USER MOD reduce.3.24.130724 H: found=0, std=0, add=1375, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1375 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: A 50 TYR OH : rot 10:sc= 2.15 USER MOD Set 1.2: A 99 LYS NZ :NH3+ -179:sc= 1.67 (180deg=0.464) USER MOD Set 2.1: A 88 ASN : amide:sc= 0.00395 X(o=0.0097,f=0.035) USER MOD Set 2.2: A 91 SER OG : rot -150:sc= 0.0057 USER MOD Set 3.1: A 52 GLN : amide:sc= -4.26! C(o=-8.1!,f=-20!) USER MOD Set 3.2: A 55 LYS NZ :NH3+ -179:sc= -3.8! (180deg=-4.58!) USER MOD Set 4.1: A 46 THR OG1 : rot 163:sc= 2.07 USER MOD Set 4.2: A 49 HIS : no HE2:sc= -4.35! C(o=-2.3!,f=-14!) USER MOD Set 5.1: A 38 LYS NZ :NH3+ 131:sc= 2.25 (180deg=-0.147) USER MOD Set 5.2: A 43 THR OG1 : rot -100:sc= 1.02 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -120:sc= 0.0247 (180deg=-0.0486) USER MOD Single : A 6 GLN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : A 9 GLN : amide:sc= -0.15 X(o=-0.15,f=-0.24) USER MOD Single : A 10 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 12 MET CE :methyl 166:sc= 0 (180deg=-0.329) USER MOD Single : A 13 GLN :FLIP amide:sc= -0.0228 F(o=-1.3!,f=-0.023) USER MOD Single : A 15 THR OG1 : rot -123:sc= -0.291 USER MOD Single : A 18 ASN : amide:sc= -0.163 X(o=-0.16,f=0) USER MOD Single : A 20 TYR OH : rot 85:sc= 0.534 USER MOD Single : A 21 SER OG : rot 15:sc= 0.935 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.0347 USER MOD Single : A 23 SER OG : rot 180:sc= 0.0593 USER MOD Single : A 26 TYR OH : rot 130:sc= -0.793! USER MOD Single : A 30 SER OG : rot 36:sc= 1.15 USER MOD Single : A 31 ASN :FLIP amide:sc= -0.027 F(o=-0.99,f=-0.027) USER MOD Single : A 42 LYS NZ :NH3+ 172:sc=-0.00846 (180deg=-0.108) USER MOD Single : A 47 SER OG : rot 180:sc= 0.00268 USER MOD Single : A 54 GLN : amide:sc= -0.052 K(o=-0.052,f=-0.7) USER MOD Single : A 60 LYS NZ :NH3+ 164:sc= -0.0778 (180deg=-0.355) USER MOD Single : A 61 TYR OH : rot -161:sc= 1.27 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 MET CE :methyl 180:sc= -3.27 (180deg=-3.27) USER MOD Single : A 82 SER OG : rot 105:sc= 1.28 USER MOD Single : A 83 LYS NZ :NH3+ -165:sc= 1.16 (180deg=0.832) USER MOD Single : A 87 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0657) USER MOD Single : A 93 LYS NZ :NH3+ -167:sc= -0.716 (180deg=-0.874) USER MOD Single : A 95 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 MET CE :methyl -133:sc= 0 (180deg=-0.808) USER MOD Single : A 104 LYS NZ :NH3+ 168:sc= 0.74 (180deg=0.487) USER MOD Single : A 107 GLN :FLIP amide:sc= -0.0665 F(o=-1.6!,f=-0.066) USER MOD Single : A 108 HIS : +bothHN:sc= 1.57 K(o=1.6,f=-6!) USER MOD Single : A 118 THR OG1 : rot -91:sc= 1.96 USER MOD Single : A 122 LYS NZ :NH3+ -163:sc= 1.32 (180deg=1.16) USER MOD Single : A 126 HIS : no HD1:sc= -0.0746 X(o=-0.075,f=-0.036) USER MOD Single : A 127 THR OG1 : rot 180:sc= 0.131 USER MOD Single : A 129 ASN : amide:sc= 0 X(o=0,f=-0.0037) USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 138 HIS :FLIP no HE2:sc= -1.22 F(o=-2.6!,f=-1.2) USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 LYS NZ :NH3+ -159:sc= -0.0412 (180deg=-0.305) USER MOD Single : A 143 ASN :FLIP amide:sc= -0.468 F(o=-1.9,f=-0.47) USER MOD Single : A 147 TYR OH : rot 180:sc= 0 USER MOD Single : A 150 MET CE :methyl -165:sc= -0.55 (180deg=-1.2) USER MOD Single : A 155 GLN :FLIP amide:sc= -0.653 F(o=-4.7!,f=-0.65) USER MOD Single : A 160 LYS NZ :NH3+ 163:sc= 2.07 (180deg=1.69) USER MOD Single : A 163 HIS : no HD1:sc= -1.08 X(o=-1.1,f=-0.64) USER MOD Single : A 164 HIS :FLIP no HE2:sc= 0.109 F(o=-0.59,f=0.11) USER MOD Single : A 165 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 166 HIS : no HD1:sc= -0.261 K(o=-0.26,f=-0.83) USER MOD Single : A 167 HIS : no HD1:sc= -0.0187 X(o=-0.019,f=-0.019) USER MOD Single : A 168 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 13.495 8.090 17.166 1.00 0.00 N ATOM 2 CA MET A 1 12.146 7.994 16.566 1.00 0.00 C ATOM 3 C MET A 1 11.547 6.616 16.811 1.00 0.00 C ATOM 4 O MET A 1 12.271 5.626 16.882 1.00 0.00 O ATOM 5 CB MET A 1 12.216 8.249 15.056 1.00 0.00 C ATOM 6 CG MET A 1 12.596 9.670 14.687 1.00 0.00 C ATOM 7 SD MET A 1 11.395 10.880 15.268 1.00 0.00 S ATOM 8 CE MET A 1 12.136 12.395 14.671 1.00 0.00 C ATOM 0 H1 MET A 1 13.507 8.852 17.873 1.00 0.00 H new ATOM 0 H2 MET A 1 13.736 7.188 17.625 1.00 0.00 H new ATOM 0 H3 MET A 1 14.192 8.297 16.422 1.00 0.00 H new ATOM 0 HA MET A 1 11.514 8.749 17.035 1.00 0.00 H new ATOM 0 HB2 MET A 1 12.941 7.564 14.616 1.00 0.00 H new ATOM 0 HB3 MET A 1 11.247 8.016 14.613 1.00 0.00 H new ATOM 0 HG2 MET A 1 13.574 9.902 15.109 1.00 0.00 H new ATOM 0 HG3 MET A 1 12.690 9.748 13.604 1.00 0.00 H new ATOM 0 HE1 MET A 1 11.509 13.242 14.951 1.00 0.00 H new ATOM 0 HE2 MET A 1 13.126 12.514 15.112 1.00 0.00 H new ATOM 0 HE3 MET A 1 12.225 12.353 13.585 1.00 0.00 H new ATOM 20 N PRO A 2 10.213 6.534 16.957 1.00 0.00 N ATOM 21 CA PRO A 2 9.510 5.252 17.083 1.00 0.00 C ATOM 22 C PRO A 2 9.704 4.385 15.840 1.00 0.00 C ATOM 23 O PRO A 2 9.849 3.165 15.930 1.00 0.00 O ATOM 24 CB PRO A 2 8.039 5.653 17.244 1.00 0.00 C ATOM 25 CG PRO A 2 7.955 7.060 16.747 1.00 0.00 C ATOM 26 CD PRO A 2 9.291 7.680 17.033 1.00 0.00 C ATOM 0 HA PRO A 2 9.881 4.656 17.917 1.00 0.00 H new ATOM 0 HB2 PRO A 2 7.387 4.994 16.670 1.00 0.00 H new ATOM 0 HB3 PRO A 2 7.725 5.585 18.285 1.00 0.00 H new ATOM 0 HG2 PRO A 2 7.734 7.084 15.680 1.00 0.00 H new ATOM 0 HG3 PRO A 2 7.156 7.605 17.250 1.00 0.00 H new ATOM 0 HD2 PRO A 2 9.543 8.449 16.303 1.00 0.00 H new ATOM 0 HD3 PRO A 2 9.315 8.152 18.015 1.00 0.00 H new ATOM 34 N VAL A 3 9.695 5.030 14.683 1.00 0.00 N ATOM 35 CA VAL A 3 10.021 4.372 13.429 1.00 0.00 C ATOM 36 C VAL A 3 11.486 4.634 13.094 1.00 0.00 C ATOM 37 O VAL A 3 11.937 5.780 13.104 1.00 0.00 O ATOM 38 CB VAL A 3 9.103 4.849 12.277 1.00 0.00 C ATOM 39 CG1 VAL A 3 9.084 6.369 12.180 1.00 0.00 C ATOM 40 CG2 VAL A 3 9.526 4.232 10.948 1.00 0.00 C ATOM 0 H VAL A 3 9.463 6.019 14.588 1.00 0.00 H new ATOM 0 HA VAL A 3 9.857 3.301 13.545 1.00 0.00 H new ATOM 0 HB VAL A 3 8.091 4.512 12.502 1.00 0.00 H new ATOM 0 HG11 VAL A 3 8.431 6.673 11.362 1.00 0.00 H new ATOM 0 HG12 VAL A 3 8.714 6.789 13.115 1.00 0.00 H new ATOM 0 HG13 VAL A 3 10.094 6.734 11.993 1.00 0.00 H new ATOM 0 HG21 VAL A 3 8.864 4.584 10.156 1.00 0.00 H new ATOM 0 HG22 VAL A 3 10.551 4.525 10.721 1.00 0.00 H new ATOM 0 HG23 VAL A 3 9.465 3.146 11.015 1.00 0.00 H new ATOM 50 N ARG A 4 12.237 3.578 12.825 1.00 0.00 N ATOM 51 CA ARG A 4 13.676 3.704 12.648 1.00 0.00 C ATOM 52 C ARG A 4 14.102 3.247 11.264 1.00 0.00 C ATOM 53 O ARG A 4 15.024 3.814 10.676 1.00 0.00 O ATOM 54 CB ARG A 4 14.401 2.876 13.704 1.00 0.00 C ATOM 55 CG ARG A 4 13.962 3.197 15.118 1.00 0.00 C ATOM 56 CD ARG A 4 14.445 2.146 16.098 1.00 0.00 C ATOM 57 NE ARG A 4 13.803 2.288 17.400 1.00 0.00 N ATOM 58 CZ ARG A 4 12.650 1.699 17.725 1.00 0.00 C ATOM 59 NH1 ARG A 4 12.013 0.938 16.838 1.00 0.00 N ATOM 60 NH2 ARG A 4 12.128 1.872 18.930 1.00 0.00 N ATOM 0 H ARG A 4 11.877 2.629 12.725 1.00 0.00 H new ATOM 0 HA ARG A 4 13.939 4.756 12.758 1.00 0.00 H new ATOM 0 HB2 ARG A 4 14.229 1.818 13.508 1.00 0.00 H new ATOM 0 HB3 ARG A 4 15.474 3.046 13.616 1.00 0.00 H new ATOM 0 HG2 ARG A 4 14.350 4.173 15.408 1.00 0.00 H new ATOM 0 HG3 ARG A 4 12.875 3.261 15.157 1.00 0.00 H new ATOM 0 HD2 ARG A 4 14.240 1.153 15.697 1.00 0.00 H new ATOM 0 HD3 ARG A 4 15.526 2.226 16.214 1.00 0.00 H new ATOM 0 HE ARG A 4 14.261 2.870 18.102 1.00 0.00 H new ATOM 0 HH11 ARG A 4 12.406 0.803 15.906 1.00 0.00 H new ATOM 0 HH12 ARG A 4 11.132 0.490 17.090 1.00 0.00 H new ATOM 0 HH21 ARG A 4 12.607 2.457 19.614 1.00 0.00 H new ATOM 0 HH22 ARG A 4 11.247 1.420 19.174 1.00 0.00 H new ATOM 74 N ALA A 5 13.439 2.201 10.770 1.00 0.00 N ATOM 75 CA ALA A 5 13.751 1.608 9.469 1.00 0.00 C ATOM 76 C ALA A 5 15.145 0.980 9.488 1.00 0.00 C ATOM 77 O ALA A 5 15.701 0.626 8.451 1.00 0.00 O ATOM 78 CB ALA A 5 13.629 2.652 8.359 1.00 0.00 C ATOM 0 H ALA A 5 12.671 1.741 11.260 1.00 0.00 H new ATOM 0 HA ALA A 5 13.029 0.817 9.264 1.00 0.00 H new ATOM 0 HB1 ALA A 5 13.865 2.192 7.399 1.00 0.00 H new ATOM 0 HB2 ALA A 5 12.611 