0 HD13 LEU B 30 22.984 4.042 4.147 1.00 0.29 H new ATOM 0 HD21 LEU B 30 23.975 2.317 6.500 1.00 0.33 H new ATOM 0 HD22 LEU B 30 23.119 3.870 6.652 1.00 0.33 H new ATOM 0 HD23 LEU B 30 22.488 2.422 7.472 1.00 0.33 H new ATOM 2552 N THR B 31 17.785 2.616 6.198 1.00 0.19 N ATOM 2553 CA THR B 31 16.376 3.089 6.167 1.00 0.18 C ATOM 2554 C THR B 31 15.888 3.257 7.602 1.00 0.18 C ATOM 2555 O THR B 31 15.206 4.206 7.932 1.00 0.18 O ATOM 2556 CB THR B 31 15.504 2.072 5.430 1.00 0.17 C ATOM 2557 OG1 THR B 31 15.558 0.825 6.108 1.00 0.18 O ATOM 2558 CG2 THR B 31 16.018 1.906 3.999 1.00 0.19 C ATOM 0 H THR B 31 17.954 1.714 5.753 1.00 0.19 H new ATOM 0 HA THR B 31 16.313 4.043 5.643 1.00 0.18 H new ATOM 0 HB THR B 31 14.472 2.423 5.404 1.00 0.17 H new ATOM 0 HG1 THR B 31 16.459 0.687 6.468 1.00 0.18 H new ATOM 0 HG21 THR B 31 15.398 1.181 3.471 1.00 0.19 H new ATOM 0 HG22 THR B 31 15.974 2.865 3.483 1.00 0.19 H new ATOM 0 HG23 THR B 31 17.049 1.553 4.021 1.00 0.19 H new ATOM 2566 N VAL B 32 16.255 2.352 8.464 1.00 0.18 N ATOM 2567 CA VAL B 32 15.836 2.466 9.884 1.00 0.20 C ATOM 2568 C VAL B 32 16.525 3.688 10.493 1.00 0.20 C ATOM 2569 O VAL B 32 15.940 4.425 11.263 1.00 0.21 O ATOM 2570 CB VAL B 32 16.250 1.201 10.643 1.00 0.22 C ATOM 2571 CG1 VAL B 32 15.992 1.391 12.141 1.00 0.23 C ATOM 2572 CG2 VAL B 32 15.435 0.009 10.124 1.00 0.22 C ATOM 0 H VAL B 32 16.828 1.537 8.244 1.00 0.18 H new ATOM 0 HA VAL B 32 14.754 2.578 9.952 1.00 0.20 H new ATOM 0 HB VAL B 32 17.312 1.012 10.485 1.00 0.22 H new ATOM 0 HG11 VAL B 32 16.287 0.490 12.678 1.00 0.23 H new ATOM 0 HG12 VAL B 32 16.573 2.238 12.506 1.00 0.23 H new ATOM 0 HG13 VAL B 32 14.931 1.581 12.306 1.00 0.23 H new ATOM 0 HG21 VAL B 32 15.727 -0.893 10.662 1.00 0.22 H new ATOM 0 HG22 VAL B 32 14.373 0.198 10.282 1.00 0.22 H new ATOM 0 HG23 VAL B 32 15.625 -0.126 9.059 1.00 0.22 H new ATOM 2582 N TRP B 33 17.771 3.903 10.156 1.00 0.21 N ATOM 2583 CA TRP B 33 18.507 5.071 10.716 1.00 0.23 C ATOM 2584 C TRP B 33 17.792 6.368 10.320 1.00 0.22 C ATOM 2585 O TRP B 33 17.535 7.216 11.151 1.00 0.23 O ATOM 2586 CB TRP B 33 19.938 5.091 10.172 1.00 0.25 C ATOM 2587 CG TRP B 33 20.660 6.266 10.745 1.00 0.27 C ATOM 2588 CD1 TRP B 33 21.335 6.258 11.917 1.00 0.32 C ATOM 2589 CD2 TRP B 33 20.789 7.615 10.206 1.00 0.27 C ATOM 2590 NE1 TRP B 33 21.872 7.513 12.132 1.00 0.33 N ATOM 2591 CE2 TRP B 33 21.564 8.385 11.105 1.00 0.31 C ATOM 2592 CE3 TRP B 33 20.316 8.237 9.037 1.00 0.26 C ATOM 2593 CZ2 TRP B 33 21.858 9.726 10.854 1.00 0.32 C ATOM 2594 CZ3 TRP B 33 20.610 9.589 8.780 1.00 0.29 C ATOM 2595 CH2 TRP B 33 21.379 10.330 9.688 1.00 0.31 C ATOM 0 H TRP B 33 18.309 3.318 9.516 1.00 0.21 H new ATOM 0 HA TRP B 33 18.535 4.989 11.803 1.00 0.23 H new ATOM 0 HB2 TRP B 33 20.454 4.167 10.435 1.00 0.25 H new ATOM 0 HB3 TRP B 33 19.926 5.151 9.084 1.00 0.25 H new ATOM 0 HD1 TRP B 33 21.438 5.409 12.577 1.00 0.32 H new ATOM 0 HE1 TRP B 33 22.428 7.765 12.949 1.00 0.33 H new ATOM 0 HE3 TRP B 33 19.723 7.673 8.332 1.00 0.26 H new ATOM 0 HZ2 TRP B 33 22.451 10.293 11.556 1.00 0.32 H new ATOM 0 HZ3 TRP B 33 20.242 10.058 7.879 1.00 0.29 H new ATOM 0 HH2 TRP B 33 21.601 11.368 9.487 1.00 0.31 H new ATOM 2606 N GLY B 34 17.454 6.536 9.064 1.00 0.22 N ATOM 2607 CA GLY B 34 16.752 7.784 8.658 1.00 0.23 C ATOM 2608 C GLY B 34 15.437 7.884 9.430 1.00 0.22 C ATOM 2609 O GLY B 34 15.080 8.929 9.930 1.00 0.23 O ATOM 0 H GLY B 34 17.633 5.869 8.314 1.00 0.22 H new ATOM 0 HA2 GLY B 34 17.377 8.653 8.864 1.00 0.23 H new ATOM 0 HA3 GLY B 34 16.560 7.777 7.585 1.00 0.23 H new ATOM 2613 N THR B 35 14.712 6.805 9.538 1.00 0.22 N ATOM 2614 CA THR B 35 13.423 6.855 10.283 1.00 0.24 C ATOM 2615 C THR B 35 13.692 7.277 11.734 1.00 0.24 C ATOM 2616 O THR B 35 13.062 8.180 12.253 1.00 0.24 O ATOM 2617 CB THR B 35 12.773 5.464 10.253 1.00 0.27 C ATOM 2618 OG1 THR B 35 12.624 5.042 8.905 1.00 0.30 O ATOM 2619 CG2 THR B 35 11.393 5.513 10.913 1.00 0.30 C ATOM 0 H THR B 35 14.955 5.896 9.145 1.00 0.22 H new ATOM 0 HA THR B 35 12.751 7.578 9.820 1.00 0.24 H new ATOM 0 HB THR B 35 13.409 4.765 10.796 1.00 0.27 H new ATOM 0 HG1 THR B 35 13.483 4.710 8.569 1.00 0.30 H new ATOM 0 HG21 THR B 35 10.941 4.521 10.886 1.00 0.30 H new ATOM 0 HG22 THR B 35 11.496 5.837 11.949 1.00 0.30 H new ATOM 0 HG23 THR B 35 10.757 6.216 10.375 1.00 0.30 H new ATOM 2627 N LYS B 36 14.623 6.639 12.389 1.00 0.25 N ATOM 2628 CA LYS B 36 14.929 7.015 13.800 1.00 0.28 C ATOM 2629 C LYS B 36 15.415 8.464 13.845 1.00 0.28 C ATOM 2630 O LYS B 36 15.038 9.234 14.706 1.00 0.30 O ATOM 2631 CB LYS B 36 16.031 6.092 14.339 1.00 0.32 C ATOM 2632 CG LYS B 36 15.491 4.663 14.544 1.00 0.47 C ATOM 2633 CD LYS B 36 14.828 4.527 15.929 1.00 0.77 C ATOM 2634 CE LYS B 36 15.874 4.653 17.056 1.00 1.44 C ATOM 2635 NZ LYS B 36 15.886 6.055 17.558 1.00 2.01 N ATOM 0 H LYS B 36 15.184 5.876 12.010 1.00 0.25 H new ATOM 0 HA LYS B 36 14.032 6.913 14.411 1.00 0.28 H new ATOM 0 HB2 LYS B 36 16.870 6.073 13.643 1.00 0.32 H new ATOM 0 HB3 LYS B 36 16.410 6.482 15.284 1.00 0.32 H new ATOM 0 HG2 LYS B 36 14.768 4.426 13.764 1.00 0.47 H new ATOM 0 HG3 LYS B 36 16.305 3.944 14.452 1.00 0.47 H new ATOM 0 HD2 LYS B 36 14.065 5.296 16.048 1.00 0.77 H new ATOM 0 HD3 LYS B 36 14.324 3.564 16.002 1.00 0.77 H new ATOM 0 HE2 LYS B 36 15.636 3.965 17.868 1.00 1.44 H new ATOM 0 HE3 LYS B 36 16.861 4.379 16.685 1.00 1.44 H new ATOM 0 HZ1 LYS B 36 16.837 6.458 17.439 1.00 2.01 H new ATOM 0 HZ2 LYS B 36 15.200 6.622 17.020 1.00 2.01 H new ATOM 0 HZ3 LYS B 36 15.629 6.065 18.566 1.00 2.01 H new ATOM 2649 N ASN B 37 16.248 8.832 12.915 1.00 0.27 N ATOM 2650 CA ASN B 37 16.777 10.226 12.871 1.00 0.30 C ATOM 2651 C ASN B 37 15.629 11.224 12.696 1.00 0.29 C ATOM 2652 O ASN B 37 15.614 12.274 13.303 1.00 0.32 O ATOM 2653 CB ASN B 37 17.767 10.347 11.721 1.00 0.32 C ATOM 2654 CG ASN B 37 18.254 11.793 11.610 1.00 0.37 C ATOM 2655 OD1 ASN B 37 19.127 12.244 12.469 1.00 0.74 O flip ATOM 2656 ND2 ASN B 37 17.833 12.522 10.734 1.00 0.48 N flip ATOM 0 H ASN B 37 16.590 8.221 12.174 1.00 0.27 H new ATOM 0 HA ASN B 37 17.284 10.453 13.809 1.00 0.30 H new ATOM 0 HB2 ASN B 37 18.613 9.680 11.885 1.00 0.32 H new ATOM 0 HB3 ASN B 37 17.295 10.039 10.788 1.00 0.32 H new ATOM 0 HD21 ASN B 37 17.151 12.171 10.062 1.00 0.48 H new ATOM 0 HD22 ASN B 37 18.162 13.485 10.670 1.00 0.48 H new ATOM 2663 N LEU B 38 14.662 10.909 11.881 1.00 0.26 N ATOM 2664 CA LEU B 38 13.522 11.852 11.699 1.00 0.27 C ATOM 2665 C LEU B 38 12.846 12.059 13.052 1.00 0.26 C ATOM 2666 O LEU B 38 12.445 13.152 13.395 1.00 0.28 O ATOM 2667 CB LEU B 38 12.516 11.288 10.689 1.00 0.26 C ATOM 2668 CG LEU B 38 13.102 11.345 9.267 1.00 0.30 C ATOM 2669 CD1 LEU B 38 12.203 10.539 8.321 1.00 0.34 C ATOM 2670 CD2 LEU B 38 13.189 12.806 8.771 1.00 0.35 C ATOM 0 H LEU B 38 14.610 10.048 11.337 1.00 0.26 H new ATOM 0 HA LEU B 38 13.890 12.803 11.314 1.00 0.27 H new ATOM 0 HB2 LEU B 38 12.269 10.258 10.947 1.00 0.26 H new ATOM 0 HB3 LEU B 38 11.588 11.859 10.731 1.00 0.26 H new ATOM 0 HG LEU B 38 14.107 10.923 9.282 1.00 0.30 H new ATOM 0 HD11 LEU B 38 12.612 10.575 7.311 1.00 0.34 H new ATOM 0 HD12 LEU B 38 12.157 9.503 8.657 1.00 0.34 H new ATOM 0 HD13 LEU B 38 11.200 10.965 8.321 1.00 0.34 H new ATOM 0 HD21 LEU B 38 13.606 12.824 7.764 1.00 0.35 H new ATOM 0 HD22 LEU B 38 12.192 13.246 8.759 1.00 0.35 H new ATOM 0 HD23 LEU B 38 13.831 13.380 9.440 1.00 0.35 H new ATOM 2682 N GLN B 39 12.729 11.019 13.829 1.00 0.26 N ATOM 2683 CA GLN B 39 12.090 11.166 15.163 1.00 0.29 C ATOM 2684 C GLN B 39 12.905 12.174 15.971 1.00 0.33 C ATOM 2685 O GLN B 39 12.361 12.997 16.676 1.00 0.35 O ATOM 2686 CB GLN B 39 12.086 9.820 15.891 1.00 0.32 C ATOM 2687 CG GLN B 39 11.314 9.955 17.204 1.00 0.40 C ATOM 2688 CD GLN B 39 11.284 8.608 17.928 1.00 0.45 C ATOM 2689 OE1 GLN B 39 12.038 7.711 17.605 1.00 0.84 O ATOM 2690 NE2 GLN B 39 10.438 8.431 18.903 1.00 0.98 N ATOM 0 H GLN B 39 13.047 10.078 13.598 1.00 0.26 H new ATOM 0 HA GLN B 39 11.061 11.507 15.048 1.00 0.29 H new ATOM 0 HB2 GLN B 39 11.627 9.056 15.263 1.00 0.32 H new ATOM 0 HB3 GLN B 39 13.108 9.498 16.089 1.00 0.32 H new ATOM 0 HG2 GLN B 39 11.784 10.708 17.837 1.00 0.40 H new ATOM 0 HG3 GLN B 39 10.297 10.294 17.006 1.00 0.40 H new ATOM 0 HE21 GLN B 39 9.806 9.185 19.173 1.00 0.98 H new ATOM 0 HE22 GLN B 39 10.408 7.539 19.396 1.00 0.98 H new ATOM 2699 N THR B 40 14.207 12.130 15.875 1.00 0.36 N ATOM 2700 CA THR B 40 15.024 13.108 16.643 1.00 0.42 C ATOM 2701 C THR B 40 14.635 14.515 16.194 1.00 0.41 C ATOM 2702 O THR B 40 14.506 15.415 16.999 1.00 0.43 O ATOM 2703 CB THR B 40 16.517 12.881 16.386 1.00 0.47 C ATOM 2704 OG1 THR B 40 16.834 13.247 15.050 1.00 0.46 O ATOM 2705 CG2 THR B 40 16.854 11.407 16.615 1.00 0.49 C ATOM 0 H THR B 40 14.733 11.467 15.305 1.00 0.36 H new ATOM 0 HA THR B 40 14.838 12.982 17.710 1.00 0.42 H new ATOM 0 HB THR B 40 17.101 13.495 17.071 1.00 0.47 H new ATOM 0 HG1 THR B 40 16.658 12.490 14.453 1.00 0.46 H new ATOM 0 HG21 THR B 40 17.916 11.244 16.432 1.00 0.49 H new ATOM 0 HG22 THR B 40 16.617 11.135 17.643 1.00 0.49 H new ATOM 0 HG23 THR B 40 16.270 10.790 15.932 1.00 0.49 H new ATOM 2713 N ARG B 41 14.419 14.719 14.918 1.00 0.39 N ATOM 2714 CA ARG B 41 14.007 16.078 14.467 1.00 0.40 C ATOM 2715 C ARG B 41 12.696 16.432 15.159 1.00 0.36 C ATOM 2716 O ARG B 41 12.484 17.550 15.583 1.00 0.37 O ATOM 2717 CB ARG B 41 13.773 16.110 12.955 1.00 0.43 C ATOM 2718 CG ARG B 41 15.098 15.974 12.199 1.00 0.55 C ATOM 2719 CD ARG B 41 14.845 16.273 10.715 1.00 0.66 C ATOM 2720 NE ARG B 41 15.954 15.728 9.865 1.00 0.89 N ATOM 2721 CZ ARG B 41 17.199 16.056 10.069 1.00 1.05 C ATOM 2722 NH1 ARG B 41 17.506 16.975 10.938 1.00 1.23 N ATOM 2723 NH2 ARG B 41 18.140 15.501 9.358 1.00 1.32 N ATOM 0 H ARG B 41 14.509 14.017 14.184 1.00 0.39 H new ATOM 0 HA ARG B 41 14.798 16.786 14.715 1.00 0.40 H new ATOM 0 HB2 ARG B 41 13.101 15.301 12.669 1.00 0.43 H new ATOM 0 HB3 ARG B 41 13.284 17.044 12.677 1.00 0.43 H new ATOM 0 HG2 ARG B 41 15.838 16.665 12.604 1.00 0.55 H new ATOM 0 HG3 ARG B 41 15.501 14.969 12.319 1.00 0.55 H new ATOM 0 HD2 ARG B 41 13.896 15.834 10.408 1.00 0.66 H new ATOM 0 HD3 ARG B 41 14.762 17.349 10.565 1.00 0.66 H new ATOM 0 HE ARG B 41 15.728 15.084 9.107 1.00 0.89 H new ATOM 0 HH11 ARG B 41 16.770 17.444 11.465 1.00 1.23 H new ATOM 0 HH12 ARG B 41 18.483 17.226 11.092 1.00 1.23 H new ATOM 0 HH21 ARG B 41 17.901 14.812 8.645 1.00 1.32 H new ATOM 0 HH22 ARG B 41 19.115 15.755 9.515 1.00 1.32 H new ATOM 2737 N VAL B 42 11.808 15.481 15.272 1.00 0.33 N ATOM 2738 CA VAL B 42 10.508 15.759 15.933 1.00 0.35 C ATOM 2739 C VAL B 42 10.766 16.163 17.384 1.00 0.38 C ATOM 2740 O VAL B 42 10.197 17.110 17.879 1.00 0.40 O ATOM 2741 CB VAL B 42 9.622 14.508 15.882 1.00 0.37 C ATOM 2742 CG1 VAL B 42 8.373 14.720 16.741 1.00 0.43 C ATOM 2743 CG2 VAL B 42 9.207 14.239 14.434 1.00 0.38 C ATOM 0 H VAL B 42 11.930 14.526 14.935 1.00 0.33 H new ATOM 0 HA VAL B 42 9.995 16.570 15.416 1.00 0.35 H new ATOM 0 HB VAL B 42 10.180 13.655 16.268 1.00 0.37 H new ATOM 0 HG11 VAL B 42 7.748 13.828 16.701 1.00 0.43 H new ATOM 0 HG12 VAL B 42 8.669 14.909 17.773 1.00 0.43 H new ATOM 0 HG13 VAL B 42 7.811 15.574 16.362 1.00 0.43 H new ATOM 0 HG21 VAL B 42 8.577 13.350 14.395 1.00 0.38 H new ATOM 0 HG22 VAL B 42 8.651 15.095 14.050 1.00 0.38 H new ATOM 0 HG23 VAL B 42 10.096 14.080 13.824 1.00 0.38 H new ATOM 2753 N THR B 43 11.629 15.467 18.073 1.00 0.39 N ATOM 2754 CA THR B 43 11.898 15.845 19.490 1.00 0.45 C ATOM 2755 C THR B 43 12.432 17.276 19.533 1.00 0.44 C ATOM 2756 O THR B 43 12.060 18.063 20.384 1.00 0.47 O ATOM 2757 CB THR B 43 12.943 14.901 20.087 1.00 0.50 C ATOM 2758 OG1 THR B 43 14.145 14.997 19.336 1.00 0.50 O ATOM 2759 CG2 THR B 43 12.425 13.462 20.049 1.00 0.51 C ATOM 0 H THR B 43 12.153 14.665 17.723 1.00 0.39 H new ATOM 0 HA THR B 43 10.975 15.774 20.066 1.00 0.45 H new ATOM 0 HB THR B 43 13.136 15.182 21.122 1.00 0.50 H new ATOM 0 HG1 THR B 43 13.931 15.049 18.381 1.00 0.50 H new ATOM 0 HG21 THR B 43 13.174 12.794 20.476 1.00 0.51 H new ATOM 0 HG22 THR B 43 11.504 13.391 20.628 1.00 0.51 H new ATOM 0 HG23 THR B 43 12.228 13.173 19.017 1.00 0.51 H new ATOM 2767 N ALA B 44 13.287 17.631 18.613 1.00 0.42 N ATOM 2768 CA ALA B 44 13.822 19.018 18.601 1.00 0.43 C ATOM 2769 C ALA B 44 12.673 19.988 18.319 1.00 0.39 C ATOM 2770 O ALA B 44 12.537 21.013 18.956 1.00 0.39 O ATOM 2771 CB ALA B 44 14.886 19.147 17.511 1.00 0.45 C ATOM 0 H ALA B 44 13.636 17.022 17.873 1.00 0.42 H new ATOM 0 HA ALA B 44 14.272 19.251 19.566 1.00 0.43 H new ATOM 0 HB1 ALA B 44 15.277 20.164 17.503 1.00 0.45 H new ATOM 0 HB2 ALA B 44 15.698 18.447 17.710 1.00 0.45 H new ATOM 0 HB3 ALA B 44 14.443 18.921 16.541 1.00 0.45 H new ATOM 2777 N ILE B 45 11.832 19.649 17.380 1.00 0.35 N ATOM 2778 CA ILE B 45 10.675 20.524 17.049 1.00 0.32 C ATOM 2779 C ILE B 45 9.796 20.679 18.287 1.00 0.32 C ATOM 2780 O ILE B 45 9.270 21.741 18.555 1.00 0.31 O ATOM 2781 CB ILE B 45 9.868 19.912 15.896 1.00 0.31 C ATOM 2782 CG1 ILE B 45 10.689 20.004 14.607 1.00 0.32 C ATOM 2783 CG2 ILE B 45 8.554 20.683 15.717 1.00 0.30 C ATOM 2784 CD1 ILE B 45 10.031 19.164 13.511 1.00 0.33 C ATOM 0 H ILE B 45 11.899 18.796 16.825 1.00 0.35 H new ATOM 0 HA ILE B 45 11.034 21.505 16.736 1.00 0.32 H new ATOM 0 HB ILE B 45 9.645 18.869 16.121 1.00 0.31 H new ATOM 0 HG12 ILE B 45 10.763 21.043 14.286 1.00 0.32 H new ATOM 0 HG13 ILE B 45 11.705 19.652 14.786 1.00 0.32 H new ATOM 0 HG21 ILE B 45 7.984 20.245 14.897 1.00 0.30 H new ATOM 0 HG22 ILE B 45 7.971 20.626 16.636 1.00 0.30 H new ATOM 0 HG23 ILE B 45 8.772 21.727 15.490 1.00 0.30 H new ATOM 0 HD11 ILE B 45 10.620 19.234 12.596 1.00 0.33 H new ATOM 0 HD12 ILE B 45 9.980 18.123 13.831 1.00 0.33 H new ATOM 0 HD13 ILE B 45 9.024 19.536 13.323 1.00 0.33 H new ATOM 2796 N GLU B 46 9.611 19.625 19.033 1.00 0.34 N ATOM 2797 CA GLU B 46 8.743 19.715 20.239 1.00 0.36 C ATOM 2798 C GLU B 46 9.313 20.761 21.203 1.00 0.38 C ATOM 2799 O GLU B 46 8.584 21.542 21.778 1.00 0.38 O ATOM 2800 CB GLU B 46 8.709 18.347 20.931 1.00 0.43 C ATOM 2801 CG GLU B 46 7.932 17.350 20.066 1.00 1.20 C ATOM 2802 CD GLU B 46 6.430 17.621 20.168 1.00 1.67 C ATOM 2803 OE1 GLU B 46 5.809 17.073 21.063 1.00 2.26 O ATOM 2804 OE2 GLU B 46 5.927 18.368 19.346 1.00 2.17 O ATOM 0 H GLU B 46 10.022 18.708 18.860 1.00 0.34 H new ATOM 0 HA GLU B 46 7.734 20.007 19.947 1.00 0.36 H new ATOM 0 HB2 GLU B 46 9.724 17.986 21.095 1.00 0.43 H new ATOM 0 HB3 GLU B 46 8.240 18.436 21.911 1.00 0.43 H new ATOM 0 HG2 GLU B 46 8.254 17.430 19.028 1.00 1.20 H new ATOM 0 HG3 GLU B 46 8.148 16.332 20.389 1.00 1.20 H new ATOM 2811 N LYS B 47 10.605 20.812 21.377 1.00 0.41 N ATOM 2812 CA LYS B 47 11.165 21.844 22.297 1.00 0.43 C ATOM 2813 C LYS B 47 10.815 23.242 21.775 1.00 0.41 C ATOM 2814 O LYS B 47 10.473 24.130 22.535 1.00 0.42 O ATOM 2815 CB LYS B 47 12.686 21.689 22.402 1.00 0.48 C ATOM 2816 CG LYS B 47 13.014 20.411 23.182 1.00 1.21 C ATOM 2817 CD LYS B 47 14.531 20.291 23.403 1.00 1.54 C ATOM 2818 CE LYS B 47 15.215 19.748 22.143 1.00 2.31 C ATOM 2819 NZ LYS B 47 16.654 19.484 22.436 1.00 2.88 N ATOM 0 H LYS B 47 11.287 20.197 20.932 1.00 0.41 H new ATOM 0 HA LYS B 47 10.731 21.711 23.288 1.00 0.43 H new ATOM 0 HB2 LYS B 47 13.128 21.644 21.407 1.00 0.48 H new ATOM 0 HB3 LYS B 47 13.117 22.555 22.904 1.00 0.48 H new ATOM 0 HG2 LYS B 47 12.500 20.422 24.143 1.00 1.21 H new ATOM 0 HG3 LYS B 47 12.650 19.541 22.636 1.00 1.21 H new ATOM 0 HD2 LYS B 47 14.946 21.266 23.658 1.00 1.54 H new ATOM 0 HD3 LYS B 47 14.731 19.630 24.246 1.00 1.54 H new ATOM 0 HE2 LYS B 47 14.725 18.831 21.816 1.00 2.31 H new ATOM 0 HE3 LYS B 47 15.124 20.466 21.328 1.00 2.31 H new ATOM 0 HZ1 LYS B 47 17.120 19.115 21.582 1.00 2.88 H new ATOM 0 HZ2 LYS B 47 17.117 20.368 22.729 1.00 2.88 H new ATOM 0 HZ3 LYS B 47 16.730 18.784 23.201 1.00 2.88 H new ATOM 2833 N TYR B 48 10.883 23.447 20.484 1.00 0.38 N ATOM 2834 CA TYR B 48 10.538 24.791 19.925 1.00 0.36 C ATOM 2835 C TYR B 48 9.034 25.041 20.067 1.00 0.32 C ATOM 2836 O TYR B 48 8.606 26.130 20.384 1.00 0.33 O ATOM 2837 CB TYR B 48 10.949 24.874 18.451 1.00 0.37 C ATOM 2838 CG TYR B 48 12.454 24.957 18.354 1.00 0.40 C ATOM 2839 CD1 TYR B 48 13.104 26.151 18.682 1.00 0.45 C ATOM 2840 CD2 TYR B 48 13.198 23.847 17.941 1.00 0.41 C ATOM 2841 CE1 TYR B 48 14.498 26.236 18.599 1.00 0.51 C ATOM 2842 CE2 TYR B 48 14.595 23.929 17.857 1.00 0.46 C ATOM 2843 CZ TYR B 48 15.244 25.125 18.187 1.00 0.51 C ATOM 2844 OH TYR B 48 16.618 25.208 18.110 1.00 0.57 O ATOM 0 H TYR B 48 11.161 22.747 19.796 1.00 0.38 H new ATOM 0 HA TYR B 48 11.081 25.555 20.481 1.00 0.36 H new ATOM 0 HB2 TYR B 48 10.586 23.999 17.911 1.00 0.37 H new ATOM 0 HB3 TYR B 48 10.495 25.748 17.984 1.00 0.37 H new ATOM 0 HD1 TYR B 48 12.529 27.008 19.000 1.00 0.45 H new ATOM 0 HD2 TYR B 48 12.696 22.925 17.686 1.00 0.41 H new ATOM 0 HE1 TYR B 48 14.999 27.159 18.853 1.00 0.51 H new ATOM 0 HE2 TYR B 48 15.169 23.072 17.538 1.00 0.46 H new ATOM 0 HH TYR B 48 16.981 24.349 17.809 1.00 0.57 H new ATOM 2854 N LEU B 49 8.222 24.046 19.843 1.00 0.30 N ATOM 2855 CA LEU B 49 6.753 24.253 19.982 1.00 0.29 C ATOM 2856 C LEU B 49 6.453 24.687 21.426 1.00 0.32 C ATOM 2857 O LEU B 49 5.643 25.556 21.670 1.00 0.32 O ATOM 2858 CB LEU B 49 6.008 22.950 19.641 1.00 0.29 C ATOM 2859 CG LEU B 49 6.106 22.648 18.134 1.00 0.25 C ATOM 2860 CD1 LEU B 49 5.562 21.239 17.869 1.00 0.27 C ATOM 2861 CD2 LEU B 49 5.292 23.672 17.320 1.00 0.25 C ATOM 0 H LEU B 49 8.508 23.105 19.572 1.00 0.30 H new ATOM 0 HA LEU B 49 6.415 25.028 19.294 1.00 0.29 H new ATOM 0 HB2 LEU B 49 6.431 22.123 20.211 1.00 0.29 H new ATOM 0 HB3 LEU B 49 4.961 23.036 19.933 1.00 0.29 H new ATOM 0 HG LEU B 49 7.150 22.712 17.828 1.00 0.25 H new ATOM 0 HD11 LEU B 49 5.628 21.018 16.804 1.00 0.27 H new ATOM 0 HD12 LEU B 49 6.150 20.511 18.428 1.00 0.27 H new ATOM 0 HD13 LEU B 49 4.521 21.185 18.187 1.00 0.27 H new ATOM 0 HD21 LEU B 49 5.375 23.441 16.258 1.00 0.25 H new ATOM 0 HD22 LEU B 49 4.245 23.627 17.621 1.00 0.25 H new ATOM 0 HD23 LEU B 49 5.679 24.674 17.504 1.00 0.25 H new ATOM 2873 N LYS B 50 7.113 24.105 22.389 1.00 0.35 N ATOM 2874 CA LYS B 50 6.871 24.517 23.805 1.00 0.39 C ATOM 2875 C LYS B 50 7.221 26.006 23.959 1.00 0.39 C ATOM 2876 O LYS B 50 6.536 26.763 24.626 1.00 0.41 O ATOM 2877 CB LYS B 50 7.751 23.685 24.738 1.00 0.44 C ATOM 2878 CG LYS B 50 7.246 22.241 24.760 1.00 1.03 C ATOM 2879 CD LYS B 50 8.124 21.407 25.692 1.00 1.21 C ATOM 2880 CE LYS B 50 7.620 19.963 25.716 1.00 1.58 C ATOM 2881 NZ LYS B 50 7.868 19.325 24.393 1.00 2.18 N ATOM 0 H LYS B 50 7.805 23.367 22.261 1.00 0.35 H new ATOM 0 HA LYS B 50 5.824 24.356 24.062 1.00 0.39 H new ATOM 0 HB2 LYS B 50 8.787 23.714 24.401 1.00 0.44 H new ATOM 0 HB3 LYS B 50 7.731 24.104 25.744 1.00 0.44 H new ATOM 0 HG2 LYS B 50 6.210 22.212 25.097 1.00 1.03 H new ATOM 0 HG3 LYS B 50 7.266 21.822 23.754 1.00 1.03 H new ATOM 0 HD2 LYS B 50 9.160 21.436 25.354 1.00 1.21 H new ATOM 0 HD3 LYS B 50 8.105 21.826 26.698 1.00 1.21 H new ATOM 0 HE2 LYS B 50 8.127 19.403 26.502 1.00 1.58 H new ATOM 0 HE3 LYS B 50 6.555 19.943 25.947 1.00 1.58 H new ATOM 0 HZ1 LYS B 50 6.990 18.887 24.049 1.00 2.18 H new ATOM 0 HZ2 LYS B 50 8.184 20.046 23.714 1.00 2.18 H new ATOM 0 HZ3 LYS B 50 8.603 18.596 24.492 1.00 2.18 H new ATOM 2895 N ASP B 51 8.282 26.424 23.329 1.00 0.38 N ATOM 2896 CA ASP B 51 8.698 27.855 23.409 1.00 0.40 C ATOM 2897 C ASP B 51 7.570 28.729 22.859 1.00 0.38 C ATOM 2898 O ASP B 51 7.277 29.786 23.380 1.00 0.40 O ATOM 2899 CB ASP B 51 9.976 28.075 22.595 1.00 0.42 C ATOM 2900 CG ASP B 51 11.158 27.413 23.305 1.00 1.29 C ATOM 2901 OD1 ASP B 51 11.059 27.189 24.501 1.00 1.96 O ATOM 2902 OD2 ASP B 51 12.145 27.143 22.640 1.00 2.07 O ATOM 0 H ASP B 51 8.885 25.833 22.757 1.00 0.38 H new ATOM 0 HA ASP B 51 8.897 28.123 24.447 1.00 0.40 H new ATOM 0 HB2 ASP B 51 9.859 27.657 21.595 1.00 0.42 H new ATOM 0 HB3 ASP B 51 10.163 29.142 22.474 1.00 0.42 H new ATOM 2907 N GLN B 52 6.930 28.289 21.814 1.00 0.36 N ATOM 2908 CA GLN B 52 5.814 29.086 21.234 1.00 0.38 C ATOM 2909 C GLN B 52 4.751 29.288 22.316 1.00 0.38 C ATOM 2910 O GLN B 52 4.175 30.351 22.440 1.00 0.40 O ATOM 2911 CB GLN B 52 5.231 28.324 20.031 1.00 0.42 C ATOM 2912 CG GLN B 52 3.848 28.869 19.650 1.00 1.31 C ATOM 2913 CD GLN B 52 2.756 28.292 20.566 1.00 2.37 C ATOM 2914 OE1 GLN B 52 3.033 27.306 21.378 1.00 3.28 O flip ATOM 2915 NE2 GLN B 52 1.632 28.750 20.540 1.00 2.59 N flip ATOM 0 H GLN B 52 7.131 27.411 21.335 1.00 0.36 H new ATOM 0 HA GLN B 52 6.165 30.060 20.893 1.00 0.38 H new ATOM 0 HB2 GLN B 52 5.906 28.410 19.180 1.00 0.42 H new ATOM 0 HB3 GLN B 52 5.154 27.263 20.271 1.00 0.42 H new ATOM 0 HG2 GLN B 52 3.850 29.957 19.721 1.00 1.31 H new ATOM 0 HG3 GLN B 52 3.627 28.618 18.613 1.00 1.31 H new ATOM 0 HE21 GLN B 52 1.409 29.520 19.909 1.00 2.59 H new ATOM 0 HE22 GLN B 52 0.910 28.365 21.150 1.00 2.59 H new ATOM 2924 N ALA B 53 4.488 28.282 23.101 1.00 0.39 N ATOM 2925 CA ALA B 53 3.467 28.418 24.173 1.00 0.45 C ATOM 2926 C ALA B 53 3.875 29.542 25.127 1.00 0.47 C ATOM 2927 O ALA B 53 3.044 30.271 25.628 1.00 0.53 O ATOM 2928 CB ALA B 53 3.377 27.110 24.955 1.00 0.50 C ATOM 0 H ALA B 53 4.938 27.369 23.045 1.00 0.39 H new ATOM 0 HA ALA B 53 2.501 28.649 23.725 1.00 0.45 H new ATOM 0 HB1 ALA B 53 2.629 27.207 25.742 1.00 0.50 H new ATOM 0 HB2 ALA B 53 3.092 26.302 24.281 1.00 0.50 H new ATOM 0 HB3 ALA B 53 4.346 26.885 25.401 1.00 0.50 H new ATOM 2934 N GLN B 54 5.146 29.685 25.387 1.00 0.45 N ATOM 2935 CA GLN B 54 5.589 30.761 26.321 1.00 0.50 C ATOM 2936 C GLN B 54 5.161 32.123 25.766 1.00 0.55 C ATOM 2937 O GLN B 54 4.732 32.990 26.503 1.00 0.62 O ATOM 2938 CB GLN B 54 7.114 30.717 26.472 1.00 0.51 C ATOM 2939 CG GLN B 54 7.581 31.814 27.436 1.00 0.58 C ATOM 2940 CD GLN B 54 9.101 31.753 27.572 1.00 0.62 C ATOM 2941 OE1 GLN B 54 9.805 31.631 26.590 1.00 0.97 O ATOM 2942 NE2 GLN B 54 9.641 31.839 28.755 1.00 1.03 N ATOM 0 H GLN B 54 5.892 29.109 24.997 1.00 0.45 H new ATOM 0 HA GLN B 54 5.130 30.608 27.298 1.00 0.50 H new ATOM 0 HB2 GLN B 54 7.422 29.740 26.844 1.00 0.51 H new ATOM 0 HB3 GLN B 54 7.587 30.851 25.499 1.00 0.51 H new ATOM 0 HG2 GLN B 54 7.277 32.793 27.066 1.00 0.58 H new ATOM 0 HG3 GLN B 54 7.112 31.682 28.411 1.00 0.58 H new ATOM 0 HE21 GLN B 54 9.049 31.941 29.579 1.00 1.03 H new ATOM 0 HE22 GLN B 54 10.655 31.804 28.856 1.00 1.03 H new ATOM 2951 N LEU B 55 5.263 32.326 24.482 1.00 0.54 N ATOM 2952 CA LEU B 55 4.846 33.639 23.913 1.00 0.62 C ATOM 2953 C LEU B 55 3.319 33.751 23.993 1.00 0.66 C ATOM 2954 O LEU B 55 2.601 32.984 23.382 1.00 0.60 O ATOM 2955 CB LEU B 55 5.284 33.722 22.449 1.00 0.60 C ATOM 2956 CG LEU B 55 6.788 33.444 22.340 1.00 0.63 C ATOM 2957 CD1 LEU B 55 7.207 33.517 20.868 1.00 0.65 C ATOM 2958 CD2 LEU B 55 7.578 