3.040 8.335 1.00 0.00 H new ATOM 0 HB3 ALA A 5 14.324 3.469 8.550 1.00 0.00 H new ATOM 84 N GLN A 6 15.683 0.807 10.693 1.00 0.00 N ATOM 85 CA GLN A 6 17.048 0.317 10.868 1.00 0.00 C ATOM 86 C GLN A 6 17.077 -1.164 11.226 1.00 0.00 C ATOM 87 O GLN A 6 18.090 -1.671 11.707 1.00 0.00 O ATOM 88 CB GLN A 6 17.770 1.127 11.947 1.00 0.00 C ATOM 89 CG GLN A 6 18.023 2.570 11.553 1.00 0.00 C ATOM 90 CD GLN A 6 18.793 3.337 12.608 1.00 0.00 C ATOM 91 OE1 GLN A 6 18.210 3.955 13.499 1.00 0.00 O ATOM 92 NE2 GLN A 6 20.113 3.294 12.516 1.00 0.00 N ATOM 0 H GLN A 6 15.192 1.000 11.566 1.00 0.00 H new ATOM 0 HA GLN A 6 17.563 0.441 9.915 1.00 0.00 H new ATOM 0 HB2 GLN A 6 17.178 1.107 12.862 1.00 0.00 H new ATOM 0 HB3 GLN A 6 18.723 0.648 12.173 1.00 0.00 H new ATOM 0 HG2 GLN A 6 18.577 2.594 10.615 1.00 0.00 H new ATOM 0 HG3 GLN A 6 17.069 3.066 11.373 1.00 0.00 H new ATOM 0 HE21 GLN A 6 20.555 2.769 11.761 1.00 0.00 H new ATOM 0 HE22 GLN A 6 20.688 3.785 13.200 1.00 0.00 H new ATOM 101 N ARG A 7 15.972 -1.860 10.987 1.00 0.00 N ATOM 102 CA ARG A 7 15.927 -3.305 11.198 1.00 0.00 C ATOM 103 C ARG A 7 16.858 -3.996 10.204 1.00 0.00 C ATOM 104 O ARG A 7 17.501 -4.998 10.520 1.00 0.00 O ATOM 105 CB ARG A 7 14.493 -3.825 11.057 1.00 0.00 C ATOM 106 CG ARG A 7 14.369 -5.338 11.161 1.00 0.00 C ATOM 107 CD ARG A 7 12.919 -5.786 11.073 1.00 0.00 C ATOM 108 NE ARG A 7 12.793 -7.240 11.044 1.00 0.00 N ATOM 109 CZ ARG A 7 11.628 -7.885 10.981 1.00 0.00 C ATOM 110 NH1 ARG A 7 10.486 -7.209 10.973 1.00 0.00 N ATOM 111 NH2 ARG A 7 11.603 -9.208 10.931 1.00 0.00 N ATOM 0 H ARG A 7 15.100 -1.453 10.649 1.00 0.00 H new ATOM 0 HA ARG A 7 16.264 -3.530 12.210 1.00 0.00 H new ATOM 0 HB2 ARG A 7 13.874 -3.366 11.828 1.00 0.00 H new ATOM 0 HB3 ARG A 7 14.094 -3.504 10.095 1.00 0.00 H new ATOM 0 HG2 ARG A 7 14.945 -5.807 10.363 1.00 0.00 H new ATOM 0 HG3 ARG A 7 14.798 -5.675 12.104 1.00 0.00 H new ATOM 0 HD2 ARG A 7 12.366 -5.392 11.926 1.00 0.00 H new ATOM 0 HD3 ARG A 7 12.464 -5.365 10.176 1.00 0.00 H new ATOM 0 HE ARG A 7 13.648 -7.796 11.074 1.00 0.00 H new ATOM 0 HH11 ARG A 7 10.496 -6.190 11.015 1.00 0.00 H new ATOM 0 HH12 ARG A 7 9.598 -7.709 10.925 1.00 0.00 H new ATOM 0 HH21 ARG A 7 12.476 -9.735 10.941 1.00 0.00 H new ATOM 0 HH22 ARG A 7 10.711 -9.700 10.883 1.00 0.00 H new ATOM 125 N ILE A 8 16.931 -3.439 9.001 1.00 0.00 N ATOM 126 CA ILE A 8 17.857 -3.912 7.981 1.00 0.00 C ATOM 127 C ILE A 8 18.570 -2.717 7.354 1.00 0.00 C ATOM 128 O ILE A 8 19.781 -2.558 7.516 1.00 0.00 O ATOM 129 CB ILE A 8 17.141 -4.724 6.876 1.00 0.00 C ATOM 130 CG1 ILE A 8 16.404 -5.923 7.482 1.00 0.00 C ATOM 131 CG2 ILE A 8 18.141 -5.191 5.827 1.00 0.00 C ATOM 132 CD1 ILE A 8 15.625 -6.737 6.468 1.00 0.00 C ATOM 0 H ILE A 8 16.353 -2.651 8.707 1.00 0.00 H new ATOM 0 HA ILE A 8 18.575 -4.575 8.464 1.00 0.00 H new ATOM 0 HB ILE A 8 16.409 -4.077 6.393 1.00 0.00 H new ATOM 0 HG12 ILE A 8 17.128 -6.571 7.976 1.00 0.00 H new ATOM 0 HG13 ILE A 8 15.719 -5.566 8.251 1.00 0.00 H new ATOM 0 HG21 ILE A 8 17.621 -5.761 5.057 1.00 0.00 H new ATOM 0 HG22 ILE A 8 18.624 -4.325 5.374 1.00 0.00 H new ATOM 0 HG23 ILE A 8 18.895 -5.822 6.298 1.00 0.00 H new ATOM 0 HD11 ILE A 8 15.130 -7.568 6.971 1.00 0.00 H new ATOM 0 HD12 ILE A 8 14.876 -6.104 5.991 1.00 0.00 H new ATOM 0 HD13 ILE A 8 16.307 -7.125 5.712 1.00 0.00 H new ATOM 144 N GLN A 9 17.792 -1.878 6.654 1.00 0.00 N ATOM 145 CA GLN A 9 18.283 -0.637 6.040 1.00 0.00 C ATOM 146 C GLN A 9 19.131 -0.940 4.804 1.00 0.00 C ATOM 147 O GLN A 9 18.774 -0.567 3.689 1.00 0.00 O ATOM 148 CB GLN A 9 19.067 0.208 7.055 1.00 0.00 C ATOM 149 CG GLN A 9 19.388 1.616 6.576 1.00 0.00 C ATOM 150 CD GLN A 9 18.142 2.434 6.284 1.00 0.00 C ATOM 151 OE1 GLN A 9 17.652 2.464 5.158 1.00 0.00 O ATOM 152 NE2 GLN A 9 17.618 3.101 7.301 1.00 0.00 N ATOM 0 H GLN A 9 16.798 -2.043 6.497 1.00 0.00 H new ATOM 0 HA GLN A 9 17.419 -0.054 5.720 1.00 0.00 H new ATOM 0 HB2 GLN A 9 18.492 0.272 7.979 1.00 0.00 H new ATOM 0 HB3 GLN A 9 19.999 -0.304 7.295 1.00 0.00 H new ATOM 0 HG2 GLN A 9 19.983 2.126 7.333 1.00 0.00 H new ATOM 0 HG3 GLN A 9 19.999 1.558 5.675 1.00 0.00 H new ATOM 0 HE21 GLN A 9 18.054 3.051 8.222 1.00 0.00 H new ATOM 0 HE22 GLN A 9 16.779 3.664 7.163 1.00 0.00 H new ATOM 161 N HIS A 10 20.245 -1.624 5.001 1.00 0.00 N ATOM 162 CA HIS A 10 21.083 -2.032 3.888 1.00 0.00 C ATOM 163 C HIS A 10 20.854 -3.506 3.592 1.00 0.00 C ATOM 164 O HIS A 10 21.130 -4.364 4.432 1.00 0.00 O ATOM 165 CB HIS A 10 22.562 -1.768 4.186 1.00 0.00 C ATOM 166 CG HIS A 10 23.479 -2.143 3.055 1.00 0.00 C ATOM 167 ND1 HIS A 10 23.699 -1.337 1.958 1.00 0.00 N ATOM 168 CD2 HIS A 10 24.224 -3.254 2.856 1.00 0.00 C ATOM 169 CE1 HIS A 10 24.538 -1.939 1.136 1.00 0.00 C ATOM 170 NE2 HIS A 10 24.873 -3.104 1.658 1.00 0.00 N ATOM 0 H HIS A 10 20.589 -1.908 5.918 1.00 0.00 H new ATOM 0 HA HIS A 10 20.811 -1.443 3.012 1.00 0.00 H new ATOM 0 HB2 HIS A 10 22.695 -0.711 4.415 1.00 0.00 H new ATOM 0 HB3 HIS A 10 22.850 -2.326 5.077 1.00 0.00 H new ATOM 0 HD2 HIS A 10 24.295 -4.103 3.519 1.00 0.00 H new ATOM 0 HE1 HIS A 10 24.891 -1.545 0.195 1.00 0.00 H new ATOM 0 HE2 HIS A 10 25.510 -3.781 1.239 1.00 0.00 H new ATOM 179 N VAL A 11 20.347 -3.791 2.405 1.00 0.00 N ATOM 180 CA VAL A 11 20.039 -5.159 2.016 1.00 0.00 C ATOM 181 C VAL A 11 21.254 -5.841 1.399 1.00 0.00 C ATOM 182 O VAL A 11 22.345 -5.273 1.353 1.00 0.00 O ATOM 183 CB VAL A 11 18.854 -5.223 1.030 1.00 0.00 C ATOM 184 CG1 VAL A 11 17.602 -4.635 1.660 1.00 0.00 C ATOM 185 CG2 VAL A 11 19.187 -4.506 -0.269 1.00 0.00 C ATOM 0 H VAL A 11 20.139 -3.092 1.691 1.00 0.00 H new ATOM 0 HA VAL A 11 19.757 -5.688 2.926 1.00 0.00 H new ATOM 0 HB VAL A 11 18.664 -6.271 0.798 1.00 0.00 H new ATOM 0 HG11 VAL A 11 16.777 -4.689 0.949 1.00 0.00 H new ATOM 0 HG12 VAL A 11 17.346 -5.200 2.556 1.00 0.00 H new ATOM 0 HG13 VAL A 11 17.783 -3.594 1.927 1.00 0.00 H new ATOM 0 HG21 VAL A 11 18.335 -4.566 -0.946 1.00 0.00 H new ATOM 0 HG22 VAL A 11 19.412 -3.460 -0.060 1.00 0.00 H new ATOM 0 HG23 VAL A 11 20.053 -4.977 -0.733 1.00 0.00 H new ATOM 195 N MET A 12 21.055 -7.059 0.918 1.00 0.00 N ATOM 196 CA MET A 12 22.153 -7.870 0.415 1.00 0.00 C ATOM 197 C MET A 12 22.243 -7.768 -1.105 1.00 0.00 C ATOM 198 O MET A 12 22.984 -6.941 -1.640 1.00 0.00 O ATOM 199 CB MET A 12 21.942 -9.327 0.829 1.00 0.00 C ATOM 200 CG MET A 12 21.377 -9.474 2.229 1.00 0.00 C ATOM 201 SD MET A 12 20.695 -11.112 2.536 1.00 0.00 S ATOM 202 CE MET A 12 19.678 -10.770 3.971 1.00 0.00 C ATOM 0 H MET A 12 20.141 -7.508 0.865 1.00 0.00 H new ATOM 0 HA MET A 12 23.087 -7.502 0.840 1.00 0.00 H new ATOM 0 HB2 MET A 12 21.267 -9.806 0.120 1.00 0.00 H new ATOM 0 HB3 MET A 12 22.893 -9.856 0.771 1.00 0.00 H new ATOM 0 HG2 MET A 12 22.163 -9.270 2.956 1.00 0.00 H new ATOM 0 HG3 MET A 12 20.599 -8.726 2.382 1.00 0.00 H new ATOM 0 HE1 MET A 12 18.998 -11.604 4.142 1.00 0.00 H new ATOM 0 HE2 MET A 12 20.315 -10.636 4.845 1.00 0.00 H new ATOM 0 HE3 MET A 12 19.101 -9.861 3.800 1.00 0.00 H new ATOM 212 N GLN A 13 21.462 -8.605 -1.787 1.00 0.00 N ATOM 213 CA GLN A 13 21.412 -8.641 -3.245 1.00 0.00 C ATOM 214 C GLN A 13 20.386 -9.671 -3.703 1.00 0.00 C ATOM 215 O GLN A 13 20.537 -10.865 -3.440 1.00 0.00 O ATOM 216 CB GLN A 13 22.789 -8.968 -3.849 1.00 0.00 C ATOM 217 CG GLN A 13 23.431 -10.229 -3.289 1.00 0.00 C ATOM 218 CD GLN A 13 24.687 -10.633 -4.033 1.00 0.00 C ATOM 219 OE1 GLN A 13 24.716 -10.386 -5.336 1.00 0.00 O flip ATOM 220 NE2 GLN A 13 25.617 -11.192 -3.449 1.00 0.00 N flip ATOM 0 H GLN A 13 20.843 -9.281 -1.339 1.00 0.00 H new ATOM 0 HA GLN A 13 21.119 -7.652 -3.596 1.00 0.00 H new ATOM 0 HB2 GLN A 13 22.684 -9.076 -4.929 1.00 0.00 H new ATOM 0 HB3 GLN A 13 23.459 -8.125 -3.677 1.00 0.00 H new ATOM 0 HG2 GLN A 13 23.673 -10.071 -2.238 1.00 0.00 H new ATOM 0 HG3 GLN A 13 22.711 -11.046 -3.331 1.00 0.00 H new ATOM 0 HE21 GLN A 13 25.559 -11.365 -2.445 1.00 0.00 H new ATOM 0 HE22 GLN A 13 26.445 -11.482 -3.969 1.00 0.00 H new ATOM 229 N ASP A 14 19.325 -9.191 -4.347 1.00 0.00 N ATOM 230 CA ASP A 14 18.256 -10.054 -4.859 1.00 0.00 C ATOM 231 C ASP A 14 17.643 -10.872 -3.720 1.00 0.00 C ATOM 232 O ASP A 14 17.163 -11.988 -3.909 1.00 0.00 