34.486 23.153 1.00 0.78 C ATOM 0 H LEU B 55 5.614 31.647 23.807 1.00 0.54 H new ATOM 0 HA LEU B 55 5.309 34.450 24.475 1.00 0.62 H new ATOM 0 HB2 LEU B 55 4.727 33.000 21.852 1.00 0.60 H new ATOM 0 HB3 LEU B 55 5.057 34.710 22.048 1.00 0.60 H new ATOM 0 HG LEU B 55 7.001 32.451 22.736 1.00 0.63 H new ATOM 0 HD11 LEU B 55 8.276 33.320 20.784 1.00 0.65 H new ATOM 0 HD12 LEU B 55 6.655 32.772 20.295 1.00 0.65 H new ATOM 0 HD13 LEU B 55 6.989 34.511 20.477 1.00 0.65 H new ATOM 0 HD21 LEU B 55 8.645 34.280 23.069 1.00 0.78 H new ATOM 0 HD22 LEU B 55 7.370 35.484 22.766 1.00 0.78 H new ATOM 0 HD23 LEU B 55 7.279 34.433 24.200 1.00 0.78 H new ATOM 2970 N ASN B 56 2.821 34.702 24.744 1.00 0.78 N ATOM 2971 CA ASN B 56 1.339 34.880 24.877 1.00 0.86 C ATOM 2972 C ASN B 56 0.989 36.356 24.706 1.00 0.97 C ATOM 2973 O ASN B 56 0.379 36.752 23.734 1.00 0.92 O ATOM 2974 CB ASN B 56 0.903 34.411 26.265 1.00 0.92 C ATOM 2975 CG ASN B 56 1.211 32.921 26.414 1.00 0.85 C ATOM 2976 OD1 ASN B 56 1.978 32.530 27.271 1.00 1.37 O ATOM 2977 ND2 ASN B 56 0.639 32.066 25.611 1.00 1.36 N ATOM 0 H ASN B 56 3.381 35.369 25.275 1.00 0.78 H new ATOM 0 HA ASN B 56 0.827 34.295 24.113 1.00 0.86 H new ATOM 0 HB2 ASN B 56 1.424 34.981 27.034 1.00 0.92 H new ATOM 0 HB3 ASN B 56 -0.163 34.589 26.404 1.00 0.92 H new ATOM 0 HD21 ASN B 56 0.836 31.069 25.703 1.00 1.36 H new ATOM 0 HD22 ASN B 56 -0.005 32.394 24.891 1.00 1.36 H new ATOM 3149 N THR B 68 1.233 38.812 31.645 1.00 1.01 N ATOM 3150 CA THR B 68 0.460 37.530 31.627 1.00 1.12 C ATOM 3151 C THR B 68 1.198 36.481 30.802 1.00 0.99 C ATOM 3152 O THR B 68 1.402 36.630 29.613 1.00 0.86 O ATOM 3153 CB THR B 68 -0.924 37.781 31.018 1.00 1.20 C ATOM 3154 OG1 THR B 68 -1.653 36.562 30.996 1.00 1.39 O ATOM 3155 CG2 THR B 68 -0.783 38.320 29.589 1.00 1.09 C ATOM 0 HA THR B 68 0.353 37.164 32.648 1.00 1.12 H new ATOM 0 HB THR B 68 -1.453 38.518 31.622 1.00 1.20 H new ATOM 0 HG1 THR B 68 -2.540 36.718 30.609 1.00 1.39 H new ATOM 0 HG21 THR B 68 -1.773 38.494 29.167 1.00 1.09 H new ATOM 0 HG22 THR B 68 -0.226 39.257 29.607 1.00 1.09 H new ATOM 0 HG23 THR B 68 -0.250 37.592 28.977 1.00 1.09 H new ATOM 3163 N THR B 69 1.597 35.411 31.442 1.00 1.06 N ATOM 3164 CA THR B 69 2.326 34.313 30.741 1.00 0.95 C ATOM 3165 C THR B 69 1.453 33.056 30.729 1.00 0.99 C ATOM 3166 O THR B 69 1.062 32.550 31.763 1.00 1.16 O ATOM 3167 CB THR B 69 3.636 34.020 31.482 1.00 1.05 C ATOM 3168 OG1 THR B 69 4.397 33.082 30.733 1.00 1.09 O ATOM 3169 CG2 THR B 69 3.339 33.443 32.873 1.00 1.28 C ATOM 0 H THR B 69 1.445 35.250 32.438 1.00 1.06 H new ATOM 0 HA THR B 69 2.548 34.613 29.717 1.00 0.95 H new ATOM 0 HB THR B 69 4.198 34.947 31.596 1.00 1.05 H new ATOM 0 HG1 THR B 69 5.236 32.893 31.202 1.00 1.09 H new ATOM 0 HG21 THR B 69 4.277 33.239 33.390 1.00 1.28 H new ATOM 0 HG22 THR B 69 2.756 34.162 33.449 1.00 1.28 H new ATOM 0 HG23 THR B 69 2.773 32.517 32.770 1.00 1.28 H new ATOM 3177 N VAL B 70 1.144 32.554 29.559 1.00 0.89 N ATOM 3178 CA VAL B 70 0.297 31.324 29.445 1.00 0.97 C ATOM 3179 C VAL B 70 1.040 30.297 28.576 1.00 0.85 C ATOM 3180 O VAL B 70 0.889 30.282 27.370 1.00 0.80 O ATOM 3181 CB VAL B 70 -1.030 31.692 28.770 1.00 1.07 C ATOM 3182 CG1 VAL B 70 -1.888 30.435 28.603 1.00 1.24 C ATOM 3183 CG2 VAL B 70 -1.775 32.706 29.641 1.00 1.18 C ATOM 0 H VAL B 70 1.445 32.948 28.668 1.00 0.89 H new ATOM 0 HA VAL B 70 0.102 30.906 30.433 1.00 0.97 H new ATOM 0 HB VAL B 70 -0.832 32.126 27.790 1.00 1.07 H new ATOM 0 HG11 VAL B 70 -2.830 30.699 28.123 1.00 1.24 H new ATOM 0 HG12 VAL B 70 -1.356 29.711 27.985 1.00 1.24 H new ATOM 0 HG13 VAL B 70 -2.089 29.999 29.582 1.00 1.24 H new ATOM 0 HG21 VAL B 70 -2.719 32.970 29.165 1.00 1.18 H new ATOM 0 HG22 VAL B 70 -1.972 32.269 30.620 1.00 1.18 H new ATOM 0 HG23 VAL B 70 -1.165 33.602 29.759 1.00 1.18 H new ATOM 3193 N PRO B 71 1.853 29.453 29.177 1.00 0.84 N ATOM 3194 CA PRO B 71 2.638 28.425 28.437 1.00 0.75 C ATOM 3195 C PRO B 71 1.846 27.134 28.194 1.00 0.74 C ATOM 3196 O PRO B 71 2.206 26.073 28.664 1.00 0.78 O ATOM 3197 CB PRO B 71 3.825 28.169 29.370 1.00 0.84 C ATOM 3198 CG PRO B 71 3.269 28.359 30.751 1.00 0.99 C ATOM 3199 CD PRO B 71 2.123 29.383 30.628 1.00 0.98 C ATOM 0 HA PRO B 71 2.920 28.761 27.439 1.00 0.75 H new ATOM 0 HB2 PRO B 71 4.223 27.163 29.238 1.00 0.84 H new ATOM 0 HB3 PRO B 71 4.642 28.863 29.172 1.00 0.84 H new ATOM 0 HG2 PRO B 71 2.903 27.415 31.155 1.00 0.99 H new ATOM 0 HG3 PRO B 71 4.039 28.720 31.432 1.00 0.99 H new ATOM 0 HD2 PRO B 71 1.241 29.062 31.182 1.00 0.98 H new ATOM 0 HD3 PRO B 71 2.413 30.355 31.026 1.00 0.98 H new ATOM 3207 N TRP B 72 0.781 27.214 27.446 1.00 0.72 N ATOM 3208 CA TRP B 72 -0.013 25.989 27.155 1.00 0.75 C ATOM 3209 C TRP B 72 0.818 25.093 26.225 1.00 0.68 C ATOM 3210 O TRP B 72 1.122 25.492 25.120 1.00 0.60 O ATOM 3211 CB TRP B 72 -1.292 26.394 26.430 1.00 0.78 C ATOM 3212 CG TRP B 72 -2.197 25.212 26.325 1.00 0.84 C ATOM 3213 CD1 TRP B 72 -2.940 24.713 27.338 1.00 0.94 C ATOM 3214 CD2 TRP B 72 -2.465 24.372 25.165 1.00 0.84 C ATOM 3215 NE1 TRP B 72 -3.653 23.622 26.874 1.00 0.99 N ATOM 3216 CE2 TRP B 72 -3.394 23.373 25.540 1.00 0.94 C ATOM 3217 CE3 TRP B 72 -1.999 24.382 23.838 1.00 0.79 C ATOM 3218 CZ2 TRP B 72 -3.844 22.416 24.628 1.00 0.97 C ATOM 3219 CZ3 TRP B 72 -2.449 23.422 22.917 1.00 0.84 C ATOM 3220 CH2 TRP B 72 -3.371 22.441 23.312 1.00 0.92 C ATOM 0 H TRP B 72 0.427 28.073 27.025 1.00 0.72 H new ATOM 0 HA TRP B 72 -0.259 25.463 28.077 1.00 0.75 H new ATOM 0 HB2 TRP B 72 -1.789 27.200 26.969 1.00 0.78 H new ATOM 0 HB3 TRP B 72 -1.055 26.774 25.436 1.00 0.78 H new ATOM 0 HD1 TRP B 72 -2.972 25.102 28.345 1.00 0.94 H new ATOM 0 HE1 TRP B 72 -4.291 23.069 27.446 1.00 0.99 H new ATOM 0 HE3 TRP B 72 -1.290 25.134 23.525 1.00 0.79 H new ATOM 0 HZ2 TRP B 72 -4.553 21.662 24.937 1.00 0.97 H new ATOM 0 HZ3 TRP B 72 -2.084 23.439 21.901 1.00 0.84 H new ATOM 0 HH2 TRP B 72 -3.715 21.705 22.600 1.00 0.92 H new ATOM 3231 N PRO B 73 1.210 23.908 26.643 1.00 0.71 N ATOM 3232 CA PRO B 73 2.044 23.030 25.781 1.00 0.66 C ATOM 3233 C PRO B 73 1.587 23.063 24.321 1.00 0.58 C ATOM 3234 O PRO B 73 0.411 23.149 24.028 1.00 0.61 O ATOM 3235 CB PRO B 73 1.840 21.642 26.394 1.00 0.75 C ATOM 3236 CG PRO B 73 1.607 21.905 27.850 1.00 0.85 C ATOM 3237 CD PRO B 73 0.912 23.273 27.939 1.00 0.82 C ATOM 0 HA PRO B 73 3.089 23.340 25.753 1.00 0.66 H new ATOM 0 HB2 PRO B 73 0.990 21.130 25.942 1.00 0.75 H new ATOM 0 HB3 PRO B 73 2.713 21.008 26.240 1.00 0.75 H new ATOM 0 HG2 PRO B 73 0.986 21.125 28.291 1.00 0.85 H new ATOM 0 HG3 PRO B 73 2.549 21.912 28.399 1.00 0.85 H new ATOM 0 HD2 PRO B 73 -0.162 23.166 28.094 1.00 0.82 H new ATOM 0 HD3 PRO B 73 1.297 23.863 28.771 1.00 0.82 H new ATOM 3245 N ASN B 74 2.515 22.988 23.409 1.00 0.52 N ATOM 3246 CA ASN B 74 2.166 23.002 21.955 1.00 0.48 C ATOM 3247 C ASN B 74 2.949 21.884 21.276 1.00 0.50 C ATOM 3248 O ASN B 74 2.906 21.699 20.077 1.00 0.80 O ATOM 3249 CB ASN B 74 2.549 24.360 21.359 1.00 0.47 C ATOM 3250 CG ASN B 74 1.825 24.560 20.025 1.00 0.53 C ATOM 3251 OD1 ASN B 74 2.410 24.410 18.974 1.00 1.17 O ATOM 3252 ND2 ASN B 74 0.563 24.889 20.027 1.00 1.26 N ATOM 0 H ASN B 74 3.513 22.917 23.608 1.00 0.52 H new ATOM 0 HA ASN B 74 1.097 22.848 21.807 1.00 0.48 H new ATOM 0 HB2 ASN B 74 2.284 25.159 22.051 1.00 0.47 H new ATOM 0 HB3 ASN B 74 3.628 24.412 21.210 1.00 0.47 H new ATOM 0 HD21 ASN B 74 0.069 25.020 19.144 1.00 1.26 H new ATOM 0 HD22 ASN B 74 0.070 25.015 20.911 1.00 1.26 H new ATOM 3259 N ALA B 75 3.669 21.145 22.068 1.00 0.47 N ATOM 3260 CA ALA B 75 4.490 20.020 21.563 1.00 0.47 C ATOM 3261 C ALA B 75 3.660 18.749 21.666 1.00 0.46 C ATOM 3262 O ALA B 75 3.114 18.445 22.706 1.00 0.47 O ATOM 3263 CB ALA B 75 5.750 19.902 22.435 1.00 0.53 C ATOM 0 H ALA B 75 3.722 21.281 23.077 1.00 0.47 H new ATOM 0 HA ALA B 75 4.787 20.182 20.527 1.00 0.47 H new ATOM 0 HB1 ALA B 75 6.365 19.077 22.075 1.00 0.53 H new ATOM 0 HB2 ALA B 75 6.319 20.830 22.380 1.00 0.53 H new ATOM 0 HB3 ALA B 75 5.461 19.715 23.469 1.00 0.53 H new ATOM 3269 N SER B 76 3.548 18.002 20.612 1.00 0.47 N ATOM 3270 CA SER B 76 2.737 16.765 20.702 1.00 0.49 C ATOM 3271 C SER B 76 3.585 15.700 21.382 1.00 0.48 C ATOM 3272 O SER B 76 4.352 14.993 20.758 1.00 0.49 O ATOM 3273 CB SER B 76 2.363 16.306 19.294 1.00 0.54 C ATOM 3274 OG SER B 76 2.095 17.442 18.489 1.00 1.38 O ATOM 0 H SER B 76 3.975 18.189 19.705 1.00 0.47 H new ATOM 0 HA SER B 76 1.824 16.941 21.271 1.00 0.49 H new ATOM 0 HB2 SER B 76 3.175 15.722 18.861 1.00 0.54 H new ATOM 0 HB3 SER B 76 1.488 15.657 19.331 1.00 0.54 H new ATOM 0 HG SER B 76 1.556 18.083 18.997 1.00 1.38 H new ATOM 3280 N LEU B 77 3.445 15.591 22.671 1.00 0.50 N ATOM 3281 CA LEU B 77 4.233 14.588 23.423 1.00 0.53 C ATOM 3282 C LEU B 77 3.595 13.220 23.222 1.00 0.52 C ATOM 3283 O LEU B 77 2.391 13.076 23.235 1.00 0.56 O ATOM 3284 CB LEU B 77 4.234 14.962 24.908 1.00 0.61 C ATOM 3285 CG LEU B 77 4.790 16.383 25.078 1.00 0.65 C ATOM 3286 CD1 LEU B 77 4.644 16.811 26.540 1.00 0.75 C ATOM 3287 CD2 LEU B 77 6.275 16.429 24.675 1.00 0.66 C ATOM 0 H LEU B 77 2.814 16.158 23.237 1.00 0.50 H new ATOM 0 HA LEU B 77 5.262 14.563 23.066 1.00 0.53 H new ATOM 0 HB2 LEU B 77 3.222 14.906 25.309 1.00 0.61 H new ATOM 0 HB3 LEU B 77 4.840 14.253 25.472 1.00 0.61 H new ATOM 0 HG LEU B 77 4.231 17.063 24.435 1.00 0.65 H new ATOM 0 HD11 LEU B 77 5.038 17.820 26.665 1.00 0.75 H new ATOM 0 HD12 LEU B 77 3.591 16.795 26.820 1.00 0.75 H new ATOM 0 HD13 LEU B 77 5.199 16.123 27.178 1.00 0.75 H new ATOM 0 HD21 LEU B 77 6.655 17.443 24.801 1.00 0.66 H new ATOM 0 HD22 LEU B 77 6.845 15.747 25.306 1.00 0.66 H new ATOM 0 HD23 LEU B 77 6.378 16.130 23.632 1.00 0.66 H new ATOM 3299 N THR B 78 4.395 12.215 23.020 1.00 0.51 N ATOM 3300 CA THR B 78 3.847 10.845 22.799 1.00 0.51 C ATOM 3301 C THR B 78 4.761 9.828 23.491 1.00 0.58 C ATOM 3302 O THR B 78 5.653 9.278 22.883 1.00 0.66 O ATOM 3303 CB THR B 78 3.840 10.576 21.289 1.00 0.55 C ATOM 3304 OG1 THR B 78 3.324 9.275 21.055 1.00 0.61 O ATOM 3305 CG2 THR B 78 5.273 10.679 20.723 1.00 0.63 C ATOM 0 H THR B 78 5.413 12.281 22.998 1.00 0.51 H new ATOM 0 HA THR B 78 2.838 10.762 23.204 1.00 0.51 H new ATOM 0 HB THR B 78 3.215 11.317 20.791 1.00 0.55 H new ATOM 0 HG1 THR B 78 2.389 9.341 20.768 1.00 0.61 H new ATOM 0 HG21 THR B 78 5.255 10.486 19.650 1.00 0.63 H new ATOM 0 HG22 THR B 78 5.665 11.680 20.905 1.00 0.63 H new ATOM 0 HG23 THR B 78 5.912 9.944 21.213 1.00 0.63 H new ATOM 3313 N PRO B 79 4.542 9.585 24.756 1.00 0.66 N ATOM 3314 CA PRO B 79 5.351 8.631 25.554 1.00 0.77 C ATOM 3315 C PRO B 79 4.685 7.263 25.758 1.00 0.68 C ATOM 3316 O PRO B 79 5.316 6.229 25.669 1.00 0.70 O ATOM 3317 CB PRO B 79 5.417 9.361 26.892 1.00 0.99 C ATOM 3318 CG PRO B 79 4.062 10.008 27.033 1.00 0.97 C ATOM 3319 CD PRO B 79 3.515 10.209 25.601 1.00 0.75 C ATOM 0 HA PRO B 79 6.302 8.397 25.075 1.00 0.77 H new ATOM 0 HB2 PRO B 79 5.615 8.671 27.712 1.00 0.99 H new ATOM 0 HB3 PRO B 79 6.215 10.104 26.901 1.00 0.99 H new ATOM 0 HG2 PRO B 79 3.392 9.379 27.619 1.00 0.97 H new ATOM 0 HG3 PRO B 79 4.141 10.962 27.555 1.00 0.97 H new ATOM 0 HD2 PRO B 79 2.543 9.733 25.471 1.00 0.75 H new ATOM 0 HD3 PRO B 79 3.386 11.265 25.364 1.00 0.75 H new ATOM 3327 N LYS B 80 3.435 7.266 26.104 1.00 0.66 N ATOM 3328 CA LYS B 80 2.727 5.989 26.400 1.00 0.67 C ATOM 3329 C LYS B 80 2.271 5.244 25.139 1.00 0.64 C ATOM 3330 O LYS B 80 2.384 4.037 25.067 1.00 0.65 O ATOM 3331 CB LYS B 80 1.498 6.304 27.254 1.00 0.79 C ATOM 3332 CG LYS B 80 0.782 5.005 27.630 1.00 1.31 C ATOM 3333 CD LYS B 80 -0.295 5.297 28.682 1.00 1.46 C ATOM 3334 CE LYS B 80 -1.437 6.105 28.054 1.00 2.32 C ATOM 3335 NZ LYS B 80 -2.628 6.053 28.946 1.00 2.97 N ATOM 0 H LYS B 80 2.863 8.106 26.197 1.00 0.66 H new ATOM 0 HA LYS B 80 3.431 5.339 26.920 1.00 0.67 H new ATOM 0 HB2 LYS B 80 1.797 6.839 28.155 1.00 0.79 H new ATOM 0 HB3 LYS B 80 0.820 6.958 26.705 1.00 0.79 H new ATOM 0 HG2 LYS B 80 0.329 4.559 26.745 1.00 1.31 H new ATOM 0 HG3 LYS B 80 1.499 4.282 28.020 1.00 1.31 H new ATOM 0 HD2 LYS B 80 -0.681 4.362 29.088 1.00 1.46 H new ATOM 0 HD3 LYS B 80 0.139 5.851 29.514 1.00 1.46 H new ATOM 0 HE2 LYS B 80 -1.126 7.139 27.904 1.00 2.32 H new ATOM 0 HE3 LYS B 80 -1.686 5.701 27.073 1.00 2.32 H new ATOM 0 HZ1 LYS B 80 -3.404 6.601 28.522 1.00 2.97 H new ATOM 0 HZ2 LYS B 80 -2.928 5.065 29.067 1.00 2.97 H new ATOM 0 HZ3 LYS B 80 -2.385 6.457 29.873 1.00 2.97 H new ATOM 3349 N TRP B 81 1.696 5.920 24.175 1.00 0.65 N ATOM 3350 CA TRP B 81 1.170 5.181 22.972 1.00 0.67 C ATOM 3351 C TRP B 81 2.200 5.013 21.846 1.00 0.62 C ATOM 3352 O TRP B 81 2.587 3.908 21.530 1.00 0.64 O ATOM 3353 CB TRP B 81 -0.103 5.865 22.439 1.00 0.73 C ATOM 3354 CG TRP B 81 0.181 7.228 21.889 1.00 0.69 C ATOM 3355 CD1 TRP B 81 0.488 7.498 20.600 1.00 0.70 C ATOM 3356 CD2 TRP B 81 0.137 8.508 22.577 1.00 0.68 C ATOM 3357 NE1 TRP B 81 0.678 8.861 20.461 1.00 0.68 N ATOM 3358 CE2 TRP B 81 0.460 9.530 21.650 1.00 0.66 C ATOM 3359 CE3 TRP B 81 -0.138 8.877 23.903 1.00 0.71 C ATOM 3360 CZ2 TRP B 81 0.505 10.872 22.030 1.00 0.66 C ATOM 3361 CZ3 TRP B 81 -0.098 10.225 24.290 1.00 0.72 C ATOM 3362 CH2 TRP B 81 0.222 11.222 23.355 1.00 0.68 C ATOM 0 H TRP B 81 1.567 6.932 24.162 1.00 0.65 H new ATOM 0 HA TRP B 81 0.934 4.174 23.315 1.00 0.67 H new ATOM 0 HB2 TRP B 81 -0.549 5.246 21.661 1.00 0.73 H new ATOM 0 HB3 TRP B 81 -0.836 5.944 23.242 1.00 0.73 H new ATOM 0 HD1 TRP B 81 0.571 6.768 19.808 1.00 0.70 H new ATOM 0 HE1 TRP B 81 0.946 9.316 19.588 1.00 0.68 H new ATOM 0 HE3 TRP B 81 -0.382 8.117 24.631 1.00 0.71 H new ATOM 0 HZ2 TRP B 81 0.756 11.634 21.307 1.00 0.66 H new ATOM 0 HZ3 TRP B 81 -0.315 10.497 25.313 1.00 0.72 H new ATOM 0 HH2 TRP B 81 0.250 12.258 23.658 1.00 0.68 H new ATOM 3373 N ASN B 82 2.597 6.061 21.183 1.00 0.59 N ATOM 3374 CA ASN B 82 3.531 5.882 20.033 1.00 0.59 C ATOM 3375 C ASN B 82 4.927 5.431 20.491 1.00 0.53 C ATOM 3376 O ASN B 82 5.510 4.539 19.908 1.00 0.49 O ATOM 3377 CB ASN B 82 3.632 7.199 19.238 1.00 0.69 C ATOM 3378 CG ASN B 82 3.883 6.891 17.756 1.00 1.07 C ATOM 3379 OD1 ASN B 82 3.700 7.826 16.864 1.00 0.96 O flip ATOM 3380 ND2 ASN B 82 4.251 5.787 17.410 1.00 1.86 N flip ATOM 0 H ASN B 82 2.321 7.023 21.382 1.00 0.59 H new ATOM 0 HA ASN B 82 3.129 5.096 19.394 1.00 0.59 H new ATOM 0 HB2 ASN B 82 2.712 7.773 19.349 1.00 0.69 H new ATOM 0 HB3 ASN B 82 4.441 7.813 19.634 1.00 0.69 H new ATOM 0 HD21 ASN B 82 4.394 5.056 18.106 1.00 1.86 H new ATOM 0 HD22 ASN B 82 4.417 5.591 16.423 1.00 1.86 H new ATOM 3387 N ASN B 83 5.488 6.033 21.505 1.00 0.56 N ATOM 3388 CA ASN B 83 6.855 5.604 21.932 1.00 0.57 C ATOM 3389 C ASN B 83 6.819 4.164 22.443 1.00 0.53 C ATOM 3390 O ASN B 83 7.688 3.371 22.137 1.00 0.52 O ATOM 3391 CB ASN B 83 7.379 6.526 23.035 1.00 0.66 C ATOM 3392 CG ASN B 83 7.794 7.871 22.430 1.00 1.22 C ATOM 3393 OD1 ASN B 83 7.710 8.053 21.139 1.00 1.99 O flip ATOM 3394 ND2 ASN B 83 8.196 8.770 23.142 1.00 1.84 N flip ATOM 0 H ASN B 83 5.071 6.789 22.048 1.00 0.56 H new ATOM 0 HA ASN B 83 7.521 5.663 21.071 1.00 0.57 H new ATOM 0 HB2 ASN B 83 6.609 6.679 23.791 1.00 0.66 H new ATOM 0 HB3 ASN B 83 8.230 6.063 23.535 1.00 0.66 H new ATOM 0 HD21 ASN B 83 8.263 8.631 24.150 1.00 1.84 H new ATOM 0 HD22 ASN B 83 8.467 9.664 22.731 1.00 1.84 H new ATOM 3401 N GLU B 84 5.822 3.806 23.206 1.00 0.53 N ATOM 3402 CA GLU B 84 5.754 2.405 23.701 1.00 0.52 C ATOM 3403 C GLU B 84 5.686 1.487 22.489 1.00 0.47 C ATOM 3404 O GLU B 84 6.382 0.494 22.396 1.00 0.48 O ATOM 3405 CB GLU B 84 4.513 2.214 24.574 1.00 0.56 C ATOM 3406 CG GLU B 84 4.518 0.799 25.155 1.00 1.26 C ATOM 3407 CD GLU B 84 3.337 0.637 26.112 1.00 1.71 C ATOM 3408 OE1 GLU B 84 2.634 1.611 26.324 1.00 2.23 O ATOM 3409 OE2 GLU B 84 3.158 -0.457 26.618 1.00 2.29 O ATOM 0 H GLU B 84 5.061 4.416 23.504 1.00 0.53 H new ATOM 0 HA GLU B 84 6.631 2.174 24.305 1.00 0.52 H new ATOM 0 HB2 GLU B 84 4.503 2.950 25.378 1.00 0.56 H new ATOM 0 HB3 GLU B 84 3.611 2.374 23.984 1.00 0.56 H new ATOM 0 HG2 GLU B 84 4.453 0.065 24.352 1.00 1.26 H new ATOM 0 HG3 GLU B 84 5.454 0.614 25.681 1.00 1.26 H new ATOM 3416 N THR B 85 4.868 1.838 21.540 1.00 0.44 N ATOM 3417 CA THR B 85 4.765 1.018 20.311 1.00 0.42 C ATOM 3418 C THR B 85 6.059 1.172 19.527 1.00 0.38 C ATOM 3419 O THR B 85 6.532 0.243 18.902 1.00 0.39 O ATOM 3420 CB THR B 85 3.598 1.504 19.453 1.00 0.45 C ATOM 3421 OG1 THR B 85 3.789 2.874 19.136 1.00 0.43 O ATOM 3422 CG2 THR B 85 2.278 1.327 20.207 1.00 0.50 C ATOM 0 H THR B 85 4.265 2.661 21.565 1.00 0.44 H new ATOM 0 HA THR B 85 4.597 -0.026 20.576 1.00 0.42 H new ATOM 0 HB THR B 85 3.558 0.917 18.535 1.00 0.45 H new ATOM 0 HG1 THR B 85 4.494 3.247 19.706 1.00 0.43 H new ATOM 0 HG21 THR B 85 1.454 1.677 19.585 1.00 0.50 H new ATOM 0 HG22 THR B 85 2.132 0.273 20.443 1.00 0.50 H new ATOM 0 HG23 THR B 85 2.306 1.905 21.131 1.00 0.50 H new ATOM 3430 N TRP B 86 6.635 2.346 19.537 1.00 0.36 N ATOM 3431 CA TRP B 86 7.888 2.533 18.772 1.00 0.34 C ATOM 3432 C TRP B 86 8.940 1.574 19.312 1.00 0.34 C ATOM 3433 O TRP B 86 9.676 0.959 18.565 1.00 0.33 O ATOM 3434 CB TRP B 86 8.412 3.968 18.900 1.00 0.34 C ATOM 3435 CG TRP B 86 9.424 4.182 17.823 1.00 0.32 C ATOM 3436 CD1 TRP B 86 10.760 4.015 17.945 1.00 0.34 C ATOM 3437 CD2 TRP B 86 9.184 4.568 16.449 1.00 0.29 C ATOM 3438 NE1 TRP B 86 11.353 4.276 16.722 1.00 0.33 N ATOM 3439 CE2 TRP B 86 10.419 4.623 15.766 1.00 0.29 C ATOM 3440 CE3 TRP B 86 8.018 4.875 15.737 1.00 0.28 C ATOM 3441 CZ2 TRP B 86 10.491 4.968 14.416 1.00 0.28 C ATOM 3442 CZ3 TRP B 86 8.088 5.224 14.386 1.00 0.27 C ATOM 3443 CH2 TRP B 86 9.318 5.270 13.724 1.00 0.27 C ATOM 0 H TRP B 86 6.293 3.168 20.036 1.00 0.36 H new ATOM 0 HA TRP B 86 7.683 2.335 17.720 1.00 0.34 H new ATOM 0 HB2 TRP B 86 7.595 4.683 18.804 1.00 0.34 H new ATOM 0 HB3 TRP B 86 8.859 4.125 19.881 1.00 0.34 H new ATOM 0 HD1 TRP B 86 11.279 3.726 18.847 1.00 0.34 H new ATOM 0 HE1 TRP B 86 12.356 4.219 16.548 1.00 0.33 H new ATOM 0 HE3 TRP B 86 7.060 4.842 16.235 1.00 0.28 H new ATOM 0 HZ2 TRP B 86 11.445 5.001 13.912 1.00 0.28 H new ATOM 0 HZ3 TRP B 86 7.182 5.461 13.848 1.00 0.27 H new ATOM 0 HH2 TRP B 86 9.360 5.539 12.679 1.00 0.27 H new ATOM 3454 N GLN B 87 9.015 1.425 20.607 1.00 0.37 N ATOM 3455 CA GLN B 87 10.019 0.490 21.162 1.00 0.39 C ATOM 3456 C GLN B 87 9.714 -0.896 20.605 1.00 0.37 C ATOM 3457 O GLN B 87 10.595 -1.609 20.173 1.00 0.38 O ATOM 3458 CB GLN B 87 9.937 0.479 22.691 1.00 0.43 C ATOM 3459 CG GLN B 87 10.452 1.813 23.237 1.00 0.46 C ATOM 3460 CD GLN B 87 10.223 1.870 24.748 1.00 0.52 C ATOM 3461 OE1 GLN B 87 9.391 1.158 25.274 1.00 1.21 O ATOM 3462 NE2 GLN B 87 10.932 2.690 25.475 1.00 1.03 N ATOM 0 H GLN B 87 8.431 1.905 21.292 1.00 0.37 H new ATOM 0 HA GLN B 87 11.027 0.798 20.883 1.00 0.39 H new ATOM 0 HB2 GLN B 87 8.908 0.316 23.010 1.00 0.43 H new ATOM 0 HB3 GLN B 87 10.529 -0.344 23.092 1.00 0.43 H new ATOM 0 HG2 GLN B 87 11.514 1.923 23.015 1.00 0.46 H new ATOM 0 HG3 GLN B 87 9.937 2.641 22.749 1.00 0.46 H new ATOM 0 HE21 GLN B 87 11.631 3.288 25.034 1.00 1.03 H new ATOM 0 HE22 GLN B 87 10.787 2.733 26.484 1.00 1.03 H new ATOM 3471 N GLU B 88 8.465 -1.273 20.570 1.00 0.37 N ATOM 3472 CA GLU B 88 8.125 -2.601 19.996 1.00 0.37 C ATOM 3473 C GLU B 88 8.570 -2.620 18.532 1.00 0.34 C ATOM 3474 O GLU B 88 9.172 -3.563 18.065 1.00 0.34 O ATOM 3475 CB GLU B 88 6.612 -2.825 20.072 1.00 0.39 C ATOM 3476 CG GLU B 88 6.190 -3.023 21.529 1.00 1.17 C ATOM 3477 CD GLU B 88 4.673 -3.213 21.595 1.00 1.41 C ATOM 3478 OE1 GLU B 88 4.040 -3.133 20.554 1.00 1.92 O ATOM 3479 OE2 GLU B 88 4.169 -3.434 22.685 1.00 1.95 O ATOM 0 H GLU B 88 7.675 -0.725 20.910 1.00 0.37 H new ATOM 0 HA GLU B 88 8.628 -3.390 20.555 1.00 0.37 H new ATOM 0 HB2 GLU B 88 6.087 -1.971 19.645 1.00 0.39 H new ATOM 0 HB3 GLU B 88 6.334 -3.698 19.481 1.00 0.39 H new ATOM 0 HG2 GLU B 88 6.695 -3.892 21.951 1.00 1.17 H new ATOM 0 HG3 GLU B 88 6.486 -2.160 22.126 1.00 1.17 H new ATOM 3486 N TRP B 89 8.284 -1.571 17.808 1.00 0.32 N ATOM 3487 CA TRP B 89 8.694 -1.516 16.377 1.00 0.29 C ATOM 3488 C TRP B 89 10.215 -1.624 16.280 1.00 0.29 C ATOM 3489 O TRP B 89 10.742 -2.427 15.536 1.00 0.30 O ATOM 3490 CB TRP B 89 8.223 -0.183 15.788 1.00 0.28 C ATOM 3491 CG TRP B 89 8.803 0.022 14.427 1.00 0.25 C ATOM 3492 CD1 TRP B 89 8.340 -0.543 13.289 1.00 0.24 C ATOM 3493 CD2 TRP B 89 9.931 0.857 14.042 1.00 0.24 C ATOM 3494 NE1 TRP B 89 9.121 -0.116 12.232 1.00 0.23 N ATOM 3495 CE2 TRP B 89 10.115 0.750 12.646 1.00 0.22 C ATOM 3496 CE3 TRP B 89 10.809 1.686 14.766 1.00 0.26 C ATOM 3497 CZ2 TRP B 89 11.134 1.444 11.990 1.00 0.22 C ATOM 3498 CZ3 TRP B 89 11.833 2.385 14.109 1.00 0.26 C ATOM 3499 CH2 TRP B 89 11.995 2.264 12.723 1.00 0.25 C ATOM 0 H TRP B 89 7.784 -0.750 18.147 1.00 0.32 H new ATOM 0 HA TRP B 89 8.247 -2.341 15.822 1.00 0.29 H new ATOM 0 HB2 TRP B 89 7.135 -0.168 15.732 1.00 0.28 H new ATOM 0 HB3 TRP B 89 8.520 0.636 16.443 1.00 0.28 H new ATOM 0 HD1 TRP B 89 7.499 -1.217 13.218 1.00 0.24 H new ATOM 0 HE1 TRP B 89 8.981 -0.405 11.264 1.00 0.23 H new ATOM 0 HE3 TRP B 89 10.693 1.785 15.835 1.00 0.26 H new ATOM 0 HZ2 TRP B 89 11.256 1.347 10.921 1.00 0.22 H new ATOM 0 HZ3 TRP B 89 12.499 3.019 14.675 1.00 0.26 H new ATOM 0 HH2 TRP B 89 12.785 2.804 12.222 1.00 0.25 H new ATOM 3510 N GLU B 90 10.926 -0.833 17.035 1.00 0.31 N ATOM 3511 CA GLU B 90 12.409 -0.908 16.986 1.00 0.33 C ATOM 3512 C GLU B 90 12.850 -2.291 17.467 1.00 0.33 C ATOM 3513 O GLU B 90 13.713 -2.915 16.883 1.00 0.34 O ATOM 3514 CB GLU B 90 13.010 0.179 17.887 1.00 0.37 C ATOM 3515 CG GLU B 90 14.540 0.119 17.820 1.00 0.84 C ATOM 3516 CD GLU B 90 15.138 1.212 18.709 1.00 1.16 C ATOM 3517 OE1 GLU B 90 14.377 2.009 19.231 1.00 1.82 O ATOM 3518 OE2 GLU B 90 16.351 1.235 18.846 1.00 1.67 O ATOM 0 H GLU B 90 10.544 -0.141 17.680 1.00 0.31 H new ATOM 0 HA GLU B 90 12.756 -0.749 15.965 1.00 0.33 H new ATOM 0 HB2 GLU B 90 12.661 1.162 17.570 1.00 0.37 H new ATOM 0 HB3 GLU B 90 12.676 0.039 18.915 1.00 0.37 H new ATOM 0 HG2 GLU B 90 14.890 -0.860 18.146 1.00 0.84 H new ATOM 0 HG3 GLU B 90 14.874 0.250 16.791 1.00 0.84 H new ATOM 3525 N ARG B 91 12.261 -2.778 18.527 1.00 0.34 N ATOM 3526 CA ARG B 91 12.654 -4.122 19.034 1.00 0.36 C ATOM 3527 C ARG B 91 12.323 -5.189 17.988 1.00 0.34 C ATOM 3528 O ARG B 91 13.092 -6.102 17.764 1.00 0.34 O ATOM 3529 CB ARG B 91 11.902 -4.434 20.335 1.00 0.40 C ATOM 3530 CG ARG B 91 12.466 -3.596 21.494 1.00 0.44 C ATOM 3531 CD ARG B 91 13.933 -3.981 21.782 1.00 1.07 C ATOM 3532 NE ARG B 91 14.827 -2.943 21.195 1.00 1.67 N ATOM 3533 CZ ARG B 91 16.090 -2.898 21.524 1.00 2.30 C ATOM 3534 NH1 ARG B 91 16.588 -3.782 22.345 1.00 2.62 N ATOM 3535 NH2 ARG B 91 16.856 -1.964 21.031 1.00 3.17 N ATOM 0 H ARG B 91 11.530 -2.306 19.059 1.00 0.34 H new ATOM 0 HA ARG B 91 13.726 -4.124 19.229 1.00 0.36 H new ATOM 0 HB2 ARG B 91 10.840 -4.223 20.208 1.00 0.40 H new ATOM 0 HB3 ARG B 91 11.991 -5.495 20.568 1.00 0.40 H new ATOM 0 HG2 ARG B 91 12.405 -2.536 21.247 1.00 0.44 H new ATOM 0 HG3 ARG B 91 11.862 -3.750 22.388 1.00 0.44 H new ATOM 0 HD2 ARG B 91 14.099 -4.058 22.857 1.00 1.07 H new ATOM 0 HD3 ARG B 91 14.158 -4.958 21.354 1.00 1.07 H new ATOM 0 HE ARG B 91 14.451 -2.264 20.533 1.00 1.67 H new ATOM 0 HH11 ARG B 91 15.990 -4.512 22.732 1.00 2.62 H new ATOM 0 HH12 ARG B 91 17.575 -3.743 22.599 1.00 2.62 H new ATOM 0 HH21 ARG B 91 16.468 -1.271 20.390 1.00 3.17 H new ATOM 0 HH22 ARG B 91 17.843 -1.926 21.286 1.00 3.17 H new ATOM 3549 N LYS B 92 11.197 -5.080 17.333 1.00 0.33 N ATOM 3550 CA LYS B 92 10.857 -6.093 16.299 1.00 0.33 C ATOM 3551 C LYS B 92 11.944 -6.064 15.230 1.00 0.31 C ATOM 3552 O LYS B 92 12.393 -7.085 14.754 1.00 0.32 O ATOM 3553 CB LYS B 92 9.495 -5.766 15.677 1.00 0.34 C ATOM 3554 CG LYS B 92 8.377 -6.137 16.664 1.00 0.68 C ATOM 3555 CD LYS B 92 7.053 -5.489 16.241 1.00 1.09 C ATOM 3556 CE LYS B 92 6.468 -6.236 15.043 1.00 1.41 C ATOM 3557 NZ LYS B 92 5.161 -5.626 14.680 1.00 2.14 N ATOM 0 H LYS B 92 10.507 -4.341 17.469 1.00 0.33 H new ATOM 0 HA LYS B 92 10.800 -7.085 16.746 1.00 0.33 H new ATOM 0 HB2 LYS B 92 9.441 -4.705 15.432 1.00 0.34 H new ATOM 0 HB3 LYS B 92 9.368 -6.316 14.744 1.00 0.34 H new ATOM 0 HG2 LYS B 92 8.263 -7.220 16.703 1.00 0.68 H new ATOM 0 HG3 LYS B 92 8.646 -5.808 17.668 1.00 0.68 H new ATOM 0 HD2 LYS B 92 6.348 -5.507 17.072 1.00 1.09 H new ATOM 0 HD3 LYS B 92 7.216 -4.442 15.984 1.00 1.09 H new ATOM 0 HE2 LYS B 92 7.154 -6.186 14.197 1.00 1.41 H new ATOM 0 HE3 LYS B 92 6.336 -7.291 15.285 1.00 1.41 H new ATOM 0 HZ1 LYS B 92 4.757 -6.130 13.865 1.00 2.14 H new ATOM 0 HZ2 LYS B 92 4.509 -5.695 15.488 1.00 2.14 H new ATOM 0 HZ3 LYS B 92 5.301 -4.625 14.433 1.00 2.14 H new ATOM 3571 N VAL B 93 12.386 -4.892 14.869 1.00 0.29 N ATOM 3572 CA VAL B 93 13.463 -4.780 13.853 1.00 0.28 C ATOM 3573 C VAL B 93 14.734 -5.445 14.387 1.00 0.29 C ATOM 3574 O VAL B 93 15.439 -6.127 13.669 1.00 0.29 O ATOM 3575 CB VAL B 93 13.736 -3.296 13.572 1.00 0.28 C ATOM 3576 CG1 VAL B 93 15.008 -3.147 12.718 1.00 0.29 C ATOM 3577 CG2 VAL B 93 12.536 -2.696 12.831 1.00 0.28 C ATOM 0 H VAL B 93 12.044 -4.004 15.237 1.00 0.29 H new ATOM 0 HA VAL B 93 13.156 -5.275 12.932 1.00 0.28 H new ATOM 0 HB VAL B 93 13.884 -2.769 14.514 1.00 0.28 H new ATOM 0 HG11 VAL B 93 15.194 -2.091 12.523 1.00 0.29 H new ATOM 0 HG12 VAL B 93 15.857 -3.573 13.253 1.00 0.29 H new ATOM 0 HG13 VAL B 93 14.875 -3.672 11.772 1.00 0.29 H new ATOM 0 HG21 VAL B 93 12.724 -1.642 12.628 1.00 0.28 H new ATOM 0 HG22 VAL B 93 12.388 -3.226 11.890 1.00 0.28 H new ATOM 0 HG23 VAL B 93 11.642 -2.794 13.447 1.00 0.28 H new ATOM 3587 N ASP B 94 15.038 -5.248 15.641 1.00 0.30 N ATOM 3588 CA ASP B 94 16.269 -5.864 16.211 1.00 0.32 C ATOM 3589 C ASP B 94 16.196 -7.391 16.130 1.00 0.33 C ATOM 3590 O ASP B 94 17.179 -8.044 15.834 1.00 0.35 O ATOM 3591 CB ASP B 94 16.425 -5.438 17.671 1.00 0.35 C ATOM 3592 CG ASP B 94 16.785 -3.952 17.735 1.00 1.26 C ATOM 3593 OD1 ASP B 94 17.264 -3.436 16.738 1.00 2.03 O ATOM 3594 OD2 ASP B 94 16.584 -3.359 18.781 1.00 1.96 O ATOM 0 H ASP B 94 14.489 -4.689 16.294 1.00 0.30 H new ATOM 0 HA ASP B 94 17.128 -5.524 15.633 1.00 0.32 H new ATOM 0 HB2 ASP B 94 15.499 -5.622 18.215 1.00 0.35 H new ATOM 0 HB3 ASP B 94 17.201 -6.032 18.153 1.00 0.35 H new ATOM 3599 N PHE B 95 15.055 -7.977 16.388 1.00 0.34 N ATOM 3600 CA PHE B 95 14.970 -9.465 16.315 1.00 0.36 C ATOM 3601 C PHE B 95 15.079 -9.914 14.861 1.00 0.34 C ATOM 3602 O PHE B 95 15.740 -10.885 14.552 1.00 0.35 O ATOM 3603 CB PHE B 95 13.635 -9.950 16.890 1.00 0.39 C ATOM 3604 CG PHE B 95 13.624 -9.767 18.389 1.00 0.43 C ATOM 3605 CD1 PHE B 95 14.439 -10.574 19.194 1.00 0.47 C ATOM 3606 CD2 PHE B 95 12.802 -8.799 18.976 1.00 0.43 C ATOM 3607 CE1 PHE B 95 14.432 -10.413 20.582 1.00 0.51 C ATOM 3608 CE2 PHE B 95 12.794 -8.639 20.367 1.00 0.47 C ATOM 3609 CZ PHE B 95 13.610 -9.446 21.170 1.00 0.51 C ATOM 0 H PHE B 95 14.191 -7.498 16.642 1.00 0.34 H new ATOM 0 HA PHE B 95 15.788 -9.890 16.897 1.00 0.36 H new ATOM 0 HB2 PHE B 95 12.812 -9.394 16.441 1.00 0.39 H new ATOM 0 HB3 PHE B 95 13.482 -11.000 16.642 1.00 0.39 H new ATOM 0 HD1 PHE B 95 15.073 -11.321 18.741 1.00 0.47 H new ATOM 0 HD2 PHE B 95 12.174 -8.176 18.357 1.00 0.43 H new ATOM 0 HE1 PHE B 95 15.061 -11.035 21.201 1.00 0.51 H new ATOM 0 HE2 PHE B 95 12.158 -7.893 20.821 1.00 0.47 H new ATOM 0 HZ PHE B 95 13.605 -9.322 22.243 1.00 0.51 H new ATOM 3619 N LEU B 96 14.452 -9.214 13.958 1.00 0.32 N ATOM 3620 CA LEU B 96 14.550 -9.621 12.533 1.00 0.32 C ATOM 3621 C LEU B 96 15.974 -9.361 12.048 1.00 0.31 C ATOM 3622 O LEU B 96 16.555 -10.159 11.340 1.00 0.32 O ATOM 3623 CB LEU B 96 13.563 -8.808 11.691 1.00 0.32 C ATOM 3624 CG LEU B 96 12.126 -9.058 12.168 1.00 0.33 C ATOM 3625 CD1 LEU B 96 11.169 -8.180 11.356 1.00 0.35 C ATOM 3626 CD2 LEU B 96 11.749 -10.537 11.971 1.00 0.36 C ATOM 0 H LEU B 96 13.883 -8.388 14.143 1.00 0.32 H new ATOM 0 HA LEU B 96 14.309 -10.679 12.433 1.00 0.32 H new ATOM 0 HB2 LEU B 96 13.799 -7.746 11.765 1.00 0.32 H new ATOM 0 HB3 LEU B 96 13.658 -9.083 10.640 1.00 0.32 H new ATOM 0 HG LEU B 96 12.053 -8.812 13.227 1.00 0.33 H new ATOM 0 HD11 LEU B 96 10.146 -8.352 11.689 1.00 0.35 H new ATOM 0 HD12 LEU B 96 11.426 -7.131 11.501 1.00 0.35 H new ATOM 0 HD13 LEU B 96 11.253 -8.431 10.299 1.00 0.35 H new ATOM 0 HD21 LEU B 96 10.727 -10.701 12.313 1.00 0.36 H new ATOM 0 HD22 LEU B 96 11.823 -10.794 10.914 1.00 0.36 H new ATOM 0 HD23 LEU B 96 12.429 -11.166 12.546 1.00 0.36 H new ATOM 3638 N GLU B 97 16.548 -8.255 12.442 1.00 0.31 N ATOM 3639 CA GLU B 97 17.943 -7.951 12.024 1.00 0.32 C ATOM 3640 C GLU B 97 18.864 -9.055 12.544 1.00 0.33 C ATOM 3641 O GLU B 97 19.668 -9.605 11.816 1.00 0.35 O ATOM 3642 CB GLU B 97 18.365 -6.599 12.609 1.00 0.34 C ATOM 3643 CG GLU B 97 19.784 -6.247 12.151 1.00 0.95 C ATOM 3644 CD GLU B 97 20.188 -4.895 12.744 1.00 1.23 C ATOM 3645 OE1 GLU B 97 19.328 -4.234 13.304 1.00 1.69 O ATOM 3646 OE2 GLU B 97 21.349 -4.542 12.626 1.00 1.86 O ATOM 0 H GLU B 97 16.109 -7.551 13.035 1.00 0.31 H new ATOM 0 HA GLU B 97 18.008 -7.903 10.937 1.00 0.32 H new ATOM 0 HB2 GLU B 97 17.669 -5.823 12.291 1.00 0.34 H new ATOM 0 HB3 GLU B 97 18.325 -6.636 13.698 1.00 0.34 H new ATOM 0 HG2 GLU B 97 20.483 -7.020 12.470 1.00 0.95 H new ATOM 0 HG3 GLU B 97 19.827 -6.207 11.063 1.00 0.95 H new ATOM 3653 N GLU B 98 18.752 -9.382 13.806 1.00 0.34 N ATOM 3654 CA GLU B 98 19.617 -10.451 14.376 1.00 0.37 C ATOM 3655 C GLU B 98 19.343 -11.765 13.646 1.00 0.36 C ATOM 3656 O GLU B 98 20.251 -12.495 13.299 1.00 0.37 O ATOM 3657 CB GLU B 98 19.318 -10.614 15.870 1.00 0.40 C ATOM 3658 CG GLU B 98 20.242 -11.679 16.464 1.00 1.18 C ATOM 3659 CD GLU B 98 20.008 -11.770 17.972 1.00 1.33 C ATOM 3660 OE1 GLU B 98 19.257 -10.956 18.483 1.00 1.78 O ATOM 3661 OE2 GLU B 98 20.583 -12.651 18.590 1.00 1.85 O ATOM 0 H GLU B 98 18.099 -8.954 14.463 1.00 0.34 H new ATOM 0 HA GLU B 98 20.665 -10.179 14.251 1.00 0.37 H new ATOM 0 HB2 GLU B 98 19.462 -9.665 16.386 1.00 0.40 H new ATOM 0 HB3 GLU B 98 18.276 -10.901 16.014 1.00 0.40 H new ATOM 0 HG2 GLU B 98 20.050 -12.645 15.996 1.00 1.18 H new ATOM 0 HG3 GLU B 98 21.283 -11.427 16.261 1.00 1.18 H new ATOM 3668 N ASN B 99 18.098 -12.073 13.405 1.00 0.35 N ATOM 3669 CA ASN B 99 17.775 -13.339 12.695 1.00 0.35 C ATOM 3670 C ASN B 99 18.439 -13.312 11.318 1.00 0.33 C ATOM 3671 O ASN B 99 19.074 -14.259 10.905 1.00 0.34 O ATOM 3672 CB ASN B 99 16.257 -13.460 12.530 1.00 0.36 C ATOM 3673 CG ASN B 99 15.918 -14.763 11.805 1.00 1.25 C ATOM 3674 OD1 ASN B 99 15.740 -14.777 10.603 1.00 2.16 O ATOM 3675 ND2 ASN B 99 15.814 -15.867 12.493 1.00 1.82 N ATOM 0 H ASN B 99 17.294 -11.504 13.669 1.00 0.35 H new ATOM 0 HA ASN B 99 18.141 -14.191 13.268 1.00 0.35 H new ATOM 0 HB2 ASN B 99 15.773 -13.440 13.506 1.00 0.36 H new ATOM 0 HB3 ASN B 99 15.874 -12.609 11.967 1.00 0.36 H new ATOM 0 HD21 ASN B 99 15.583 -16.742 12.022 1.00 1.82 H new ATOM 0 HD22 ASN B 99 15.963 -15.855 13.502 1.00 1.82 H new ATOM 3682 N ILE B 100 18.308 -12.223 10.610 1.00 0.31 N ATOM 3683 CA ILE B 100 18.941 -12.134 9.266 1.00 0.30 C ATOM 3684 C ILE B 100 20.455 -12.310 9.410 1.00 0.31 C ATOM 3685 O ILE B 100 21.061 -13.094 8.711 1.00 0.32 O ATOM 3686 CB ILE B 100 18.627 -10.768 8.648 1.00 0.28 C ATOM 3687 CG1 ILE B 100 17.138 -10.715 8.292 1.00 0.29 C ATOM 3688 CG2 ILE B 100 19.469 -10.555 7.380 1.00 0.28 C ATOM 3689 CD1 ILE B 100 16.741 -9.272 7.978 1.00 0.30 C ATOM 0 H ILE B 100 17.791 -11.394 10.904 1.00 0.31 H new ATOM 0 HA ILE B 100 18.549 -12.917 8.617 1.00 0.30 H new ATOM 0 HB ILE B 100 18.867 -9.982 9.364 1.00 0.28 H new ATOM 0 HG12 ILE B 100 16.935 -11.355 7.433 1.00 0.29 H new ATOM 0 HG13 ILE B 100 16.541 -11.096 9.121 1.00 0.29 H new ATOM 0 HG21 ILE B 100 19.238 -9.581 6.949 1.00 0.28 H new ATOM 0 HG22 ILE B 100 20.528 -10.597 7.635 1.00 0.28 H new ATOM 0 HG23 ILE B 100 19.239 -11.336 6.655 1.00 0.28 H new ATOM 0 HD11 ILE B 100 15.682 -9.233 7.724 1.00 0.30 H new ATOM 0 HD12 ILE B 100 16.929 -8.645 8.850 1.00 0.30 H new ATOM 0 HD13 ILE B 100 17.329 -8.908 7.136 1.00 0.30 H new ATOM 3701 N THR B 101 21.072 -11.598 10.315 1.00 0.33 N ATOM 3702 CA THR B 101 22.546 -11.747 10.485 1.00 0.36 C ATOM 3703 C THR B 101 22.864 -13.195 10.859 1.00 0.38 C ATOM 3704 O THR B 101 23.792 -13.789 10.345 1.00 0.40 O ATOM 3705 CB THR B 101 23.035 -10.823 11.603 1.00 0.39 C ATOM 3706 OG1 THR B 101 22.297 -11.082 12.786 1.00 0.40 O ATOM 3707 CG2 THR B 101 22.844 -9.364 11.191 1.00 0.39 C ATOM 0 H THR B 101 20.624 -10.926 10.938 1.00 0.33 H new ATOM 0 HA THR B 101 23.045 -11.483 9.553 1.00 0.36 H new ATOM 0 HB THR B 101 24.094 -11.008 11.785 1.00 0.39 H new ATOM 0 HG1 THR B 101 21.478 -11.570 12.560 1.00 0.40 H new ATOM 0 HG21 THR B 101 23.194 -8.711 11.991 1.00 0.39 H new ATOM 0 HG22 THR B 101 23.415 -9.164 10.284 1.00 0.39 H new ATOM 0 HG23 THR B 101 21.787 -9.174 11.004 1.00 0.39 H new ATOM 3715 N ALA B 102 22.098 -13.770 11.746 1.00 0.38 N ATOM 3716 CA ALA B 102 22.352 -15.181 12.141 1.00 0.41 C ATOM 3717 C ALA B 102 22.191 -16.081 10.918 1.00 0.40 C ATOM 3718 O ALA B 102 23.012 -16.934 10.646 1.00 0.42 O ATOM 3719 CB ALA B 102 21.355 -15.602 13.221 1.00 0.43 C ATOM 0 H ALA B 102 21.309 -13.323 12.213 1.00 0.38 H new ATOM 0 HA ALA B 102 23.365 -15.273 12.534 1.00 0.41 H new ATOM 0 HB1 ALA B 102 21.544 -16.636 13.508 1.00 0.43 H new ATOM 0 HB2 ALA B 102 21.469 -14.957 14.092 1.00 0.43 H new ATOM 0 HB3 ALA B 102 20.340 -15.513 12.834 1.00 0.43 H new ATOM 3725 N LEU B 103 21.135 -15.895 10.174 1.00 0.37 N ATOM 3726 CA LEU B 103 20.925 -16.738 8.968 1.00 0.36 C ATOM 3727 C LEU B 103 22.033 -16.449 7.949 1.00 0.34 C ATOM 3728 O LEU B 103 22.557 -17.349 7.321 1.00 0.36 O ATOM 3729 CB LEU B 103 19.569 -16.402 8.341 1.00 0.34 C ATOM 3730 CG LEU B 103 18.410 -16.887 9.228 1.00 0.35 C ATOM 3731 CD1 LEU B 103 17.088 -16.405 8.621 1.00 0.37 C ATOM 3732 CD2 LEU B 103 18.405 -18.425 9.324 1.00 0.43 C ATOM 0 H LEU B 103 20.412 -15.197 10.350 1.00 0.37 H new ATOM 0 HA LEU B 103 20.948 -17.790 9.252 1.00 0.36 H new ATOM 0 HB2 LEU B 103 19.491 -15.325 8.193 1.00 0.34 H new ATOM 0 HB3 LEU B 103 19.496 -16.865 7.357 1.00 0.34 H new ATOM 0 HG LEU B 103 18.534 -16.481 10.232 1.00 0.35 H new ATOM 0 HD11 LEU B 103 16.258 -16.743 9.242 1.00 0.37 H new ATOM 0 HD12 LEU B 103 17.085 -15.316 8.573 1.00 0.37 H new ATOM 0 HD13 LEU B 103 16.979 -16.813 7.616 1.00 0.37 H new ATOM 0 HD21 LEU B 103 17.577 -18.747 9.956 1.00 0.43 H new ATOM 0 HD22 LEU B 103 18.288 -18.851 8.328 1.00 0.43 H new ATOM 0 HD23 LEU B 103 19.346 -18.766 9.756 1.00 0.43 H new ATOM 3744 N LEU B 104 22.408 -15.206 7.784 1.00 0.33 N ATOM 3745 CA LEU B 104 23.492 -14.893 6.808 1.00 0.33 C ATOM 3746 C LEU B 104 24.780 -15.579 7.246 1.00 0.37 C ATOM 3747 O LEU B 104 25.513 -16.109 6.439 1.00 0.39 O ATOM 3748 CB LEU B 104 23.724 -13.378 6.740 1.00 0.33 C ATOM 3749 CG LEU B 104 22.551 -12.687 6.029 1.00 0.29 C ATOM 3750 CD1 LEU B 104 22.667 -11.173 6.242 1.00 0.31 C ATOM 3751 CD2 LEU B 104 22.581 -12.998 4.518 1.00 0.28 C ATOM 0 H LEU B 104 22.015 -14.404 8.277 1.00 0.33 H new ATOM 0 HA LEU B 104 23.196 -15.253 5.823 1.00 0.33 H new ATOM 0 HB2 LEU B 104 23.835 -12.975 7.747 1.00 0.33 H new ATOM 0 HB3 LEU B 104 24.653 -13.170 6.209 1.00 0.33 H new ATOM 0 HG LEU B 104 21.612 -13.054 6.442 1.00 0.29 H new ATOM 0 HD11 LEU B 104 21.839 -10.671 5.742 1.00 0.31 H new ATOM 0 HD12 LEU B 104 22.634 -10.952 7.309 1.00 0.31 H new ATOM 0 HD13 LEU B 104 23.611 -10.818 5.827 1.00 0.31 H new ATOM 0 HD21 LEU B 104 21.744 -12.501 4.028 1.00 0.28 H new ATOM 0 HD22 LEU B 104 23.517 -12.638 4.091 1.00 0.28 H new ATOM 0 HD23 LEU B 104 22.504 -14.075 4.367 1.00 0.28 H new ATOM 3763 N GLU B 105 25.066 -15.585 8.519 1.00 0.40 N ATOM 3764 CA GLU B 105 26.314 -16.249 8.980 1.00 0.45 C ATOM 3765 C GLU B 105 26.258 -17.727 8.587 1.00 0.46 C ATOM 3766 O GLU B 105 27.223 -18.286 8.109 1.00 0.48 O ATOM 3767 CB GLU B 105 26.444 -16.110 10.500 1.00 0.49 C ATOM 3768 CG GLU B 105 27.736 -16.789 10.970 1.00 0.53 C ATOM 3769 CD GLU B 105 27.883 -16.621 12.483 1.00 1.15 C ATOM 3770 OE1 GLU B 105 27.114 -15.865 13.053 1.00 1.82 O ATOM 3771 OE2 GLU B 105 28.759 -17.257 13.047 1.00 1.84 O ATOM 0 H GLU B 105 24.495 -15.163 9.252 1.00 0.40 H new ATOM 0 HA GLU B 105 27.180 -15.780 8.514 1.00 0.45 H new ATOM 0 HB2 GLU B 105 26.452 -15.056 10.780 1.00 0.49 H new ATOM 0 HB3 GLU B 105 25.583 -16.563 10.992 1.00 0.49 H new ATOM 0 HG2 GLU B 105 27.717 -17.848 10.712 1.00 0.53 H new ATOM 0 HG3 GLU B 105 28.595 -16.352 10.460 1.00 0.53 H new ATOM 3778 N GLU B 106 25.130 -18.359 8.764 1.00 0.45 N ATOM 3779 CA GLU B 106 25.026 -19.792 8.376 1.00 0.47 C ATOM 3780 C GLU B 106 25.071 -19.883 6.853 1.00 0.44 C ATOM 3781 O GLU B 106 25.687 -20.763 6.287 1.00 0.46 O ATOM 3782 CB GLU B 106 23.698 -20.367 8.878 1.00 0.48 C ATOM 3783 CG GLU B 106 23.723 -20.469 10.404 1.00 1.17 C ATOM 3784 CD GLU B 106 24.723 -21.545 10.832 1.00 1.66 C ATOM 3785 OE1 GLU B 106 25.032 -22.397 10.016 1.00 2.26 O ATOM 3786 OE2 GLU B 106 25.160 -21.499 11.971 1.00 2.27 O ATOM 0 H GLU B 106 24.283 -17.948 9.157 1.00 0.45 H new ATOM 0 HA GLU B 106 25.848 -20.357 8.814 1.00 0.47 H new ATOM 0 HB2 GLU B 106 22.872 -19.731 8.560 1.00 0.48 H new ATOM 0 HB3 GLU B 106 23.529 -21.351 8.441 1.00 0.48 H new ATOM 0 HG2 GLU B 106 24.000 -19.508 10.838 1.00 1.17 H new ATOM 0 HG3 GLU B 106 22.729 -20.713 10.778 1.00 1.17 H new ATOM 3793 N ALA B 107 24.418 -18.970 6.187 1.00 0.39 N ATOM 3794 CA ALA B 107 24.418 -18.991 4.701 1.00 0.37 C ATOM 3795 C ALA B 107 25.847 -18.808 4.187 1.00 0.40 C ATOM 3796 O ALA B 107 26.298 -19.523 3.314 1.00 0.41 O ATOM 3797 CB ALA B 107 23.531 -17.862 4.172 1.00 0.34 C ATOM 0 H ALA B 107 23.885 -18.211 6.610 1.00 0.39 H new ATOM 0 HA ALA B 107 24.029 -19.947 4.352 1.00 0.37 H new ATOM 0 HB1 ALA B 107 23.532 -17.879 3.082 1.00 0.34 H new ATOM 0 HB2 ALA B 107 22.513 -17.998 4.536 1.00 0.34 H new ATOM 0 HB3 ALA B 107 23.916 -16.903 4.521 1.00 0.34 H new ATOM 3803 N GLN B 108 26.570 -17.858 4.723 1.00 0.42 N ATOM 3804 CA GLN B 108 27.970 -17.646 4.260 1.00 0.46 C ATOM 3805 C GLN B 108 28.775 -18.919 4.505 1.00 0.50 C ATOM 3806 O GLN B 108 29.481 -19.398 3.639 1.00 0.53 O ATOM 3807 CB GLN B 108 28.602 -16.488 5.038 1.00 0.50 C ATOM 3808 CG GLN B 108 27.961 -15.162 4.619 1.00 0.48 C ATOM 3809 CD GLN B 108 28.597 -14.021 5.418 1.00 0.98 C ATOM 3810 OE1 GLN B 108 29.797 -13.996 5.613 1.00 1.68 O ATOM 3811 NE2 GLN B 108 27.838 -13.076 5.901 1.00 1.58 N ATOM 0 H GLN B 108 26.252 -17.225 5.457 1.00 0.42 H new ATOM 0 HA GLN B 108 27.970 -17.407 3.197 1.00 0.46 H new ATOM 0 HB2 GLN B 108 28.469 -16.643 6.109 1.00 0.50 H new ATOM 0 HB3 GLN B 108 29.675 -16.457 4.852 1.00 0.50 H new ATOM 0 HG2 GLN B 108 28.103 -14.997 3.551 1.00 0.48 H new ATOM 0 HG3 GLN B 108 26.886 -15.192 4.797 1.00 0.48 H new ATOM 0 HE21 GLN B 108 26.831 -13.097 5.738 1.00 1.58 H new ATOM 0 HE22 GLN B 108 28.251 -12.316 6.442 1.00 1.58 H new ATOM 3820 N ILE B 109 28.675 -19.471 5.680 1.00 0.52 N ATOM 3821 CA ILE B 109 29.429 -20.714 5.983 1.00 0.57 C ATOM 3822 C ILE B 109 29.000 -21.820 5.016 1.00 0.56 C ATOM 3823 O ILE B 109 29.821 -22.476 4.408 1.00 0.58 O ATOM 3824 CB ILE B 109 29.143 -21.139 7.424 1.00 0.61 C ATOM 3825 CG1 ILE B 109 29.768 -20.120 8.375 1.00 0.64 C ATOM 3826 CG2 ILE B 109 29.756 -22.517 7.683 1.00 0.67 C ATOM 3827 CD1 ILE B 109 29.248 -20.354 9.793 1.00 0.67 C ATOM 0 H ILE B 109 28.102 -19.113 6.444 1.00 0.52 H new ATOM 0 HA ILE B 109 30.498 -20.535 5.866 1.00 0.57 H new ATOM 0 HB ILE B 109 28.066 -21.187 7.586 1.00 0.61 H new ATOM 0 HG12 ILE B 109 30.854 -20.209 8.356 1.00 0.64 H new ATOM 0 HG13 ILE B 109 29.525 -19.108 8.050 1.00 0.64 H new ATOM 0 HG21 ILE B 109 29.552 -22.819 8.710 1.00 0.67 H new ATOM 0 HG22 ILE B 109 29.320 -23.244 6.998 1.00 0.67 H new ATOM 0 HG23 ILE B 109 30.834 -22.471 7.526 1.00 0.67 H new ATOM 0 HD11 ILE B 109 29.695 -19.626 10.469 1.00 0.67 H new ATOM 0 HD12 ILE B 109 28.164 -20.243 9.806 1.00 0.67 H new ATOM 0 HD13 ILE B 109 29.513 -21.360 10.116 1.00 0.67 H new ATOM 3839 N GLN B 110 27.718 -22.036 4.874 1.00 0.52 N ATOM 3840 CA GLN B 110 27.237 -23.103 3.948 1.00 0.52 C ATOM 3841 C GLN B 110 27.603 -22.750 2.506 1.00 0.48 C ATOM 3842 O GLN B 110 27.987 -23.601 1.729 1.00 0.50 O ATOM 3843 CB GLN B 110 25.714 -23.229 4.073 1.00 0.50 C ATOM 3844 CG GLN B 110 25.195 -24.321 3.130 1.00 1.17 C ATOM 3845 CD GLN B 110 23.686 -24.469 3.318 1.00 1.46 C ATOM 3846 OE1 GLN B 110 23.125 -23.942 4.258 1.00 2.12 O ATOM 3847 NE2 GLN B 110 22.998 -25.153 2.447 1.00 1.93 N ATOM 0 H GLN B 110 26.984 -21.520 5.359 1.00 0.52 H new ATOM 0 HA GLN B 110 27.710 -24.049 4.212 1.00 0.52 H new ATOM 0 HB2 GLN B 110 25.445 -23.468 5.102 1.00 0.50 H new ATOM 0 HB3 GLN B 110 25.242 -22.276 3.833 1.00 0.50 H new ATOM 0 HG2 GLN B 110 25.421 -24.063 2.095 1.00 1.17 H new ATOM 0 HG3 GLN B 110 25.694 -25.267 3.339 1.00 1.17 H new ATOM 0 HE21 GLN B 110 23.470 -25.595 1.658 1.00 1.93 H new ATOM 0 HE22 GLN B 110 21.988 -25.246 2.554 1.00 1.93 H new ATOM 3856 N GLN B 111 27.479 -21.505 2.140 1.00 0.45 N ATOM 3857 CA GLN B 111 27.811 -21.104 0.745 1.00 0.43 C ATOM 3858 C GLN B 111 29.275 -21.425 0.447 1.00 0.49 C ATOM 3859 O GLN B 111 29.601 -22.002 -0.572 1.00 0.49 O ATOM 3860 CB GLN B 111 27.563 -19.606 0.571 1.00 0.42 C ATOM 3861 CG GLN B 111 27.667 -19.241 -0.913 1.00 0.42 C ATOM 3862 CD GLN B 111 26.482 -19.841 -1.675 1.00 0.38 C ATOM 3863 OE1 GLN B 111 25.358 -19.782 -1.214 1.00 0.37 O ATOM 3864 NE2 GLN B 111 26.684 -20.417 -2.832 1.00 0.40 N ATOM 0 H GLN B 111 27.162 -20.748 2.746 1.00 0.45 H new ATOM 0 HA GLN B 111 27.178 -21.657 0.051 1.00 0.43 H new ATOM 0 HB2 GLN B 111 26.577 -19.343 0.953 1.00 0.42 H new ATOM 0 HB3 GLN B 111 28.291 -19.036 1.149 1.00 0.42 H new ATOM 0 HG2 GLN B 111 27.677 -18.157 -1.031 1.00 0.42 H new ATOM 0 HG3 GLN B 111 28.604 -19.615 -1.325 1.00 0.42 H new ATOM 0 HE21 GLN B 111 27.626 -20.467 -3.219 1.00 0.40 H new ATOM 0 HE22 GLN B 111 25.899 -20.816 -3.347 1.00 0.40 H new ATOM 3873 N GLU B 112 30.164 -21.046 1.323 1.00 0.54 N ATOM 3874 CA GLU B 112 31.606 -21.326 1.085 1.00 0.60 C ATOM 3875 C GLU B 112 31.820 -22.837 0.973 1.00 0.62 C ATOM 3876 O GLU B 112 32.562 -23.307 0.136 1.00 0.64 O ATOM 3877 CB GLU B 112 32.436 -20.779 2.249 1.00 0.66 C ATOM 3878 CG GLU B 112 33.922 -20.856 1.893 1.00 1.29 C ATOM 3879 CD GLU B 112 34.759 -20.310 3.051 1.00 1.72 C ATOM 3880 OE1 GLU B 112 34.175 -19.758 3.969 1.00 2.25 O ATOM 3881 OE2 GLU B 112 35.969 -20.459 3.001 1.00 2.27 O ATOM 0 H GLU B 112 29.954 -20.555 2.192 1.00 0.54 H new ATOM 0 HA GLU B 112 31.919 -20.843 0.159 1.00 0.60 H new ATOM 0 HB2 GLU B 112 32.154 -19.747 2.458 1.00 0.66 H new ATOM 0 HB3 GLU B 112 32.237 -21.354 3.154 1.00 0.66 H new ATOM 0 HG2 GLU B 112 34.203 -21.888 1.684 1.00 1.29 H new ATOM 0 HG3 GLU B 112 34.119 -20.282 0.987 1.00 1.29 H new ATOM 3888 N LYS B 113 31.178 -23.604 1.816 1.00 0.62 N ATOM 3889 CA LYS B 113 31.356 -25.082 1.751 1.00 0.65 C ATOM 3890 C LYS B 113 30.893 -25.601 0.390 1.00 0.60 C ATOM 3891 O LYS B 113 31.513 -26.466 -0.195 1.00 0.63 O ATOM 3892 CB LYS B 113 30.536 -25.756 2.853 1.00 0.68 C ATOM 3893 CG LYS B 113 31.160 -25.450 4.214 1.00 0.75 C ATOM 3894 CD LYS B 113 30.338 -26.125 5.310 1.00 1.28 C ATOM 3895 CE LYS B 113 30.954 -25.817 6.675 1.00 1.53 C ATOM 3896 NZ LYS B 113 32.205 -26.609 6.855 1.00 2.10 N ATOM 0 H LYS B 113 30.543 -23.272 2.542 1.00 0.62 H new ATOM 0 HA LYS B 113 32.412 -25.315 1.890 1.00 0.65 H new ATOM 0 HB2 LYS B 113 29.507 -25.399 2.825 1.00 0.68 H new ATOM 0 HB3 LYS B 113 30.504 -26.833 2.690 1.00 0.68 H new ATOM 0 HG2 LYS B 113 32.189 -25.807 4.243 1.00 0.75 H new ATOM 0 HG3 LYS B 113 31.192 -24.373 4.378 1.00 0.75 H new ATOM 0 HD2 LYS B 113 29.308 -25.771 5.276 1.00 1.28 H new ATOM 0 HD3 LYS B 113 30.310 -27.202 5.147 1.00 1.28 H new ATOM 0 HE2 LYS B 113 31.172 -24.752 6.754 1.00 1.53 H new ATOM 0 HE3 LYS B 113 30.244 -26.056 7.467 1.00 1.53 H new ATOM 0 HZ1 LYS B 113 32.528 -26.529 7.840 1.00 2.10 H new ATOM 0 HZ2 LYS B 113 32.019 -27.608 6.632 1.00 2.10 H new ATOM 0 HZ3 LYS B 113 32.942 -26.244 6.218 1.00 2.10 H new ATOM 3910 N ASN B 114 29.809 -25.085 -0.123 1.00 0.53 N ATOM 3911 CA ASN B 114 29.327 -25.564 -1.449 1.00 0.49 C ATOM 3912 C ASN B 114 30.395 -25.309 -2.510 1.00 0.49 C ATOM 3913 O ASN B 114 30.747 -26.188 -3.271 1.00 0.50 O ATOM 3914 CB ASN B 114 28.038 -24.831 -1.822 1.00 0.44 C ATOM 3915 CG ASN B 114 26.897 -25.326 -0.930 1.00 0.46 C ATOM 3916 OD1 ASN B 114 26.255 -24.547 -0.254 1.00 1.19 O ATOM 3917 ND2 ASN B 114 26.621 -26.602 -0.897 1.00 1.18 N ATOM 0 H ASN B 114 29.241 -24.359 0.314 1.00 0.53 H new ATOM 0 HA ASN B 114 29.128 -26.634 -1.395 1.00 0.49 H new ATOM 0 HB2 ASN B 114 28.170 -23.756 -1.700 1.00 0.44 H new ATOM 0 HB3 ASN B 114 27.797 -25.006 -2.871 1.00 0.44 H new ATOM 0 HD21 ASN B 114 25.866 -26.945 -0.303 1.00 1.18 H new ATOM 0 HD22 ASN B 114 27.160 -27.255 -1.465 1.00 1.18 H new ATOM 3924 N MET B 115 30.922 -24.116 -2.568 1.00 0.50 N ATOM 3925 CA MET B 115 31.972 -23.828 -3.582 1.00 0.54 C ATOM 3926 C MET B 115 33.209 -24.665 -3.263 1.00 0.61 C ATOM 3927 O MET B 115 33.847 -25.210 -4.137 1.00 0.63 O ATOM 3928 CB MET B 115 32.329 -22.340 -3.541 1.00 0.57 C ATOM 3929 CG MET B 115 33.342 -22.021 -4.644 1.00 0.72 C ATOM 3930 SD MET B 115 33.787 -20.266 -4.569 1.00 0.94 S ATOM 3931 CE MET B 115 34.653 -20.301 -2.979 1.00 1.46 C ATOM 0 H MET B 115 30.672 -23.335 -1.961 1.00 0.50 H new ATOM 0 HA MET B 115 31.606 -24.078 -4.578 1.00 0.54 H new ATOM 0 HB2 MET B 115 31.431 -21.737 -3.674 1.00 0.57 H new ATOM 0 HB3 MET B 115 32.745 -22.083 -2.567 1.00 0.57 H new ATOM 0 HG2 MET B 115 34.232 -22.638 -4.524 1.00 0.72 H new ATOM 0 HG3 MET B 115 32.919 -22.258 -5.620 1.00 0.72 H new ATOM 0 HE1 MET B 115 35.419 -19.526 -2.965 1.00 1.46 H new ATOM 0 HE2 MET B 115 33.941 -20.123 -2.173 1.00 1.46 H new ATOM 0 HE3 MET B 115 35.121 -21.276 -2.841 1.00 1.46 H new ATOM 3941 N TYR B 116 33.549 -24.771 -2.008 1.00 0.65 N ATOM 3942 CA TYR B 116 34.740 -25.575 -1.624 1.00 0.73 C ATOM 3943 C TYR B 116 34.544 -27.024 -2.079 1.00 0.72 C ATOM 3944 O TYR B 116 35.407 -27.614 -2.699 1.00 0.76 O ATOM 3945 CB TYR B 116 34.918 -25.523 -0.106 1.00 0.78 C ATOM 3946 CG TYR B 116 36.130 -26.326 0.297 1.00 0.87 C ATOM 3947 CD1 TYR B 116 37.382 -25.707 0.362 1.00 0.95 C ATOM 3948 CD2 TYR B 116 36.000 -27.683 0.616 1.00 0.91 C ATOM 3949 CE1 TYR B 116 38.508 -26.445 0.744 1.00 1.05 C ATOM 3950 CE2 TYR B 116 37.125 -28.420 0.998 1.00 1.01 C ATOM 3951 CZ TYR B 116 38.378 -27.801 1.061 1.00 1.07 C ATOM 3952 OH TYR B 116 39.487 -28.530 1.434 1.00 1.18 O ATOM 0 H TYR B 116 33.052 -24.334 -1.232 1.00 0.65 H new ATOM 0 HA TYR B 116 35.630 -25.168 -2.103 1.00 0.73 H new ATOM 0 HB2 TYR B 116 35.031 -24.489 0.220 1.00 0.78 H new ATOM 0 HB3 TYR B 116 34.029 -25.917 0.387 1.00 0.78 H new ATOM 0 HD1 TYR B 116 37.480 -24.660 0.117 1.00 0.95 H new ATOM 0 HD2 TYR B 116 35.032 -28.160 0.567 1.00 0.91 H new ATOM 0 HE1 TYR B 116 39.476 -25.968 0.794 1.00 1.05 H new ATOM 0 HE2 TYR B 116 37.027 -29.467 1.244 1.00 1.01 H new ATOM 0 HH TYR B 116 39.223 -29.455 1.621 1.00 1.18 H new ATOM 3962 N GLU B 117 33.414 -27.607 -1.771 1.00 0.68 N ATOM 3963 CA GLU B 117 33.174 -29.017 -2.187 1.00 0.68 C ATOM 3964 C GLU B 117 33.198 -29.105 -3.713 1.00 0.64 C ATOM 3965 O GLU B 117 33.730 -30.038 -4.282 1.00 0.68 O ATOM 3966 CB GLU B 117 31.809 -29.475 -1.668 1.00 0.66 C ATOM 3967 CG GLU B 117 31.864 -29.618 -0.146 1.00 0.72 C ATOM 3968 CD GLU B 117 30.464 -29.924 0.391 1.00 0.73 C ATOM 3969 OE1 GLU B 117 29.551 -30.026 -0.413 1.00 1.29 O ATOM 3970 OE2 GLU B 117 30.329 -30.056 1.596 1.00 1.28 O ATOM 0 H GLU B 117 32.653 -27.169 -1.252 1.00 0.68 H new ATOM 0 HA GLU B 117 33.952 -29.659 -1.774 1.00 0.68 H new ATOM 0 HB2 GLU B 117 31.041 -28.754 -1.949 1.00 0.66 H new ATOM 0 HB3 GLU B 117 31.535 -30.427 -2.124 1.00 0.66 H new ATOM 0 HG2 GLU B 117 32.553 -30.416 0.130 1.00 0.72 H new ATOM 0 HG3 GLU B 117 32.244 -28.700 0.302 1.00 0.72 H new ATOM 3977 N LEU B 118 32.627 -28.135 -4.380 1.00 0.58 N ATOM 3978 CA LEU B 118 32.612 -28.151 -5.872 1.00 0.56 C ATOM 3979 C LEU B 118 34.047 -28.154 -6.399 1.00 0.64 C ATOM 3980 O LEU B 118 34.370 -28.852 -7.340 1.00 0.67 O ATOM 3981 CB LEU B 118 31.861 -26.916 -6.394 1.00 0.51 C ATOM 3982 CG LEU B 118 31.834 -26.910 -7.931 1.00 0.52 C ATOM 3983 CD1 LEU B 118 31.115 -28.165 -8.457 1.00 0.53 C ATOM 3984 CD2 LEU B 118 31.093 -25.653 -8.405 1.00 0.53 C ATOM 0 H LEU B 118 32.169 -27.330 -3.953 1.00 0.58 H new ATOM 0 HA LEU B 118 32.103 -29.050 -6.221 1.00 0.56 H new ATOM 0 HB2 LEU B 118 30.842 -26.913 -6.007 1.00 0.51 H new ATOM 0 HB3 LEU B 118 32.344 -26.009 -6.030 1.00 0.51 H new ATOM 0 HG LEU B 118 32.855 -26.910 -8.313 1.00 0.52 H new ATOM 0 HD11 LEU B 118 31.103 -28.148 -9.547 1.00 0.53 H new ATOM 0 HD12 LEU B 118 31.641 -29.056 -8.114 1.00 0.53 H new ATOM 0 HD13 LEU B 118 30.091 -28.181 -8.083 1.00 0.53 H new ATOM 0 HD21 LEU B 118 31.066 -25.636 -9.495 1.00 0.53 H new ATOM 0 HD22 LEU B 118 30.074 -25.663 -8.017 1.00 0.53 H new ATOM 0 HD23 LEU B 118 31.611 -24.766 -8.041 1.00 0.53 H new ATOM 3996 N GLN B 119 34.915 -27.385 -5.800 1.00 0.71 N ATOM 3997 CA GLN B 119 36.327 -27.358 -6.272 1.00 0.81 C ATOM 3998 C GLN B 119 36.922 -28.761 -6.152 1.00 0.86 C ATOM 3999 O GLN B 119 37.650 -29.211 -7.014 1.00 0.92 O ATOM 4000 CB GLN B 119 37.133 -26.384 -5.407 1.00 0.88 C ATOM 4001 CG GLN B 119 36.710 -24.945 -5.716 1.00 0.87 C ATOM 4002 CD GLN B 119 37.503 -23.975 -4.837 1.00 0.95 C ATOM 4003 OE1 GLN B 119 38.139 -24.432 -3.793 1.00 1.29 O flip ATOM 4004 NE2 GLN B 119 37.542 -22.790 -5.100 1.00 1.45 N flip ATOM 0 H GLN B 119 34.708 -26.777 -5.008 1.00 0.71 H new ATOM 0 HA GLN B 119 36.363 -27.033 -7.312 1.00 0.81 H new ATOM 0 HB2 GLN B 119 36.972 -26.602 -4.351 1.00 0.88 H new ATOM 0 HB3 GLN B 119 38.199 -26.509 -5.599 1.00 0.88 H new ATOM 0 HG2 GLN B 119 36.884 -24.723 -6.769 1.00 0.87 H new ATOM 0 HG3 GLN B 119 35.642 -24.823 -5.537 1.00 0.87 H new ATOM 0 HE21 GLN B 119 37.045 -22.432 -5.916 1.00 1.45 H new ATOM 0 HE22 GLN B 119 38.072 -22.153 -4.505 1.00 1.45 H new ATOM 4013 N LYS B 120 36.615 -29.457 -5.091 1.00 0.86 N ATOM 4014 CA LYS B 120 37.162 -30.832 -4.917 1.00 0.93 C ATOM 4015 C LYS B 120 36.666 -31.718 -6.058 1.00 0.90 C ATOM 4016 O LYS B 120 37.399 -32.527 -6.590 1.00 0.99 O ATOM 4017 CB LYS B 120 36.706 -31.415 -3.571 1.00 0.95 C ATOM 4018 CG LYS B 120 37.372 -30.662 -2.407 1.00 1.01 C ATOM 4019 CD LYS B 120 38.818 -31.138 -2.208 1.00 1.57 C ATOM 4020 CE LYS B 120 39.366 -30.560 -0.901 1.00 1.89 C ATOM 4021 NZ LYS B 120 40.768 -31.026 -0.702 1.00 2.45 N ATOM 0 H LYS B 120 36.009 -29.132 -4.337 1.00 0.86 H new ATOM 0 HA LYS B 120 38.251 -30.791 -4.931 1.00 0.93 H new ATOM 0 HB2 LYS B 120 35.622 -31.344 -3.485 1.00 0.95 H new ATOM 0 HB3 LYS B 120 36.961 -32.474 -3.521 1.00 0.95 H new ATOM 0 HG2 LYS B 120 37.361 -29.591 -2.607 1.00 1.01 H new ATOM 0 HG3 LYS B 120 36.802 -30.821 -1.491 1.00 1.01 H new ATOM 0 HD2 LYS B 120 38.854 -32.227 -2.181 1.00 1.57 H new ATOM 0 HD3 LYS B 120 39.436 -30.820 -3.047 1.00 1.57 H new ATOM 0 HE2 LYS B 120 39.334 -29.471 -0.931 1.00 1.89 H new ATOM 0 HE3 LYS B 120 38.744 -30.874 -0.063 1.00 1.89 H new ATOM 0 HZ1 LYS B 120 41.141 -30.634 0.186 1.00 2.45 H new ATOM 0 HZ2 LYS B 120 40.785 -32.065 -0.656 1.00 2.45 H new ATOM 0 HZ3 LYS B 120 41.357 -30.705 -1.497 1.00 2.45 H new ATOM 4035 N LEU B 121 35.431 -31.566 -6.445 1.00 0.80 N ATOM 4036 CA LEU B 121 34.903 -32.398 -7.558 1.00 0.78 C ATOM 4037 C LEU B 121 35.749 -32.112 -8.796 1.00 0.86 C ATOM 4038 O LEU B 121 36.182 -33.016 -9.484 1.00 0.95 O ATOM 4039 CB LEU B 121 33.436 -32.036 -7.833 1.00 0.67 C ATOM 4040 CG LEU B 121 32.583 -32.303 -6.582 1.00 0.67 C ATOM 4041 CD1 LEU B 121 31.131 -31.892 -6.859 1.00 0.62 C ATOM 4042 CD2 LEU B 121 32.633 -33.797 -6.217 1.00 0.77 C ATOM 0 H LEU B 121 34.768 -30.905 -6.040 1.00 0.80 H new ATOM 0 HA LEU B 121 34.952 -33.455 -7.298 1.00 0.78 H new ATOM 0 HB2 LEU B 121 33.359 -30.987 -8.118 1.00 0.67 H new ATOM 0 HB3 LEU B 121 33.060 -32.622 -8.671 1.00 0.67 H new ATOM 0 HG LEU B 121 32.978 -31.721 -5.749 1.00 0.67 H new ATOM 0 HD11 LEU B 121 30.524 -32.080 -5.973 1.00 0.62 H new ATOM 0 HD12 LEU B 121 31.094 -30.831 -7.105 1.00 0.62 H new ATOM 0 HD13 LEU B 121 30.742 -32.472 -7.696 1.00 0.62 H new ATOM 0 HD21 LEU B 121 32.026 -33.975 -5.330 1.00 0.77 H new ATOM 0 HD22 LEU B 121 32.245 -34.387 -7.047 1.00 0.77 H new ATOM 0 HD23 LEU B 121 33.664 -34.088 -6.015 1.00 0.77 H new ATOM 4054 N ASN B 122 36.003 -30.857 -9.071 1.00 0.88 N ATOM 4055 CA ASN B 122 36.842 -30.484 -10.251 1.00 1.02 C ATOM 4056 C ASN B 122 38.005 -29.605 -9.779 1.00 1.08 C ATOM 4057 O ASN B 122 38.142 -28.469 -10.189 1.00 1.15 O ATOM 4058 CB ASN B 122 35.988 -29.703 -11.250 1.00 1.10 C ATOM 4059 CG ASN B 122 36.788 -29.472 -12.533 1.00 1.30 C ATOM 4060 OD1 ASN B 122 37.690 -30.226 -12.844 1.00 1.77 O ATOM 4061 ND2 ASN B 122 36.497 -28.451 -13.293 1.00 1.70 N ATOM 0 H ASN B 122 35.661 -30.067 -8.523 1.00 0.88 H new ATOM 0 HA ASN B 122 37.231 -31.383 -10.729 1.00 1.02 H new ATOM 0 HB2 ASN B 122 35.074 -30.254 -11.473 1.00 1.10 H new ATOM 0 HB3 ASN B 122 35.687 -28.748 -10.819 1.00 1.10 H new ATOM 0 HD21 ASN B 122 37.026 -28.285 -14.149 1.00 1.70 H new ATOM 0 HD22 ASN B 122 35.740 -27.819 -13.031 1.00 1.70 H new ATOM 4068 N SER B 123 38.853 -30.125 -8.924 1.00 1.09 N ATOM 4069 CA SER B 123 40.009 -29.321 -8.434 1.00 1.18 C ATOM 4070 C SER B 123 41.192 -29.522 -9.385 1.00 1.37 C ATOM 4071 O SER B 123 41.590 -30.658 -9.575 1.00 1.92 O ATOM 4072 CB SER B 123 40.396 -29.792 -7.027 1.00 1.16 C ATOM 4073 OG SER B 123 41.798 -29.635 -6.845 1.00 1.84 O ATOM 4074 OXT SER B 123 41.672 -28.535 -9.916 1.00 1.65 O ATOM 0 H SER B 123 38.792 -31.071 -8.547 1.00 1.09 H new ATOM 0 HA SER B 123 39.739 -28.265 -8.399 1.00 1.18 H new ATOM 0 HB2 SER B 123 39.854 -29.216 -6.277 1.00 1.16 H new ATOM 0 HB3 SER B 123 40.115 -30.836 -6.891 1.00 1.16 H new ATOM 0 HG SER B 123 42.047 -29.934 -5.946 1.00 1.84 H new ATOM 4081 N ALA C 1 20.806 -40.917 -15.719 1.00 0.82 N ATOM 4082 CA ALA C 1 20.729 -40.883 -14.232 1.00 0.80 C ATOM 4083 C ALA C 1 20.936 -39.448 -13.738 1.00 0.71 C ATOM 4084 O ALA C 1 21.051 -39.202 -12.554 1.00 0.70 O ATOM 4085 CB ALA C 1 21.817 -41.788 -13.647 1.00 0.90 C ATOM 0 H1 ALA C 1 20.716 -41.899 -16.049 1.00 0.82 H new ATOM 0 H2 ALA C 1 20.035 -40.345 -16.120 1.00 0.82 H new ATOM 0 H3 ALA C 1 21.721 -40.530 -16.028 1.00 0.82 H new ATOM 0 HA ALA C 1 19.749 -41.236 -13.911 1.00 0.80 H new ATOM 0 HB1 ALA C 1 21.763 -41.765 -12.559 1.00 0.90 H new ATOM 0 HB2 ALA C 1 21.667 -42.810 -13.996 1.00 0.90 H new ATOM 0 HB3 ALA C 1 22.796 -41.434 -13.969 1.00 0.90 H new ATOM 4093 N GLN C 2 20.987 -38.501 -14.634 1.00 0.67 N ATOM 4094 CA GLN C 2 21.189 -37.087 -14.210 1.00 0.60 C ATOM 4095 C GLN C 2 19.866 -36.510 -13.701 1.00 0.52 C ATOM 4096 O GLN C 2 18.808 -36.811 -14.216 1.00 0.52 O ATOM 4097 CB GLN C 2 21.673 -36.260 -15.404 1.00 0.62 C ATOM 4098 CG GLN C 2 23.069 -36.727 -15.823 1.00 0.72 C ATOM 4099 CD GLN C 2 24.078 -36.368 -14.731 1.00 1.27 C ATOM 4100 OE1 GLN C 2 24.849 -37.202 -14.302 1.00 2.01 O ATOM 4101 NE2 GLN C 2 24.107 -35.151 -14.261 1.00 1.88 N ATOM 0 H GLN C 2 20.898 -38.645 -15.640 1.00 0.67 H new ATOM 0 HA GLN C 2 21.933 -37.052 -13.414 1.00 0.60 H new ATOM 0 HB2 GLN C 2 20.978 -36.366 -16.237 1.00 0.62 H new ATOM 0 HB3 GLN C 2 21.697 -35.203 -15.141 1.00 0.62 H new ATOM 0 HG2 GLN C 2 23.068 -37.804 -15.992 1.00 0.72 H new ATOM 0 HG3 GLN C 2 23.354 -36.257 -16.764 1.00 0.72 H new ATOM 0 HE21 GLN C 2 23.460 -34.450 -14.621 1.00 1.88 H new ATOM 0 HE22 GLN C 2 24.777 -34.901 -13.534 1.00 1.88 H new ATOM 4110 N SER C 3 19.917 -35.672 -12.696 1.00 0.47 N ATOM 4111 CA SER C 3 18.661 -35.063 -12.156 1.00 0.41 C ATOM 4112 C SER C 3 18.398 -33.728 -12.852 1.00 0.37 C ATOM 4113 O SER C 3 18.345 -32.690 -12.222 1.00 0.34 O ATOM 4114 CB SER C 3 18.810 -34.836 -10.649 1.00 0.40 C ATOM 4115 OG SER C 3 17.518 -34.744 -10.065 1.00 1.37 O ATOM 0 H SER C 3 20.774 -35.383 -12.225 1.00 0.47 H new ATOM 0 HA SER C 3 17.824 -35.736 -12.340 1.00 0.41 H new ATOM 0 HB2 SER C 3 19.369 -35.656 -10.198 1.00 0.40 H new ATOM 0 HB3 SER C 3 19.375 -33.923 -10.460 1.00 0.40 H new ATOM 0 HG SER C 3 17.605 -34.616 -9.097 1.00 1.37 H new ATOM 4121 N ARG C 4 18.217 -33.748 -14.141 1.00 0.41 N ATOM 4122 CA ARG C 4 17.940 -32.481 -14.872 1.00 0.42 C ATOM 4123 C ARG C 4 16.618 -31.891 -14.382 1.00 0.42 C ATOM 4124 O ARG C 4 16.486 -30.696 -14.214 1.00 0.43 O ATOM 4125 CB ARG C 4 17.874 -32.762 -16.374 1.00 0.51 C ATOM 4126 CG ARG C 4 19.278 -33.100 -16.885 1.00 0.90 C ATOM 4127 CD ARG C 4 19.216 -33.407 -18.381 1.00 1.03 C ATOM 4128 NE ARG C 4 18.479 -34.685 -18.590 1.00 1.97 N ATOM 4129 CZ ARG C 4 18.041 -35.003 -19.779 1.00 2.55 C ATOM 4130 NH1 ARG C 4 18.234 -34.197 -20.784 1.00 2.53 N ATOM 4131 NH2 ARG C 4 17.401 -36.124 -19.962 1.00 3.56 N ATOM 0 H ARG C 4 18.249 -34.587 -14.721 1.00 0.41 H new ATOM 0 HA ARG C 4 18.739 -31.763 -14.684 1.00 0.42 H new ATOM 0 HB2 ARG C 4 17.193 -33.590 -16.572 1.00 0.51 H new ATOM 0 HB3 ARG C 4 17.481 -31.893 -16.902 1.00 0.51 H new ATOM 0 HG2 ARG C 4 19.954 -32.265 -16.702 1.00 0.90 H new ATOM 0 HG3 ARG C 4 19.677 -33.958 -16.343 1.00 0.90 H new ATOM 0 HD2 ARG C 4 18.717 -32.595 -18.910 1.00 1.03 H new ATOM 0 HD3 ARG C 4 20.223 -33.483 -18.791 1.00 1.03 H new ATOM 0 HE ARG C 4 18.316 -35.313 -17.803 1.00 1.97 H new ATOM 0 HH11 ARG C 4 18.728 -33.316 -20.643 1.00 2.53 H new ATOM 0 HH12 ARG C 4 17.891 -34.447 -21.712 1.00 2.53 H new ATOM 0 HH21 ARG C 4 17.242 -36.754 -19.176 1.00 3.56 H new ATOM 0 HH22 ARG C 4 17.060 -36.371 -20.891 1.00 3.56 H new ATOM 4145 N THR C 5 15.636 -32.717 -14.150 1.00 0.45 N ATOM 4146 CA THR C 5 14.330 -32.190 -13.668 1.00 0.49 C ATOM 4147 C THR C 5 14.533 -31.467 -12.335 1.00 0.44 C ATOM 4148 O THR C 5 13.989 -30.404 -12.111 1.00 0.46 O ATOM 4149 CB THR C 5 13.338 -33.345 -13.482 1.00 0.54 C ATOM 4150 OG1 THR C 5 12.292 -32.932 -12.614 1.00 0.68 O ATOM 4151 CG2 THR C 5 14.047 -34.558 -12.877 1.00 0.56 C ATOM 0 H THR C 5 15.681 -33.729 -14.273 1.00 0.45 H new ATOM 0 HA THR C 5 13.930 -31.492 -14.404 1.00 0.49 H new ATOM 0 HB THR C 5 12.928 -33.620 -14.454 1.00 0.54 H new ATOM 0 HG1 THR C 5 11.656 -33.668 -12.495 1.00 0.68 H new ATOM 0 HG21 THR C 5 13.332 -35.371 -12.750 1.00 0.56 H new ATOM 0 HG22 THR C 5 14.849 -34.880 -13.542 1.00 0.56 H new ATOM 0 HG23 THR C 5 14.466 -34.288 -11.908 1.00 0.56 H new ATOM 4159 N LEU C 6 15.314 -32.025 -11.448 1.00 0.39 N ATOM 4160 CA LEU C 6 15.543 -31.346 -10.140 1.00 0.37 C ATOM 4161 C LEU C 6 16.235 -30.002 -10.392 1.00 0.32 C ATOM 4162 O LEU C 6 15.899 -28.995 -9.802 1.00 0.33 O ATOM 4163 CB LEU C 6 16.426 -32.230 -9.250 1.00 0.35 C ATOM 4164 CG LEU C 6 16.673 -31.545 -7.895 1.00 0.35 C ATOM 4165 CD1 LEU C 6 15.336 -31.310 -7.167 1.00 0.41 C ATOM 4166 CD2 LEU C 6 17.575 -32.443 -7.042 1.00 0.37 C ATOM 0 H LEU C 6 15.799 -32.914 -11.571 1.00 0.39 H new ATOM 0 HA LEU C 6 14.591 -31.178 -9.637 1.00 0.37 H new ATOM 0 HB2 LEU C 6 15.946 -33.196 -9.095 1.00 0.35 H new ATOM 0 HB3 LEU C 6 17.377 -32.423 -9.746 1.00 0.35 H new ATOM 0 HG LEU C 6 17.155 -30.581 -8.058 1.00 0.35 H new ATOM 0 HD11 LEU C 6 15.524 -30.825 -6.209 1.00 0.41 H new ATOM 0 HD12 LEU C 6 14.696 -30.673 -7.778 1.00 0.41 H new ATOM 0 HD13 LEU C 6 14.841 -32.266 -6.998 1.00 0.41 H new ATOM 0 HD21 LEU C 6 17.756 -31.966 -6.079 1.00 0.37 H new ATOM 0 HD22 LEU C 6 17.087 -33.405 -6.885 1.00 0.37 H new ATOM 0 HD23 LEU C 6 18.524 -32.597 -7.555 1.00 0.37 H new ATOM 4178 N LEU C 7 17.196 -29.984 -11.275 1.00 0.29 N ATOM 4179 CA LEU C 7 17.921 -28.718 -11.586 1.00 0.27 C ATOM 4180 C LEU C 7 16.946 -27.668 -12.115 1.00 0.30 C ATOM 4181 O LEU C 7 17.049 -26.501 -11.793 1.00 0.29 O ATOM 4182 CB LEU C 7 19.011 -28.987 -12.623 1.00 0.27 C ATOM 4183 CG LEU C 7 20.143 -29.810 -11.981 1.00 0.24 C ATOM 4184 CD1 LEU C 7 21.067 -30.365 -13.080 1.00 0.27 C ATOM 4185 CD2 LEU C 7 20.961 -28.930 -11.007 1.00 0.23 C ATOM 0 H LEU C 7 17.513 -30.800 -11.799 1.00 0.29 H new ATOM 0 HA LEU C 7 18.381 -28.341 -10.673 1.00 0.27 H new ATOM 0 HB2 LEU C 7 18.593 -29.526 -13.473 1.00 0.27 H new ATOM 0 HB3 LEU C 7 19.404 -28.045 -13.005 1.00 0.27 H new ATOM 0 HG LEU C 7 19.704 -30.637 -11.423 1.00 0.24 H new ATOM 0 HD11 LEU C 7 21.867 -30.947 -12.623 1.00 0.27 H new ATOM 0 HD12 LEU C 7 20.492 -31.003 -13.751 1.00 0.27 H new ATOM 0 HD13 LEU C 7 21.497 -29.538 -13.645 1.00 0.27 H new ATOM 0 HD21 LEU C 7 21.758 -29.525 -10.561 1.00 0.23 H new ATOM 0 HD22 LEU C 7 21.396 -28.092 -11.552 1.00 0.23 H new ATOM 0 HD23 LEU C 7 20.307 -28.552 -10.221 1.00 0.23 H new ATOM 4197 N ALA C 8 16.008 -28.061 -12.929 1.00 0.35 N ATOM 4198 CA ALA C 8 15.048 -27.062 -13.469 1.00 0.39 C ATOM 4199 C ALA C 8 14.320 -26.414 -12.294 1.00 0.38 C ATOM 4200 O ALA C 8 14.098 -25.220 -12.268 1.00 0.39 O ATOM 4201 CB ALA C 8 14.036 -27.761 -14.382 1.00 0.45 C ATOM 0 H ALA C 8 15.865 -29.022 -13.241 1.00 0.35 H new ATOM 0 HA ALA C 8 15.578 -26.305 -14.047 1.00 0.39 H new ATOM 0 HB1 ALA C 8 13.334 -27.027 -14.776 1.00 0.45 H new ATOM 0 HB2 ALA C 8 14.562 -28.240 -15.208 1.00 0.45 H new ATOM 0 HB3 ALA C 8 13.492 -28.514 -13.812 1.00 0.45 H new ATOM 4207 N GLY C 9 13.974 -27.190 -11.306 1.00 0.38 N ATOM 4208 CA GLY C 9 13.291 -26.610 -10.121 1.00 0.39 C ATOM 4209 C GLY C 9 14.284 -25.716 -9.376 1.00 0.34 C ATOM 4210 O GLY C 9 13.991 -24.583 -9.051 1.00 0.34 O ATOM 0 H GLY C 9 14.134 -28.197 -11.269 1.00 0.38 H new ATOM 0 HA2 GLY C 9 12.420 -26.032 -10.431 1.00 0.39 H new ATOM 0 HA3 GLY C 9 12.930 -27.403 -9.466 1.00 0.39 H new ATOM 4214 N ILE C 10 15.466 -26.213 -9.110 1.00 0.30 N ATOM 4215 CA ILE C 10 16.479 -25.382 -8.394 1.00 0.27 C ATOM 4216 C ILE C 10 16.774 -24.130 -9.223 1.00 0.25 C ATOM 4217 O ILE C 10 16.745 -23.024 -8.723 1.00 0.25 O ATOM 4218 CB ILE C 10 17.766 -26.190 -8.197 1.00 0.25 C ATOM 4219 CG1 ILE C 10 17.483 -27.371 -7.264 1.00 0.28 C ATOM 4220 CG2 ILE C 10 18.846 -25.299 -7.572 1.00 0.26 C ATOM 4221 CD1 ILE C 10 18.683 -28.319 -7.256 1.00 0.26 C ATOM 0 H ILE C 10 15.772 -27.154 -9.357 1.00 0.30 H new ATOM 0 HA ILE C 10 16.092 -25.091 -7.418 1.00 0.27 H new ATOM 0 HB ILE C 10 18.114 -26.557 -9.163 1.00 0.25 H new ATOM 0 HG12 ILE C 10 17.285 -27.010 -6.255 1.00 0.28 H new ATOM 0 HG13 ILE C 10 16.590 -27.902 -7.594 1.00 0.28 H new ATOM 0 HG21 ILE C 10 19.760 -25.877 -7.434 1.00 0.26 H new ATOM 0 HG22 ILE C 10 19.047 -24.455 -8.231 1.00 0.26 H new ATOM 0 HG23 ILE C 10 18.500 -24.931 -6.606 1.00 0.26 H new ATOM 0 HD11 ILE C 10 18.479 -29.158 -6.591 1.00 0.26 H new ATOM 0 HD12 ILE C 10 18.860 -28.690 -8.265 1.00 0.26 H new ATOM 0 HD13 ILE C 10 19.566 -27.785 -6.906 1.00 0.26 H new ATOM 4233 N VAL C 11 17.049 -24.292 -10.492 1.00 0.26 N ATOM 4234 CA VAL C 11 17.337 -23.103 -11.346 1.00 0.27 C ATOM 4235 C VAL C 11 16.121 -22.174 -11.339 1.00 0.28 C ATOM 4236 O VAL C 11 16.238 -20.977 -11.150 1.00 0.28 O ATOM 4237 CB VAL C 11 17.625 -23.568 -12.779 1.00 0.30 C ATOM 4238 CG1 VAL C 11 17.679 -22.363 -13.727 1.00 0.35 C ATOM 4239 CG2 VAL C 11 18.970 -24.292 -12.807 1.00 0.29 C ATOM 0 H VAL C 11 17.086 -25.192 -10.971 1.00 0.26 H new ATOM 0 HA VAL C 11 18.204 -22.568 -10.959 1.00 0.27 H new ATOM 0 HB VAL C 11 16.830 -24.239 -13.104 1.00 0.30 H new ATOM 0 HG11 VAL C 11 17.884 -22.707 -14.741 1.00 0.35 H new ATOM 0 HG12 VAL C 11 16.722 -21.841 -13.707 1.00 0.35 H new ATOM 0 HG13 VAL C 11 18.469 -21.684 -13.407 1.00 0.35 H new ATOM 0 HG21 VAL C 11 19.182 -24.626 -13.823 1.00 0.29 H new ATOM 0 HG22 VAL C 11 19.756 -23.613 -12.477 1.00 0.29 H new ATOM 0 HG23 VAL C 11 18.933 -25.155 -12.142 1.00 0.29 H new ATOM 4249 N GLN C 12 14.955 -22.726 -11.538 1.00 0.32 N ATOM 4250 CA GLN C 12 13.718 -21.897 -11.539 1.00 0.34 C ATOM 4251 C GLN C 12 13.569 -21.220 -10.175 1.00 0.32 C ATOM 4252 O GLN C 12 13.174 -20.074 -10.076 1.00 0.33 O ATOM 4253 CB GLN C 12 12.505 -22.791 -11.818 1.00 0.39 C ATOM 4254 CG GLN C 12 11.231 -21.941 -11.841 1.00 1.18 C ATOM 4255 CD GLN C 12 10.037 -22.832 -12.182 1.00 1.63 C ATOM 4256 OE1 GLN C 12 10.077 -24.027 -11.965 1.00 1.99 O ATOM 4257 NE2 GLN C 12 8.972 -22.304 -12.719 1.00 2.40 N ATOM 0 H GLN C 12 14.806 -23.722 -11.701 1.00 0.32 H new ATOM 0 HA GLN C 12 13.782 -21.134 -12.315 1.00 0.34 H new ATOM 0 HB2 GLN C 12 12.630 -23.302 -12.773 1.00 0.39 H new ATOM 0 HB3 GLN C 12 12.425 -23.562 -11.052 1.00 0.39 H new ATOM 0 HG2 GLN C 12 11.080 -21.465 -10.872 1.00 1.18 H new ATOM 0 HG3 GLN C 12 11.326 -21.142 -12.577 1.00 1.18 H new ATOM 0 HE21 GLN C 12 8.937 -21.301 -12.902 1.00 2.40 H new ATOM 0 HE22 GLN C 12 8.174 -22.894 -12.956 1.00 2.40 H new ATOM 4266 N GLN C 13 13.872 -21.928 -9.123 1.00 0.30 N ATOM 4267 CA GLN C 13 13.750 -21.347 -7.757 1.00 0.29 C ATOM 4268 C GLN C 13 14.659 -20.122 -7.639 1.00 0.25 C ATOM 4269 O GLN C 13 14.287 -19.115 -7.069 1.00 0.25 O ATOM 4270 CB GLN C 13 14.167 -22.409 -6.734 1.00 0.29 C ATOM 4271 CG GLN C 13 13.960 -21.894 -5.304 1.00 0.30 C ATOM 4272 CD GLN C 13 12.464 -21.789 -5.007 1.00 0.38 C ATOM 4273 OE1 GLN C 13 11.647 -22.245 -5.782 1.00 0.84 O ATOM 4274 NE2 GLN C 13 12.069 -21.219 -3.903 1.00 0.64 N ATOM 0 H GLN C 13 14.202 -22.893 -9.152 1.00 0.30 H new ATOM 0 HA GLN C 13 12.721 -21.040 -7.570 1.00 0.29 H new ATOM 0 HB2 GLN C 13 13.584 -23.317 -6.887 1.00 0.29 H new ATOM 0 HB3 GLN C 13 15.214 -22.673 -6.883 1.00 0.29 H new ATOM 0 HG2 GLN C 13 14.436 -22.568 -4.592 1.00 0.30 H new ATOM 0 HG3 GLN C 13 14.434 -20.919 -5.186 1.00 0.30 H new ATOM 0 HE21 GLN C 13 12.755 -20.836 -3.253 1.00 0.64 H new ATOM 0 HE22 GLN C 13 11.074 -21.156 -3.690 1.00 0.64 H new ATOM 4283 N GLN C 14 15.849 -20.195 -8.170 1.00 0.22 N ATOM 4284 CA GLN C 14 16.768 -19.028 -8.081 1.00 0.20 C ATOM 4285 C GLN C 14 16.123 -17.840 -8.787 1.00 0.22 C ATOM 4286 O GLN C 14 16.167 -16.722 -8.313 1.00 0.21 O ATOM 4287 CB GLN C 14 18.093 -19.360 -8.764 1.00 0.20 C ATOM 4288 CG GLN C 14 18.849 -20.392 -7.929 1.00 0.18 C ATOM 4289 CD GLN C 14 20.173 -20.721 -8.613 1.00 0.19 C ATOM 4290 OE1 GLN C 14 20.192 -21.255 -9.705 1.00 0.28 O ATOM 4291 NE2 GLN C 14 21.292 -20.419 -8.014 1.00 0.23 N ATOM 0 H GLN C 14 16.222 -21.009 -8.659 1.00 0.22 H new ATOM 0 HA GLN C 14 16.955 -18.788 -7.034 1.00 0.20 H new ATOM 0 HB2 GLN C 14 17.911 -19.749 -9.766 1.00 0.20 H new ATOM 0 HB3 GLN C 14 18.693 -18.457 -8.877 1.00 0.20 H new ATOM 0 HG2 GLN C 14 19.031 -20.004 -6.927 1.00 0.18 H new ATOM 0 HG3 GLN C 14 18.250 -21.296 -7.817 1.00 0.18 H new ATOM 0 HE21 GLN C 14 21.275 -19.971 -7.098 1.00 0.23 H new ATOM 0 HE22 GLN C 14 22.184 -20.631 -8.462 1.00 0.23 H new ATOM 4300 N GLN C 15 15.511 -18.080 -9.915 1.00 0.26 N ATOM 4301 CA GLN C 15 14.845 -16.975 -10.654 1.00 0.29 C ATOM 4302 C GLN C 15 13.765 -16.361 -9.771 1.00 0.28 C ATOM 4303 O GLN C 15 13.652 -15.158 -9.656 1.00 0.29 O ATOM 4304 CB GLN C 15 14.215 -17.521 -11.940 1.00 0.34 C ATOM 4305 CG GLN C 15 13.525 -16.384 -12.698 1.00 0.38 C ATOM 4306 CD GLN C 15 13.061 -16.889 -14.068 1.00 0.44 C ATOM 4307 OE1 GLN C 15 13.451 -17.955 -14.497 1.00 0.82 O ATOM 4308 NE2 GLN C 15 12.228 -16.169 -14.770 1.00 0.81 N ATOM 0 H GLN C 15 15.445 -18.997 -10.356 1.00 0.26 H new ATOM 0 HA GLN C 15 15.580 -16.213 -10.914 1.00 0.29 H new ATOM 0 HB2 GLN C 15 14.981 -17.977 -12.567 1.00 0.34 H new ATOM 0 HB3 GLN C 15 13.493 -18.302 -11.700 1.00 0.34 H new ATOM 0 HG2 GLN C 15 12.673 -16.017 -12.126 1.00 0.38 H new ATOM 0 HG3 GLN C 15 14.211 -15.546 -12.821 1.00 0.38 H new ATOM 0 HE21 GLN C 15 11.900 -15.273 -14.410 1.00 0.81 H new ATOM 0 HE22 GLN C 15 11.906 -16.503 -15.678 1.00 0.81 H new ATOM 4317 N GLN C 16 12.971 -17.179 -9.137 1.00 0.28 N ATOM 4318 CA GLN C 16 11.910 -16.630 -8.258 1.00 0.29 C ATOM 4319 C GLN C 16 12.555 -15.818 -7.135 1.00 0.25 C ATOM 4320 O GLN C 16 12.098 -14.747 -6.791 1.00 0.26 O ATOM 4321 CB GLN C 16 11.085 -17.778 -7.674 1.00 0.31 C ATOM 4322 CG GLN C 16 10.251 -18.412 -8.793 1.00 0.36 C ATOM 4323 CD GLN C 16 9.395 -19.545 -8.228 1.00 0.40 C ATOM 4324 OE1 GLN C 16 8.985 -20.430 -8.952 1.00 0.93 O ATOM 4325 NE2 GLN C 16 9.103 -19.556 -6.958 1.00 0.87 N ATOM 0 H GLN C 16 13.013 -18.197 -9.191 1.00 0.28 H new ATOM 0 HA GLN C 16 11.251 -15.981 -8.835 1.00 0.29 H new ATOM 0 HB2 GLN C 16 11.742 -18.523 -7.225 1.00 0.31 H new ATOM 0 HB3 GLN C 16 10.434 -17.409 -6.882 1.00 0.31 H new ATOM 0 HG2 GLN C 16 9.613 -17.658 -9.254 1.00 0.36 H new ATOM 0 HG3 GLN C 16 10.907 -18.796 -9.574 1.00 0.36 H new ATOM 0 HE21 GLN C 16 9.447 -18.813 -6.349 1.00 0.87 H new ATOM 0 HE22 GLN C 16 8.531 -20.307 -6.573 1.00 0.87 H