O ATOM 233 CB ASP A 14 18.785 -10.969 -5.973 1.00 0.00 C ATOM 234 CG ASP A 14 17.669 -11.608 -6.780 1.00 0.00 C ATOM 235 OD1 ASP A 14 16.747 -10.878 -7.208 1.00 0.00 O ATOM 236 OD2 ASP A 14 17.719 -12.834 -7.013 1.00 0.00 O ATOM 0 H ASP A 14 19.179 -8.198 -4.530 1.00 0.00 H new ATOM 0 HA ASP A 14 17.475 -9.425 -5.286 1.00 0.00 H new ATOM 0 HB2 ASP A 14 19.426 -10.392 -6.639 1.00 0.00 H new ATOM 0 HB3 ASP A 14 19.404 -11.751 -5.533 1.00 0.00 H new ATOM 241 N THR A 15 17.644 -10.275 -2.537 1.00 0.00 N ATOM 242 CA THR A 15 17.114 -10.905 -1.339 1.00 0.00 C ATOM 243 C THR A 15 15.590 -10.864 -1.366 1.00 0.00 C ATOM 244 O THR A 15 15.011 -9.927 -1.898 1.00 0.00 O ATOM 245 CB THR A 15 17.635 -10.154 -0.096 1.00 0.00 C ATOM 246 OG1 THR A 15 19.063 -10.049 -0.160 1.00 0.00 O ATOM 247 CG2 THR A 15 17.236 -10.855 1.191 1.00 0.00 C ATOM 0 H THR A 15 18.014 -9.337 -2.382 1.00 0.00 H new ATOM 0 HA THR A 15 17.440 -11.944 -1.299 1.00 0.00 H new ATOM 0 HB THR A 15 17.186 -9.161 -0.093 1.00 0.00 H new ATOM 0 HG1 THR A 15 19.457 -10.455 0.640 1.00 0.00 H new ATOM 0 HG21 THR A 15 17.621 -10.296 2.044 1.00 0.00 H new ATOM 0 HG22 THR A 15 16.149 -10.910 1.254 1.00 0.00 H new ATOM 0 HG23 THR A 15 17.651 -11.863 1.200 1.00 0.00 H new ATOM 255 N ILE A 16 14.934 -11.873 -0.824 1.00 0.00 N ATOM 256 CA ILE A 16 13.482 -11.898 -0.834 1.00 0.00 C ATOM 257 C ILE A 16 12.935 -11.667 0.567 1.00 0.00 C ATOM 258 O ILE A 16 13.043 -12.526 1.445 1.00 0.00 O ATOM 259 CB ILE A 16 12.938 -13.216 -1.420 1.00 0.00 C ATOM 260 CG1 ILE A 16 13.501 -13.417 -2.831 1.00 0.00 C ATOM 261 CG2 ILE A 16 11.413 -13.198 -1.445 1.00 0.00 C ATOM 262 CD1 ILE A 16 12.978 -14.646 -3.537 1.00 0.00 C ATOM 0 H ILE A 16 15.375 -12.676 -0.377 1.00 0.00 H new ATOM 0 HA ILE A 16 13.143 -11.088 -1.480 1.00 0.00 H new ATOM 0 HB ILE A 16 13.254 -14.048 -0.790 1.00 0.00 H new ATOM 0 HG12 ILE A 16 13.266 -12.539 -3.432 1.00 0.00 H new ATOM 0 HG13 ILE A 16 14.587 -13.481 -2.771 1.00 0.00 H new ATOM 0 HG21 ILE A 16 11.045 -14.136 -1.861 1.00 0.00 H new ATOM 0 HG22 ILE A 16 11.034 -13.078 -0.430 1.00 0.00 H new ATOM 0 HG23 ILE A 16 11.069 -12.367 -2.061 1.00 0.00 H new ATOM 0 HD11 ILE A 16 13.426 -14.714 -4.528 1.00 0.00 H new ATOM 0 HD12 ILE A 16 13.236 -15.534 -2.960 1.00 0.00 H new ATOM 0 HD13 ILE A 16 11.894 -14.577 -3.632 1.00 0.00 H new ATOM 274 N ILE A 17 12.355 -10.494 0.766 1.00 0.00 N ATOM 275 CA ILE A 17 11.881 -10.088 2.075 1.00 0.00 C ATOM 276 C ILE A 17 10.435 -10.515 2.293 1.00 0.00 C ATOM 277 O ILE A 17 9.504 -9.899 1.770 1.00 0.00 O ATOM 278 CB ILE A 17 12.000 -8.560 2.265 1.00 0.00 C ATOM 279 CG1 ILE A 17 13.444 -8.110 2.021 1.00 0.00 C ATOM 280 CG2 ILE A 17 11.544 -8.157 3.663 1.00 0.00 C ATOM 281 CD1 ILE A 17 13.648 -6.614 2.135 1.00 0.00 C ATOM 0 H ILE A 17 12.202 -9.804 0.031 1.00 0.00 H new ATOM 0 HA ILE A 17 12.512 -10.585 2.812 1.00 0.00 H new ATOM 0 HB ILE A 17 11.353 -8.067 1.540 1.00 0.00 H new ATOM 0 HG12 ILE A 17 14.096 -8.611 2.736 1.00 0.00 H new ATOM 0 HG13 ILE A 17 13.752 -8.434 1.027 1.00 0.00 H new ATOM 0 HG21 ILE A 17 11.635 -7.077 3.778 1.00 0.00 H new ATOM 0 HG22 ILE A 17 10.504 -8.451 3.805 1.00 0.00 H new ATOM 0 HG23 ILE A 17 12.167 -8.655 4.406 1.00 0.00 H new ATOM 0 HD11 ILE A 17 14.695 -6.374 1.949 1.00 0.00 H new ATOM 0 HD12 ILE A 17 13.023 -6.105 1.401 1.00 0.00 H new ATOM 0 HD13 ILE A 17 13.373 -6.285 3.137 1.00 0.00 H new ATOM 293 N ASN A 18 10.263 -11.591 3.046 1.00 0.00 N ATOM 294 CA ASN A 18 8.941 -12.025 3.466 1.00 0.00 C ATOM 295 C ASN A 18 8.673 -11.515 4.872 1.00 0.00 C ATOM 296 O ASN A 18 9.170 -12.076 5.854 1.00 0.00 O ATOM 297 CB ASN A 18 8.818 -13.556 3.432 1.00 0.00 C ATOM 298 CG ASN A 18 8.704 -14.115 2.025 1.00 0.00 C ATOM 299 OD1 ASN A 18 7.604 -14.263 1.494 1.00 0.00 O ATOM 300 ND2 ASN A 18 9.835 -14.437 1.415 1.00 0.00 N ATOM 0 H ASN A 18 11.026 -12.181 3.379 1.00 0.00 H new ATOM 0 HA ASN A 18 8.205 -11.617 2.774 1.00 0.00 H new ATOM 0 HB2 ASN A 18 9.688 -13.995 3.921 1.00 0.00 H new ATOM 0 HB3 ASN A 18 7.943 -13.857 4.008 1.00 0.00 H new ATOM 0 HD21 ASN A 18 9.813 -14.823 0.471 1.00 0.00 H new ATOM 0 HD22 ASN A 18 10.727 -14.299 1.889 1.00 0.00 H new ATOM 307 N PHE A 19 7.904 -10.445 4.969 1.00 0.00 N ATOM 308 CA PHE A 19 7.643 -9.811 6.252 1.00 0.00 C ATOM 309 C PHE A 19 6.272 -10.205 6.781 1.00 0.00 C ATOM 310 O PHE A 19 5.375 -10.559 6.010 1.00 0.00 O ATOM 311 CB PHE A 19 7.751 -8.284 6.131 1.00 0.00 C ATOM 312 CG PHE A 19 6.779 -7.671 5.159 1.00 0.00 C ATOM 313 CD1 PHE A 19 7.097 -7.562 3.814 1.00 0.00 C ATOM 314 CD2 PHE A 19 5.546 -7.202 5.592 1.00 0.00 C ATOM 315 CE1 PHE A 19 6.206 -6.999 2.920 1.00 0.00 C ATOM 316 CE2 PHE A 19 4.653 -6.639 4.703 1.00 0.00 C ATOM 317 CZ PHE A 19 4.982 -6.539 3.365 1.00 0.00 C ATOM 0 H PHE A 19 7.448 -9.996 4.175 1.00 0.00 H new ATOM 0 HA PHE A 19 8.396 -10.157 6.960 1.00 0.00 H new ATOM 0 HB2 PHE A 19 7.592 -7.841 7.114 1.00 0.00 H new ATOM 0 HB3 PHE A 19 8.765 -8.026 5.825 1.00 0.00 H new ATOM 0 HD1 PHE A 19 8.052 -7.921 3.461 1.00 0.00 H new ATOM 0 HD2 PHE A 19 5.283 -7.279 6.637 1.00 0.00 H new ATOM 0 HE1 PHE A 19 6.466 -6.919 1.875 1.00 0.00 H new ATOM 0 HE2 PHE A 19 3.698 -6.277 5.053 1.00 0.00 H new ATOM 0 HZ PHE A 19 4.283 -6.102 2.668 1.00 0.00 H new ATOM 327 N TYR A 20 6.121 -10.159 8.096 1.00 0.00 N ATOM 328 CA TYR A 20 4.850 -10.443 8.732 1.00 0.00 C ATOM 329 C TYR A 20 4.746 -9.649 10.023 1.00 0.00 C ATOM 330 O TYR A 20 5.758 -9.158 10.520 1.00 0.00 O ATOM 331 CB TYR A 20 4.705 -11.941 9.011 1.00 0.00 C ATOM 332 CG TYR A 20 3.270 -12.375 9.203 1.00 0.00 C ATOM 333 CD1 TYR A 20 2.303 -12.016 8.279 1.00 0.00 C ATOM 334 CD2 TYR A 20 2.882 -13.136 10.298 1.00 0.00 C ATOM 335 CE1 TYR A 20 0.987 -12.397 8.434 1.00 0.00 C ATOM 336 CE2 TYR A 20 1.565 -13.526 10.460 1.00 0.00 C ATOM 337 CZ TYR A 20 0.623 -13.153 9.522 1.00 0.00 C ATOM 338 OH TYR A 20 -0.685 -13.545 9.666 1.00 0.00 O ATOM 0 H TYR A 20 6.872 -9.925 8.746 1.00 0.00 H new ATOM 0 HA TYR A 20 4.043 -10.149 8.061 1.00 0.00 H new ATOM 0 HB2 TYR A 20 5.140 -12.502 8.184 1.00 0.00 H new ATOM 0 HB3 TYR A 20 5.277 -12.195 9.903 1.00 0.00 H new ATOM 0 HD1 TYR A 20 2.585 -11.426 7.420 1.00 0.00 H new ATOM 0 HD2 TYR A 20 3.618 -13.427 11.033 1.00 0.00 H new ATOM 0 HE1 TYR A 20 0.247 -12.103 7.705 1.00 0.00 H new ATOM 0 HE2 TYR A 20 1.275 -14.119 11.315 1.00 0.00 H new ATOM 0 HH TYR A 20 -0.839 -14.365 9.152 1.00 0.00 H new ATOM 348 N SER A 21 3.528 -9.544 10.558 1.00 0.00 N ATOM 349 CA SER A 21 3.237 -8.771 11.770 1.00 0.00 C ATOM 350 C SER A 21 3.726 -7.323 11.654 1.00 0.00 C ATOM 351 O SER A 21 4.902 -7.022 11.844 1.00 0.00 O ATOM 352 CB SER A 21 3.788 -9.461 13.032 1.00 0.00 C ATOM 353 OG SER A 21 5.188 -9.694 12.966 1.00 0.00 O ATOM 0 H SER A 21 2.706 -9.998 10.159 1.00 0.00 H new ATOM 0 HA SER A 21 2.152 -8.733 11.872 1.00 0.00 H new ATOM 0 HB2 SER A 21 3.568 -8.844 13.903 1.00 0.00 H new ATOM 0 HB3 SER A 21 3.273 -10.411 13.175 1.00 0.00 H new ATOM 0 HG SER A 21 5.574 -9.165 12.237 1.00 0.00 H new ATOM 359 N THR A 22 2.787 -6.435 11.363 1.00 0.00 N ATOM 360 CA THR A 22 3.067 -5.023 11.106 1.00 0.00 C ATOM 361 C THR A 22 3.526 -4.272 12.367 1.00 0.00 C ATOM 362 O THR A 22 3.747 -3.060 12.332 1.00 0.00 O ATOM 363 CB THR A 22 1.803 -4.352 10.540 1.00 0.00 C ATOM 364 OG1 THR A 22 1.073 -5.309 9.755 1.00 0.00 O ATOM 365 CG2 THR A 22 2.156 -3.155 9.673 1.00 0.00 C ATOM 0 H THR A 22 1.797 -6.673 11.297 1.00 0.00 H new ATOM 0 HA THR A 22 3.885 -4.976 10.387 1.00 0.00 H new ATOM 0 HB THR A 22 1.195 -4.002 11.374 1.00 0.00 H new ATOM 0 HG1 THR A 22 0.266 -4.888 9.393 1.00 0.00 H new ATOM 0 HG21 THR A 22 1.242 -2.703 9.288 1.00 0.00 H new ATOM 0 HG22 THR A 22 2.701 -2.422 10.269 1.00 0.00 H new ATOM 0 HG23 THR A 22 2.779 -3.480 8.840 1.00 0.00 H new ATOM 373 N SER A 23 3.662 -5.001 13.470 1.00 0.00 N ATOM 374 CA SER A 23 4.009 -4.420 14.762 1.00 0.00 C ATOM 375 C SER A 23 5.318 -3.620 14.731 1.00 0.00 C ATOM 376 O SER A 23 5.426 -2.585 15.393 1.00 0.00 O ATOM 377 CB SER A 23 4.079 -5.528 15.812 1.00 0.00 C ATOM 378 OG SER A 23 4.599 -6.727 15.255 1.00 0.00 O ATOM 0 H SER A 23 3.535 -6.013 13.493 1.00 0.00 H new ATOM 0 HA SER A 23 3.226 -3.707 15.021 1.00 0.00 H new ATOM 0 