new ATOM 4334 N LEU C 17 13.629 -16.305 -6.570 1.00 0.22 N ATOM 4335 CA LEU C 17 14.296 -15.535 -5.487 1.00 0.19 C ATOM 4336 C LEU C 17 14.825 -14.226 -6.072 1.00 0.18 C ATOM 4337 O LEU C 17 14.713 -13.174 -5.475 1.00 0.18 O ATOM 4338 CB LEU C 17 15.463 -16.350 -4.917 1.00 0.16 C ATOM 4339 CG LEU C 17 14.934 -17.555 -4.126 1.00 0.18 C ATOM 4340 CD1 LEU C 17 16.107 -18.479 -3.782 1.00 0.18 C ATOM 4341 CD2 LEU C 17 14.233 -17.089 -2.830 1.00 0.20 C ATOM 0 H LEU C 17 14.067 -17.194 -6.811 1.00 0.22 H new ATOM 0 HA LEU C 17 13.584 -15.327 -4.688 1.00 0.19 H new ATOM 0 HB2 LEU C 17 16.107 -16.692 -5.727 1.00 0.16 H new ATOM 0 HB3 LEU C 17 16.073 -15.721 -4.269 1.00 0.16 H new ATOM 0 HG LEU C 17 14.206 -18.091 -4.734 1.00 0.18 H new ATOM 0 HD11 LEU C 17 15.741 -19.338 -3.220 1.00 0.18 H new ATOM 0 HD12 LEU C 17 16.581 -18.822 -4.701 1.00 0.18 H new ATOM 0 HD13 LEU C 17 16.834 -17.935 -3.180 1.00 0.18 H new ATOM 0 HD21 LEU C 17 13.865 -17.957 -2.283 1.00 0.20 H new ATOM 0 HD22 LEU C 17 14.943 -16.543 -2.209 1.00 0.20 H new ATOM 0 HD23 LEU C 17 13.396 -16.438 -3.083 1.00 0.20 H new ATOM 4353 N LEU C 18 15.390 -14.283 -7.246 1.00 0.19 N ATOM 4354 CA LEU C 18 15.912 -13.041 -7.875 1.00 0.20 C ATOM 4355 C LEU C 18 14.749 -12.065 -8.064 1.00 0.22 C ATOM 4356 O LEU C 18 14.873 -10.880 -7.823 1.00 0.23 O ATOM 4357 CB LEU C 18 16.540 -13.390 -9.231 1.00 0.22 C ATOM 4358 CG LEU C 18 17.091 -12.126 -9.909 1.00 0.25 C ATOM 4359 CD1 LEU C 18 18.189 -11.490 -9.039 1.00 0.26 C ATOM 4360 CD2 LEU C 18 17.679 -12.510 -11.270 1.00 0.29 C ATOM 0 H LEU C 18 15.512 -15.134 -7.795 1.00 0.19 H new ATOM 0 HA LEU C 18 16.672 -12.581 -7.243 1.00 0.20 H new ATOM 0 HB2 LEU C 18 17.342 -14.114 -9.091 1.00 0.22 H new ATOM 0 HB3 LEU C 18 15.795 -13.859 -9.874 1.00 0.22 H new ATOM 0 HG LEU C 18 16.284 -11.405 -10.038 1.00 0.25 H new ATOM 0 HD11 LEU C 18 18.571 -10.595 -9.531 1.00 0.26 H new ATOM 0 HD12 LEU C 18 17.773 -11.221 -8.068 1.00 0.26 H new ATOM 0 HD13 LEU C 18 19.002 -12.203 -8.901 1.00 0.26 H new ATOM 0 HD21 LEU C 18 18.073 -11.620 -11.760 1.00 0.29 H new ATOM 0 HD22 LEU C 18 18.483 -13.232 -11.128 1.00 0.29 H new ATOM 0 HD23 LEU C 18 16.900 -12.952 -11.891 1.00 0.29 H new ATOM 4372 N ASP C 19 13.615 -12.557 -8.496 1.00 0.25 N ATOM 4373 CA ASP C 19 12.438 -11.665 -8.694 1.00 0.28 C ATOM 4374 C ASP C 19 12.067 -11.003 -7.362 1.00 0.27 C ATOM 4375 O ASP C 19 11.899 -9.803 -7.283 1.00 0.28 O ATOM 4376 CB ASP C 19 11.252 -12.483 -9.211 1.00 0.32 C ATOM 4377 CG ASP C 19 10.059 -11.557 -9.458 1.00 0.36 C ATOM 4378 OD1 ASP C 19 10.089 -10.440 -8.969 1.00 1.12 O ATOM 4379 OD2 ASP C 19 9.136 -11.979 -10.135 1.00 1.13 O ATOM 0 H ASP C 19 13.456 -13.539 -8.720 1.00 0.25 H new ATOM 0 HA ASP C 19 12.687 -10.895 -9.424 1.00 0.28 H new ATOM 0 HB2 ASP C 19 11.525 -12.995 -10.134 1.00 0.32 H new ATOM 0 HB3 ASP C 19 10.984 -13.252 -8.487 1.00 0.32 H new ATOM 4384 N VAL C 20 11.935 -11.776 -6.313 1.00 0.25 N ATOM 4385 CA VAL C 20 11.577 -11.174 -4.995 1.00 0.24 C ATOM 4386 C VAL C 20 12.656 -10.174 -4.601 1.00 0.21 C ATOM 4387 O VAL C 20 12.375 -9.078 -4.161 1.00 0.23 O ATOM 4388 CB VAL C 20 11.493 -12.265 -3.921 1.00 0.24 C ATOM 4389 CG1 VAL C 20 11.353 -11.614 -2.535 1.00 0.24 C ATOM 4390 CG2 VAL C 20 10.281 -13.153 -4.194 1.00 0.30 C ATOM 0 H VAL C 20 12.059 -12.788 -6.313 1.00 0.25 H new ATOM 0 HA VAL C 20 10.610 -10.678 -5.077 1.00 0.24 H new ATOM 0 HB VAL C 20 12.400 -12.870 -3.945 1.00 0.24 H new ATOM 0 HG11 VAL C 20 11.293 -12.391 -1.773 1.00 0.24 H new ATOM 0 HG12 VAL C 20 12.219 -10.981 -2.341 1.00 0.24 H new ATOM 0 HG13 VAL C 20 10.447 -11.008 -2.507 1.00 0.24 H new ATOM 0 HG21 VAL C 20 10.220 -13.929 -3.431 1.00 0.30 H new ATOM 0 HG22 VAL C 20 9.374 -12.548 -4.170 1.00 0.30 H new ATOM 0 HG23 VAL C 20 10.383 -13.616 -5.176 1.00 0.30 H new ATOM 4400 N VAL C 21 13.893 -10.552 -4.749 1.00 0.18 N ATOM 4401 CA VAL C 21 14.990 -9.628 -4.381 1.00 0.18 C ATOM 4402 C VAL C 21 14.859 -8.367 -5.231 1.00 0.22 C ATOM 4403 O VAL C 21 15.020 -7.262 -4.752 1.00 0.21 O ATOM 4404 CB VAL C 21 16.333 -10.314 -4.643 1.00 0.17 C ATOM 4405 CG1 VAL C 21 17.479 -9.320 -4.459 1.00 0.21 C ATOM 4406 CG2 VAL C 21 16.513 -11.473 -3.658 1.00 0.15 C ATOM 0 H VAL C 21 14.188 -11.460 -5.108 1.00 0.18 H new ATOM 0 HA VAL C 21 14.935 -9.362 -3.325 1.00 0.18 H new ATOM 0 HB VAL C 21 16.344 -10.688 -5.667 1.00 0.17 H new ATOM 0 HG11 VAL C 21 18.429 -9.820 -4.648 1.00 0.21 H new ATOM 0 HG12 VAL C 21 17.359 -8.493 -5.159 1.00 0.21 H new ATOM 0 HG13 VAL C 21 17.468 -8.937 -3.439 1.00 0.21 H new ATOM 0 HG21 VAL C 21 17.469 -11.963 -3.843 1.00 0.15 H new ATOM 0 HG22 VAL C 21 16.493 -11.090 -2.638 1.00 0.15 H new ATOM 0 HG23 VAL C 21 15.705 -12.192 -3.791 1.00 0.15 H new ATOM 4416 N LYS C 22 14.548 -8.523 -6.492 1.00 0.28 N ATOM 4417 CA LYS C 22 14.386 -7.332 -7.367 1.00 0.33 C ATOM 4418 C LYS C 22 13.231 -6.492 -6.819 1.00 0.32 C ATOM 4419 O LYS C 22 13.295 -5.279 -6.774 1.00 0.33 O ATOM 4420 CB LYS C 22 14.069 -7.794 -8.798 1.00 0.39 C ATOM 4421 CG LYS C 22 13.897 -6.593 -9.747 1.00 0.46 C ATOM 4422 CD LYS C 22 15.244 -5.893 -9.973 1.00 0.75 C ATOM 4423 CE LYS C 22 15.151 -4.976 -11.195 1.00 1.12 C ATOM 4424 NZ LYS C 22 16.380 -4.136 -11.278 1.00 1.91 N ATOM 0 H LYS C 22 14.400 -9.423 -6.949 1.00 0.28 H new ATOM 0 HA LYS C 22 15.301 -6.739 -7.384 1.00 0.33 H new ATOM 0 HB2 LYS C 22 14.871 -8.436 -9.162 1.00 0.39 H new ATOM 0 HB3 LYS C 22 13.158 -8.393 -8.796 1.00 0.39 H new ATOM 0 HG2 LYS C 22 13.491 -6.930 -10.701 1.00 0.46 H new ATOM 0 HG3 LYS C 22 13.180 -5.888 -9.326 1.00 0.46 H new ATOM 0 HD2 LYS C 22 15.516 -5.313 -9.091 1.00 0.75 H new ATOM 0 HD3 LYS C 22 16.029 -6.634 -10.121 1.00 0.75 H new ATOM 0 HE2 LYS C 22 15.041 -5.570 -12.102 1.00 1.12 H new ATOM 0 HE3 LYS C 22 14.268 -4.342 -11.121 1.00 1.12 H new ATOM 0 HZ1 LYS C 22 16.319 -3.512 -12.108 1.00 1.91 H new ATOM 0 HZ2 LYS C 22 16.465 -3.559 -10.417 1.00 1.91 H new ATOM 0 HZ3 LYS C 22 17.215 -4.750 -11.367 1.00 1.91 H new ATOM 4438 N ARG C 23 12.178 -7.137 -6.393 1.00 0.33 N ATOM 4439 CA ARG C 23 11.021 -6.387 -5.840 1.00 0.34 C ATOM 4440 C ARG C 23 11.458 -5.669 -4.569 1.00 0.29 C ATOM 4441 O ARG C 23 11.088 -4.538 -4.323 1.00 0.29 O ATOM 4442 CB ARG C 23 9.901 -7.377 -5.502 1.00 0.39 C ATOM 4443 CG ARG C 23 9.327 -7.997 -6.786 1.00 0.59 C ATOM 4444 CD ARG C 23 8.336 -7.037 -7.458 1.00 0.93 C ATOM 4445 NE ARG C 23 7.675 -7.741 -8.594 1.00 0.81 N ATOM 4446 CZ ARG C 23 6.622 -7.224 -9.168 1.00 1.05 C ATOM 4447 NH1 ARG C 23 6.134 -6.091 -8.738 1.00 1.68 N ATOM 4448 NH2 ARG C 23 6.057 -7.841 -10.171 1.00 1.08 N ATOM 0 H ARG C 23 12.072 -8.151 -6.405 1.00 0.33 H new ATOM 0 HA ARG C 23 10.663 -5.660 -6.569 1.00 0.34 H new ATOM 0 HB2 ARG C 23 10.286 -8.163 -4.852 1.00 0.39 H new ATOM 0 HB3 ARG C 23 9.110 -6.867 -4.952 1.00 0.39 H new ATOM 0 HG2 ARG C 23 10.138 -8.232 -7.476 1.00 0.59 H new ATOM 0 HG3 ARG C 23 8.827 -8.936 -6.550 1.00 0.59 H new ATOM 0 HD2 ARG C 23 7.590 -6.701 -6.738 1.00 0.93 H new ATOM 0 HD3 ARG C 23 8.856 -6.149 -7.817 1.00 0.93 H new ATOM 0 HE ARG C 23 8.047 -8.631 -8.925 1.00 0.81 H new ATOM 0 HH11 ARG C 23 6.575 -5.610 -7.954 1.00 1.68 H new ATOM 0 HH12 ARG C 23 5.312 -5.687 -9.186 1.00 1.68 H new ATOM 0 HH21 ARG C 23 6.438 -8.726 -10.505 1.00 1.08 H new ATOM 0 HH22 ARG C 23 5.235 -7.438 -10.620 1.00 1.08 H new ATOM 4462 N GLN C 24 12.255 -6.311 -3.761 1.00 0.24 N ATOM 4463 CA GLN C 24 12.719 -5.650 -2.517 1.00 0.19 C ATOM 4464 C GLN C 24 13.511 -4.401 -2.895 1.00 0.19 C ATOM 4465 O GLN C 24 13.382 -3.364 -2.276 1.00 0.19 O ATOM 4466 CB GLN C 24 13.605 -6.610 -1.721 1.00 0.16 C ATOM 4467 CG GLN C 24 12.745 -7.739 -1.149 1.00 0.17 C ATOM 4468 CD GLN C 24 13.640 -8.770 -0.458 1.00 0.17 C ATOM 4469 OE1 GLN C 24 14.741 -9.030 -0.901 1.00 0.19 O ATOM 4470 NE2 GLN C 24 13.209 -9.371 0.619 1.00 0.18 N ATOM 0 H GLN C 24 12.602 -7.259 -3.910 1.00 0.24 H new ATOM 0 HA GLN C 24 11.864 -5.372 -1.901 1.00 0.19 H new ATOM 0 HB2 GLN C 24 14.384 -7.021 -2.363 1.00 0.16 H new ATOM 0 HB3 GLN C 24 14.106 -6.075 -0.914 1.00 0.16 H new ATOM 0 HG2 GLN C 24 12.023 -7.335 -0.439 1.00 0.17 H new ATOM 0 HG3 GLN C 24 12.175 -8.215 -1.947 1.00 0.17 H new ATOM 0 HE21 GLN C 24 12.284 -9.152 0.990 1.00 0.18 H new ATOM 0 HE22 GLN C 24 13.797 -10.059 1.089 1.00 0.18 H new ATOM 4479 N GLN C 25 14.318 -4.483 -3.920 1.00 0.21 N ATOM 4480 CA GLN C 25 15.097 -3.286 -4.336 1.00 0.23 C ATOM 4481 C GLN C 25 14.129 -2.160 -4.703 1.00 0.25 C ATOM 4482 O GLN C 25 14.245 -1.051 -4.221 1.00 0.25 O ATOM 4483 CB GLN C 25 15.975 -3.648 -5.542 1.00 0.28 C ATOM 4484 CG GLN C 25 16.707 -2.405 -6.068 1.00 0.32 C ATOM 4485 CD GLN C 25 17.548 -1.776 -4.952 1.00 0.34 C ATOM 4486 OE1 GLN C 25 18.840 -1.952 -4.945 1.00 1.06 O flip ATOM 4487 NE2 GLN C 25 17.025 -1.111 -4.081 1.00 1.13 N flip ATOM 0 H GLN C 25 14.469 -5.321 -4.481 1.00 0.21 H new ATOM 0 HA GLN C 25 15.737 -2.953 -3.519 1.00 0.23 H new ATOM 0 HB2 GLN C 25 16.700 -4.410 -5.256 1.00 0.28 H new ATOM 0 HB3 GLN C 25 15.358 -4.076 -6.333 1.00 0.28 H new ATOM 0 HG2 GLN C 25 17.348 -2.679 -6.906 1.00 0.32 H new ATOM 0 HG3 GLN C 25 15.985 -1.680 -6.442 1.00 0.32 H new ATOM 0 HE21 GLN C 25 16.015 -0.971 -4.083 1.00 1.13 H new ATOM 0 HE22 GLN C 25 17.596 -0.692 -3.347 1.00 1.13 H new ATOM 4496 N GLU C 26 13.155 -2.439 -5.532 1.00 0.27 N ATOM 4497 CA GLU C 26 12.173 -1.378 -5.893 1.00 0.29 C ATOM 4498 C GLU C 26 11.464 -0.905 -4.625 1.00 0.26 C ATOM 4499 O GLU C 26 11.358 0.275 -4.362 1.00 0.26 O ATOM 4500 CB GLU C 26 11.148 -1.926 -6.893 1.00 0.34 C ATOM 4501 CG GLU C 26 11.824 -2.157 -8.249 1.00 0.54 C ATOM 4502 CD GLU C 26 10.834 -2.817 -9.211 1.00 1.19 C ATOM 4503 OE1 GLU C 26 9.690 -2.990 -8.827 1.00 1.94 O ATOM 4504 OE2 GLU C 26 11.237 -3.132 -10.319 1.00 1.85 O ATOM 0 H GLU C 26 13.000 -3.347 -5.970 1.00 0.27 H new ATOM 0 HA GLU C 26 12.695 -0.541 -6.356 1.00 0.29 H new ATOM 0 HB2 GLU C 26 10.727 -2.860 -6.522 1.00 0.34 H new ATOM 0 HB3 GLU C 26 10.321 -1.224 -7.003 1.00 0.34 H new ATOM 0 HG2 GLU C 26 12.169 -1.209 -8.661 1.00 0.54 H new ATOM 0 HG3 GLU C 26 12.703 -2.790 -8.125 1.00 0.54 H new ATOM 4511 N LEU C 27 10.992 -1.824 -3.829 1.00 0.24 N ATOM 4512 CA LEU C 27 10.299 -1.447 -2.566 1.00 0.22 C ATOM 4513 C LEU C 27 11.266 -0.668 -1.671 1.00 0.19 C ATOM 4514 O LEU C 27 10.902 0.301 -1.037 1.00 0.20 O ATOM 4515 CB LEU C 27 9.814 -2.719 -1.862 1.00 0.22 C ATOM 4516 CG LEU C 27 9.272 -2.395 -0.463 1.00 0.22 C ATOM 4517 CD1 LEU C 27 8.220 -1.286 -0.541 1.00 0.25 C ATOM 4518 CD2 LEU C 27 8.623 -3.651 0.128 1.00 0.23 C ATOM 0 H LEU C 27 11.057 -2.827 -4.001 1.00 0.24 H new ATOM 0 HA LEU C 27 9.438 -0.814 -2.782 1.00 0.22 H new ATOM 0 HB2 LEU C 27 9.035 -3.195 -2.457 1.00 0.22 H new ATOM 0 HB3 LEU C 27 10.635 -3.432 -1.783 1.00 0.22 H new ATOM 0 HG LEU C 27 10.098 -2.061 0.165 1.00 0.22 H new ATOM 0 HD11 LEU C 27 7.846 -1.068 0.459 1.00 0.25 H new ATOM 0 HD12 LEU C 27 8.669 -0.387 -0.964 1.00 0.25 H new ATOM 0 HD13 LEU C 27 7.395 -1.611 -1.174 1.00 0.25 H new ATOM 0 HD21 LEU C 27 8.236 -3.427 1.122 1.00 0.23 H new ATOM 0 HD22 LEU C 27 7.805 -3.975 -0.515 1.00 0.23 H new ATOM 0 HD23 LEU C 27 9.366 -4.446 0.198 1.00 0.23 H new ATOM 4530 N LEU C 28 12.501 -1.082 -1.615 1.00 0.18 N ATOM 4531 CA LEU C 28 13.480 -0.359 -0.761 1.00 0.18 C ATOM 4532 C LEU C 28 13.584 1.089 -1.240 1.00 0.20 C ATOM 4533 O LEU C 28 13.658 2.007 -0.449 1.00 0.20 O ATOM 4534 CB LEU C 28 14.854 -1.040 -0.875 1.00 0.18 C ATOM 4535 CG LEU C 28 14.893 -2.304 0.005 1.00 0.18 C ATOM 4536 CD1 LEU C 28 16.015 -3.237 -0.475 1.00 0.21 C ATOM 4537 CD2 LEU C 28 15.158 -1.925 1.473 1.00 0.21 C ATOM 0 H LEU C 28 12.872 -1.886 -2.121 1.00 0.18 H new ATOM 0 HA LEU C 28 13.152 -0.379 0.278 1.00 0.18 H new ATOM 0 HB2 LEU C 28 15.052 -1.304 -1.914 1.00 0.18 H new ATOM 0 HB3 LEU C 28 15.638 -0.348 -0.567 1.00 0.18 H new ATOM 0 HG LEU C 28 13.930 -2.808 -0.072 1.00 0.18 H new ATOM 0 HD11 LEU C 28 16.039 -4.129 0.150 1.00 0.21 H new ATOM 0 HD12 LEU C 28 15.831 -3.524 -1.510 1.00 0.21 H new ATOM 0 HD13 LEU C 28 16.972 -2.720 -0.406 1.00 0.21 H new ATOM 0 HD21 LEU C 28 15.183 -2.828 2.083 1.00 0.21 H new ATOM 0 HD22 LEU C 28 16.115 -1.410 1.549 1.00 0.21 H new ATOM 0 HD23 LEU C 28 14.364 -1.269 1.828 1.00 0.21 H new ATOM 4549 N ARG C 29 13.577 1.304 -2.525 1.00 0.22 N ATOM 4550 CA ARG C 29 13.664 2.699 -3.031 1.00 0.24 C ATOM 4551 C ARG C 29 12.456 3.501 -2.531 1.00 0.24 C ATOM 4552 O ARG C 29 12.580 4.648 -2.148 1.00 0.24 O ATOM 4553 CB ARG C 29 13.675 2.688 -4.562 1.00 0.28 C ATOM 4554 CG ARG C 29 15.002 2.109 -5.056 1.00 0.29 C ATOM 4555 CD ARG C 29 15.028 2.108 -6.585 1.00 0.33 C ATOM 4556 NE ARG C 29 16.260 1.411 -7.052 1.00 0.38 N ATOM 4557 CZ ARG C 29 16.361 1.032 -8.296 1.00 0.88 C ATOM 4558 NH1 ARG C 29 15.372 1.246 -9.120 1.00 1.82 N ATOM 4559 NH2 ARG C 29 17.446 0.431 -8.708 1.00 0.86 N ATOM 0 H ARG C 29 13.515 0.580 -3.241 1.00 0.22 H new ATOM 0 HA ARG C 29 14.581 3.161 -2.666 1.00 0.24 H new ATOM 0 HB2 ARG C 29 12.843 2.093 -4.938 1.00 0.28 H new ATOM 0 HB3 ARG C 29 13.542 3.700 -4.945 1.00 0.28 H new ATOM 0 HG2 ARG C 29 15.833 2.699 -4.669 1.00 0.29 H new ATOM 0 HG3 ARG C 29 15.129 1.094 -4.680 1.00 0.29 H new ATOM 0 HD2 ARG C 29 14.142 1.608 -6.976 1.00 0.33 H new ATOM 0 HD3 ARG C 29 15.009 3.131 -6.962 1.00 0.33 H new ATOM 0 HE ARG C 29 17.023 1.231 -6.400 1.00 0.38 H new ATOM 0 HH11 ARG C 29 14.524 1.708 -8.790 1.00 1.82 H new ATOM 0 HH12 ARG C 29 15.447 0.951 -10.094 1.00 1.82 H new ATOM 0 HH21 ARG C 29 18.212 0.259 -8.057 1.00 0.86 H new ATOM 0 HH22 ARG C 29 17.527 0.134 -9.680 1.00 0.86 H new ATOM 4573 N LEU C 30 11.287 2.910 -2.527 1.00 0.23 N ATOM 4574 CA LEU C 30 10.085 3.652 -2.051 1.00 0.23 C ATOM 4575 C LEU C 30 10.257 4.005 -0.572 1.00 0.21 C ATOM 4576 O LEU C 30 9.910 5.087 -0.143 1.00 0.22 O ATOM 4577 CB LEU C 30 8.832 2.781 -2.212 1.00 0.24 C ATOM 4578 CG LEU C 30 8.710 2.266 -3.650 1.00 0.27 C ATOM 4579 CD1 LEU C 30 7.333 1.629 -3.835 1.00 0.29 C ATOM 4580 CD2 LEU C 30 8.880 3.418 -4.650 1.00 0.34 C ATOM 0 H LEU C 30 11.116 1.952 -2.831 1.00 0.23 H new ATOM 0 HA LEU C 30 9.974 4.561 -2.642 1.00 0.23 H new ATOM 0 HB2 LEU C 30 8.878 1.939 -1.522 1.00 0.24 H new ATOM 0 HB3 LEU C 30 7.945 3.359 -1.951 1.00 0.24 H new ATOM 0 HG LEU C 30 9.492 1.529 -3.833 1.00 0.27 H new ATOM 0 HD11 LEU C 30 7.237 1.260 -4.856 1.00 0.29 H new ATOM 0 HD12 LEU C 30 7.219 0.800 -3.137 1.00 0.29 H new ATOM 0 HD13 LEU C 30 6.559 2.373 -3.644 1.00 0.29 H new ATOM 0 HD21 LEU C 30 8.790 3.034 -5.666 1.00 0.34 H new ATOM 0 HD22 LEU C 30 8.108 4.168 -4.476 1.00 0.34 H new ATOM 0 HD23 LEU C 30 9.862 3.872 -4.519 1.00 0.34 H new ATOM 4592 N THR C 31 10.789 3.108 0.213 1.00 0.19 N ATOM 4593 CA THR C 31 10.974 3.420 1.657 1.00 0.18 C ATOM 4594 C THR C 31 11.892 4.633 1.779 1.00 0.18 C ATOM 4595 O THR C 31 11.669 5.518 2.579 1.00 0.18 O ATOM 4596 CB THR C 31 11.592 2.212 2.369 1.00 0.17 C ATOM 4597 OG1 THR C 31 12.855 1.918 1.791 1.00 0.18 O ATOM 4598 CG2 THR C 31 10.665 1.003 2.220 1.00 0.19 C ATOM 0 H THR C 31 11.100 2.182 -0.080 1.00 0.19 H new ATOM 0 HA THR C 31 10.013 3.642 2.121 1.00 0.18 H new ATOM 0 HB THR C 31 11.722 2.440 3.427 1.00 0.17 H new ATOM 0 HG1 THR C 31 12.782 1.947 0.814 1.00 0.18 H new ATOM 0 HG21 THR C 31 11.104 0.143 2.726 1.00 0.19 H new ATOM 0 HG22 THR C 31 9.696 1.230 2.665 1.00 0.19 H new ATOM 0 HG23 THR C 31 10.534 0.773 1.163 1.00 0.19 H new ATOM 4606 N VAL C 32 12.907 4.694 0.967 1.00 0.18 N ATOM 4607 CA VAL C 32 13.822 5.860 1.010 1.00 0.19 C ATOM 4608 C VAL C 32 13.046 7.097 0.558 1.00 0.20 C ATOM 4609 O VAL C 32 13.199 8.173 1.098 1.00 0.21 O ATOM 4610 CB VAL C 32 15.006 5.613 0.072 1.00 0.22 C ATOM 4611 CG1 VAL C 32 15.857 6.880 -0.035 1.00 0.23 C ATOM 4612 CG2 VAL C 32 15.863 4.471 0.622 1.00 0.22 C ATOM 0 H VAL C 32 13.141 3.983 0.274 1.00 0.18 H new ATOM 0 HA VAL C 32 14.201 6.009 2.021 1.00 0.19 H new ATOM 0 HB VAL C 32 14.631 5.347 -0.916 1.00 0.22 H new ATOM 0 HG11 VAL C 32 16.698 6.698 -0.704 1.00 0.23 H new ATOM 0 HG12 VAL C 32 15.249 7.694 -0.430 1.00 0.23 H new ATOM 0 HG13 VAL C 32 16.231 7.152 0.952 1.00 0.23 H new ATOM 0 HG21 VAL C 32 16.706 4.295 -0.046 1.00 0.22 H new ATOM 0 HG22 VAL C 32 16.233 4.738 1.612 1.00 0.22 H new ATOM 0 HG23 VAL C 32 15.261 3.565 0.692 1.00 0.22 H new ATOM 4622 N TRP C 33 12.214 6.952 -0.442 1.00 0.21 N ATOM 4623 CA TRP C 33 11.435 8.123 -0.935 1.00 0.23 C ATOM 4624 C TRP C 33 10.560 8.675 0.194 1.00 0.23 C ATOM 4625 O TRP C 33 10.545 9.862 0.449 1.00 0.23 O ATOM 4626 CB TRP C 33 10.548 7.702 -2.108 1.00 0.25 C ATOM 4627 CG TRP C 33 9.781 8.889 -2.599 1.00 0.27 C ATOM 4628 CD1 TRP C 33 10.218 9.764 -3.536 1.00 0.32 C ATOM 4629 CD2 TRP C 33 8.457 9.345 -2.200 1.00 0.27 C ATOM 4630 NE1 TRP C 33 9.248 10.729 -3.735 1.00 0.34 N ATOM 4631 CE2 TRP C 33 8.142 10.513 -2.935 1.00 0.31 C ATOM 4632 CE3 TRP C 33 7.507 8.864 -1.281 1.00 0.26 C ATOM 4633 CZ2 TRP C 33 6.928 11.180 -2.762 1.00 0.32 C ATOM 4634 CZ3 TRP C 33 6.285 9.532 -1.105 1.00 0.29 C ATOM 4635 CH2 TRP C 33 5.996 10.687 -1.844 1.00 0.31 C ATOM 0 H TRP C 33 12.042 6.076 -0.935 1.00 0.21 H new ATOM 0 HA TRP C 33 12.128 8.896 -1.267 1.00 0.23 H new ATOM 0 HB2 TRP C 33 11.159 7.292 -2.912 1.00 0.25 H new ATOM 0 HB3 TRP C 33 9.862 6.915 -1.796 1.00 0.25 H new ATOM 0 HD1 TRP C 33 11.169 9.716 -4.045 1.00 0.32 H new ATOM 0 HE1 TRP C 33 9.338 11.505 -4.391 1.00 0.34 H new ATOM 0 HE3 TRP C 33 7.719 7.974 -0.707 1.00 0.26 H new ATOM 0 HZ2 TRP C 33 6.710 12.070 -3.333 1.00 0.32 H new ATOM 0 HZ3 TRP C 33 5.563 9.154 -0.396 1.00 0.29 H new ATOM 0 HH2 TRP C 33 5.054 11.196 -1.704 1.00 0.31 H new ATOM 4646 N GLY C 34 9.830 7.834 0.880 1.00 0.22 N ATOM 4647 CA GLY C 34 8.977 8.345 1.982 1.00 0.23 C ATOM 4648 C GLY C 34 9.866 9.025 3.020 1.00 0.22 C ATOM 4649 O GLY C 34 9.558 10.092 3.508 1.00 0.23 O ATOM 0 H GLY C 34 9.790 6.827 0.724 1.00 0.22 H new ATOM 0 HA2 GLY C 34 8.243 9.051 1.594 1.00 0.23 H new ATOM 0 HA3 GLY C 34 8.422 7.526 2.440 1.00 0.23 H new ATOM 4653 N THR C 35 10.973 8.421 3.360 1.00 0.22 N ATOM 4654 CA THR C 35 11.874 9.045 4.369 1.00 0.24 C ATOM 4655 C THR C 35 12.332 10.417 3.854 1.00 0.24 C ATOM 4656 O THR C 35 12.241 11.411 4.547 1.00 0.24 O ATOM 4657 CB THR C 35 13.093 8.137 4.584 1.00 0.27 C ATOM 4658 OG1 THR C 35 12.654 6.837 4.956 1.00 0.30 O ATOM 4659 CG2 THR C 35 13.979 8.698 5.699 1.00 0.30 C ATOM 0 H THR C 35 11.290 7.527 2.985 1.00 0.22 H new ATOM 0 HA THR C 35 11.346 9.171 5.314 1.00 0.24 H new ATOM 0 HB THR C 35 13.664 8.090 3.657 1.00 0.27 H new ATOM 0 HG1 THR C 35 12.357 6.351 4.158 1.00 0.30 H new ATOM 0 HG21 THR C 35 14.840 8.046 5.842 1.00 0.30 H new ATOM 0 HG22 THR C 35 14.321 9.696 5.424 1.00 0.30 H new ATOM 0 HG23 THR C 35 13.407 8.753 6.625 1.00 0.30 H new ATOM 4667 N LYS C 36 12.814 10.484 2.641 1.00 0.25 N ATOM 4668 CA LYS C 36 13.262 11.799 2.099 1.00 0.28 C ATOM 4669 C LYS C 36 12.076 12.762 2.049 1.00 0.28 C ATOM 4670 O LYS C 36 12.184 13.922 2.391 1.00 0.30 O ATOM 4671 CB LYS C 36 13.813 11.602 0.682 1.00 0.32 C ATOM 4672 CG LYS C 36 15.152 10.839 0.725 1.00 0.47 C ATOM 4673 CD LYS C 36 16.324 11.817 0.935 1.00 0.77 C ATOM 4674 CE LYS C 36 16.497 12.738 -0.291 1.00 1.44 C ATOM 4675 NZ LYS C 36 15.797 14.033 -0.044 1.00 2.00 N ATOM 0 H LYS C 36 12.916 9.692 2.007 1.00 0.25 H new ATOM 0 HA LYS C 36 14.039 12.211 2.742 1.00 0.28 H new ATOM 0 HB2 LYS C 36 13.092 11.050 0.079 1.00 0.32 H new ATOM 0 HB3 LYS C 36 13.955 12.571 0.203 1.00 0.32 H new ATOM 0 HG2 LYS C 36 15.134 10.106 1.531 1.00 0.47 H new ATOM 0 HG3 LYS C 36 15.293 10.287 -0.204 1.00 0.47 H new ATOM 0 HD2 LYS C 36 16.145 12.420 1.826 1.00 0.77 H new ATOM 0 HD3 LYS C 36 17.243 11.258 1.108 1.00 0.77 H new ATOM 0 HE2 LYS C 36 17.556 12.915 -0.480 1.00 1.44 H new ATOM 0 HE3 LYS C 36 16.091 12.257 -1.181 1.00 1.44 H new ATOM 0 HZ1 LYS C 36 15.087 14.191 -0.787 1.00 2.00 H new ATOM 0 HZ2 LYS C 36 15.327 14.002 0.883 1.00 2.00 H new ATOM 0 HZ3 LYS C 36 16.489 14.809 -0.055 1.00 2.00 H new ATOM 4689 N ASN C 37 10.944 12.278 1.622 1.00 0.27 N ATOM 4690 CA ASN C 37 9.730 13.137 1.539 1.00 0.30 C ATOM 4691 C ASN C 37 9.359 13.671 2.928 1.00 0.29 C ATOM 4692 O ASN C 37 8.984 14.814 3.080 1.00 0.33 O ATOM 4693 CB ASN C 37 8.582 12.320 0.961 1.00 0.32 C ATOM 4694 CG ASN C 37 7.305 13.163 0.950 1.00 0.37 C ATOM 4695 OD1 ASN C 37 7.157 14.096 0.048 1.00 0.74 O flip ATOM 4696 ND2 ASN C 37 6.430 12.969 1.769 1.00 0.48 N flip ATOM 0 H ASN C 37 10.806 11.312 1.323 1.00 0.27 H new ATOM 0 HA ASN C 37 9.931 13.990 0.890 1.00 0.30 H new ATOM 0 HB2 ASN C 37 8.826 11.998 -0.051 1.00 0.32 H new ATOM 0 HB3 ASN C 37 8.429 11.418 1.554 1.00 0.32 H new ATOM 0 HD21 ASN C 37 6.544 12.241 2.474 1.00 0.48 H new ATOM 0 HD22 ASN C 37 5.581 13.534 1.752 1.00 0.48 H new ATOM 4703 N LEU C 38 9.468 12.864 3.948 1.00 0.26 N ATOM 4704 CA LEU C 38 9.131 13.357 5.315 1.00 0.27 C ATOM 4705 C LEU C 38 10.047 14.532 5.642 1.00 0.26 C ATOM 4706 O LEU C 38 9.632 15.511 6.231 1.00 0.28 O ATOM 4707 CB LEU C 38 9.316 12.240 6.349 1.00 0.26 C ATOM 4708 CG LEU C 38 8.211 11.180 6.195 1.00 0.30 C ATOM 4709 CD1 LEU C 38 8.568 9.957 7.046 1.00 0.34 C ATOM 4710 CD2 LEU C 38 6.848 11.746 6.654 1.00 0.35 C ATOM 0 H LEU C 38 9.773 11.892 3.896 1.00 0.26 H new ATOM 0 HA LEU C 38 8.089 13.675 5.345 1.00 0.27 H new ATOM 0 HB2 LEU C 38 10.294 11.776 6.222 1.00 0.26 H new ATOM 0 HB3 LEU C 38 9.290 12.659 7.355 1.00 0.26 H new ATOM 0 HG LEU C 38 8.135 10.897 5.145 1.00 0.30 H new ATOM 0 HD11 LEU C 38 7.789 9.201 6.942 1.00 0.34 H new ATOM 0 HD12 LEU C 38 9.520 9.546 6.710 1.00 0.34 H new ATOM 0 HD13 LEU C 38 8.649 10.253 8.092 1.00 0.34 H new ATOM 0 HD21 LEU C 38 6.079 10.982 6.538 1.00 0.35 H new ATOM 0 HD22 LEU C 38 6.911 12.041 7.701 1.00 0.35 H new ATOM 0 HD23 LEU C 38 6.592 12.614 6.047 1.00 0.35 H new ATOM 4722 N GLN C 39 11.290 14.454 5.253 1.00 0.25 N ATOM 4723 CA GLN C 39 12.220 15.578 5.532 1.00 0.29 C ATOM 4724 C GLN C 39 11.670 16.831 4.853 1.00 0.33 C ATOM 4725 O GLN C 39 11.714 17.912 5.403 1.00 0.35 O ATOM 4726 CB GLN C 39 13.605 15.265 4.967 1.00 0.31 C ATOM 4727 CG GLN C 39 14.582 16.366 5.375 1.00 0.39 C ATOM 4728 CD GLN C 39 15.972 16.042 4.831 1.00 0.44 C ATOM 4729 OE1 GLN C 39 16.120 15.204 3.964 1.00 0.84 O ATOM 4730 NE2 GLN C 39 17.003 16.676 5.310 1.00 0.97 N ATOM 0 H GLN C 39 11.698 13.662 4.756 1.00 0.25 H new ATOM 0 HA GLN C 39 12.306 15.730 6.608 1.00 0.29 H new ATOM 0 HB2 GLN C 39 13.952 14.301 5.338 1.00 0.31 H new ATOM 0 HB3 GLN C 39 13.558 15.190 3.881 1.00 0.31 H new ATOM 0 HG2 GLN C 39 14.244 17.328 4.989 1.00 0.39 H new ATOM 0 HG3 GLN C 39 14.616 16.452 6.461 1.00 0.39 H new ATOM 0 HE21 GLN C 39 16.876 17.379 6.038 1.00 0.97 H new ATOM 0 HE22 GLN C 39 17.938 16.470 4.957 1.00 0.97 H new ATOM 4739 N THR C 40 11.144 16.706 3.664 1.00 0.36 N ATOM 4740 CA THR C 40 10.590 17.911 2.985 1.00 0.42 C ATOM 4741 C THR C 40 9.471 18.487 3.855 1.00 0.41 C ATOM 4742 O THR C 40 9.364 19.686 4.020 1.00 