HB2 SER A 23 4.707 -5.207 16.643 1.00 0.00 H new ATOM 0 HB3 SER A 23 3.084 -5.713 16.217 1.00 0.00 H new ATOM 0 HG SER A 23 4.636 -7.420 15.947 1.00 0.00 H new ATOM 384 N ASP A 24 6.306 -4.077 13.967 1.00 0.00 N ATOM 385 CA ASP A 24 7.581 -3.364 13.894 1.00 0.00 C ATOM 386 C ASP A 24 7.572 -2.383 12.727 1.00 0.00 C ATOM 387 O ASP A 24 6.715 -2.456 11.845 1.00 0.00 O ATOM 388 CB ASP A 24 8.767 -4.331 13.781 1.00 0.00 C ATOM 389 CG ASP A 24 8.884 -4.990 12.422 1.00 0.00 C ATOM 390 OD1 ASP A 24 8.214 -6.015 12.196 1.00 0.00 O ATOM 391 OD2 ASP A 24 9.670 -4.499 11.587 1.00 0.00 O ATOM 0 H ASP A 24 6.253 -4.922 13.398 1.00 0.00 H new ATOM 0 HA ASP A 24 7.704 -2.806 14.822 1.00 0.00 H new ATOM 0 HB2 ASP A 24 9.689 -3.789 13.993 1.00 0.00 H new ATOM 0 HB3 ASP A 24 8.669 -5.104 14.543 1.00 0.00 H new ATOM 396 N ASP A 25 8.533 -1.471 12.723 1.00 0.00 N ATOM 397 CA ASP A 25 8.537 -0.365 11.769 1.00 0.00 C ATOM 398 C ASP A 25 9.119 -0.763 10.413 1.00 0.00 C ATOM 399 O ASP A 25 9.215 0.067 9.514 1.00 0.00 O ATOM 400 CB ASP A 25 9.288 0.841 12.348 1.00 0.00 C ATOM 401 CG ASP A 25 10.670 0.501 12.876 1.00 0.00 C ATOM 402 OD1 ASP A 25 10.756 -0.145 13.944 1.00 0.00 O ATOM 403 OD2 ASP A 25 11.669 0.897 12.243 1.00 0.00 O ATOM 0 H ASP A 25 9.322 -1.473 13.369 1.00 0.00 H new ATOM 0 HA ASP A 25 7.497 -0.087 11.597 1.00 0.00 H new ATOM 0 HB2 ASP A 25 9.381 1.605 11.576 1.00 0.00 H new ATOM 0 HB3 ASP A 25 8.696 1.273 13.155 1.00 0.00 H new ATOM 408 N TYR A 26 9.493 -2.027 10.258 1.00 0.00 N ATOM 409 CA TYR A 26 9.956 -2.521 8.967 1.00 0.00 C ATOM 410 C TYR A 26 8.836 -3.299 8.277 1.00 0.00 C ATOM 411 O TYR A 26 8.977 -3.744 7.138 1.00 0.00 O ATOM 412 CB TYR A 26 11.180 -3.418 9.154 1.00 0.00 C ATOM 413 CG TYR A 26 12.264 -3.208 8.123 1.00 0.00 C ATOM 414 CD1 TYR A 26 12.264 -3.907 6.922 1.00 0.00 C ATOM 415 CD2 TYR A 26 13.296 -2.313 8.361 1.00 0.00 C ATOM 416 CE1 TYR A 26 13.268 -3.720 5.990 1.00 0.00 C ATOM 417 CE2 TYR A 26 14.301 -2.120 7.437 1.00 0.00 C ATOM 418 CZ TYR A 26 14.281 -2.823 6.253 1.00 0.00 C ATOM 419 OH TYR A 26 15.288 -2.630 5.335 1.00 0.00 O ATOM 0 H TYR A 26 9.485 -2.724 11.003 1.00 0.00 H new ATOM 0 HA TYR A 26 10.236 -1.672 8.343 1.00 0.00 H new ATOM 0 HB2 TYR A 26 11.598 -3.242 10.145 1.00 0.00 H new ATOM 0 HB3 TYR A 26 10.861 -4.460 9.123 1.00 0.00 H new ATOM 0 HD1 TYR A 26 11.468 -4.607 6.714 1.00 0.00 H new ATOM 0 HD2 TYR A 26 13.313 -1.757 9.287 1.00 0.00 H new ATOM 0 HE1 TYR A 26 13.259 -4.273 5.062 1.00 0.00 H new ATOM 0 HE2 TYR A 26 15.099 -1.422 7.641 1.00 0.00 H new ATOM 0 HH TYR A 26 15.402 -1.670 5.172 1.00 0.00 H new ATOM 429 N GLY A 27 7.726 -3.459 8.984 1.00 0.00 N ATOM 430 CA GLY A 27 6.591 -4.198 8.461 1.00 0.00 C ATOM 431 C GLY A 27 5.576 -3.303 7.775 1.00 0.00 C ATOM 432 O GLY A 27 4.549 -3.781 7.285 1.00 0.00 O ATOM 0 H GLY A 27 7.590 -3.085 9.923 1.00 0.00 H new ATOM 0 HA2 GLY A 27 6.945 -4.948 7.753 1.00 0.00 H new ATOM 0 HA3 GLY A 27 6.105 -4.734 9.276 1.00 0.00 H new ATOM 436 N ASP A 28 5.860 -2.003 7.755 1.00 0.00 N ATOM 437 CA ASP A 28 4.917 -0.990 7.265 1.00 0.00 C ATOM 438 C ASP A 28 4.494 -1.243 5.817 1.00 0.00 C ATOM 439 O ASP A 28 3.447 -0.757 5.382 1.00 0.00 O ATOM 440 CB ASP A 28 5.533 0.411 7.369 1.00 0.00 C ATOM 441 CG ASP A 28 6.092 0.900 6.043 1.00 0.00 C ATOM 442 OD1 ASP A 28 7.164 0.424 5.634 1.00 0.00 O ATOM 443 OD2 ASP A 28 5.433 1.752 5.401 1.00 0.00 O ATOM 0 H ASP A 28 6.748 -1.618 8.077 1.00 0.00 H new ATOM 0 HA ASP A 28 4.030 -1.057 7.895 1.00 0.00 H new ATOM 0 HB2 ASP A 28 4.776 1.112 7.721 1.00 0.00 H new ATOM 0 HB3 ASP A 28 6.329 0.400 8.114 1.00 0.00 H new ATOM 448 N PHE A 29 5.306 -1.995 5.082 1.00 0.00 N ATOM 449 CA PHE A 29 5.052 -2.282 3.668 1.00 0.00 C ATOM 450 C PHE A 29 3.675 -2.902 3.444 1.00 0.00 C ATOM 451 O PHE A 29 3.137 -2.845 2.339 1.00 0.00 O ATOM 452 CB PHE A 29 6.127 -3.215 3.113 1.00 0.00 C ATOM 453 CG PHE A 29 7.495 -2.602 3.075 1.00 0.00 C ATOM 454 CD1 PHE A 29 7.905 -1.877 1.973 1.00 0.00 C ATOM 455 CD2 PHE A 29 8.368 -2.751 4.139 1.00 0.00 C ATOM 456 CE1 PHE A 29 9.161 -1.312 1.929 1.00 0.00 C ATOM 457 CE2 PHE A 29 9.626 -2.187 4.102 1.00 0.00 C ATOM 458 CZ PHE A 29 10.023 -1.465 2.997 1.00 0.00 C ATOM 0 H PHE A 29 6.158 -2.423 5.445 1.00 0.00 H new ATOM 0 HA PHE A 29 5.081 -1.329 3.140 1.00 0.00 H new ATOM 0 HB2 PHE A 29 6.160 -4.119 3.721 1.00 0.00 H new ATOM 0 HB3 PHE A 29 5.846 -3.519 2.105 1.00 0.00 H new ATOM 0 HD1 PHE A 29 7.234 -1.752 1.136 1.00 0.00 H new ATOM 0 HD2 PHE A 29 8.061 -3.315 5.007 1.00 0.00 H new ATOM 0 HE1 PHE A 29 9.471 -0.750 1.060 1.00 0.00 H new ATOM 0 HE2 PHE A 29 10.299 -2.311 4.938 1.00 0.00 H new ATOM 0 HZ PHE A 29 11.006 -1.020 2.966 1.00 0.00 H new ATOM 468 N SER A 30 3.114 -3.493 4.491 1.00 0.00 N ATOM 469 CA SER A 30 1.794 -4.090 4.409 1.00 0.00 C ATOM 470 C SER A 30 0.744 -3.025 4.086 1.00 0.00 C ATOM 471 O SER A 30 0.809 -1.896 4.579 1.00 0.00 O ATOM 472 CB SER A 30 1.453 -4.799 5.721 1.00 0.00 C ATOM 473 OG SER A 30 0.240 -5.518 5.610 1.00 0.00 O ATOM 0 H SER A 30 3.556 -3.570 5.407 1.00 0.00 H new ATOM 0 HA SER A 30 1.793 -4.826 3.605 1.00 0.00 H new ATOM 0 HB2 SER A 30 2.260 -5.480 5.990 1.00 0.00 H new ATOM 0 HB3 SER A 30 1.373 -4.066 6.524 1.00 0.00 H new ATOM 0 HG SER A 30 0.162 -5.891 4.707 1.00 0.00 H new ATOM 479 N ASN A 31 -0.226 -3.387 3.260 1.00 0.00 N ATOM 480 CA ASN A 31 -1.264 -2.447 2.843 1.00 0.00 C ATOM 481 C ASN A 31 -2.243 -2.182 3.983 1.00 0.00 C ATOM 482 O ASN A 31 -2.920 -1.153 4.007 1.00 0.00 O ATOM 483 CB ASN A 31 -2.011 -2.968 1.610 1.00 0.00 C ATOM 484 CG ASN A 31 -2.814 -4.224 1.888 1.00 0.00 C ATOM 485 OD1 ASN A 31 -2.182 -5.374 1.731 1.00 0.00 O flip ATOM 486 ND2 ASN A 31 -3.993 -4.160 2.242 1.00 0.00 N flip ATOM 0 H ASN A 31 -0.319 -4.322 2.864 1.00 0.00 H new ATOM 0 HA ASN A 31 -0.778 -1.508 2.578 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -2.680 -2.190 1.242 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -1.292 -3.172 0.816 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -4.444 -3.252 2.351 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -4.518 -5.015 2.425 1.00 0.00 H new ATOM 493 N PHE A 32 -2.292 -3.103 4.940 1.00 0.00 N ATOM 494 CA PHE A 32 -3.198 -2.985 6.077 1.00 0.00 C ATOM 495 C PHE A 32 -2.509 -2.252 7.231 1.00 0.00 C ATOM 496 O PHE A 32 -3.056 -2.132 8.326 1.00 0.00 O ATOM 497 CB PHE A 32 -3.657 -4.384 6.515 1.00 0.00 C ATOM 498 CG PHE A 32 -4.877 -4.399 7.403 1.00 0.00 C ATOM 499 CD1 PHE A 32 -6.142 -4.210 6.868 1.00 0.00 C ATOM 500 CD2 PHE A 32 -4.759 -4.618 8.767 1.00 0.00 C ATOM 501 CE1 PHE A 32 -7.265 -4.240 7.674 1.00 0.00 C ATOM 502 CE2 PHE A 32 -5.877 -4.647 9.578 1.00 0.00 C ATOM 503 CZ PHE A 32 -7.132 -4.458 9.031 1.00 0.00 C ATOM 0 H PHE A 32 -1.713 -3.942 4.950 1.00 0.00 H new ATOM 0 HA PHE A 32 -4.072 -2.404 5.783 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -3.865 -4.978 5.625 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -2.836 -4.873 7.040 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -6.252 -4.037 5.808 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -3.781 -4.768 9.201 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -8.244 -4.093 7.243 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -5.770 -4.817 10.639 1.00 0.00 H new ATOM 0 HZ PHE A 32 -8.007 -4.481 9.664 1.00 0.00 H new ATOM 513 N ALA A 33 -1.304 -1.753 6.973 1.00 0.00 N ATOM 514 CA ALA A 33 -0.538 -1.039 7.988 1.00 0.00 C ATOM 515 C ALA A 33 -1.246 0.244 8.405 1.00 0.00 C ATOM 516 O ALA A 33 -1.749 0.988 7.562 1.00 0.00 O ATOM 517 CB ALA A 33 0.860 -0.729 7.477 1.00 0.00 C ATOM 0 H ALA A 33 -0.837 -1.830 6.069 1.00 0.00 H new ATOM 0 HA ALA A 33 -0.457 -1.682 8.864 1.00 0.00 H new ATOM 0 HB1 ALA A 33 1.419 -0.196 8.246 1.00 0.00 H new ATOM 0 HB2 ALA A 33 1.373 -1.659 7.235 1.00 0.00 H new ATOM 0 HB3 ALA A 33 0.791 -0.109 6.583 1.00 0.00 H new ATOM 523 N ALA A 34 -1.260 0.505 9.707 1.00 0.00 N ATOM 524 CA ALA A 34 -1.961 1.655 10.258 1.00 0.00 C ATOM 525 C ALA A 34 -1.093 2.907 10.201 1.00 0.00 C ATOM 526 O ALA A 34 -0.769 3.508 11.226 1.00 0.00 O ATOM 527 CB ALA A 34 -2.404 1.368 11.688 1.00 0.00 C ATOM 0 H ALA A 34 -0.789 -0.071 10.405 1.00 0.00 H new ATOM 0 HA ALA A 34 -2.847 