0.43 O ATOM 4743 CB THR C 40 10.027 17.535 1.611 1.00 0.47 C ATOM 4744 OG1 THR C 40 8.859 16.745 1.775 1.00 0.46 O ATOM 4745 CG2 THR C 40 11.074 16.750 0.822 1.00 0.49 C ATOM 0 H THR C 40 11.075 15.834 3.140 1.00 0.36 H new ATOM 0 HA THR C 40 11.381 18.648 2.847 1.00 0.42 H new ATOM 0 HB THR C 40 9.774 18.443 1.064 1.00 0.47 H new ATOM 0 HG1 THR C 40 9.111 15.845 2.070 1.00 0.46 H new ATOM 0 HG21 THR C 40 10.670 16.484 -0.155 1.00 0.49 H new ATOM 0 HG22 THR C 40 11.966 17.363 0.691 1.00 0.49 H new ATOM 0 HG23 THR C 40 11.334 15.842 1.366 1.00 0.49 H new ATOM 4753 N ARG C 41 8.655 17.652 4.447 1.00 0.39 N ATOM 4754 CA ARG C 41 7.584 18.199 5.324 1.00 0.39 C ATOM 4755 C ARG C 41 8.254 18.978 6.451 1.00 0.35 C ATOM 4756 O ARG C 41 7.807 20.038 6.842 1.00 0.37 O ATOM 4757 CB ARG C 41 6.760 17.068 5.949 1.00 0.43 C ATOM 4758 CG ARG C 41 5.901 16.370 4.891 1.00 0.55 C ATOM 4759 CD ARG C 41 4.913 15.430 5.600 1.00 0.66 C ATOM 4760 NE ARG C 41 4.370 14.413 4.641 1.00 0.89 N ATOM 4761 CZ ARG C 41 3.779 14.760 3.532 1.00 1.04 C ATOM 4762 NH1 ARG C 41 3.522 16.014 3.278 1.00 1.22 N ATOM 4763 NH2 ARG C 41 3.396 13.839 2.694 1.00 1.32 N ATOM 0 H ARG C 41 8.684 16.636 4.362 1.00 0.39 H new ATOM 0 HA ARG C 41 6.923 18.831 4.731 1.00 0.39 H new ATOM 0 HB2 ARG C 41 7.426 16.344 6.418 1.00 0.43 H new ATOM 0 HB3 ARG C 41 6.121 17.470 6.735 1.00 0.43 H new ATOM 0 HG2 ARG C 41 5.361 17.107 4.296 1.00 0.55 H new ATOM 0 HG3 ARG C 41 6.532 15.806 4.204 1.00 0.55 H new ATOM 0 HD2 ARG C 41 5.412 14.927 6.428 1.00 0.66 H new ATOM 0 HD3 ARG C 41 4.094 16.009 6.026 1.00 0.66 H new ATOM 0 HE ARG C 41 4.466 13.422 4.863 1.00 0.89 H new ATOM 0 HH11 ARG C 41 3.784 16.735 3.951 1.00 1.22 H new ATOM 0 HH12 ARG C 41 3.059 16.273 2.407 1.00 1.22 H new ATOM 0 HH21 ARG C 41 3.559 12.855 2.908 1.00 1.32 H new ATOM 0 HH22 ARG C 41 2.933 14.102 1.824 1.00 1.32 H new ATOM 4777 N VAL C 42 9.330 18.455 6.980 1.00 0.33 N ATOM 4778 CA VAL C 42 10.030 19.163 8.083 1.00 0.35 C ATOM 4779 C VAL C 42 10.502 20.526 7.581 1.00 0.37 C ATOM 4780 O VAL C 42 10.346 21.525 8.249 1.00 0.40 O ATOM 4781 CB VAL C 42 11.228 18.333 8.562 1.00 0.37 C ATOM 4782 CG1 VAL C 42 12.068 19.151 9.549 1.00 0.43 C ATOM 4783 CG2 VAL C 42 10.717 17.069 9.255 1.00 0.37 C ATOM 0 H VAL C 42 9.750 17.571 6.694 1.00 0.33 H new ATOM 0 HA VAL C 42 9.347 19.301 8.921 1.00 0.35 H new ATOM 0 HB VAL C 42 11.846 18.062 7.706 1.00 0.37 H new ATOM 0 HG11 VAL C 42 12.917 18.556 9.885 1.00 0.43 H new ATOM 0 HG12 VAL C 42 12.430 20.054 9.057 1.00 0.43 H new ATOM 0 HG13 VAL C 42 11.455 19.426 10.407 1.00 0.43 H new ATOM 0 HG21 VAL C 42 11.564 16.474 9.598 1.00 0.37 H new ATOM 0 HG22 VAL C 42 10.099 17.347 10.109 1.00 0.37 H new ATOM 0 HG23 VAL C 42 10.123 16.484 8.553 1.00 0.37 H new ATOM 4793 N THR C 43 11.071 20.587 6.406 1.00 0.39 N ATOM 4794 CA THR C 43 11.537 21.908 5.894 1.00 0.45 C ATOM 4795 C THR C 43 10.341 22.859 5.796 1.00 0.44 C ATOM 4796 O THR C 43 10.429 24.022 6.140 1.00 0.47 O ATOM 4797 CB THR C 43 12.162 21.732 4.506 1.00 0.50 C ATOM 4798 OG1 THR C 43 11.189 21.202 3.617 1.00 0.50 O ATOM 4799 CG2 THR C 43 13.358 20.780 4.587 1.00 0.51 C ATOM 0 H THR C 43 11.231 19.792 5.787 1.00 0.39 H new ATOM 0 HA THR C 43 12.282 22.320 6.575 1.00 0.45 H new ATOM 0 HB THR C 43 12.505 22.700 4.140 1.00 0.50 H new ATOM 0 HG1 THR C 43 10.604 20.584 4.103 1.00 0.50 H new ATOM 0 HG21 THR C 43 13.796 20.661 3.596 1.00 0.51 H new ATOM 0 HG22 THR C 43 14.105 21.191 5.267 1.00 0.51 H new ATOM 0 HG23 THR C 43 13.026 19.810 4.956 1.00 0.51 H new ATOM 4807 N ALA C 44 9.217 22.373 5.347 1.00 0.41 N ATOM 4808 CA ALA C 44 8.018 23.251 5.247 1.00 0.43 C ATOM 4809 C ALA C 44 7.608 23.686 6.654 1.00 0.39 C ATOM 4810 O ALA C 44 7.313 24.838 6.904 1.00 0.39 O ATOM 4811 CB ALA C 44 6.875 22.479 4.586 1.00 0.45 C ATOM 0 H ALA C 44 9.077 21.409 5.046 1.00 0.41 H new ATOM 0 HA ALA C 44 8.247 24.130 4.644 1.00 0.43 H new ATOM 0 HB1 ALA C 44 5.997 23.121 4.512 1.00 0.45 H new ATOM 0 HB2 ALA C 44 7.178 22.164 3.588 1.00 0.45 H new ATOM 0 HB3 ALA C 44 6.634 21.602 5.186 1.00 0.45 H new ATOM 4817 N ILE C 45 7.615 22.766 7.579 1.00 0.35 N ATOM 4818 CA ILE C 45 7.247 23.101 8.981 1.00 0.32 C ATOM 4819 C ILE C 45 8.212 24.162 9.512 1.00 0.32 C ATOM 4820 O ILE C 45 7.825 25.064 10.228 1.00 0.31 O ATOM 4821 CB ILE C 45 7.313 21.841 9.856 1.00 0.31 C ATOM 4822 CG1 ILE C 45 6.168 20.901 9.466 1.00 0.32 C ATOM 4823 CG2 ILE C 45 7.167 22.227 11.334 1.00 0.30 C ATOM 4824 CD1 ILE C 45 6.369 19.534 10.126 1.00 0.33 C ATOM 0 H ILE C 45 7.862 21.789 7.421 1.00 0.35 H new ATOM 0 HA ILE C 45 6.229 23.490 9.009 1.00 0.32 H new ATOM 0 HB ILE C 45 8.272 21.345 9.706 1.00 0.31 H new ATOM 0 HG12 ILE C 45 5.214 21.328 9.776 1.00 0.32 H new ATOM 0 HG13 ILE C 45 6.130 20.789 8.382 1.00 0.32 H new ATOM 0 HG21 ILE C 45 7.214 21.330 11.951 1.00 0.30 H new ATOM 0 HG22 ILE C 45 7.974 22.903 11.615 1.00 0.30 H new ATOM 0 HG23 ILE C 45 6.208 22.723 11.488 1.00 0.30 H new ATOM 0 HD11 ILE C 45 5.551 18.870 9.845 1.00 0.33 H new ATOM 0 HD12 ILE C 45 7.315 19.105 9.794 1.00 0.33 H new ATOM 0 HD13 ILE C 45 6.384 19.652 11.210 1.00 0.33 H new ATOM 4836 N GLU C 46 9.470 24.051 9.187 1.00 0.35 N ATOM 4837 CA GLU C 46 10.453 25.043 9.700 1.00 0.36 C ATOM 4838 C GLU C 46 10.065 26.445 9.215 1.00 0.38 C ATOM 4839 O GLU C 46 10.140 27.403 9.956 1.00 0.38 O ATOM 4840 CB GLU C 46 11.844 24.687 9.164 1.00 0.44 C ATOM 4841 CG GLU C 46 12.342 23.398 9.830 1.00 1.20 C ATOM 4842 CD GLU C 46 12.785 23.680 11.268 1.00 1.67 C ATOM 4843 OE1 GLU C 46 13.942 24.018 11.455 1.00 2.26 O ATOM 4844 OE2 GLU C 46 11.962 23.545 12.159 1.00 2.17 O ATOM 0 H GLU C 46 9.858 23.320 8.591 1.00 0.35 H new ATOM 0 HA GLU C 46 10.460 25.027 10.790 1.00 0.36 H new ATOM 0 HB2 GLU C 46 11.805 24.557 8.082 1.00 0.44 H new ATOM 0 HB3 GLU C 46 12.540 25.502 9.362 1.00 0.44 H new ATOM 0 HG2 GLU C 46 11.550 22.649 9.826 1.00 1.20 H new ATOM 0 HG3 GLU C 46 13.174 22.984 9.260 1.00 1.20 H new ATOM 4851 N LYS C 47 9.627 26.585 7.995 1.00 0.41 N ATOM 4852 CA LYS C 47 9.229 27.944 7.527 1.00 0.43 C ATOM 4853 C LYS C 47 8.062 28.456 8.382 1.00 0.41 C ATOM 4854 O LYS C 47 8.014 29.616 8.749 1.00 0.42 O ATOM 4855 CB LYS C 47 8.820 27.897 6.049 1.00 0.48 C ATOM 4856 CG LYS C 47 10.063 27.655 5.181 1.00 1.21 C ATOM 4857 CD LYS C 47 9.691 27.721 3.691 1.00 1.54 C ATOM 4858 CE LYS C 47 9.071 26.397 3.238 1.00 2.30 C ATOM 4859 NZ LYS C 47 8.874 26.421 1.761 1.00 2.87 N ATOM 0 H LYS C 47 9.528 25.834 7.312 1.00 0.41 H new ATOM 0 HA LYS C 47 10.076 28.622 7.630 1.00 0.43 H new ATOM 0 HB2 LYS C 47 8.091 27.103 5.888 1.00 0.48 H new ATOM 0 HB3 LYS C 47 8.341 28.833 5.763 1.00 0.48 H new ATOM 0 HG2 LYS C 47 10.824 28.402 5.407 1.00 1.21 H new ATOM 0 HG3 LYS C 47 10.494 26.681 5.413 1.00 1.21 H new ATOM 0 HD2 LYS C 47 8.988 28.536 3.521 1.00 1.54 H new ATOM 0 HD3 LYS C 47 10.579 27.936 3.097 1.00 1.54 H new ATOM 0 HE2 LYS C 47 9.719 25.566 3.516 1.00 2.30 H new ATOM 0 HE3 LYS C 47 8.117 26.239 3.741 1.00 2.30 H new ATOM 0 HZ1 LYS C 47 8.453 25.522 1.452 1.00 2.87 H new ATOM 0 HZ2 LYS C 47 8.240 27.205 1.508 1.00 2.87 H new ATOM 0 HZ3 LYS C 47 9.792 26.553 1.290 1.00 2.87 H new ATOM 4873 N TYR C 48 7.131 27.602 8.714 1.00 0.38 N ATOM 4874 CA TYR C 48 5.981 28.049 9.556 1.00 0.36 C ATOM 4875 C TYR C 48 6.468 28.351 10.976 1.00 0.32 C ATOM 4876 O TYR C 48 6.041 29.301 11.595 1.00 0.32 O ATOM 4877 CB TYR C 48 4.893 26.972 9.591 1.00 0.37 C ATOM 4878 CG TYR C 48 4.196 26.927 8.249 1.00 0.40 C ATOM 4879 CD1 TYR C 48 3.294 27.938 7.898 1.00 0.45 C ATOM 4880 CD2 TYR C 48 4.455 25.884 7.357 1.00 0.41 C ATOM 4881 CE1 TYR C 48 2.649 27.903 6.655 1.00 0.50 C ATOM 4882 CE2 TYR C 48 3.814 25.847 6.110 1.00 0.46 C ATOM 4883 CZ TYR C 48 2.908 26.858 5.760 1.00 0.50 C ATOM 4884 OH TYR C 48 2.275 26.827 4.532 1.00 0.56 O ATOM 0 H TYR C 48 7.116 26.619 8.441 1.00 0.38 H new ATOM 0 HA TYR C 48 5.557 28.954 9.122 1.00 0.36 H new ATOM 0 HB2 TYR C 48 5.333 26.001 9.819 1.00 0.37 H new ATOM 0 HB3 TYR C 48 4.174 27.190 10.381 1.00 0.37 H new ATOM 0 HD1 TYR C 48 3.095 28.746 8.586 1.00 0.45 H new ATOM 0 HD2 TYR C 48 5.151 25.104 7.628 1.00 0.41 H new ATOM 0 HE1 TYR C 48 1.951 28.683 6.387 1.00 0.50 H new ATOM 0 HE2 TYR C 48 4.018 25.041 5.421 1.00 0.46 H new ATOM 0 HH TYR C 48 2.568 26.036 4.033 1.00 0.56 H new ATOM 4894 N LEU C 49 7.354 27.552 11.504 1.00 0.30 N ATOM 4895 CA LEU C 49 7.853 27.822 12.881 1.00 0.29 C ATOM 4896 C LEU C 49 8.515 29.212 12.906 1.00 0.32 C ATOM 4897 O LEU C 49 8.351 29.975 13.834 1.00 0.32 O ATOM 4898 CB LEU C 49 8.859 26.733 13.291 1.00 0.29 C ATOM 4899 CG LEU C 49 8.140 25.385 13.511 1.00 0.25 C ATOM 4900 CD1 LEU C 49 9.190 24.287 13.689 1.00 0.27 C ATOM 4901 CD2 LEU C 49 7.247 25.441 14.765 1.00 0.25 C ATOM 0 H LEU C 49 7.751 26.731 11.046 1.00 0.30 H new ATOM 0 HA LEU C 49 7.025 27.807 13.590 1.00 0.29 H new ATOM 0 HB2 LEU C 49 9.620 26.624 12.518 1.00 0.29 H new ATOM 0 HB3 LEU C 49 9.373 27.031 14.205 1.00 0.29 H new ATOM 0 HG LEU C 49 7.511 25.174 12.646 1.00 0.25 H new ATOM 0 HD11 LEU C 49 8.693 23.330 13.845 1.00 0.27 H new ATOM 0 HD12 LEU C 49 9.813 24.231 12.796 1.00 0.27 H new ATOM 0 HD13 LEU C 49 9.814 24.517 14.553 1.00 0.27 H new ATOM 0 HD21 LEU C 49 6.750 24.481 14.901 1.00 0.25 H new ATOM 0 HD22 LEU C 49 7.861 25.659 15.639 1.00 0.25 H new ATOM 0 HD23 LEU C 49 6.498 26.223 14.643 1.00 0.25 H new ATOM 4913 N LYS C 50 9.245 29.557 11.881 1.00 0.35 N ATOM 4914 CA LYS C 50 9.885 30.904 11.850 1.00 0.39 C ATOM 4915 C LYS C 50 8.786 31.973 11.906 1.00 0.39 C ATOM 4916 O LYS C 50 8.907 32.989 12.574 1.00 0.41 O ATOM 4917 CB LYS C 50 10.688 31.063 10.560 1.00 0.44 C ATOM 4918 CG LYS C 50 11.916 30.156 10.612 1.00 1.03 C ATOM 4919 CD LYS C 50 12.721 30.313 9.322 1.00 1.21 C ATOM 4920 CE LYS C 50 13.951 29.405 9.374 1.00 1.58 C ATOM 4921 NZ LYS C 50 13.521 27.979 9.311 1.00 2.18 N ATOM 0 H LYS C 50 9.426 28.969 11.068 1.00 0.35 H new ATOM 0 HA LYS C 50 10.556 31.015 12.702 1.00 0.39 H new ATOM 0 HB2 LYS C 50 10.069 30.807 9.700 1.00 0.44 H new ATOM 0 HB3 LYS C 50 10.994 32.102 10.435 1.00 0.44 H new ATOM 0 HG2 LYS C 50 12.534 30.412 11.472 1.00 1.03 H new ATOM 0 HG3 LYS C 50 11.609 29.118 10.738 1.00 1.03 H new ATOM 0 HD2 LYS C 50 12.103 30.057 8.462 1.00 1.21 H new ATOM 0 HD3 LYS C 50 13.028 31.351 9.196 1.00 1.21 H new ATOM 0 HE2 LYS C 50 14.618 29.631 8.543 1.00 1.58 H new ATOM 0 HE3 LYS C 50 14.511 29.587 10.291 1.00 1.58 H new ATOM 0 HZ1 LYS C 50 13.964 27.448 10.088 1.00 2.18 H new ATOM 0 HZ2 LYS C 50 12.486 27.924 9.400 1.00 2.18 H new ATOM 0 HZ3 LYS C 50 13.813 27.568 8.401 1.00 2.18 H new ATOM 4935 N ASP C 51 7.705 31.741 11.210 1.00 0.38 N ATOM 4936 CA ASP C 51 6.580 32.723 11.210 1.00 0.40 C ATOM 4937 C ASP C 51 6.072 32.892 12.640 1.00 0.38 C ATOM 4938 O ASP C 51 5.745 33.981 13.071 1.00 0.40 O ATOM 4939 CB ASP C 51 5.445 32.230 10.306 1.00 0.42 C ATOM 4940 CG ASP C 51 5.879 32.327 8.842 1.00 1.29 C ATOM 4941 OD1 ASP C 51 6.778 33.102 8.560 1.00 1.96 O ATOM 4942 OD2 ASP C 51 5.304 31.624 8.026 1.00 2.07 O ATOM 0 H ASP C 51 7.552 30.910 10.639 1.00 0.38 H new ATOM 0 HA ASP C 51 6.933 33.681 10.828 1.00 0.40 H new ATOM 0 HB2 ASP C 51 5.191 31.199 10.553 1.00 0.42 H new ATOM 0 HB3 ASP C 51 4.549 32.828 10.471 1.00 0.42 H new ATOM 4947 N GLN C 52 6.010 31.823 13.381 1.00 0.36 N ATOM 4948 CA GLN C 52 5.534 31.916 14.787 1.00 0.37 C ATOM 4949 C GLN C 52 6.439 32.893 15.544 1.00 0.38 C ATOM 4950 O GLN C 52 5.980 33.683 16.344 1.00 0.40 O ATOM 4951 CB GLN C 52 5.574 30.516 15.427 1.00 0.42 C ATOM 4952 CG GLN C 52 5.495 30.608 16.957 1.00 1.31 C ATOM 4953 CD GLN C 52 6.866 30.953 17.559 1.00 2.37 C ATOM 4954 OE1 GLN C 52 7.937 30.932 16.810 1.00 3.28 O flip ATOM 4955 NE2 GLN C 52 6.960 31.252 18.733 1.00 2.59 N flip ATOM 0 H GLN C 52 6.269 30.886 13.072 1.00 0.36 H new ATOM 0 HA GLN C 52 4.508 32.282 14.826 1.00 0.37 H new ATOM 0 HB2 GLN C 52 4.744 29.917 15.052 1.00 0.42 H new ATOM 0 HB3 GLN C 52 6.492 30.006 15.137 1.00 0.42 H new ATOM 0 HG2 GLN C 52 4.767 31.367 17.242 1.00 1.31 H new ATOM 0 HG3 GLN C 52 5.143 29.660 17.364 1.00 1.31 H new ATOM 0 HE21 GLN C 52 6.128 31.270 19.323 1.00 2.59 H new ATOM 0 HE22 GLN C 52 7.871 31.485 19.129 1.00 2.59 H new ATOM 4964 N ALA C 53 7.716 32.849 15.296 1.00 0.39 N ATOM 4965 CA ALA C 53 8.644 33.775 15.997 1.00 0.45 C ATOM 4966 C ALA C 53 8.252 35.222 15.691 1.00 0.47 C ATOM 4967 O ALA C 53 8.353 36.094 16.532 1.00 0.53 O ATOM 4968 CB ALA C 53 10.064 33.527 15.500 1.00 0.50 C ATOM 0 H ALA C 53 8.158 32.210 14.636 1.00 0.39 H new ATOM 0 HA ALA C 53 8.589 33.602 17.072 1.00 0.45 H new ATOM 0 HB1 ALA C 53 10.751 34.203 16.010 1.00 0.50 H new ATOM 0 HB2 ALA C 53 10.348 32.496 15.709 1.00 0.50 H new ATOM 0 HB3 ALA C 53 10.110 33.705 14.426 1.00 0.50 H new ATOM 4974 N GLN C 54 7.817 35.490 14.491 1.00 0.45 N ATOM 4975 CA GLN C 54 7.435 36.888 14.139 1.00 0.50 C ATOM 4976 C GLN C 54 6.308 37.355 15.062 1.00 0.55 C ATOM 4977 O GLN C 54 6.286 38.487 15.500 1.00 0.62 O ATOM 4978 CB GLN C 54 6.971 36.945 12.680 1.00 0.51 C ATOM 4979 CG GLN C 54 6.587 38.382 12.305 1.00 0.58 C ATOM 4980 CD GLN C 54 6.127 38.422 10.846 1.00 0.62 C ATOM 4981 OE1 GLN C 54 5.361 37.584 10.416 1.00 0.97 O ATOM 4982 NE2 GLN C 54 6.565 39.368 10.059 1.00 1.03 N ATOM 0 H GLN C 54 7.710 34.806 13.742 1.00 0.45 H new ATOM 0 HA GLN C 54 8.297 37.543 14.263 1.00 0.50 H new ATOM 0 HB2 GLN C 54 7.765 36.589 12.024 1.00 0.51 H new ATOM 0 HB3 GLN C 54 6.117 36.283 12.536 1.00 0.51 H new ATOM 0 HG2 GLN C 54 5.791 38.740 12.958 1.00 0.58 H new ATOM 0 HG3 GLN C 54 7.439 39.047 12.447 1.00 0.58 H new ATOM 0 HE21 GLN C 54 7.209 40.073 10.418 1.00 1.03 H new ATOM 0 HE22 GLN C 54 6.263 39.402 9.085 1.00 1.03 H new ATOM 4991 N LEU C 55 5.372 36.502 15.364 1.00 0.54 N ATOM 4992 CA LEU C 55 4.263 36.927 16.264 1.00 0.62 C ATOM 4993 C LEU C 55 4.812 37.088 17.680 1.00 0.65 C ATOM 4994 O LEU C 55 5.267 36.140 18.291 1.00 0.59 O ATOM 4995 CB LEU C 55 3.166 35.861 16.268 1.00 0.60 C ATOM 4996 CG LEU C 55 2.717 35.567 14.831 1.00 0.63 C ATOM 4997 CD1 LEU C 55 1.634 34.482 14.847 1.00 0.65 C ATOM 4998 CD2 LEU C 55 2.163 36.845 14.179 1.00 0.78 C ATOM 0 H LEU C 55 5.325 35.539 15.032 1.00 0.54 H new ATOM 0 HA LEU C 55 3.847 37.871 15.913 1.00 0.62 H new ATOM 0 HB2 LEU C 55 3.535 34.949 16.736 1.00 0.60 H new ATOM 0 HB3 LEU C 55 2.317 36.203 16.861 1.00 0.60 H new ATOM 0 HG LEU C 55 3.573 35.219 14.252 1.00 0.63 H new ATOM 0 HD11 LEU C 55 1.314 34.272 13.826 1.00 0.65 H new ATOM 0 HD12 LEU C 55 2.036 33.573 15.295 1.00 0.65 H new ATOM 0 HD13 LEU C 55 0.781 34.828 15.431 1.00 0.65 H new ATOM 0 HD21 LEU C 55 1.847 36.626 13.159 1.00 0.78 H new ATOM 0 HD22 LEU C 55 1.310 37.206 14.753 1.00 0.78 H new ATOM 0 HD23 LEU C 55 2.939 37.610 14.162 1.00 0.78 H new ATOM 5010 N ASN C 56 4.775 38.286 18.207 1.00 0.78 N ATOM 5011 CA ASN C 56 5.293 38.529 19.590 1.00 0.85 C ATOM 5012 C ASN C 56 4.280 39.362 20.375 1.00 0.97 C ATOM 5013 O ASN C 56 3.656 38.888 21.304 1.00 0.92 O ATOM 5014 CB ASN C 56 6.615 39.287 19.500 1.00 0.92 C ATOM 5015 CG ASN C 56 7.640 38.429 18.760 1.00 0.85 C ATOM 5016 OD1 ASN C 56 8.131 38.811 17.717 1.00 1.37 O ATOM 5017 ND2 ASN C 56 7.990 37.275 19.262 1.00 1.36 N ATOM 0 H ASN C 56 4.406 39.112 17.736 1.00 0.78 H new ATOM 0 HA ASN C 56 5.448 37.577 20.098 1.00 0.85 H new ATOM 0 HB2 ASN C 56 6.470 40.233 18.978 1.00 0.92 H new ATOM 0 HB3 ASN C 56 6.978 39.527 20.499 1.00 0.92 H new ATOM 0 HD21 ASN C 56 8.675 36.695 18.778 1.00 1.36 H new ATOM 0 HD22 ASN C 56 7.578 36.954 20.138 1.00 1.36 H new ATOM 5189 N THR C 68 6.558 46.236 19.022 1.00 1.01 N ATOM 5190 CA THR C 68 7.755 45.409 19.383 1.00 1.12 C ATOM 5191 C THR C 68 7.726 44.088 18.618 1.00 0.99 C ATOM 5192 O THR C 68 6.831 43.283 18.775 1.00 0.86 O ATOM 5193 CB THR C 68 7.747 45.131 20.892 1.00 1.21 C ATOM 5194 OG1 THR C 68 8.875 44.334 21.226 1.00 1.39 O ATOM 5195 CG2 THR C 68 6.465 44.392 21.290 1.00 1.09 C ATOM 0 HA THR C 68 8.661 45.954 19.117 1.00 1.12 H new ATOM 0 HB THR C 68 7.788 46.079 21.429 1.00 1.21 H new ATOM 0 HG1 THR C 68 8.875 44.155 22.189 1.00 1.39 H new ATOM 0 HG21 THR C 68 6.473 44.201 22.363 1.00 1.09 H new ATOM 0 HG22 THR C 68 5.599 45.003 21.037 1.00 1.09 H new ATOM 0 HG23 THR C 68 6.410 43.445 20.754 1.00 1.09 H new ATOM 5203 N THR C 69 8.715 43.870 17.785 1.00 1.06 N ATOM 5204 CA THR C 69 8.794 42.609 16.983 1.00 0.95 C ATOM 5205 C THR C 69 10.008 41.801 17.440 1.00 1.00 C ATOM 5206 O THR C 69 11.129 42.268 17.389 1.00 1.16 O ATOM 5207 CB THR C 69 8.945 42.959 15.494 1.00 1.05 C ATOM 5208 OG1 THR C 69 8.886 41.766 14.720 1.00 1.09 O ATOM 5209 CG2 THR C 69 10.290 43.660 15.250 1.00 1.28 C ATOM 0 H THR C 69 9.482 44.523 17.625 1.00 1.06 H new ATOM 0 HA THR C 69 7.886 42.023 17.128 1.00 0.95 H new ATOM 0 HB THR C 69 8.136 43.629 15.202 1.00 1.05 H new ATOM 0 HG1 THR C 69 8.980 41.987 13.770 1.00 1.09 H new ATOM 0 HG21 THR C 69 10.387 43.904 14.192 1.00 1.28 H new ATOM 0 HG22 THR C 69 10.335 44.576 15.839 1.00 1.28 H new ATOM 0 HG23 THR C 69 11.104 42.998 15.546 1.00 1.28 H new ATOM 5217 N VAL C 70 9.791 40.592 17.891 1.00 0.89 N ATOM 5218 CA VAL C 70 10.920 39.728 18.360 1.00 0.98 C ATOM 5219 C VAL C 70 10.849 38.388 17.611 1.00 0.85 C ATOM 5220 O VAL C 70 10.208 37.460 18.063 1.00 0.80 O ATOM 5221 CB VAL C 70 10.769 39.480 19.867 1.00 1.08 C ATOM 5222 CG1 VAL C 70 11.891 38.558 20.353 1.00 1.24 C ATOM 5223 CG2 VAL C 70 10.858 40.814 20.616 1.00 1.18 C ATOM 0 H VAL C 70 8.869 40.160 17.956 1.00 0.89 H new ATOM 0 HA VAL C 70 11.877 40.214 18.167 1.00 0.98 H new ATOM 0 HB VAL C 70 9.803 39.013 20.058 1.00 1.08 H new ATOM 0 HG11 VAL C 70 11.781 38.384 21.423 1.00 1.24 H new ATOM 0 HG12 VAL C 70 11.836 37.607 19.823 1.00 1.24 H new ATOM 0 HG13 VAL C 70 12.856 39.026 20.159 1.00 1.24 H new ATOM 0 HG21 VAL C 70 10.751 40.638 21.686 1.00 1.18 H new ATOM 0 HG22 VAL C 70 11.825 41.278 20.420 1.00 1.18 H new ATOM 0 HG23 VAL C 70 10.062 41.476 20.276 1.00 1.18 H new ATOM 5233 N PRO C 71 11.489 38.287 16.464 1.00 0.84 N ATOM 5234 CA PRO C 71 11.477 37.042 15.644 1.00 0.75 C ATOM 5235 C PRO C 71 12.554 36.037 16.075 1.00 0.74 C ATOM 5236 O PRO C 71 13.446 35.707 15.320 1.00 0.78 O ATOM 5237 CB PRO C 71 11.754 37.568 14.232 1.00 0.84 C ATOM 5238 CG PRO C 71 12.651 38.752 14.436 1.00 0.99 C ATOM 5239 CD PRO C 71 12.292 39.344 15.813 1.00 0.99 C ATOM 0 HA PRO C 71 10.541 36.492 15.739 1.00 0.75 H new ATOM 0 HB2 PRO C 71 12.234 36.809 13.614 1.00 0.84 H new ATOM 0 HB3 PRO C 71 10.831 37.853 13.727 1.00 0.84 H new ATOM 0 HG2 PRO C 71 13.699 38.454 14.404 1.00 0.99 H new ATOM 0 HG3 PRO C 71 12.505 39.490 13.647 1.00 0.99 H new ATOM 0 HD2 PRO C 71 13.186 39.578 16.391 1.00 0.99 H new ATOM 0 HD3 PRO C 71 11.726 40.270 15.713 1.00 0.99 H new ATOM 5247 N TRP C 72 12.464 35.532 17.276 1.00 0.72 N ATOM 5248 CA TRP C 72 13.467 34.533 17.740 1.00 0.75 C ATOM 5249 C TRP C 72 13.231 33.235 16.961 1.00 0.67 C ATOM 5250 O TRP C 72 12.177 32.646 17.081 1.00 0.60 O ATOM 5251 CB TRP C 72 13.244 34.262 19.226 1.00 0.78 C ATOM 5252 CG TRP C 72 14.370 33.440 19.756 1.00 0.84 C ATOM 5253 CD1 TRP C 72 15.608 33.904 20.037 1.00 0.94 C ATOM 5254 CD2 TRP C 72 14.380 32.020 20.072 1.00 0.84 C ATOM 5255 NE1 TRP C 72 16.382 32.856 20.503 1.00 0.99 N ATOM 5256 CE2 TRP C 72 15.667 31.672 20.543 1.00 0.93 C ATOM 5257 CE3 TRP C 72 13.405 31.009 19.994 1.00 0.79 C ATOM 5258 CZ2 TRP C 72 15.976 30.366 20.926 1.00 0.97 C ATOM 5259 CZ3 TRP C 72 13.712 29.695 20.378 1.00 0.84 C ATOM 5260 CH2 TRP C 72 14.994 29.374 20.843 1.00 0.92 C ATOM 0 H TRP C 72 11.740 35.768 17.954 1.00 0.72 H new ATOM 0 HA TRP C 72 14.480 34.902 17.580 1.00 0.75 H new ATOM 0 HB2 TRP C 72 13.178 35.203 19.772 1.00 0.78 H new ATOM 0 HB3 TRP C 72 12.298 33.741 19.374 1.00 0.78 H new ATOM 0 HD1 TRP C 72 15.939 34.925 19.917 1.00 0.94 H new ATOM 0 HE1 TRP C 72 17.359 32.945 20.782 1.00 0.99 H new ATOM 0 HE3 TRP C 72 12.414 31.246 19.636 1.00 0.79 H new ATOM 0 HZ2 TRP C 72 16.966 30.123 21.284 1.00 0.97 H new ATOM 0 HZ3 TRP C 72 12.956 28.927 20.315 1.00 0.84 H new ATOM 0 HH2 TRP C 72 15.224 28.361 21.137 1.00 0.92 H new ATOM 5271 N PRO C 73 14.166 32.780 16.155 1.00 0.71 N ATOM 5272 CA PRO C 73 13.958 31.540 15.362 1.00 0.65 C ATOM 5273 C PRO C 73 13.245 30.459 16.177 1.00 0.58 C ATOM 5274 O PRO C 73 13.459 30.317 17.365 1.00 0.61 O ATOM 5275 CB PRO C 73 15.383 31.114 14.998 1.00 0.74 C ATOM 5276 CG PRO C 73 16.147 32.400 14.904 1.00 0.84 C ATOM 5277 CD PRO C 73 15.497 33.364 15.909 1.00 0.82 C ATOM 0 HA PRO C 73 13.322 31.698 14.491 1.00 0.65 H new ATOM 0 HB2 PRO C 73 15.806 30.455 15.756 1.00 0.74 H new ATOM 0 HB3 PRO C 73 15.405 30.569 14.054 1.00 0.74 H new ATOM 0 HG2 PRO C 73 17.200 32.245 15.140 1.00 0.84 H new ATOM 0 HG3 PRO C 73 16.103 32.805 13.893 1.00 0.84 H new ATOM 0 HD2 PRO C 73 16.078 33.434 16.828 1.00 0.82 H new ATOM 0 HD3 PRO C 73 15.421 34.373 15.503 1.00 0.82 H new ATOM 5285 N ASN C 74 12.403 29.695 15.538 1.00 0.52 N ATOM 5286 CA ASN C 74 11.664 28.604 16.243 1.00 0.48 C ATOM 5287 C ASN C 74 11.756 27.348 15.383 1.00 0.50 C ATOM 5288 O ASN C 74 11.196 26.314 15.688 1.00 0.80 O ATOM 5289 CB ASN C 74 10.203 29.021 16.433 1.00 0.47 C ATOM 5290 CG ASN C 74 9.551 28.147 17.510 1.00 0.53 C ATOM 5291 OD1 ASN C 74 8.798 27.246 17.207 1.00 1.17 O ATOM 5292 ND2 ASN C 74 9.813 28.379 18.767 1.00 1.26 N ATOM 0 H ASN C 74 12.191 29.780 14.544 1.00 0.52 H new ATOM 0 HA ASN C 74 12.094 28.411 17.226 1.00 0.48 H new ATOM 0 HB2 ASN C 74 10.149 30.071 16.721 1.00 0.47 H new ATOM 0 HB3 ASN C 74 9.661 28.921 15.493 1.00 0.47 H new ATOM 0 HD21 ASN C 74 9.385 27.803 19.492 1.00 1.26 H new ATOM 0 HD22 ASN C 74 10.446 29.136 19.025 1.00 1.26 H new ATOM 5299 N ALA C 75 12.472 27.460 14.303 1.00 0.47 N ATOM 5300 CA ALA C 75 12.658 26.331 13.363 1.00 0.47 C ATOM 5301 C ALA C 75 13.939 25.602 13.746 1.00 0.46 C ATOM 5302 O ALA C 75 14.982 26.207 13.891 1.00 0.47 O ATOM 5303 CB ALA C 75 12.774 26.891 11.935 1.00 0.53 C ATOM 0 H ALA C 75 12.950 28.317 14.027 1.00 0.47 H new ATOM 0 HA ALA C 75 11.815 25.641 13.408 1.00 0.47 H new ATOM 0 HB1 ALA C 75 12.911 26.069 11.232 1.00 0.53 H new ATOM 0 HB2 ALA C 75 11.864 27.436 11.683 1.00 0.53 H new ATOM 0 HB3 ALA C 75 13.629 27.565 11.877 1.00 0.53 H new ATOM 5309 N SER C 76 13.885 24.317 13.916 1.00 0.47 N ATOM 5310 CA SER C 76 15.125 23.600 14.295 1.00 0.48 C ATOM 5311 C SER C 76 15.957 23.413 13.033 1.00 0.48 C ATOM 5312 O SER C 76 15.790 22.466 12.292 1.00 0.49 O ATOM 5313 CB SER C 76 14.760 22.235 14.880 1.00 0.54 C ATOM 5314 OG SER C 76 13.585 22.361 15.661 1.00 1.38 O ATOM 0 H SER C 76 13.051 23.739 13.811 1.00 0.47 H new ATOM 0 HA SER C 76 15.687 24.164 15.040 1.00 0.48 H new ATOM 0 HB2 SER C 76 14.602 21.513 14.079 1.00 0.54 H new ATOM 0 HB3 SER C 76 15.579 21.858 15.492 1.00 0.54 H new ATOM 0 HG SER C 76 13.778 22.899 16.457 1.00 1.38 H new ATOM 5320 N LEU C 77 16.851 24.328 12.789 1.00 0.50 N ATOM 