1.838 9.650 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -2.927 2.237 12.088 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -3.072 0.507 11.696 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -1.530 1.155 12.304 1.00 0.00 H new ATOM 533 N TRP A 35 -0.701 3.275 8.998 1.00 0.00 N ATOM 534 CA TRP A 35 0.068 4.488 8.785 1.00 0.00 C ATOM 535 C TRP A 35 -0.769 5.504 8.022 1.00 0.00 C ATOM 536 O TRP A 35 -1.113 5.286 6.861 1.00 0.00 O ATOM 537 CB TRP A 35 1.365 4.188 8.032 1.00 0.00 C ATOM 538 CG TRP A 35 2.391 3.481 8.869 1.00 0.00 C ATOM 539 CD1 TRP A 35 2.499 2.137 9.078 1.00 0.00 C ATOM 540 CD2 TRP A 35 3.453 4.090 9.612 1.00 0.00 C ATOM 541 NE1 TRP A 35 3.563 1.872 9.906 1.00 0.00 N ATOM 542 CE2 TRP A 35 4.165 3.055 10.246 1.00 0.00 C ATOM 543 CE3 TRP A 35 3.873 5.410 9.801 1.00 0.00 C ATOM 544 CZ2 TRP A 35 5.271 3.301 11.056 1.00 0.00 C ATOM 545 CZ3 TRP A 35 4.970 5.652 10.605 1.00 0.00 C ATOM 546 CH2 TRP A 35 5.659 4.602 11.223 1.00 0.00 C ATOM 0 H TRP A 35 -0.903 2.749 8.148 1.00 0.00 H new ATOM 0 HA TRP A 35 0.334 4.905 9.756 1.00 0.00 H new ATOM 0 HB2 TRP A 35 1.136 3.577 7.159 1.00 0.00 H new ATOM 0 HB3 TRP A 35 1.788 5.123 7.665 1.00 0.00 H new ATOM 0 HD1 TRP A 35 1.844 1.390 8.654 1.00 0.00 H new ATOM 0 HE1 TRP A 35 3.857 0.946 10.217 1.00 0.00 H new ATOM 0 HE3 TRP A 35 3.349 6.226 9.327 1.00 0.00 H new ATOM 0 HZ2 TRP A 35 5.804 2.493 11.535 1.00 0.00 H new ATOM 0 HZ3 TRP A 35 5.301 6.668 10.759 1.00 0.00 H new ATOM 0 HH2 TRP A 35 6.514 4.824 11.844 1.00 0.00 H new ATOM 557 N PRO A 36 -1.115 6.620 8.682 1.00 0.00 N ATOM 558 CA PRO A 36 -1.977 7.660 8.109 1.00 0.00 C ATOM 559 C PRO A 36 -1.439 8.215 6.796 1.00 0.00 C ATOM 560 O PRO A 36 -0.289 8.665 6.716 1.00 0.00 O ATOM 561 CB PRO A 36 -1.988 8.753 9.181 1.00 0.00 C ATOM 562 CG PRO A 36 -1.653 8.044 10.444 1.00 0.00 C ATOM 563 CD PRO A 36 -0.697 6.953 10.055 1.00 0.00 C ATOM 0 HA PRO A 36 -2.965 7.269 7.867 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -1.260 9.533 8.959 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -2.963 9.236 9.244 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -1.200 8.723 11.166 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -2.548 7.633 10.911 1.00 0.00 H new ATOM 0 HD2 PRO A 36 0.338 7.292 10.091 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -0.774 6.093 10.720 1.00 0.00 H new ATOM 571 N ILE A 37 -2.279 8.172 5.776 1.00 0.00 N ATOM 572 CA ILE A 37 -1.929 8.677 4.463 1.00 0.00 C ATOM 573 C ILE A 37 -2.815 9.858 4.087 1.00 0.00 C ATOM 574 O ILE A 37 -3.986 9.919 4.469 1.00 0.00 O ATOM 575 CB ILE A 37 -2.042 7.583 3.377 1.00 0.00 C ATOM 576 CG1 ILE A 37 -3.424 6.923 3.413 1.00 0.00 C ATOM 577 CG2 ILE A 37 -0.951 6.541 3.563 1.00 0.00 C ATOM 578 CD1 ILE A 37 -3.653 5.920 2.299 1.00 0.00 C ATOM 0 H ILE A 37 -3.221 7.786 5.836 1.00 0.00 H new ATOM 0 HA ILE A 37 -0.890 9.003 4.514 1.00 0.00 H new ATOM 0 HB ILE A 37 -1.914 8.053 2.402 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -3.552 6.422 4.372 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -4.188 7.698 3.354 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.043 5.777 2.791 1.00 0.00 H new ATOM 0 HG22 ILE A 37 0.026 7.019 3.486 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -1.053 6.079 4.545 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -4.653 5.496 2.391 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -3.559 6.419 1.335 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -2.913 5.123 2.369 1.00 0.00 H new ATOM 590 N LYS A 38 -2.249 10.798 3.352 1.00 0.00 N ATOM 591 CA LYS A 38 -2.984 11.973 2.920 1.00 0.00 C ATOM 592 C LYS A 38 -3.224 11.896 1.418 1.00 0.00 C ATOM 593 O LYS A 38 -2.309 12.118 0.625 1.00 0.00 O ATOM 594 CB LYS A 38 -2.199 13.239 3.277 1.00 0.00 C ATOM 595 CG LYS A 38 -3.002 14.524 3.168 1.00 0.00 C ATOM 596 CD LYS A 38 -4.180 14.528 4.127 1.00 0.00 C ATOM 597 CE LYS A 38 -4.778 15.918 4.266 1.00 0.00 C ATOM 598 NZ LYS A 38 -5.986 15.921 5.131 1.00 0.00 N ATOM 0 H LYS A 38 -1.278 10.770 3.041 1.00 0.00 H new ATOM 0 HA LYS A 38 -3.947 12.010 3.429 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -1.823 13.144 4.296 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -1.330 13.311 2.622 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -2.357 15.377 3.379 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -3.363 14.643 2.146 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -4.943 13.836 3.771 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -3.856 14.170 5.104 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -4.032 16.594 4.684 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -5.038 16.301 3.279 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -5.905 16.679 5.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -6.831 16.082 4.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -6.069 15.004 5.615 1.00 0.00 H new ATOM 612 N VAL A 39 -4.447 11.551 1.034 1.00 0.00 N ATOM 613 CA VAL A 39 -4.774 11.349 -0.370 1.00 0.00 C ATOM 614 C VAL A 39 -5.917 12.261 -0.793 1.00 0.00 C ATOM 615 O VAL A 39 -6.988 12.244 -0.180 1.00 0.00 O ATOM 616 CB VAL A 39 -5.177 9.888 -0.661 1.00 0.00 C ATOM 617 CG1 VAL A 39 -5.212 9.636 -2.158 1.00 0.00 C ATOM 618 CG2 VAL A 39 -4.236 8.914 0.030 1.00 0.00 C ATOM 0 H VAL A 39 -5.227 11.406 1.675 1.00 0.00 H new ATOM 0 HA VAL A 39 -3.875 11.587 -0.939 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.178 9.724 -0.261 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -5.498 8.601 -2.346 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -5.938 10.303 -2.622 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -4.225 9.823 -2.582 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -4.543 7.892 -0.192 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -3.219 9.074 -0.329 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -4.270 9.077 1.107 1.00 0.00 H new ATOM 628 N ASP A 40 -5.669 13.060 -1.830 1.00 0.00 N ATOM 629 CA ASP A 40 -6.669 13.975 -2.389 1.00 0.00 C ATOM 630 C ASP A 40 -7.145 14.975 -1.340 1.00 0.00 C ATOM 631 O ASP A 40 -8.245 15.522 -1.438 1.00 0.00 O ATOM 632 CB ASP A 40 -7.871 13.207 -2.962 1.00 0.00 C ATOM 633 CG ASP A 40 -7.499 12.288 -4.109 1.00 0.00 C ATOM 634 OD1 ASP A 40 -7.023 12.783 -5.154 1.00 0.00 O ATOM 635 OD2 ASP A 40 -7.693 11.063 -3.981 1.00 0.00 O ATOM 0 H ASP A 40 -4.769 13.093 -2.308 1.00 0.00 H new ATOM 0 HA ASP A 40 -6.189 14.521 -3.201 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -8.331 12.619 -2.168 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -8.620 13.921 -3.305 1.00 0.00 H new ATOM 640 N GLY A 41 -6.303 15.224 -0.348 1.00 0.00 N ATOM 641 CA GLY A 41 -6.656 16.146 0.712 1.00 0.00 C ATOM 642 C GLY A 41 -7.346 15.466 1.880 1.00 0.00 C ATOM 643 O GLY A 41 -7.625 16.100 2.897 1.00 0.00 O ATOM 0 H GLY A 41 -5.379 14.803 -0.258 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -5.754 16.644 1.069 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -7.310 16.920 0.311 1.00 0.00 H new ATOM 647 N LYS A 42 -7.608 14.174 1.756 1.00 0.00 N ATOM 648 CA LYS A 42 -8.294 13.438 2.810 1.00 0.00 C ATOM 649 C LYS A 42 -7.317 12.568 3.585 1.00 0.00 C ATOM 650 O LYS A 42 -6.419 11.956 3.006 1.00 0.00 O ATOM 651 CB LYS A 42 -9.426 12.586 2.227 1.00 0.00 C ATOM 652 CG LYS A 42 -10.580 13.412 1.682 1.00 0.00 C ATOM 653 CD LYS A 42 -11.659 12.537 1.067 1.00 0.00 C ATOM 654 CE LYS A 42 -12.871 13.356 0.648 1.00 0.00 C ATOM 655 NZ LYS A 42 -12.524 14.412 -0.340 1.00 0.00 N ATOM 0 H LYS A 42 -7.358 13.614 0.941 1.00 0.00 H new ATOM 0 HA LYS A 42 -8.729 14.161 3.500 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -9.027 11.961 1.428 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -9.801 11.915 3.000 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -11.011 14.009 2.486 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -10.206 14.109 0.932 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -11.255 12.014 0.200 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -11.964 11.775 1.785 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -13.624 12.694 0.220 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -13.317 13.818 1.529 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -13.395 14.853 -0.697 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -11.932 15.135 0.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -12.001 13.988 -1.132 1.00 0.00 H new ATOM 669 N THR A 43 -7.481 12.543 4.898 1.00 0.00 N ATOM 670 CA THR A 43 -6.620 11.755 5.765 1.00 0.00 C ATOM 671 C THR A 43 -7.201 10.356 5.966 1.00 0.00 C ATOM 672 O THR A 43 -8.276 10.194 6.553 1.00 0.00 O ATOM 673 CB THR A 43 -6.452 12.436 7.137 1.00 0.00 C ATOM 674 OG1 THR A 43 -6.248 13.848 6.966 1.00 0.00 O ATOM 675 CG2 THR A 43 -5.273 11.843 7.896 1.00 0.00 C ATOM 0 H THR A 43 -8.208 13.063 5.389 1.00 0.00 H new ATOM 0 HA THR A 43 -5.645 11.678 5.284 1.00 0.00 H new ATOM 0 HB THR A 43 -7.362 12.266 7.713 1.00 0.00 H new ATOM 0 HG1 THR A 43 -5.293 14.052 7.045 1.00 0.00 H new ATOM 0 HG21 THR A 43 -5.175 12.340 8.861 1.00 0.00 H new ATOM 0 HG22 THR A 43 -5.440 10.777 8.052 1.00 0.00 H new ATOM 0 HG23 THR A 43 -4.359 11.987 7.319 1.00 0.00 H new ATOM 683 N TRP A 44 -6.497 9.354 5.466 1.00 0.00 N ATOM 684 CA TRP A 44 -6.928 7.972 5.599 1.00 0.00 C ATOM 685 C TRP A 44 -6.024 7.241 6.587 1.00 0.00 C ATOM 686 O TRP A 44 -4.803 7.320 6.482 1.00 0.00 O ATOM 687 CB TRP A 44 -6.895 7.262 4.239 1.00 0.00 C ATOM 688 CG TRP A 44 -7.617 8.007 3.155 1.00 0.00 C ATOM 689 CD1 TRP A 44 -7.076 8.912 2.289 1.00 0.00 C ATOM 690 CD2 TRP A 44 -9.006 7.909 2.817 1.00 0.00 C ATOM 691 NE1 TRP A 44 -8.042 9.389 1.439 1.00 0.00 N ATOM 692 CE2 TRP A 44 -9.234 8.785 1.738 1.00 0.00 C ATOM 693 CE3 TRP A 44 -10.077 7.164 3.316 1.00 0.00 C ATOM 694 CZ2 TRP A 44 -10.488 8.939 1.158 1.00 0.00 C ATOM 695 CZ3 TRP A 44 -11.322 7.318 2.737 1.00 0.00 C ATOM 696 CH2 TRP A 44 -11.517 8.198 1.665 1.00 0.00 C ATOM 0 H TRP A 44 -5.619 9.473 4.961 1.00 0.00 H new ATOM 0 HA TRP A 44 -7.953 7.962 5.971 1.00 0.00 H new ATOM 0 HB2 TRP A 44 -5.857 7.117 3.939 1.00 0.00 H new ATOM 0 HB3 TRP A 44 -7.338 6.272 4.345 1.00 0.00 H new ATOM 0 HD1 TRP A 44 -6.038 9.210 2.275 1.00 0.00 H new ATOM 0 HE1 TRP A 44 -7.896 10.081 0.704 1.00 0.00 H new ATOM 0 HE3 TRP A 44 -9.934 6.480 4.140 1.00 0.00 H new ATOM 0 HZ2 TRP A 44 -10.643 9.621 0.335 1.00 0.00 H new ATOM 0 HZ3 TRP A 44 -12.159 6.751 3.117 1.00 0.00 H new ATOM 0 HH2 TRP A 44 -12.501 8.292 1.230 1.00 0.00 H new ATOM 707 N PRO A 45 -6.610 6.530 7.562 1.00 0.00 N ATOM 708 CA PRO A 45 -5.843 5.811 8.588 1.00 0.00 C ATOM 709 C PRO A 45 -5.026 4.660 8.006 1.00 0.00 C ATOM 710 O PRO A 45 -3.974 4.303 8.533 1.00 0.00 O ATOM 711 CB PRO A 45 -6.919 5.263 9.538 1.00 0.00 C ATOM 712 CG PRO A 45 -8.162 6.019 9.208 1.00 0.00 C ATOM 713 CD PRO A 45 -8.057 6.382 7.755 1.00 0.00 C ATOM 0 HA PRO A 45 -5.119 6.465 9.074 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -7.061 4.192 9.394 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -6.635 5.410 10.580 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -9.048 5.412 9.395 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -8.251 6.912 9.827 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -8.474 5.606 7.113 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -8.592 7.304 7.529 1.00 0.00 H new ATOM 721 N THR A 46 -5.518 4.094 6.913 1.00 0.00 N ATOM 722 CA THR A 46 -4.884 2.950 6.273 1.00 0.00 C ATOM 723 C THR A 46 -5.107 3.006 4.769 1.00 0.00 C ATOM 724 O THR A 46 -6.005 3.711 4.297 1.00 0.00 O ATOM 725 CB THR A 46 -5.454 1.619 6.801 1.00 0.00 C ATOM 726 OG1 THR A 46 -6.883 1.680 6.790 1.00 0.00 O ATOM 727 CG2 THR A 46 -4.963 1.315 8.208 1.00 0.00 C ATOM 0 H THR A 46 -6.366 4.414 6.446 1.00 0.00 H new ATOM 0 HA THR A 46 -3.820 2.996 6.504 1.00 0.00 H new ATOM 0 HB THR A 46 -5.106 0.818 6.149 1.00 0.00 H new ATOM 0 HG1 THR A 46 -7.250 0.774 6.856 1.00 0.00 H new ATOM 0 HG21 THR A 46 -5.387 0.369 8.545 1.00 0.00 H new ATOM 0 HG22 THR A 46 -3.875 1.245 8.207 1.00 0.00 H new ATOM 0 HG23 THR A 46 -5.275 2.113 8.882 1.00 0.00 H new ATOM 735 N SER A 47 -4.312 2.252 4.024 1.00 0.00 N ATOM 736 CA SER A 47 -4.452 2.189 2.575 1.00 0.00 C ATOM 737 C SER A 47 -5.773 1.520 2.190 1.00 0.00 C ATOM 738 O SER A 47 -6.373 1.842 1.161 1.00 0.00 O ATOM 739 CB SER A 47 -3.280 1.408 1.979 1.00 0.00 C ATOM 740 OG SER A 47 -2.058 1.772 2.603 1.00 0.00 O ATOM 0 H SER A 47 -3.561 1.673 4.400 1.00 0.00 H new ATOM 0 HA SER A 47 -4.451 3.204 2.179 1.00 0.00 H new ATOM 0 HB2 SER A 47 -3.451 0.338 2.102 1.00 0.00 H new ATOM 0 HB3 SER A 47 -3.217 1.600 0.908 1.00 0.00 H new ATOM 0 HG SER A 47 -1.323 1.259 2.207 1.00 0.00 H new ATOM 746 N GLU A 48 -6.229 0.606 3.044 1.00 0.00 N ATOM 747 CA GLU A 48 -7.440 -0.165 2.790 1.00 0.00 C ATOM 748 C GLU A 48 -8.681 0.733 2.741 1.00 0.00 C ATOM 749 O GLU A 48 -9.636 0.436 2.024 1.00 0.00 O ATOM 750 CB GLU A 48 -7.567 -1.292 3.837 1.00 0.00 C ATOM 751 CG GLU A 48 -8.929 -1.430 4.512 1.00 0.00 C ATOM 752 CD GLU A 48 -9.124 -0.438 5.641 1.00 0.00 C ATOM 753 OE1 GLU A 48 -8.285 -0.418 6.566 1.00 0.00 O ATOM 754 OE2 GLU A 48 -10.106 0.329 5.605 1.00 0.00 O ATOM 0 H GLU A 48 -5.771 0.381 3.927 1.00 0.00 H new ATOM 0 HA GLU A 48 -7.366 -0.627 1.805 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -7.326 -2.239 3.353 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -6.816 -1.129 4.610 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -9.714 -1.288 3.769 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -9.037 -2.443 4.901 1.00 0.00 H new ATOM 761 N HIS A 49 -8.652 1.848 3.468 1.00 0.00 N ATOM 762 CA HIS A 49 -9.788 2.768 3.480 1.00 0.00 C ATOM 763 C HIS A 49 -9.970 3.422 2.117 1.00 0.00 C ATOM 764 O HIS A 49 -11.090 3.552 1.628 1.00 0.00 O ATOM 765 CB HIS A 49 -9.630 3.846 4.556 1.00 0.00 C ATOM 766 CG HIS A 49 -10.066 3.414 5.925 1.00 0.00 C ATOM 767 ND1 HIS A 49 -9.208 2.871 6.855 1.00 0.00 N ATOM 768 CD2 HIS A 49 -11.278 3.470 6.532 1.00 0.00 C ATOM 769 CE1 HIS A 49 -9.869 2.618 7.966 1.00 0.00 C ATOM 770 NE2 HIS A 49 -11.123 2.972 7.798 1.00 0.00 N ATOM 0 H HIS A 49 -7.865 2.134 4.050 1.00 0.00 H new ATOM 0 HA HIS A 49 -10.675 2.180 3.714 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -8.584 4.151 4.599 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -10.206 4.724 4.263 1.00 0.00 H new ATOM 0 HD1 HIS A 49 -8.215 2.692 6.707 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -12.195 3.839 6.097 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -9.450 2.191 8.865 1.00 0.00 H new ATOM 779 N TYR A 50 -8.868 3.816 1.494 1.00 0.00 N ATOM 780 CA TYR A 50 -8.930 4.440 0.179 1.00 0.00 C ATOM 781 C TYR A 50 -9.314 3.395 -0.863 1.00 0.00 C ATOM 782 O TYR A 50 -10.086 3.661 -1.783 1.00 0.00 O ATOM 783 CB TYR A 50 -7.590 5.088 -0.178 1.00 0.00 C ATOM 784 CG TYR A 50 -7.665 6.010 -1.375 1.00 0.00 C ATOM 785 CD1 TYR A 50 -8.366 7.205 -1.300 1.00 0.00 C ATOM 786 CD2 TYR A 50 -7.043 5.688 -2.576 1.00 0.00 C ATOM 787 CE1 TYR A 50 -8.446 8.055 -2.383 1.00 0.00 C ATOM 788 CE2 TYR A 50 -7.117 6.536 -3.666 1.00 0.00 C ATOM 789 CZ TYR A 50 -7.820 7.719 -3.564 1.00 0.00 C ATOM 790 OH TYR A 50 -7.899 8.572 -4.643 1.00 0.00 O ATOM 0 H TYR A 50 -7.927 3.716 1.874 1.00 0.00 H new ATOM 0 HA TYR A 50 -9.687 5.224 0.195 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -7.227 5.651 0.682 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -6.859 4.305 -0.378 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -8.858 7.474 -0.377 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -6.494 4.762 -2.659 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -8.997 8.981 -2.306 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -6.627 6.274 -4.592 1.00 0.00 H new ATOM 0 HH TYR A 50 -8.291 9.424 -4.358 1.00 0.00 H new ATOM 800 N PHE A 51 -8.786 2.193 -0.682 1.00 0.00 N ATOM 801 CA PHE A 51 -9.102 1.062 -1.545 1.00 0.00 C ATOM 802 C PHE A 51 -10.597 0.738 -1.478 1.00 0.00 C ATOM 803 O PHE A 51 -11.240 0.433 -2.491 1.00 0.00 O ATOM 804 CB PHE A 51 -8.258 -0.142 -1.103 1.00 0.00 C ATOM 805 CG PHE A 51 -8.391 -1.365 -1.966 1.00 0.00 C ATOM 806 CD1 PHE A 51 -7.784 -1.422 -3.210 1.00 0.00 C ATOM 807 CD2 PHE A 51 -9.109 -2.464 -1.524 1.00 0.00 C ATOM 808 CE1 PHE A 51 -7.893 -2.553 -3.998 1.00 0.00 C ATOM 809 CE2 PHE A 51 -9.220 -3.599 -2.306 1.00 0.00 C ATOM 810 CZ PHE A 51 -8.611 -3.643 -3.545 1.00 0.00 C ATOM 0 H PHE A 51 -8.128 1.974 0.066 1.00 0.00 H new ATOM 0 HA PHE A 51 -8.867 1.308 -2.580 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -7.210 0.157 -1.082 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -8.535 -0.405 -0.082 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -7.220 -0.574 -3.568 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -9.588 -2.434 -0.557 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -7.417 -2.584 -4.967 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -9.782 -4.449 -1.949 1.00 0.00 H new ATOM 0 HZ PHE A 51 -8.696 -4.528 -4.158 1.00 0.00 H new ATOM 820 N GLN A 52 -11.148 0.818 -0.275 1.00 0.00 N ATOM 821 CA GLN A 52 -12.553 0.535 -0.051 1.00 0.00 C ATOM 822 C GLN A 52 -13.425 1.655 -0.616 1.00 0.00 C ATOM 823 O GLN A 52 -14.411 1.399 -1.302 1.00 0.00 O ATOM 824 CB GLN A 52 -12.807 0.368 1.447 1.00 0.00 C ATOM 825 CG GLN A 52 -14.051 -0.439 1.786 1.00 0.00 C ATOM 826 CD GLN A 52 -13.948 -1.894 1.359 1.00 0.00 C ATOM 827 OE1 GLN A 52 -13.326 -2.225 0.349 1.00 0.00 O ATOM 828 NE2 GLN A 52 -14.532 -2.780 2.145 1.00 0.00 N ATOM 0 H GLN A 52 -10.635 1.080 0.567 1.00 0.00 H new ATOM 0 HA GLN A 52 -12.814 -0.390 -0.566 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -11.941 -0.115 1.899 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -12.894 1.355 1.901 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -14.226 -0.393 2.861 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -14.916 0.016 1.303 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -15.039 -2.470 2.974 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -14.476 -3.774 1.923 1.00 0.00 H new ATOM 837 N ALA A 53 -13.029 2.892 -0.340 1.00 0.00 N ATOM 838 CA ALA A 53 -13.788 4.066 -0.765 1.00 0.00 C ATOM 839 C ALA A 53 -13.816 4.215 -2.285 1.00 0.00 C ATOM 840 O ALA A 53 -14.836 4.603 -2.860 1.00 0.00 O ATOM 841 CB ALA A 53 -13.210 5.318 -0.123 1.00 0.00 C ATOM 0 H ALA A 53 -12.180 3.111 0.181 1.00 0.00 H new ATOM 0 HA ALA A 53 -14.818 3.929 -0.435 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -13.781 6.189 -0.445 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -13.265 5.229 0.962 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -12.169 5.435 -0.426 1.00 0.00 H new ATOM 847 N GLN A 54 -12.697 3.921 -2.934 1.00 0.00 N ATOM 848 CA GLN A 54 -12.603 4.046 -4.384 1.00 0.00 C ATOM 849 C GLN A 54 -13.155 2.813 -5.090 1.00 0.00 C ATOM 850 O GLN A 54 -13.430 2.852 -6.293 1.00 0.00 O ATOM 851 CB GLN A 54 -11.158 4.303 -4.806 1.00 0.00 C ATOM 852 CG GLN A 54 -10.884 5.755 -5.174 1.00 0.00 C ATOM 853 CD GLN A 54 -11.268 6.736 -4.079 1.00 0.00 C ATOM 854 OE1 GLN A 54 -11.218 6.423 -2.893 1.00 0.00 O ATOM 855 NE2 GLN A 54 -11.664 7.934 -4.478 1.00 0.00 N ATOM 0 H GLN A 54 -11.843 3.595 -2.481 1.00 0.00 H new ATOM 0 HA GLN A 54 -13.213 4.898 -4.683 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -10.493 4.010 -3.994 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -10.918 3.668 -5.659 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -9.824 5.871 -5.401 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -11.433 6.002 -6.082 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -11.692 8.157 -5.473 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -11.941 8.635 -3.791 1.00 0.00 H new ATOM 864 N LYS A 55 -13.298 1.716 -4.349 1.00 0.00 N ATOM 865 CA LYS A 55 -13.946 0.521 -4.876 1.00 0.00 C ATOM 866 C LYS A 55 -15.359 0.845 -5.354 1.00 0.00 C ATOM 867 O LYS A 55 -15.818 0.336 -6.378 1.00 0.00 O ATOM 868 CB LYS A 55 -13.999 -0.570 -3.805 1.00 0.00 C ATOM 869 CG LYS A 55 -14.647 -1.865 -4.271 1.00 0.00 C ATOM 870 CD LYS A 55 -14.672 -2.920 -3.172 1.00 0.00 C ATOM 871 CE LYS A 55 -13.283 -3.458 -2.851 1.00 0.00 C ATOM 872 NZ LYS A 55 -12.436 -2.470 -2.124 1.00 0.00 N ATOM 0 H LYS A 55 -12.974 1.632 -3.385 1.00 0.00 H new ATOM 0 HA LYS A 55 -13.362 0.160 -5.723 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -12.984 -0.784 -3.469 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -14.547 -0.191 -2.942 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -15.666 -1.662 -4.601 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -14.104 -2.252 -5.133 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -15.110 -2.491 -2.271 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -15.316 -3.744 -3.478 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -13.378 -4.361 -2.248 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -12.786 -3.744 -3.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -11.498 -2.882 -1.946 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -12.334 -1.610 -2.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -12.885 -2.228 -1.218 1.00 0.00 H new ATOM 886 N PHE A 56 -16.036 1.704 -4.610 1.00 0.00 N ATOM 887 CA PHE A 56 -17.398 2.082 -4.936 1.00 0.00 C ATOM 888 C PHE A 56 -17.416 3.417 -5.666 1.00 0.00 C ATOM 889 O PHE A 56 -16.552 4.266 -5.447 1.00 0.00 O ATOM 890 CB PHE A 56 -18.249 2.166 -3.665 1.00 0.00 C ATOM 891 CG PHE A 56 -18.252 0.896 -2.862 1.00 0.00 C ATOM 892 CD1 PHE A 56 -18.973 -0.208 -3.288 1.00 0.00 C ATOM 893 CD2 PHE A 56 -17.535 0.807 -1.679 1.00 0.00 C ATOM 894 CE1 PHE A 56 -18.976 -1.377 -2.552 1.00 0.00 C ATOM 895 CE2 PHE A 56 -17.536 -0.360 -0.938 1.00 0.00 C ATOM 896 CZ PHE A 56 -18.257 -1.452 -1.374 1.00 0.00 C ATOM 0 H PHE A 56 -15.662 2.153 -3.774 1.00 0.00 H new ATOM 0 HA PHE A 56 -17.820 1.319 -5.589 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -17.878 2.980 -3.042 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -19.274 2.416 -3.939 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -19.539 -0.154 -4.206 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -16.969 1.659 -1.332 1.00 0.00 H new ATOM 0 HE1 PHE A 56 -19.540 -2.231 -2.897 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -16.973 -0.417 -0.018 1.00 0.00 H new ATOM 0 HZ PHE A 56 -18.260 -2.364 -0.796 1.00 0.00 H new ATOM 906 N LEU A 57 -18.393 3.589 -6.544 1.00 0.00 N ATOM 907 CA LEU A 57 -18.566 4.844 -7.268 1.00 0.00 C ATOM 908 C LEU A 57 -19.590 5.722 -6.556 1.00 0.00 C ATOM 909 O LEU A 57 -19.918 6.817 -7.011 1.00 0.00 O ATOM 910 CB LEU A 57 -19.008 4.595 -8.719 1.00 0.00 C ATOM 911 CG LEU A 57 -20.398 3.966 -8.903 1.00 0.00 C ATOM 912 CD1 LEU A 57 -20.890 4.176 -10.326 1.00 0.00 C ATOM 913 CD2 LEU A 57 -20.365 2.481 -8.584 1.00 0.00 C ATOM 0 H LEU A 57 -19.082 2.873 -6.774 1.00 0.00 H new ATOM 0 HA LEU A 57 -17.604 5.355 -7.290 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -18.988 5.546 -9.252 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -18.272 3.947 -9.196 1.00 0.00 H new ATOM 0 HG LEU A 57 -21.084 4.456 -8.212 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -21.876 3.725 -10.441 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -20.953 5.244 -10.535 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -20.194 3.710 -11.024 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -21.360 2.057 -8.721 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -19.662 1.981 -9.251 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -20.049 2.338 -7.551 1.00 0.00 H new ATOM 925 N ASP A 58 -20.087 5.226 -5.432 1.00 0.00 N ATOM 926 CA ASP A 58 -21.069 5.951 -4.645 1.00 0.00 C ATOM 927 C ASP A 58 -20.371 6.875 -3.659 1.00 0.00 C ATOM 928 O ASP A 58 -19.729 6.418 -2.712 1.00 0.00 O ATOM 929 CB ASP A 58 -21.986 4.978 -3.900 1.00 0.00 C ATOM 930 CG ASP A 58 -23.027 5.690 -3.060 1.00 0.00 C ATOM 931 OD1 ASP A 58 -23.874 6.403 -3.635 1.00 0.00 O ATOM 932 OD2 ASP A 58 -23.011 5.533 -1.823 1.00 0.00 O ATOM 0 H ASP A 58 -19.824 4.320 -5.045 1.00 0.00 H new ATOM 0 HA ASP A 58 -21.679 6.551 -5.320 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -22.486 4.331 -4.621 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -21.384 4.335 -3.258 1.00 0.00 H new ATOM 937 N GLU A 59 -20.494 8.175 -3.898 1.00 0.00 N ATOM 938 CA GLU A 59 -19.828 9.184 -3.078 1.00 0.00 C ATOM 939 C GLU A 59 -20.288 9.097 -1.624 1.00 0.00 C ATOM 940 O GLU A 59 -19.514 9.346 -0.701 1.00 0.00 O ATOM 941 CB GLU A 59 -20.116 10.582 -3.629 1.00 0.00 C ATOM 942 CG GLU A 59 -19.217 