5321 CA LEU C 77 17.702 24.237 11.580 1.00 0.53 C ATOM 5322 C LEU C 77 18.799 23.206 11.834 1.00 0.52 C ATOM 5323 O LEU C 77 19.365 23.139 12.903 1.00 0.55 O ATOM 5324 CB LEU C 77 18.313 25.612 11.298 1.00 0.62 C ATOM 5325 CG LEU C 77 17.192 26.649 11.139 1.00 0.65 C ATOM 5326 CD1 LEU C 77 17.811 28.044 11.012 1.00 0.75 C ATOM 5327 CD2 LEU C 77 16.351 26.343 9.888 1.00 0.66 C ATOM 0 H LEU C 77 17.027 25.139 13.381 1.00 0.50 H new ATOM 0 HA LEU C 77 17.114 23.929 10.715 1.00 0.53 H new ATOM 0 HB2 LEU C 77 18.977 25.901 12.113 1.00 0.62 H new ATOM 0 HB3 LEU C 77 18.918 25.574 10.392 1.00 0.62 H new ATOM 0 HG LEU C 77 16.543 26.609 12.014 1.00 0.65 H new ATOM 0 HD11 LEU C 77 17.019 28.784 10.899 1.00 0.75 H new ATOM 0 HD12 LEU C 77 18.391 28.267 11.907 1.00 0.75 H new ATOM 0 HD13 LEU C 77 18.464 28.074 10.139 1.00 0.75 H new ATOM 0 HD21 LEU C 77 15.561 27.087 9.790 1.00 0.66 H new ATOM 0 HD22 LEU C 77 16.989 26.372 9.005 1.00 0.66 H new ATOM 0 HD23 LEU C 77 15.907 25.352 9.982 1.00 0.66 H new ATOM 5339 N THR C 78 19.090 22.390 10.863 1.00 0.51 N ATOM 5340 CA THR C 78 20.141 21.344 11.045 1.00 0.51 C ATOM 5341 C THR C 78 20.922 21.197 9.740 1.00 0.57 C ATOM 5342 O THR C 78 20.612 20.361 8.919 1.00 0.66 O ATOM 5343 CB THR C 78 19.441 20.018 11.369 1.00 0.55 C ATOM 5344 OG1 THR C 78 20.416 18.999 11.537 1.00 0.61 O ATOM 5345 CG2 THR C 78 18.473 19.633 10.228 1.00 0.64 C ATOM 0 H THR C 78 18.645 22.399 9.945 1.00 0.51 H new ATOM 0 HA THR C 78 20.823 21.618 11.850 1.00 0.51 H new ATOM 0 HB THR C 78 18.869 20.131 12.290 1.00 0.55 H new ATOM 0 HG1 THR C 78 20.901 19.145 12.376 1.00 0.61 H new ATOM 0 HG21 THR C 78 17.982 18.690 10.470 1.00 0.64 H new ATOM 0 HG22 THR C 78 17.721 20.413 10.110 1.00 0.64 H new ATOM 0 HG23 THR C 78 19.032 19.523 9.298 1.00 0.64 H new ATOM 5353 N PRO C 79 21.924 22.011 9.543 1.00 0.65 N ATOM 5354 CA PRO C 79 22.756 21.984 8.318 1.00 0.77 C ATOM 5355 C PRO C 79 24.100 21.265 8.489 1.00 0.67 C ATOM 5356 O PRO C 79 24.534 20.513 7.639 1.00 0.70 O ATOM 5357 CB PRO C 79 23.006 23.475 8.111 1.00 0.98 C ATOM 5358 CG PRO C 79 23.155 24.029 9.504 1.00 0.96 C ATOM 5359 CD PRO C 79 22.376 23.083 10.445 1.00 0.75 C ATOM 0 HA PRO C 79 22.270 21.449 7.502 1.00 0.77 H new ATOM 0 HB2 PRO C 79 23.903 23.648 7.517 1.00 0.98 H new ATOM 0 HB3 PRO C 79 22.178 23.947 7.583 1.00 0.98 H new ATOM 0 HG2 PRO C 79 24.206 24.080 9.790 1.00 0.96 H new ATOM 0 HG3 PRO C 79 22.760 25.043 9.561 1.00 0.96 H new ATOM 0 HD2 PRO C 79 23.010 22.697 11.243 1.00 0.75 H new ATOM 0 HD3 PRO C 79 21.537 23.590 10.921 1.00 0.75 H new ATOM 5367 N LYS C 80 24.786 21.557 9.552 1.00 0.66 N ATOM 5368 CA LYS C 80 26.140 20.973 9.768 1.00 0.66 C ATOM 5369 C LYS C 80 26.095 19.538 10.308 1.00 0.63 C ATOM 5370 O LYS C 80 26.857 18.697 9.876 1.00 0.65 O ATOM 5371 CB LYS C 80 26.890 21.851 10.770 1.00 0.79 C ATOM 5372 CG LYS C 80 28.309 21.312 10.967 1.00 1.30 C ATOM 5373 CD LYS C 80 29.138 22.322 11.769 1.00 1.45 C ATOM 5374 CE LYS C 80 28.627 22.388 13.211 1.00 2.31 C ATOM 5375 NZ LYS C 80 29.653 23.052 14.063 1.00 2.95 N ATOM 0 H LYS C 80 24.466 22.182 10.291 1.00 0.66 H new ATOM 0 HA LYS C 80 26.642 20.939 8.801 1.00 0.66 H new ATOM 0 HB2 LYS C 80 26.928 22.879 10.410 1.00 0.79 H new ATOM 0 HB3 LYS C 80 26.361 21.866 11.723 1.00 0.79 H new ATOM 0 HG2 LYS C 80 28.276 20.357 11.491 1.00 1.30 H new ATOM 0 HG3 LYS C 80 28.777 21.129 10.000 1.00 1.30 H new ATOM 0 HD2 LYS C 80 30.189 22.032 11.759 1.00 1.45 H new ATOM 0 HD3 LYS C 80 29.075 23.307 11.306 1.00 1.45 H new ATOM 0 HE2 LYS C 80 27.689 22.941 13.252 1.00 2.31 H new ATOM 0 HE3 LYS C 80 28.422 21.384 13.583 1.00 2.31 H new ATOM 0 HZ1 LYS C 80 29.311 23.100 15.044 1.00 2.95 H new ATOM 0 HZ2 LYS C 80 30.537 22.506 14.031 1.00 2.95 H new ATOM 0 HZ3 LYS C 80 29.827 24.015 13.710 1.00 2.95 H new ATOM 5389 N TRP C 81 25.273 19.252 11.288 1.00 0.65 N ATOM 5390 CA TRP C 81 25.282 17.868 11.878 1.00 0.67 C ATOM 5391 C TRP C 81 24.334 16.884 11.173 1.00 0.62 C ATOM 5392 O TRP C 81 24.780 15.919 10.586 1.00 0.63 O ATOM 5393 CB TRP C 81 24.973 17.923 13.386 1.00 0.72 C ATOM 5394 CG TRP C 81 23.575 18.382 13.655 1.00 0.68 C ATOM 5395 CD1 TRP C 81 22.502 17.569 13.788 1.00 0.69 C ATOM 5396 CD2 TRP C 81 23.090 19.736 13.874 1.00 0.67 C ATOM 5397 NE1 TRP C 81 21.382 18.341 14.034 1.00 0.68 N ATOM 5398 CE2 TRP C 81 21.695 19.685 14.110 1.00 0.65 C ATOM 5399 CE3 TRP C 81 23.718 20.994 13.883 1.00 0.70 C ATOM 5400 CZ2 TRP C 81 20.952 20.842 14.346 1.00 0.65 C ATOM 5401 CZ3 TRP C 81 22.975 22.160 14.123 1.00 0.71 C ATOM 5402 CH2 TRP C 81 21.594 22.085 14.354 1.00 0.67 C ATOM 0 H TRP C 81 24.605 19.902 11.702 1.00 0.65 H new ATOM 0 HA TRP C 81 26.289 17.482 11.721 1.00 0.67 H new ATOM 0 HB2 TRP C 81 25.121 16.935 13.823 1.00 0.72 H new ATOM 0 HB3 TRP C 81 25.676 18.596 13.876 1.00 0.72 H new ATOM 0 HD1 TRP C 81 22.518 16.492 13.714 1.00 0.69 H new ATOM 0 HE1 TRP C 81 20.440 17.965 14.146 1.00 0.68 H new ATOM 0 HE3 TRP C 81 24.781 21.063 13.704 1.00 0.70 H new ATOM 0 HZ2 TRP C 81 19.888 20.779 14.521 1.00 0.65 H new ATOM 0 HZ3 TRP C 81 23.469 23.120 14.130 1.00 0.71 H new ATOM 0 HH2 TRP C 81 21.027 22.985 14.538 1.00 0.67 H new ATOM 5413 N ASN C 82 23.046 17.048 11.275 1.00 0.59 N ATOM 5414 CA ASN C 82 22.132 16.034 10.662 1.00 0.59 C ATOM 5415 C ASN C 82 22.185 16.063 9.125 1.00 0.53 C ATOM 5416 O ASN C 82 22.251 15.028 8.492 1.00 0.49 O ATOM 5417 CB ASN C 82 20.689 16.273 11.150 1.00 0.70 C ATOM 5418 CG ASN C 82 19.929 14.941 11.218 1.00 1.07 C ATOM 5419 OD1 ASN C 82 18.810 14.874 11.888 1.00 0.96 O flip ATOM 5420 ND2 ASN C 82 20.360 13.952 10.659 1.00 1.86 N flip ATOM 0 H ASN C 82 22.587 17.827 11.748 1.00 0.59 H new ATOM 0 HA ASN C 82 22.469 15.047 10.979 1.00 0.59 H new ATOM 0 HB2 ASN C 82 20.702 16.744 12.133 1.00 0.70 H new ATOM 0 HB3 ASN C 82 20.177 16.959 10.475 1.00 0.70 H new ATOM 0 HD21 ASN C 82 21.234 14.002 10.135 1.00 1.86 H new ATOM 0 HD22 ASN C 82 19.848 13.071 10.714 1.00 1.86 H new ATOM 5427 N ASN C 83 22.143 17.214 8.509 1.00 0.56 N ATOM 5428 CA ASN C 83 22.178 17.240 7.015 1.00 0.57 C ATOM 5429 C ASN C 83 23.517 16.701 6.513 1.00 0.52 C ATOM 5430 O ASN C 83 23.568 15.936 5.569 1.00 0.51 O ATOM 5431 CB ASN C 83 21.974 18.669 6.509 1.00 0.66 C ATOM 5432 CG ASN C 83 20.505 19.069 6.664 1.00 1.22 C ATOM 5433 OD1 ASN C 83 19.645 18.204 7.129 1.00 1.99 O flip ATOM 5434 ND2 ASN C 83 20.135 20.189 6.366 1.00 1.83 N flip ATOM 0 H ASN C 83 22.087 18.125 8.965 1.00 0.56 H new ATOM 0 HA ASN C 83 21.374 16.610 6.635 1.00 0.57 H new ATOM 0 HB2 ASN C 83 22.609 19.357 7.068 1.00 0.66 H new ATOM 0 HB3 ASN C 83 22.271 18.740 5.463 1.00 0.66 H new ATOM 0 HD21 ASN C 83 20.804 20.867 6.002 1.00 1.83 H new ATOM 0 HD22 ASN C 83 19.155 20.450 6.480 1.00 1.83 H new ATOM 5441 N GLU C 84 24.603 17.073 7.132 1.00 0.52 N ATOM 5442 CA GLU C 84 25.914 16.544 6.668 1.00 0.52 C ATOM 5443 C GLU C 84 25.875 15.025 6.791 1.00 0.47 C ATOM 5444 O GLU C 84 26.258 14.301 5.893 1.00 0.47 O ATOM 5445 CB GLU C 84 27.047 17.108 7.527 1.00 0.55 C ATOM 5446 CG GLU C 84 28.391 16.634 6.970 1.00 1.26 C ATOM 5447 CD GLU C 84 29.528 17.275 7.764 1.00 1.70 C ATOM 5448 OE1 GLU C 84 29.237 18.083 8.632 1.00 2.23 O ATOM 5449 OE2 GLU C 84 30.672 16.950 7.491 1.00 2.29 O ATOM 0 H GLU C 84 24.640 17.711 7.927 1.00 0.52 H new ATOM 0 HA GLU C 84 26.094 16.839 5.634 1.00 0.52 H new ATOM 0 HB2 GLU C 84 27.007 18.197 7.532 1.00 0.55 H new ATOM 0 HB3 GLU C 84 26.933 16.780 8.560 1.00 0.55 H new ATOM 0 HG2 GLU C 84 28.459 15.548 7.030 1.00 1.26 H new ATOM 0 HG3 GLU C 84 28.474 16.900 5.916 1.00 1.26 H new ATOM 5456 N THR C 85 25.381 14.539 7.895 1.00 0.44 N ATOM 5457 CA THR C 85 25.276 13.072 8.082 1.00 0.42 C ATOM 5458 C THR C 85 24.202 12.548 7.137 1.00 0.38 C ATOM 5459 O THR C 85 24.312 11.467 6.594 1.00 0.38 O ATOM 5460 CB THR C 85 24.872 12.755 9.524 1.00 0.44 C ATOM 5461 OG1 THR C 85 23.642 13.402 9.817 1.00 0.43 O ATOM 5462 CG2 THR C 85 25.952 13.244 10.493 1.00 0.49 C ATOM 0 H THR C 85 25.045 15.100 8.677 1.00 0.44 H new ATOM 0 HA THR C 85 26.237 12.603 7.873 1.00 0.42 H new ATOM 0 HB THR C 85 24.759 11.677 9.637 1.00 0.44 H new ATOM 0 HG1 THR C 85 23.475 14.103 9.153 1.00 0.43 H new ATOM 0 HG21 THR C 85 25.654 13.013 11.516 1.00 0.49 H new ATOM 0 HG22 THR C 85 26.895 12.746 10.268 1.00 0.49 H new ATOM 0 HG23 THR C 85 26.076 14.322 10.385 1.00 0.49 H new ATOM 5470 N TRP C 86 23.153 13.304 6.938 1.00 0.36 N ATOM 5471 CA TRP C 86 22.083 12.820 6.035 1.00 0.33 C ATOM 5472 C TRP C 86 22.675 12.595 4.650 1.00 0.34 C ATOM 5473 O TRP C 86 22.387 11.612 3.995 1.00 0.33 O ATOM 5474 CB TRP C 86 20.946 13.842 5.922 1.00 0.34 C ATOM 5475 CG TRP C 86 19.766 13.145 5.326 1.00 0.32 C ATOM 5476 CD1 TRP C 86 19.440 13.105 4.013 1.00 0.34 C ATOM 5477 CD2 TRP C 86 18.772 12.349 6.017 1.00 0.29 C ATOM 5478 NE1 TRP C 86 18.306 12.325 3.860 1.00 0.33 N ATOM 5479 CE2 TRP C 86 17.857 11.839 5.071 1.00 0.29 C ATOM 5480 CE3 TRP C 86 18.585 12.029 7.364 1.00 0.28 C ATOM 5481 CZ2 TRP C 86 16.789 11.028 5.457 1.00 0.28 C ATOM 5482 CZ3 TRP C 86 17.514 11.221 7.754 1.00 0.26 C ATOM 5483 CH2 TRP C 86 16.619 10.719 6.806 1.00 0.27 C ATOM 0 H TRP C 86 22.998 14.221 7.357 1.00 0.36 H new ATOM 0 HA TRP C 86 21.679 11.894 6.444 1.00 0.33 H new ATOM 0 HB2 TRP C 86 20.696 14.246 6.903 1.00 0.34 H new ATOM 0 HB3 TRP C 86 21.248 14.683 5.298 1.00 0.34 H new ATOM 0 HD1 TRP C 86 19.976 13.600 3.216 1.00 0.34 H new ATOM 0 HE1 TRP C 86 17.858 12.134 2.964 1.00 0.33 H new ATOM 0 HE3 TRP C 86 19.271 12.408 8.107 1.00 0.28 H new ATOM 0 HZ2 TRP C 86 16.101 10.644 4.718 1.00 0.28 H new ATOM 0 HZ3 TRP C 86 17.377 10.982 8.798 1.00 0.26 H new ATOM 0 HH2 TRP C 86 15.796 10.092 7.118 1.00 0.27 H new ATOM 5494 N GLN C 87 23.516 13.486 4.197 1.00 0.37 N ATOM 5495 CA GLN C 87 24.122 13.285 2.860 1.00 0.39 C ATOM 5496 C GLN C 87 24.895 11.971 2.895 1.00 0.37 C ATOM 5497 O GLN C 87 24.805 11.165 1.994 1.00 0.38 O ATOM 5498 CB GLN C 87 25.068 14.444 2.538 1.00 0.42 C ATOM 5499 CG GLN C 87 24.253 15.715 2.290 1.00 0.46 C ATOM 5500 CD GLN C 87 25.197 16.905 2.114 1.00 0.53 C ATOM 5501 OE1 GLN C 87 26.339 16.858 2.527 1.00 1.21 O ATOM 5502 NE2 GLN C 87 24.767 17.977 1.506 1.00 1.03 N ATOM 0 H GLN C 87 23.803 14.331 4.691 1.00 0.37 H new ATOM 0 HA GLN C 87 23.351 13.251 2.090 1.00 0.39 H new ATOM 0 HB2 GLN C 87 25.763 14.600 3.363 1.00 0.42 H new ATOM 0 HB3 GLN C 87 25.666 14.205 1.659 1.00 0.42 H new ATOM 0 HG2 GLN C 87 23.634 15.594 1.401 1.00 0.46 H new ATOM 0 HG3 GLN C 87 23.577 15.895 3.126 1.00 0.46 H new ATOM 0 HE21 GLN C 87 23.809 18.017 1.159 1.00 1.03 H new ATOM 0 HE22 GLN C 87 25.389 18.775 1.378 1.00 1.03 H new ATOM 5511 N GLU C 88 25.623 11.727 3.951 1.00 0.37 N ATOM 5512 CA GLU C 88 26.357 10.438 4.046 1.00 0.37 C ATOM 5513 C GLU C 88 25.338 9.300 4.009 1.00 0.34 C ATOM 5514 O GLU C 88 25.500 8.325 3.304 1.00 0.34 O ATOM 5515 CB GLU C 88 27.140 10.376 5.361 1.00 0.39 C ATOM 5516 CG GLU C 88 28.307 11.366 5.314 1.00 1.18 C ATOM 5517 CD GLU C 88 29.065 11.324 6.642 1.00 1.42 C ATOM 5518 OE1 GLU C 88 28.650 10.583 7.517 1.00 1.92 O ATOM 5519 OE2 GLU C 88 30.051 12.033 6.760 1.00 1.96 O ATOM 0 H GLU C 88 25.739 12.359 4.743 1.00 0.37 H new ATOM 0 HA GLU C 88 27.057 10.350 3.215 1.00 0.37 H new ATOM 0 HB2 GLU C 88 26.483 10.613 6.198 1.00 0.39 H new ATOM 0 HB3 GLU C 88 27.514 9.366 5.525 1.00 0.39 H new ATOM 0 HG2 GLU C 88 28.978 11.115 4.492 1.00 1.18 H new ATOM 0 HG3 GLU C 88 27.936 12.374 5.127 1.00 1.18 H new ATOM 5526 N TRP C 89 24.277 9.429 4.761 1.00 0.32 N ATOM 5527 CA TRP C 89 23.234 8.366 4.775 1.00 0.29 C ATOM 5528 C TRP C 89 22.667 8.197 3.366 1.00 0.30 C ATOM 5529 O TRP C 89 22.590 7.102 2.847 1.00 0.30 O ATOM 5530 CB TRP C 89 22.121 8.789 5.738 1.00 0.28 C ATOM 5531 CG TRP C 89 20.945 7.874 5.616 1.00 0.25 C ATOM 5532 CD1 TRP C 89 20.846 6.650 6.181 1.00 0.25 C ATOM 5533 CD2 TRP C 89 19.692 8.102 4.908 1.00 0.24 C ATOM 5534 NE1 TRP C 89 19.615 6.110 5.858 1.00 0.23 N ATOM 5535 CE2 TRP C 89 18.868 6.966 5.075 1.00 0.23 C ATOM 5536 CE3 TRP C 89 19.197 9.173 4.141 1.00 0.26 C ATOM 5537 CZ2 TRP C 89 17.599 6.894 4.504 1.00 0.23 C ATOM 5538 CZ3 TRP C 89 17.918 9.102 3.566 1.00 0.27 C ATOM 5539 CH2 TRP C 89 17.121 7.965 3.748 1.00 0.25 C ATOM 0 H TRP C 89 24.089 10.227 5.367 1.00 0.32 H new ATOM 0 HA TRP C 89 23.662 7.418 5.101 1.00 0.29 H new ATOM 0 HB2 TRP C 89 22.494 8.776 6.762 1.00 0.28 H new ATOM 0 HB3 TRP C 89 21.816 9.813 5.523 1.00 0.28 H new ATOM 0 HD1 TRP C 89 21.603 6.173 6.785 1.00 0.25 H new ATOM 0 HE1 TRP C 89 19.297 5.190 6.162 1.00 0.23 H new ATOM 0 HE3 TRP C 89 19.804 10.054 3.994 1.00 0.26 H new ATOM 0 HZ2 TRP C 89 16.989 6.014 4.646 1.00 0.23 H new ATOM 0 HZ3 TRP C 89 17.547 9.929 2.980 1.00 0.27 H new ATOM 0 HH2 TRP C 89 16.138 7.917 3.304 1.00 0.25 H new ATOM 5550 N GLU C 90 22.277 9.272 2.736 1.00 0.31 N ATOM 5551 CA GLU C 90 21.729 9.155 1.359 1.00 0.33 C ATOM 5552 C GLU C 90 22.823 8.620 0.433 1.00 0.33 C ATOM 5553 O GLU C 90 22.587 7.760 -0.391 1.00 0.34 O ATOM 5554 CB GLU C 90 21.259 10.530 0.872 1.00 0.37 C ATOM 5555 CG GLU C 90 20.675 10.409 -0.540 1.00 0.85 C ATOM 5556 CD GLU C 90 20.193 11.783 -1.012 1.00 1.16 C ATOM 5557 OE1 GLU C 90 20.234 12.708 -0.218 1.00 1.82 O ATOM 5558 OE2 GLU C 90 19.783 11.885 -2.158 1.00 1.67 O ATOM 0 H GLU C 90 22.314 10.219 3.114 1.00 0.31 H new ATOM 0 HA GLU C 90 20.880 8.471 1.356 1.00 0.33 H new ATOM 0 HB2 GLU C 90 20.508 10.930 1.553 1.00 0.37 H new ATOM 0 HB3 GLU C 90 22.094 11.231 0.871 1.00 0.37 H new ATOM 0 HG2 GLU C 90 21.429 10.021 -1.225 1.00 0.85 H new ATOM 0 HG3 GLU C 90 19.847 9.700 -0.543 1.00 0.85 H new ATOM 5565 N ARG C 91 24.023 9.121 0.565 1.00 0.34 N ATOM 5566 CA ARG C 91 25.125 8.633 -0.311 1.00 0.36 C ATOM 5567 C ARG C 91 25.391 7.155 -0.032 1.00 0.34 C ATOM 5568 O ARG C 91 25.612 6.378 -0.940 1.00 0.34 O ATOM 5569 CB ARG C 91 26.403 9.440 -0.046 1.00 0.40 C ATOM 5570 CG ARG C 91 26.277 10.853 -0.641 1.00 0.44 C ATOM 5571 CD ARG C 91 26.163 10.796 -2.176 1.00 1.07 C ATOM 5572 NE ARG C 91 24.738 11.007 -2.551 1.00 1.67 N ATOM 5573 CZ ARG C 91 24.415 11.262 -3.787 1.00 2.30 C ATOM 5574 NH1 ARG C 91 25.338 11.304 -4.707 1.00 2.61 N ATOM 5575 NH2 ARG C 91 23.169 11.469 -4.105 1.00 3.18 N ATOM 0 H ARG C 91 24.285 9.842 1.237 1.00 0.34 H new ATOM 0 HA ARG C 91 24.830 8.759 -1.353 1.00 0.36 H new ATOM 0 HB2 ARG C 91 26.584 9.505 1.027 1.00 0.40 H new ATOM 0 HB3 ARG C 91 27.261 8.929 -0.484 1.00 0.40 H new ATOM 0 HG2 ARG C 91 25.400 11.350 -0.226 1.00 0.44 H new ATOM 0 HG3 ARG C 91 27.145 11.449 -0.359 1.00 0.44 H new ATOM 0 HD2 ARG C 91 26.792 11.561 -2.631 1.00 1.07 H new ATOM 0 HD3 ARG C 91 26.514 9.833 -2.547 1.00 1.07 H new ATOM 0 HE ARG C 91 24.011 10.952 -1.837 1.00 1.67 H new ATOM 0 HH11 ARG C 91 26.313 11.137 -4.459 1.00 2.61 H new ATOM 0 HH12 ARG C 91 25.085 11.504 -5.675 1.00 2.61 H new ATOM 0 HH21 ARG C 91 22.446 11.431 -3.386 1.00 3.18 H new ATOM 0 HH22 ARG C 91 22.916 11.669 -5.073 1.00 3.18 H new ATOM 5589 N LYS C 92 25.359 6.746 1.208 1.00 0.33 N ATOM 5590 CA LYS C 92 25.598 5.309 1.504 1.00 0.33 C ATOM 5591 C LYS C 92 24.524 4.494 0.790 1.00 0.31 C ATOM 5592 O LYS C 92 24.787 3.457 0.216 1.00 0.32 O ATOM 5593 CB LYS C 92 25.524 5.069 3.015 1.00 0.34 C ATOM 5594 CG LYS C 92 26.801 5.603 3.687 1.00 0.68 C ATOM 5595 CD LYS C 92 26.596 5.730 5.205 1.00 1.08 C ATOM 5596 CE LYS C 92 26.638 4.345 5.853 1.00 1.41 C ATOM 5597 NZ LYS C 92 26.489 4.484 7.330 1.00 2.13 N ATOM 0 H LYS C 92 25.180 7.339 2.018 1.00 0.33 H new ATOM 0 HA LYS C 92 26.587 5.010 1.158 1.00 0.33 H new ATOM 0 HB2 LYS C 92 24.648 5.567 3.430 1.00 0.34 H new ATOM 0 HB3 LYS C 92 25.412 4.004 3.219 1.00 0.34 H new ATOM 0 HG2 LYS C 92 27.635 4.932 3.481 1.00 0.68 H new ATOM 0 HG3 LYS C 92 27.062 6.574 3.267 1.00 0.68 H new ATOM 0 HD2 LYS C 92 27.371 6.365 5.634 1.00 1.08 H new ATOM 0 HD3 LYS C 92 25.640 6.210 5.413 1.00 1.08 H new ATOM 0 HE2 LYS C 92 25.839 3.720 5.453 1.00 1.41 H new ATOM 0 HE3 LYS C 92 27.579 3.849 5.617 1.00 1.41 H new ATOM 0 HZ1 LYS C 92 26.517 3.543 7.772 1.00 2.13 H new ATOM 0 HZ2 LYS C 92 27.266 5.066 7.704 1.00 2.13 H new ATOM 0 HZ3 LYS C 92 25.580 4.940 7.546 1.00 2.13 H new ATOM 5611 N VAL C 93 23.311 4.972 0.805 1.00 0.29 N ATOM 5612 CA VAL C 93 22.215 4.248 0.114 1.00 0.28 C ATOM 5613 C VAL C 93 22.512 4.193 -1.387 1.00 0.29 C ATOM 5614 O VAL C 93 22.291 3.190 -2.038 1.00 0.29 O ATOM 5615 CB VAL C 93 20.893 4.990 0.352 1.00 0.28 C ATOM 5616 CG1 VAL C 93 19.792 4.408 -0.551 1.00 0.30 C ATOM 5617 CG2 VAL C 93 20.491 4.836 1.823 1.00 0.28 C ATOM 0 H VAL C 93 23.033 5.837 1.269 1.00 0.29 H new ATOM 0 HA VAL C 93 22.138 3.233 0.504 1.00 0.28 H new ATOM 0 HB VAL C 93 21.021 6.046 0.113 1.00 0.28 H new ATOM 0 HG11 VAL C 93 18.858 4.941 -0.375 1.00 0.30 H new ATOM 0 HG12 VAL C 93 20.082 4.519 -1.596 1.00 0.30 H new ATOM 0 HG13 VAL C 93 19.655 3.351 -0.323 1.00 0.30 H new ATOM 0 HG21 VAL C 93 19.552 5.361 2.000 1.00 0.28 H new ATOM 0 HG22 VAL C 93 20.366 3.779 2.057 1.00 0.28 H new ATOM 0 HG23 VAL C 93 21.269 5.259 2.459 1.00 0.28 H new ATOM 5627 N ASP C 94 23.002 5.268 -1.943 1.00 0.30 N ATOM 5628 CA ASP C 94 23.303 5.283 -3.402 1.00 0.32 C ATOM 5629 C ASP C 94 24.364 4.235 -3.746 1.00 0.33 C ATOM 5630 O ASP C 94 24.275 3.571 -4.759 1.00 0.35 O ATOM 5631 CB ASP C 94 23.805 6.670 -3.810 1.00 0.35 C ATOM 5632 CG ASP C 94 22.651 7.671 -3.738 1.00 1.27 C ATOM 5633 OD1 ASP C 94 21.512 7.235 -3.774 1.00 2.04 O ATOM 5634 OD2 ASP C 94 22.926 8.857 -3.656 1.00 1.96 O ATOM 0 H ASP C 94 23.207 6.137 -1.449 1.00 0.30 H new ATOM 0 HA ASP C 94 22.389 5.047 -3.947 1.00 0.32 H new ATOM 0 HB2 ASP C 94 24.615 6.984 -3.151 1.00 0.35 H new ATOM 0 HB3 ASP C 94 24.211 6.639 -4.821 1.00 0.35 H new ATOM 5639 N PHE C 95 25.371 4.075 -2.924 1.00 0.33 N ATOM 5640 CA PHE C 95 26.414 3.057 -3.245 1.00 0.35 C ATOM 5641 C PHE C 95 25.831 1.656 -3.090 1.00 0.34 C ATOM 5642 O PHE C 95 26.096 0.775 -3.883 1.00 0.34 O ATOM 5643 CB PHE C 95 27.610 3.205 -2.300 1.00 0.39 C ATOM 5644 CG PHE C 95 28.373 4.466 -2.631 1.00 0.42 C ATOM 5645 CD1 PHE C 95 29.108 4.543 -3.821 1.00 0.46 C ATOM 5646 CD2 PHE C 95 28.351 5.556 -1.753 1.00 0.42 C ATOM 5647 CE1 PHE C 95 29.818 5.707 -4.132 1.00 0.51 C ATOM 5648 CE2 PHE C 95 29.061 6.721 -2.063 1.00 0.46 C ATOM 5649 CZ PHE C 95 29.795 6.797 -3.253 1.00 0.51 C ATOM 0 H PHE C 95 25.514 4.596 -2.059 1.00 0.33 H new ATOM 0 HA PHE C 95 26.744 3.211 -4.272 1.00 0.35 H new ATOM 0 HB2 PHE C 95 27.266 3.238 -1.266 1.00 0.39 H new ATOM 0 HB3 PHE C 95 28.265 2.339 -2.390 1.00 0.39 H new ATOM 0 HD1 PHE C 95 29.126 3.703 -4.499 1.00 0.46 H new ATOM 0 HD2 PHE C 95 27.785 5.498 -0.835 1.00 0.42 H new ATOM 0 HE1 PHE C 95 30.384 5.765 -5.050 1.00 0.51 H new ATOM 0 HE2 PHE C 95 29.043 7.561 -1.385 1.00 0.46 H new ATOM 0 HZ PHE C 95 30.343 7.696 -3.493 1.00 0.51 H new ATOM 5659 N LEU C 96 25.033 1.436 -2.082 1.00 0.32 N ATOM 5660 CA LEU C 96 24.443 0.083 -1.911 1.00 0.32 C ATOM 5661 C LEU C 96 23.425 -0.145 -3.023 1.00 0.31 C ATOM 5662 O LEU C 96 23.346 -1.210 -3.601 1.00 0.32 O ATOM 5663 CB LEU C 96 23.753 -0.017 -0.547 1.00 0.32 C ATOM 5664 CG LEU C 96 24.765 0.213 0.584 1.00 0.33 C ATOM 5665 CD1 LEU C 96 24.025 0.184 1.924 1.00 0.35 C ATOM 5666 CD2 LEU C 96 25.840 -0.887 0.568 1.00 0.36 C ATOM 0 H LEU C 96 24.768 2.126 -1.379 1.00 0.32 H new ATOM 0 HA LEU C 96 25.227 -0.673 -1.961 1.00 0.32 H new ATOM 0 HB2 LEU C 96 22.953 0.720 -0.483 1.00 0.32 H new ATOM 0 HB3 LEU C 96 23.292 -0.999 -0.437 1.00 0.32 H new ATOM 0 HG LEU C 96 25.250 1.179 0.444 1.00 0.33 H new ATOM 0 HD11 LEU C 96 24.735 0.346 2.735 1.00 0.35 H new ATOM 0 HD12 LEU C 96 23.270 0.970 1.940 1.00 0.35 H new ATOM 0 HD13 LEU C 96 23.543 -0.785 2.052 1.00 0.35 H new ATOM 0 HD21 LEU C 96 26.552 -0.712 1.375 1.00 0.36 H new ATOM 0 HD22 LEU C 96 25.367 -1.860 0.705 1.00 0.36 H new ATOM 0 HD23 LEU C 96 26.364 -0.870 -0.388 1.00 0.36 H new ATOM 5678 N GLU C 97 22.657 0.860 -3.343 1.00 0.31 N ATOM 5679 CA GLU C 97 21.660 0.712 -4.435 1.00 0.32 C ATOM 5680 C GLU C 97 22.396 0.370 -5.733 1.00 0.33 C ATOM 5681 O GLU C 97 22.050 -0.564 -6.430 1.00 0.36 O ATOM 5682 CB GLU C 97 20.890 2.027 -4.600 1.00 0.34 C ATOM 5683 CG GLU C 97 19.826 1.875 -5.691 1.00 0.95 C ATOM 5684 CD GLU C 97 19.056 3.189 -5.835 1.00 1.22 C ATOM 5685 OE1 GLU C 97 19.258 4.064 -5.012 1.00 1.69 O ATOM 5686 OE2 GLU C 97 18.272 3.293 -6.763 1.00 1.86 O ATOM 0 H GLU C 97 22.678 1.776 -2.895 1.00 0.31 H new ATOM 0 HA GLU C 97 20.955 -0.085 -4.196 1.00 0.32 H new ATOM 0 HB2 GLU C 97 20.419 2.304 -3.657 1.00 0.34 H new ATOM 0 HB3 GLU C 97 21.578 2.831 -4.861 1.00 0.34 H new ATOM 0 HG2 GLU C 97 20.296 1.610 -6.638 1.00 0.95 H new ATOM 0 HG3 GLU C 97 19.142 1.065 -5.437 1.00 0.95 H new ATOM 5693 N GLU C 98 23.415 1.126 -6.059 1.00 0.34 N ATOM 5694 CA GLU C 98 24.181 0.853 -7.307 1.00 0.37 C ATOM 5695 C GLU C 98 24.788 -0.548 -7.234 1.00 0.36 C ATOM 5696 O GLU C 98 24.759 -1.300 -8.189 1.00 0.37 O ATOM 5697 CB GLU C 98 25.298 1.891 -7.465 1.00 0.40 C ATOM 5698 CG GLU C 98 26.052 1.639 -8.773 1.00 1.19 C ATOM 5699 CD GLU C 98 27.094 2.738 -8.977 1.00 1.33 C ATOM 5700 OE1 GLU C 98 27.106 3.668 -8.187 1.00 1.77 O ATOM 5701 OE2 GLU C 98 27.860 2.634 -9.920 1.00 1.86 O ATOM 0 H GLU C 98 23.747 1.920 -5.512 1.00 0.34 H new ATOM 0 HA GLU C 98 23.511 0.915 -8.165 1.00 0.37 H new ATOM 0 HB2 GLU C 98 24.877 2.896 -7.464 1.00 0.40 H new ATOM 0 HB3 GLU C 98 25.985 1.832 -6.621 1.00 0.40 H new ATOM 0 HG2 GLU C 98 26.537 0.663 -8.744 1.00 1.19 H new ATOM 0 HG3 GLU C 98 25.355 1.624 -9.611 1.00 1.19 H new ATOM 5708 N ASN C 99 25.338 -0.905 -6.105 1.00 0.35 N ATOM 5709 CA ASN C 99 25.942 -2.259 -5.975 1.00 0.35 C ATOM 5710 C ASN C 99 24.858 -3.307 -6.222 1.00 0.33 C ATOM 5711 O ASN C 99 25.049 -4.255 -6.959 1.00 0.35 O ATOM 5712 CB ASN C 99 26.511 -2.434 -4.563 1.00 0.37 C ATOM 5713 CG ASN C 99 27.135 -3.825 -4.430 1.00 1.25 C ATOM 5714 OD1 ASN C 99 26.500 -4.747 -3.959 1.00 2.16 O ATOM 5715 ND2 ASN C 99 28.364 -4.017 -4.830 1.00 1.83 N ATOM 0 H ASN C 99 25.395 -0.320 -5.272 1.00 0.35 H new ATOM 0 HA ASN C 99 26.746 -2.377 -6.702 1.00 0.35 H new ATOM 0 HB2 ASN C 99 27.260 -1.668 -4.364 1.00 0.37 H new ATOM 0 HB3 ASN C 99 25.721 -2.307 -3.823 1.00 0.37 H new ATOM 0 HD21 ASN C 99 28.789 -4.940 -4.747 1.00 1.83 H new ATOM 0 HD22 ASN C 99 28.898 -3.243 -5.226 1.00 1.83 H new ATOM 5722 N ILE C 100 23.713 -3.136 -5.615 1.00 0.31 N ATOM 5723 CA ILE C 100 22.608 -4.113 -5.819 1.00 0.30 C ATOM 5724 C ILE C 100 22.241 -4.152 -7.302 1.00 0.31 C ATOM 5725 O ILE C 100 22.153 -5.204 -7.899 1.00 0.33 O ATOM 5726 CB ILE C 100 21.393 -3.693 -4.980 1.00 0.29 C ATOM 5727 CG1 ILE C 100 21.717 -3.904 -3.496 1.00 0.29 C ATOM 5728 CG2 ILE C 100 20.171 -4.540 -5.367 1.00 0.29 C ATOM 5729 CD1 ILE C 100 20.665 -3.205 -2.634 1.00 0.30 C ATOM 0 H ILE C 100 23.497 -2.362 -4.987 1.00 0.31 H new ATOM 0 HA ILE C 100 22.926 -5.107 -5.504 1.00 0.30 H new ATOM 0 HB ILE C 100 21.167 -2.643 -5.165 1.00 0.29 H new ATOM 0 HG12 ILE C 100 21.739 -4.969 -3.267 1.00 0.29 H new ATOM 0 HG13 ILE C 100 22.707 -3.508 -3.270 1.00 0.29 H new ATOM 0 HG21 ILE C 100 19.313 -4.236 -4.767 1.00 0.29 H new ATOM 0 HG22 ILE C 100 19.946 -4.393 -6.423 1.00 0.29 H new ATOM 0 HG23 ILE C 100 20.386 -5.593 -5.185 1.00 0.29 H new ATOM 0 HD11 ILE C 100 20.898 -3.357 -1.580 1.00 0.30 H new ATOM 0 HD12 ILE C 100 20.664 -2.138 -2.855 1.00 0.30 H new ATOM 0 HD13 ILE C 100 19.681 -3.621 -2.851 1.00 0.30 H new ATOM 5741 N THR C 101 22.033 -3.013 -7.907 1.00 0.33 N ATOM 5742 CA THR C 101 21.677 -3.006 -9.354 1.00 0.36 C ATOM 5743 C THR C 101 22.802 -3.659 -10.151 1.00 0.38 C ATOM 5744 O THR C 101 22.569 -4.454 -11.039 1.00 0.40 O ATOM 5745 CB THR C 101 21.492 -1.564 -9.836 1.00 0.39 C ATOM 5746 OG1 THR C 101 22.661 -0.813 -9.537 1.00 0.40 O ATOM 5747 CG2 THR C 101 20.287 -0.933 -9.139 1.00 0.39 C ATOM 0 H THR C 101 22.094 -2.095 -7.466 1.00 0.33 H new ATOM 0 HA THR C 101 20.748 -3.558 -9.499 1.00 0.36 H new ATOM 0 HB THR C 101 21.322 -1.564 -10.913 1.00 0.39 H new ATOM 0 HG1 THR C 101 23.117 -1.210 -8.766 1.00 0.40 H new ATOM 0 HG21 THR C 101 20.161 0.092 -9.487 1.00 0.39 H new ATOM 0 HG22 THR C 101 19.390 -1.507 -9.372 1.00 0.39 H new ATOM 0 HG23 THR C 101 20.449 -0.933 -8.061 1.00 0.39 H new ATOM 5755 N ALA C 102 24.025 -3.338 -9.840 1.00 0.38 N ATOM 5756 CA ALA C 102 25.153 -3.959 -10.579 1.00 0.42 C ATOM 5757 C ALA C 102 25.124 -5.470 -10.363 1.00 0.40 C ATOM 5758 O ALA C 102 25.245 -6.243 -11.293 1.00 0.42 O ATOM 5759 CB ALA C 102 26.471 -3.394 -10.059 1.00 0.44 C ATOM 0 H ALA C 102 24.290 -2.676 -9.110 1.00 0.38 H new ATOM 0 HA ALA C 102 25.060 -3.741 -11.643 1.00 0.42 H new ATOM 0 HB1 ALA C 102 27.301 -3.849 -10.600 1.00 0.44 H new ATOM 0 HB2 ALA C 102 26.488 -2.314 -10.209 1.00 0.44 H new ATOM 0 HB3 ALA C 102 26.567 -3.615 -8.996 1.00 0.44 H new ATOM 5765 N LEU C 103 24.964 -5.898 -9.138 1.00 0.37 N ATOM 5766 CA LEU C 103 24.929 -7.360 -8.863 1.00 0.36 C ATOM 5767 C LEU C 103 23.699 -7.975 -9.538 1.00 0.34 C ATOM 5768 O LEU C 103 23.765 -9.050 -10.102 1.00 0.36 O ATOM 5769 CB LEU C 103 24.842 -7.595 -7.353 1.00 0.34 C ATOM 5770 CG LEU C 103 26.156 -7.212 -6.656 1.00 0.36 C ATOM 5771 CD1 LEU C 103 25.967 -7.335 -5.139 1.00 0.38 C ATOM 5772 CD2 LEU C 103 27.305 -8.135 -7.114 1.00 0.43 C ATOM 0 H LEU C 103 24.857 -5.298 -8.320 1.00 0.37 H new ATOM 0 HA LEU C 103 25.835 -7.823 -9.254 1.00 0.36 H new ATOM 0 HB2 LEU C 103 24.022 -7.009 -6.937 1.00 0.34 H new ATOM 0 HB3 LEU C 103 24.615 -8.643 -7.158 1.00 0.34 H new ATOM 0 HG LEU C 103 26.415 -6.187 -6.920 1.00 0.36 H new ATOM 0 HD11 LEU C 103 26.894 -7.065 -4.634 1.00 0.38 H new ATOM 0 HD12 LEU C 103 25.170 -6.665 -4.816 1.00 0.38 H new ATOM 0 HD13 LEU C 103 25.702 -8.362 -4.887 1.00 0.38 H new ATOM 0 HD21 LEU C 103 28.227 -7.847 -6.609 1.00 0.43 H new ATOM 0 HD22 LEU C 103 27.063 -9.168 -6.866 1.00 0.43 H new ATOM 0 HD23 LEU C 103 27.438 -8.043 -8.192 1.00 0.43 H new ATOM 5784 N LEU C 104 22.577 -7.300 -9.496 1.00 0.33 N ATOM 5785 CA LEU C 104 21.359 -7.859 -10.151 1.00 0.33 C ATOM 5786 C LEU C 104 21.610 -7.993 -11.650 1.00 0.37 C ATOM 5787 O LEU C 104 21.229 -8.967 -12.264 1.00 0.39 O ATOM 5788 CB LEU C 104 20.156 -6.933 -9.918 1.00 0.33 C ATOM 5789 CG LEU C 104 19.697 -7.006 -8.452 1.00 0.29 C ATOM 5790 CD1 LEU C 104 18.704 -5.868 -8.184 1.00 0.31 C ATOM 5791 CD2 LEU C 104 19.011 -8.359 -8.171 1.00 0.27 C ATOM 0 H LEU C 104 22.454 -6.395 -9.041 1.00 0.33 H new ATOM 0 HA LEU C 104 21.142 -8.837 -9.721 1.00 0.33 H new ATOM 0 HB2 LEU C 104 20.425 -5.907 -10.171 1.00 0.33 H new ATOM 0 HB3 LEU C 104 19.336 -7.219 -10.577 1.00 0.33 H new ATOM 0 HG LEU C 104 20.565 -6.910 -7.800 1.00 0.29 H new ATOM 0 HD11 LEU C 104 18.372 -5.911 -7.147 1.00 0.31 H new ATOM 0 HD12 LEU C 104 19.190 -4.910 -8.370 1.00 0.31 H new ATOM 0 HD13 LEU C 104 17.843 -5.973 -8.845 1.00 0.31 H new ATOM 0 HD21 LEU C 104 18.692 -8.396 -7.129 1.00 0.27 H new ATOM 0 HD22 LEU C 104 18.143 -8.469 -8.821 1.00 0.27 H new ATOM 0 HD23 LEU C 104 19.713 -9.170 -8.364 1.00 0.27 H new ATOM 5803 N GLU C 105 22.258 -7.032 -12.248 1.00 0.40 N ATOM 5804 CA GLU C 105 22.524 -7.138 -13.707 1.00 0.45 C ATOM 5805 C GLU C 105 23.358 -8.390 -13.965 1.00 0.46 C ATOM 5806 O GLU C 105 23.102 -9.137 -14.888 1.00 0.48 O ATOM 5807 CB GLU C 105 23.276 -5.892 -14.188 1.00 0.49 C ATOM 5808 CG GLU C 105 23.536 -5.992 -15.694 1.00 0.53 C ATOM 5809 CD GLU C 105 24.261 -4.732 -16.169 1.00 1.15 C ATOM 5810 OE1 GLU C 105 24.340 -3.791 -15.397 1.00 1.83 O ATOM 5811 OE2 GLU C 105 24.713 -4.726 -17.301 1.00 1.85 O ATOM 0 H GLU C 105 22.610 -6.189 -11.795 1.00 0.40 H new ATOM 0 HA GLU C 105 21.583 -7.208 -14.253 1.00 0.45 H new ATOM 0 HB2 GLU C 105 22.693 -4.997 -13.969 1.00 0.49 H new ATOM 0 HB3 GLU C 105 24.220 -5.797 -13.652 1.00 0.49 H new ATOM 0 HG2 GLU C 105 24.137 -6.875 -15.913 1.00 0.53 H new ATOM 0 HG3 GLU C 105 22.594 -6.107 -16.230 1.00 0.53 H new ATOM 5818 N GLU C 106 24.348 -8.639 -13.151 1.00 0.45 N ATOM 5819 CA GLU C 106 25.171 -9.858 -13.360 1.00 0.47 C ATOM 5820 C GLU C 106 24.318 -11.080 -13.025 1.00 0.44 C ATOM 5821 O GLU C 106 24.358 -12.088 -13.702 1.00 0.46 O ATOM 5822 CB GLU C 106 26.383 -9.823 -12.427 1.00 0.49 C ATOM 5823 CG GLU C 106 27.350 -8.727 -12.875 1.00 1.17 C ATOM 5824 CD GLU C 106 27.983 -9.116 -14.213 1.00 1.66 C ATOM 5825 OE1 GLU C 106 27.982 -10.295 -14.525 1.00 2.25 O ATOM 5826 OE2 GLU C 106 28.454 -8.227 -14.902 1.00 2.27 O ATOM 0 H GLU C 106 24.618 -8.056 -12.359 1.00 0.45 H new ATOM 0 HA GLU C 106 25.512 -9.904 -14.394 1.00 0.47 H new ATOM 0 HB2 GLU C 106 26.060 -9.639 -11.403 1.00 0.49 H new ATOM 0 HB3 GLU C 106 26.886 -10.790 -12.433 1.00 0.49 H new ATOM 0 HG2 GLU C 106 26.821 -7.779 -12.974 1.00 1.17 H new ATOM 0 HG3 GLU C 106 28.125 -8.582 -12.123 1.00 1.17 H new ATOM 5833 N ALA C 107 23.531 -10.988 -11.985 1.00 0.40 N ATOM 5834 CA ALA C 107 22.662 -12.136 -11.606 1.00 0.37 C ATOM 5835 C ALA C 107 21.681 -12.433 -12.741 1.00 0.40 C ATOM 5836 O ALA C 107 21.501 -13.569 -13.133 1.00 0.41 O ATOM 5837 CB ALA C 107 21.883 -11.798 -10.331 1.00 0.34 C ATOM 0 H ALA C 107 23.454 -10.168 -11.384 1.00 0.40 H new ATOM 0 HA ALA C 107 23.284 -13.012 -11.425 1.00 0.37 H new ATOM 0 HB1 ALA C 107 21.249 -12.641 -10.058 1.00 0.34 H new ATOM 0 HB2 ALA C 107 22.583 -11.593 -9.521 1.00 0.34 H new ATOM 0 HB3 ALA C 107 21.263 -10.919 -10.506 1.00 0.34 H new ATOM 5843 N GLN C 108 21.046 -11.423 -13.277 1.00 0.42 N ATOM 5844 CA GLN C 108 20.082 -11.668 -14.386 1.00 0.46 C ATOM 5845 C GLN C 108 20.818 -12.316 -15.554 1.00 0.50 C ATOM 5846 O GLN C 108 20.377 -13.301 -16.109 1.00 0.53 O ATOM 5847 CB GLN C 108 19.477 -10.338 -14.848 1.00 0.49 C ATOM 5848 CG GLN C 108 18.540 -9.784 -13.772 1.00 0.47 C ATOM 5849 CD GLN C 108 17.950 -8.455 -14.248 1.00 0.98 C ATOM 5850 OE1 GLN C 108 17.581 -8.316 -15.397 1.00 1.68 O ATOM 5851 NE2 GLN C 108 17.861 -7.461 -13.408 1.00 1.58 N ATOM 0 H GLN C 108 21.153 -10.448 -12.997 1.00 0.42 H new ATOM 0 HA GLN C 108 19.286 -12.326 -14.036 1.00 0.46 H new ATOM 0 HB2 GLN C 108 20.271 -9.620 -15.054 1.00 0.49 H new ATOM 0 HB3 GLN C 108 18.929 -10.483 -15.779 1.00 0.49 H new ATOM 0 HG2 GLN C 108 17.741 -10.497 -13.568 1.00 0.47 H new ATOM 0 HG3 GLN C 108 19.085 -9.639 -12.839 1.00 0.47 H new ATOM 0 HE21 GLN C 108 18.171 -7.579 -12.443 1.00 1.58 H new ATOM 0 HE22 GLN C 108 17.481 -6.566 -13.716 1.00 1.58 H new ATOM 5860 N ILE C 109 21.943 -11.777 -15.925 1.00 0.52 N ATOM 5861 CA ILE C 109 22.710 -12.367 -17.054 1.00 0.57 C ATOM 5862 C ILE C 109 23.088 -13.812 -16.713 1.00 0.56 C ATOM 5863 O ILE C 109 22.875 -14.718 -17.492 1.00 0.58 O ATOM 5864 CB ILE C 109 23.975 -11.537 -17.291 1.00 0.61 C ATOM 5865 CG1 ILE C 109 23.573 -10.161 -17.829 1.00 0.64 C ATOM 5866 CG2 ILE C 109 24.873 -12.239 -18.312 1.00 0.67 C ATOM 5867 CD1 ILE C 109 24.779 -9.223 -17.787 1.00 0.67 C ATOM 0 H ILE C 109 22.365 -10.954 -15.496 1.00 0.52 H new ATOM 0 HA ILE C 109 22.101 -12.362 -17.958 1.00 0.57 H new ATOM 0 HB ILE C 109 24.520 -11.426 -16.353 1.00 0.61 H new ATOM 0 HG12 ILE C 109 23.205 -10.252 -18.851 1.00 0.64 H new ATOM 0 HG13 ILE C 109 22.758 -9.750 -17.233 1.00 0.64 H new ATOM 0 HG21 ILE C 109 25.771 -11.644 -18.476 1.00 0.67 H new ATOM 0 HG22 ILE C 109 25.153 -13.222 -17.935 1.00 0.67 H new ATOM 0 HG23 ILE C 109 24.335 -12.351 -19.253 1.00 0.67 H new ATOM 0 HD11 ILE C 109 24.492 -8.244 -18.170 1.00 0.67 H new ATOM 0 HD12 ILE C 109 25.126 -9.123 -16.759 1.00 0.67 H new ATOM 0 HD13 ILE C 109 25.580 -9.633 -18.402 1.00 0.67 H new ATOM 5879 N GLN C 110 23.649 -14.035 -15.554 1.00 0.53 N ATOM 5880 CA GLN C 110 24.043 -15.422 -15.171 1.00 0.52 C ATOM 5881 C GLN C 110 22.799 -16.299 -15.031 1.00 0.48 C ATOM 5882 O GLN C 110 22.792 -17.448 -15.427 1.00 0.50 O ATOM 5883 CB GLN C 110 24.793 -15.377 -13.836 1.00 0.50 C ATOM 5884 CG GLN C 110 25.211 -16.790 -13.418 1.00 1.18 C ATOM 5885 CD GLN C 110 26.006 -16.714 -12.115 1.00 1.46 C ATOM 5886 OE1 GLN C 110 26.404 -15.646 -11.693 1.00 2.12 O ATOM 5887 NE2 GLN C 110 26.241 -17.808 -11.446 1.00 1.93 N ATOM 0 H GLN C 110 23.851 -13.318 -14.857 1.00 0.53 H new ATOM 0 HA GLN C 110 24.686 -15.843 -15.943 1.00 0.52 H new ATOM 0 HB2 GLN C 110 25.673 -14.741 -13.926 1.00 0.50 H new ATOM 0 HB3 GLN C 110 24.158 -14.935 -13.068 1.00 0.50 H new ATOM 0 HG2 GLN C 110 24.330 -17.418 -13.285 1.00 1.18 H new ATOM 0 HG3 GLN C 110 25.815 -17.250 -14.200 1.00 1.18 H new ATOM 0 HE21 GLN C 110 25.907 -18.704 -11.800 1.00 1.93 H new ATOM 0 HE22 GLN C 110 26.759 -17.768 -10.568 1.00 1.93 H new ATOM 5896 N GLN C 111 21.749 -15.772 -14.465 1.00 0.45 N ATOM 5897 CA GLN C 111 20.515 -16.584 -14.295 1.00 0.43 C ATOM 5898 C GLN C 111 20.001 -17.041 -15.659 1.00 0.49 C ATOM 5899 O GLN C 111 19.676 -18.196 -15.856 1.00 0.49 O ATOM 5900 CB GLN C 111 19.444 -15.742 -13.602 1.00 0.42 C ATOM 5901 CG GLN C 111 18.266 -16.636 -13.203 1.00 0.42 C ATOM 5902 CD GLN C 111 18.699 -17.584 -12.081 1.00 0.37 C ATOM 5903 OE1 GLN C 111 19.364 -17.176 -11.148 1.00 0.37 O ATOM 5904 NE2 GLN C 111 18.349 -18.843 -12.130 1.00 0.40 N ATOM 0 H GLN C 111 21.693 -14.816 -14.114 1.00 0.45 H new ATOM 0 HA GLN C 111 20.743 -17.460 -13.687 1.00 0.43 H new ATOM 0 HB2 GLN C 111 19.862 -15.259 -12.719 1.00 0.42 H new ATOM 0 HB3 GLN C 111 19.103 -14.949 -14.268 1.00 0.42 H new ATOM 0 HG2 GLN C 111 17.427 -16.024 -12.872 1.00 0.42 H new ATOM 0 HG3 GLN C 111 17.922 -17.209 -14.065 1.00 0.42 H new ATOM 0 HE21 GLN C 111 17.791 -19.187 -12.912 1.00 0.40 H new ATOM 0 HE22 GLN C 111 18.634 -19.481 -11.387 1.00 0.40 H new ATOM 5913 N GLU C 112 19.912 -16.145 -16.603 1.00 0.54 N ATOM 5914 CA GLU C 112 19.411 -16.536 -17.948 1.00 0.60 C ATOM 5915 C GLU C 112 20.332 -17.600 -18.546 1.00 0.62 C ATOM 5916 O GLU C 112 19.881 -18.556 -19.144 1.00 0.65 O ATOM 5917 CB GLU C 112 19.387 -15.314 -18.869 1.00 0.66 C ATOM 5918 CG GLU C 112 18.668 -15.668 -20.173 1.00 1.29 C ATOM 5919 CD GLU C 112 18.646 -14.443 -21.089 1.00 1.72 C ATOM 5920 OE1 GLU C 112 19.030 -13.379 -20.630 1.00 2.25 O ATOM 5921 OE2 GLU C 112 18.254 -14.590 -22.234 1.00 2.27 O ATOM 0 H GLU C 112 20.164 -15.162 -16.501 1.00 0.54 H new ATOM 0 HA GLU C 112 18.402 -16.936 -17.851 1.00 0.60 H new ATOM 0 HB2 GLU C 112 18.880 -14.484 -18.376 1.00 0.66 H new ATOM 0 HB3 GLU C 112 20.405 -14.985 -19.081 1.00 0.66 H new ATOM 0 HG2 GLU C 112 19.175 -16.497 -20.667 1.00 1.29 H new ATOM 0 HG3 GLU C 112 17.650 -15.997 -19.963 1.00 1.29 H new ATOM 5928 N LYS C 113 21.622 -17.444 -18.391 1.00 0.62 N ATOM 5929 CA LYS C 113 22.559 -18.452 -18.959 1.00 0.65 C ATOM 5930 C LYS C 113 22.297 -19.817 -18.320 1.00 0.60 C ATOM 5931 O LYS C 113 22.329 -20.836 -18.981 1.00 0.63 O ATOM 5932 CB LYS C 113 24.006 -18.034 -18.679 1.00 0.68 C ATOM 5933 CG LYS C 113 24.356 -16.806 -19.523 1.00 0.75 C ATOM 5934 CD LYS C 113 25.801 -16.389 -19.243 1.00 1.27 C ATOM 5935 CE LYS C 113 26.154 -15.160 -20.085 1.00 1.53 C ATOM 5936 NZ LYS C 113 26.347 -15.565 -21.505 1.00 2.10 N ATOM 0 H LYS C 113 22.062 -16.667 -17.899 1.00 0.62 H new ATOM 0 HA LYS C 113 22.401 -18.515 -20.036 1.00 0.65 H new ATOM 0 HB2 LYS C 113 24.132 -17.808 -17.620 1.00 0.68 H new ATOM 0 HB3 LYS C 113 24.684 -18.854 -18.913 1.00 0.68 H new ATOM 0 HG2 LYS C 113 24.230 -17.032 -20.582 1.00 0.75 H new ATOM 0 HG3 LYS C 113 23.678 -15.985 -19.289 1.00 0.75 H new ATOM 0 HD2 LYS C 113 25.927 -16.165 -18.184 1.00 1.27 H new ATOM 0 HD3 LYS C 113 26.479 -17.210 -19.478 1.00 1.27 H new ATOM 0 HE2 LYS C 113 25.360 -14.417 -20.013 1.00 1.53 H new ATOM 0 HE3 LYS C 113 27.062 -14.694 -19.703 1.00 1.53 H new ATOM 0 HZ1 LYS C 113 26.733 -14.764 -22.045 1.00 2.10 H new ATOM 0 HZ2 LYS C 113 27.010 -16.365 -21.551 1.00 2.10 H new ATOM 0 HZ3 LYS C 113 25.433 -15.848 -21.912 1.00 2.10 H new ATOM 5950 N ASN C 114 22.044 -19.853 -17.039 1.00 0.53 N ATOM 5951 CA ASN C 114 21.786 -21.160 -16.376 1.00 0.49 C ATOM 5952 C ASN C 114 20.569 -21.828 -17.011 1.00 0.49 C ATOM 5953 O ASN C 114 20.610 -22.983 -17.383 1.00 0.51 O ATOM 5954 CB ASN C 114 21.543 -20.952 -14.879 1.00 0.44 C ATOM 5955 CG ASN C 114 22.859 -20.571 -14.202 1.00 0.46 C ATOM 5956 OD1 ASN C 114 22.955 -19.543 -13.562 1.00 1.19 O ATOM 5957 ND2 ASN C 114 23.889 -21.365 -14.322 1.00 1.18 N ATOM 0 H ASN C 114 22.005 -19.038 -16.427 1.00 0.53 H new ATOM 0 HA ASN C 114 22.657 -21.802 -16.506 1.00 0.49 H new ATOM 0 HB2 ASN C 114 20.801 -20.168 -14.725 1.00 0.44 H new ATOM 0 HB3 ASN C 114 21.142 -21.863 -14.434 1.00 0.44 H new ATOM 0 HD21 ASN C 114 24.775 -21.122 -13.878 1.00 1.18 H new ATOM 0 HD22 ASN C 114 23.808 -22.228 -14.860 1.00 1.18 H new ATOM 5964 N MET C 115 19.487 -21.112 -17.145 1.00 0.50 N ATOM 5965 CA MET C 115 18.282 -21.720 -17.766 1.00 0.54 C ATOM 5966 C MET C 115 18.590 -22.041 -19.229 1.00 0.61 C ATOM 5967 O MET C 115 18.220 -23.077 -19.740 1.00 0.63 O ATOM 5968 CB MET C 115 17.113 -20.733 -17.687 1.00 0.57 C ATOM 5969 CG MET C 115 15.848 -21.386 -18.251 1.00 0.72 C ATOM 5970 SD MET C 115 14.474 -20.207 -18.186 1.00 0.94 S ATOM 5971 CE MET C 115 15.110 -19.023 -19.399 1.00 1.46 C ATOM 0 H MET C 115 19.387 -20.140 -16.853 1.00 0.50 H new ATOM 0 HA MET C 115 18.012 -22.634 -17.238 1.00 0.54 H new ATOM 0 HB2 MET C 115 16.948 -20.432 -16.653 1.00 0.57 H new ATOM 0 HB3 MET C 115 17.349 -19.829 -18.249 1.00 0.57 H new ATOM 0 HG2 MET C 115 16.019 -21.704 -19.279 1.00 0.72 H new ATOM 0 HG3 MET C 115 15.601 -22.279 -17.677 1.00 0.72 H new ATOM 0 HE1 MET C 115 14.276 -18.524 -19.892 1.00 1.46 H new ATOM 0 HE2 MET C 115 15.729 -18.281 -18.894 1.00 1.46 H new ATOM 0 HE3 MET C 115 15.709 -19.550 -20.142 1.00 1.46 H new ATOM 5981 N TYR C 116 19.278 -21.160 -19.904 1.00 0.65 N ATOM 5982 CA TYR C 116 19.616 -21.409 -21.333 1.00 0.73 C ATOM 5983 C TYR C 116 20.455 -22.684 -21.442 1.00 0.72 C ATOM 5984 O TYR C 116 20.177 -23.553 -22.248 1.00 0.76 O ATOM 5985 CB TYR C 116 20.407 -20.218 -21.881 1.00 0.78 C ATOM 5986 CG TYR C 116 20.746 -20.454 -23.332 1.00 0.87 C ATOM 5987 CD1 TYR C 116 19.865 -20.030 -24.333 1.00 0.95 C ATOM 5988 CD2 TYR C 116 21.945 -21.085 -23.674 1.00 0.91 C ATOM 5989 CE1 TYR C 116 20.183 -20.237 -25.679 1.00 1.05 C ATOM 5990 CE2 TYR C 116 22.264 -21.295 -25.021 1.00 1.01 C ATOM 5991 CZ TYR C 116 21.382 -20.871 -26.024 1.00 1.07 C ATOM 5992 OH TYR C 116 21.698 -21.073 -27.352 1.00 1.18 O ATOM 0 H TYR C 116 19.621 -20.277 -19.526 1.00 0.65 H new ATOM 0 HA TYR C 116 18.701 -21.531 -21.912 1.00 0.73 H new ATOM 0 HB2 TYR C 116 19.823 -19.304 -21.779 1.00 0.78 H new ATOM 0 HB3 TYR C 116 21.320 -20.079 -21.303 1.00 0.78 H new ATOM 0 HD1 TYR C 116 18.939 -19.543 -24.066 1.00 0.95 H new ATOM 0 HD2 TYR C 116 22.625 -21.410 -22.900 1.00 0.91 H new ATOM 0 HE1 TYR C 116 19.504 -19.908 -26.452 1.00 1.05 H new ATOM 0 HE2 TYR C 116 23.190 -21.784 -25.287 1.00 1.01 H new ATOM 0 HH TYR C 116 22.565 -21.525 -27.417 1.00 1.18 H new ATOM 6002 N GLU C 117 21.480 -22.810 -20.642 1.00 0.68 N ATOM 6003 CA GLU C 117 22.322 -24.033 -20.713 1.00 0.68 C ATOM 6004 C GLU C 117 21.472 -25.255 -20.358 1.00 0.65 C ATOM 6005 O GLU C 117 21.585 -26.301 -20.965 1.00 0.69 O ATOM 6006 CB GLU C 117 23.476 -23.909 -19.718 1.00 0.66 C ATOM 6007 CG GLU C 117 24.458 -22.840 -20.206 1.00 0.73 C ATOM 6008 CD GLU C 117 25.525 -22.596 -19.139 1.00 0.73 C ATOM 6009 OE1 GLU C 117 25.466 -23.250 -18.111 1.00 1.29 O ATOM 6010 OE2 GLU C 117 26.383 -21.761 -19.367 1.00 1.28 O ATOM 0 H GLU C 117 21.767 -22.121 -19.947 1.00 0.68 H new ATOM 0 HA GLU C 117 22.720 -24.147 -21.721 1.00 0.68 H new ATOM 0 HB2 GLU C 117 23.094 -23.644 -18.732 1.00 0.66 H new ATOM 0 HB3 GLU C 117 23.986 -24.867 -19.615 1.00 0.66 H new ATOM 0 HG2 GLU C 117 24.927 -23.160 -21.136 1.00 0.73 H new ATOM 0 HG3 GLU C 117 23.925 -21.913 -20.420 1.00 0.73 H new ATOM 6017 N LEU C 118 20.614 -25.124 -19.380 1.00 0.58 N ATOM 6018 CA LEU C 118 19.749 -26.272 -18.982 1.00 0.56 C ATOM 6019 C LEU C 118 18.886 -26.698 -20.172 1.00 0.65 C ATOM 6020 O LEU C 118 18.694 -27.871 -20.421 1.00 0.67 O ATOM 6021 CB LEU C 118 18.853 -25.859 -17.808 1.00 0.51 C ATOM 6022 CG LEU C 118 17.948 -27.027 -17.378 1.00 0.52 C ATOM 6023 CD1 LEU C 118 18.800 -28.228 -16.929 1.00 0.54 C ATOM 6024 CD2 LEU C 118 17.063 -26.563 -16.216 1.00 0.53 C ATOM 0 H LEU C 118 20.475 -24.270 -18.840 1.00 0.58 H new ATOM 0 HA LEU C 118 20.375 -27.110 -18.675 1.00 0.56 H new ATOM 0 HB2 LEU C 118 19.470 -25.542 -16.967 1.00 0.51 H new ATOM 0 HB3 LEU C 118 18.241 -25.004 -18.095 1.00 0.51 H new ATOM 0 HG LEU C 118 17.330 -27.335 -18.222 1.00 0.52 H new ATOM 0 HD11 LEU C 118 18.146 -29.046 -16.628 1.00 0.54 H new ATOM 0 HD12 LEU C 118 19.432 -28.554 -17.755 1.00 0.54 H new ATOM 0 HD13 LEU C 118 19.426 -27.935 -16.086 1.00 0.54 H new ATOM 0 HD21 LEU C 118 16.416 -27.382 -15.902 1.00 0.53 H new ATOM 0 HD22 LEU C 118 17.692 -26.256 -15.380 1.00 0.53 H new ATOM 0 HD23 LEU C 118 16.451 -25.721 -16.539 1.00 0.53 H new ATOM 6036 N GLN C 119 18.364 -25.757 -20.914 1.00 0.71 N ATOM 6037 CA GLN C 119 17.519 -26.128 -22.085 1.00 0.82 C ATOM 6038 C GLN C 119 18.353 -26.957 -23.061 1.00 0.87 C ATOM 6039 O GLN C 119 17.883 -27.921 -23.634 1.00 0.92 O ATOM 6040 CB GLN C 119 17.027 -24.858 -22.784 1.00 0.88 C ATOM 6041 CG GLN C 119 15.989 -24.161 -21.903 1.00 0.87 C ATOM 6042 CD GLN C 119 15.520 -22.877 -22.588 1.00 0.95 C ATOM 6043 OE1 GLN C 119 16.224 -22.384 -23.570 1.00 1.29 O flip ATOM 6044 NE2 GLN C 119 14.508 -22.312 -22.221 1.00 1.46 N flip ATOM 0 H GLN C 119 18.485 -24.756 -20.761 1.00 0.71 H new ATOM 0 HA GLN C 119 16.661 -26.710 -21.749 1.00 0.82 H new ATOM 0 HB2 GLN C 119 17.865 -24.188 -22.977 1.00 0.88 H new ATOM 0 HB3 GLN C 119 16.590 -25.108 -23.751 1.00 0.88 H new ATOM 0 HG2 GLN C 119 15.141 -24.823 -21.728 1.00 0.87 H new ATOM 0 HG3 GLN C 119 16.419 -23.930 -20.929 1.00 0.87 H new ATOM 0 HE21 GLN C 119 13.958 -22.698 -21.453 1.00 1.46 H new ATOM 0 HE22 GLN C 119 14.209 -21.452 -22.681 1.00 1.46 H new ATOM 6053 N LYS C 120 19.592 -26.594 -23.252 1.00 0.86 N ATOM 6054 CA LYS C 120 20.455 -27.366 -24.190 1.00 0.93 C ATOM 6055 C LYS C 120 20.599 -28.797 -23.677 1.00 0.91 C ATOM 6056 O LYS C 120 20.572 -29.741 -24.441 1.00 0.99 O ATOM 6057 CB LYS C 120 21.840 -26.710 -24.291 1.00 0.95 C ATOM 6058 CG LYS C 120 21.737 -25.346 -24.992 1.00 1.02 C ATOM 6059 CD LYS C 120 21.643 -25.524 -26.514 1.00 1.58 C ATOM 6060 CE LYS C 120 21.794 -24.162 -27.195 1.00 1.89 C ATOM 6061 NZ LYS C 120 21.705 -24.340 -28.672 1.00 2.45 N ATOM 0 H LYS C 120 20.043 -25.798 -22.800 1.00 0.86 H new ATOM 0 HA LYS C 120 19.997 -27.375 -25.179 1.00 0.93 H new ATOM 0 HB2 LYS C 120 22.263 -26.583 -23.294 1.00 0.95 H new ATOM 0 HB3 LYS C 120 22.518 -27.360 -24.844 1.00 0.95 H new ATOM 0 HG2 LYS C 120 20.860 -24.810 -24.629 1.00 1.02 H new ATOM 0 HG3 LYS C 120 22.607 -24.738 -24.745 1.00 1.02 H new ATOM 0 HD2 LYS C 120 22.421 -26.204 -26.860 1.00 1.58 H new ATOM 0 HD3 LYS C 120 20.686 -25.972 -26.780 1.00 1.58 H new ATOM 0 HE2 LYS C 120 21.015 -23.482 -26.851 1.00 1.89 H new ATOM 0 HE3 LYS C 120 22.750 -23.712 -26.928 1.00 1.89 H new ATOM 0 HZ1 LYS C 120 21.807 -23.417 -29.140 1.00 2.45 H new ATOM 0 HZ2 LYS C 120 22.464 -24.976 -28.991 1.00 2.45 H new ATOM 0 HZ3 LYS C 120 20.782 -24.752 -28.917 1.00 2.45 H new ATOM 6075 N LEU C 121 20.740 -28.974 -22.392 1.00 0.80 N ATOM 6076 CA LEU C 121 20.872 -30.354 -21.853 1.00 0.79 C ATOM 6077 C LEU C 121 19.613 -31.136 -22.223 1.00 0.87 C ATOM 6078 O LEU C 121 19.680 -32.264 -22.671 1.00 0.96 O ATOM 6079 CB LEU C 121 21.024 -30.305 -20.328 1.00 0.68 C ATOM 6080 CG LEU C 121 22.276 -29.499 -19.947 1.00 0.67 C ATOM 6081 CD1 LEU C 121 22.379 -29.418 -18.419 1.00 0.62 C ATOM 6082 CD2 LEU C 121 23.536 -30.186 -20.507 1.00 0.77 C ATOM 0 H LEU C 121 20.769 -28.228 -21.697 1.00 0.80 H new ATOM 0 HA LEU C 121 21.753 -30.839 -22.275 1.00 0.79 H new ATOM 0 HB2 LEU C 121 20.140 -29.851 -19.881 1.00 0.68 H new ATOM 0 HB3 LEU C 121 21.098 -31.317 -19.930 1.00 0.68 H new ATOM 0 HG LEU C 121 22.199 -28.496 -20.368 1.00 0.67 H new ATOM 0 HD11 LEU C 121 23.266 -28.847 -18.144 1.00 0.62 H new ATOM 0 HD12 LEU C 121 21.492 -28.926 -18.020 1.00 0.62 H new ATOM 0 HD13 LEU C 121 22.452 -30.424 -18.005 1.00 0.62 H new ATOM 0 HD21 LEU C 121 24.418 -29.608 -20.232 1.00 0.77 H new ATOM 0 HD22 LEU C 121 23.617 -31.191 -20.093 1.00 0.77 H new ATOM 0 HD23 LEU C 121 23.465 -30.246 -21.593 1.00 0.77 H new ATOM 6094 N ASN C 122 18.464 -30.530 -22.055 1.00 0.88 N ATOM 6095 CA ASN C 122 17.179 -31.204 -22.407 1.00 1.03 C ATOM 6096 C ASN C 122 16.388 -30.300 -23.354 1.00 1.08 C ATOM 6097 O ASN C 122 15.290 -29.879 -23.051 1.00 1.15 O ATOM 6098 CB ASN C 122 16.364 -31.441 -21.132 1.00 1.11 C ATOM 6099 CG ASN C 122 15.128 -32.281 -21.469 1.00 1.31 C ATOM 6100 OD1 ASN C 122 15.129 -33.021 -22.431 1.00 1.78 O ATOM 6101 ND2 ASN C 122 14.068 -32.199 -20.714 1.00 1.70 N ATOM 0 H ASN C 122 18.362 -29.585 -21.684 1.00 0.88 H new ATOM 0 HA ASN C 122 17.382 -32.160 -22.890 1.00 1.03 H new ATOM 0 HB2 ASN C 122 16.973 -31.953 -20.387 1.00 1.11 H new ATOM 0 HB3 ASN C 122 16.063 -30.488 -20.697 1.00 1.11 H new ATOM 0 HD21 ASN C 122 13.242 -32.756 -20.932 1.00 1.70 H new ATOM 0 HD22 ASN C 122 14.065 -31.578 -19.905 1.00 1.70 H new ATOM 6108 N SER C 123 16.937 -29.997 -24.504 1.00 1.09 N ATOM 6109 CA SER C 123 16.215 -29.121 -25.473 1.00 1.18 C ATOM 6110 C SER C 123 15.337 -29.991 -26.374 1.00 1.37 C ATOM 6111 O SER C 123 15.879 -30.874 -27.020 1.00 1.92 O ATOM 6112 CB SER C 123 17.232 -28.365 -26.336 1.00 1.16 C ATOM 6113 OG SER C 123 16.687 -28.152 -27.633 1.00 1.84 O ATOM 6114 OXT SER C 123 14.139 -29.762 -26.399 1.00 1.66 O ATOM 0 H SER C 123 17.854 -30.319 -24.812 1.00 1.09 H new ATOM 0 HA SER C 123 15.597 -28.406 -24.930 1.00 1.18 H new ATOM 0 HB2 SER C 123 17.480 -27.410 -25.873 1.00 1.16 H new ATOM 0 HB3 SER C 123 18.159 -28.934 -26.408 1.00 1.16 H new ATOM 0 HG SER C 123 17.336 -27.668 -28.185 1.00 1.84 H new