11.664 -3.053 1.00 0.00 C ATOM 943 CD GLU A 59 -17.793 11.556 -3.555 1.00 0.00 C ATOM 944 OE1 GLU A 59 -17.486 12.165 -4.601 1.00 0.00 O ATOM 945 OE2 GLU A 59 -16.976 10.866 -2.913 1.00 0.00 O ATOM 0 H GLU A 59 -21.053 8.559 -4.659 1.00 0.00 H new ATOM 0 HA GLU A 59 -18.755 8.996 -3.113 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -20.002 10.566 -4.713 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -21.155 10.837 -3.422 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -19.618 12.643 -3.314 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -19.222 11.597 -1.965 1.00 0.00 H new ATOM 952 N LYS A 60 -21.550 8.731 -1.431 1.00 0.00 N ATOM 953 CA LYS A 60 -22.121 8.615 -0.094 1.00 0.00 C ATOM 954 C LYS A 60 -21.402 7.537 0.713 1.00 0.00 C ATOM 955 O LYS A 60 -20.958 7.780 1.835 1.00 0.00 O ATOM 956 CB LYS A 60 -23.613 8.292 -0.183 1.00 0.00 C ATOM 957 CG LYS A 60 -24.295 8.179 1.169 1.00 0.00 C ATOM 958 CD LYS A 60 -25.763 7.819 1.024 1.00 0.00 C ATOM 959 CE LYS A 60 -26.450 7.736 2.377 1.00 0.00 C ATOM 960 NZ LYS A 60 -26.359 9.017 3.124 1.00 0.00 N ATOM 0 H LYS A 60 -22.199 8.509 -2.186 1.00 0.00 H new ATOM 0 HA LYS A 60 -21.992 9.570 0.415 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -24.109 9.067 -0.767 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -23.741 7.355 -0.724 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -23.791 7.422 1.769 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -24.202 9.124 1.704 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -26.263 8.565 0.406 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -25.856 6.863 0.508 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -27.498 7.471 2.236 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -25.996 6.939 2.966 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -27.052 9.016 3.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -25.401 9.124 3.515 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -26.560 9.809 2.481 1.00 0.00 H new ATOM 974 N TYR A 61 -21.291 6.347 0.136 1.00 0.00 N ATOM 975 CA TYR A 61 -20.623 5.236 0.796 1.00 0.00 C ATOM 976 C TYR A 61 -19.132 5.523 0.943 1.00 0.00 C ATOM 977 O TYR A 61 -18.491 5.071 1.887 1.00 0.00 O ATOM 978 CB TYR A 61 -20.845 3.944 0.008 1.00 0.00 C ATOM 979 CG TYR A 61 -21.093 2.733 0.881 1.00 0.00 C ATOM 980 CD1 TYR A 61 -22.040 2.774 1.897 1.00 0.00 C ATOM 981 CD2 TYR A 61 -20.398 1.547 0.682 1.00 0.00 C ATOM 982 CE1 TYR A 61 -22.286 1.672 2.691 1.00 0.00 C ATOM 983 CE2 TYR A 61 -20.643 0.436 1.470 1.00 0.00 C ATOM 984 CZ TYR A 61 -21.588 0.504 2.471 1.00 0.00 C ATOM 985 OH TYR A 61 -21.841 -0.600 3.252 1.00 0.00 O ATOM 0 H TYR A 61 -21.657 6.128 -0.791 1.00 0.00 H new ATOM 0 HA TYR A 61 -21.049 5.114 1.792 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -21.695 4.079 -0.661 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -19.973 3.757 -0.618 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -22.594 3.685 2.069 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -19.655 1.491 -0.100 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -23.021 1.725 3.480 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -20.096 -0.480 1.301 1.00 0.00 H new ATOM 0 HH TYR A 61 -21.089 -1.225 3.188 1.00 0.00 H new ATOM 995 N ARG A 62 -18.591 6.294 0.012 1.00 0.00 N ATOM 996 CA ARG A 62 -17.198 6.715 0.084 1.00 0.00 C ATOM 997 C ARG A 62 -16.985 7.623 1.295 1.00 0.00 C ATOM 998 O ARG A 62 -15.986 7.503 2.009 1.00 0.00 O ATOM 999 CB ARG A 62 -16.804 7.435 -1.206 1.00 0.00 C ATOM 1000 CG ARG A 62 -15.337 7.809 -1.280 1.00 0.00 C ATOM 1001 CD ARG A 62 -14.990 8.379 -2.642 1.00 0.00 C ATOM 1002 NE ARG A 62 -15.331 7.454 -3.723 1.00 0.00 N ATOM 1003 CZ ARG A 62 -15.852 7.835 -4.888 1.00 0.00 C ATOM 1004 NH1 ARG A 62 -16.169 9.109 -5.093 1.00 0.00 N ATOM 1005 NH2 ARG A 62 -16.099 6.936 -5.832 1.00 0.00 N ATOM 0 H ARG A 62 -19.095 6.642 -0.804 1.00 0.00 H new ATOM 0 HA ARG A 62 -16.564 5.835 0.198 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -17.049 6.797 -2.055 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -17.404 8.340 -1.303 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -15.105 8.540 -0.506 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -14.723 6.930 -1.082 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -15.521 9.320 -2.788 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -13.924 8.605 -2.680 1.00 0.00 H new ATOM 0 HE ARG A 62 -15.160 6.459 -3.576 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -16.013 9.798 -4.357 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -16.568 9.398 -5.986 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -15.890 5.952 -5.666 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -16.498 7.229 -6.724 1.00 0.00 H new ATOM 1019 N GLU A 63 -17.941 8.516 1.522 1.00 0.00 N ATOM 1020 CA GLU A 63 -17.936 9.383 2.696 1.00 0.00 C ATOM 1021 C GLU A 63 -18.042 8.535 3.964 1.00 0.00 C ATOM 1022 O GLU A 63 -17.432 8.840 4.992 1.00 0.00 O ATOM 1023 CB GLU A 63 -19.113 10.366 2.612 1.00 0.00 C ATOM 1024 CG GLU A 63 -19.133 11.419 3.708 1.00 0.00 C ATOM 1025 CD GLU A 63 -18.005 12.419 3.577 1.00 0.00 C ATOM 1026 OE1 GLU A 63 -18.115 13.345 2.747 1.00 0.00 O ATOM 1027 OE2 GLU A 63 -17.008 12.301 4.310 1.00 0.00 O ATOM 0 H GLU A 63 -18.738 8.660 0.902 1.00 0.00 H new ATOM 0 HA GLU A 63 -17.004 9.948 2.729 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -19.083 10.867 1.644 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -20.045 9.802 2.650 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -20.086 11.947 3.682 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -19.067 10.928 4.679 1.00 0.00 H new ATOM 1034 N GLU A 64 -18.810 7.458 3.864 1.00 0.00 N ATOM 1035 CA GLU A 64 -18.994 6.521 4.963 1.00 0.00 C ATOM 1036 C GLU A 64 -17.660 5.891 5.373 1.00 0.00 C ATOM 1037 O GLU A 64 -17.249 5.981 6.531 1.00 0.00 O ATOM 1038 CB GLU A 64 -19.995 5.439 4.545 1.00 0.00 C ATOM 1039 CG GLU A 64 -20.324 4.439 5.638 1.00 0.00 C ATOM 1040 CD GLU A 64 -20.971 5.090 6.837 1.00 0.00 C ATOM 1041 OE1 GLU A 64 -22.188 5.359 6.788 1.00 0.00 O ATOM 1042 OE2 GLU A 64 -20.269 5.346 7.833 1.00 0.00 O ATOM 0 H GLU A 64 -19.323 7.210 3.018 1.00 0.00 H new ATOM 0 HA GLU A 64 -19.385 7.060 5.826 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -20.917 5.920 4.219 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -19.594 4.902 3.685 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -20.991 3.675 5.239 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -19.411 3.933 5.951 1.00 0.00 H new ATOM 1049 N ILE A 65 -16.974 5.281 4.410 1.00 0.00 N ATOM 1050 CA ILE A 65 -15.693 4.625 4.674 1.00 0.00 C ATOM 1051 C ILE A 65 -14.643 5.630 5.169 1.00 0.00 C ATOM 1052 O ILE A 65 -13.719 5.271 5.899 1.00 0.00 O ATOM 1053 CB ILE A 65 -15.168 3.853 3.423 1.00 0.00 C ATOM 1054 CG1 ILE A 65 -15.841 2.478 3.295 1.00 0.00 C ATOM 1055 CG2 ILE A 65 -13.658 3.673 3.472 1.00 0.00 C ATOM 1056 CD1 ILE A 65 -17.303 2.521 2.914 1.00 0.00 C ATOM 0 H ILE A 65 -17.282 5.226 3.439 1.00 0.00 H new ATOM 0 HA ILE A 65 -15.867 3.895 5.465 1.00 0.00 H new ATOM 0 HB ILE A 65 -15.421 4.456 2.551 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -15.303 1.894 2.549 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -15.743 1.951 4.244 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -13.327 3.132 2.586 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -13.176 4.650 3.501 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -13.388 3.108 4.364 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -17.692 1.505 2.848 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -17.860 3.074 3.670 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -17.413 3.015 1.949 1.00 0.00 H new ATOM 1068 N ARG A 66 -14.795 6.897 4.806 1.00 0.00 N ATOM 1069 CA ARG A 66 -13.835 7.908 5.227 1.00 0.00 C ATOM 1070 C ARG A 66 -13.969 8.216 6.718 1.00 0.00 C ATOM 1071 O ARG A 66 -12.971 8.458 7.399 1.00 0.00 O ATOM 1072 CB ARG A 66 -13.996 9.204 4.434 1.00 0.00 C ATOM 1073 CG ARG A 66 -12.905 10.212 4.752 1.00 0.00 C ATOM 1074 CD ARG A 66 -13.306 11.623 4.375 1.00 0.00 C ATOM 1075 NE ARG A 66 -14.533 12.046 5.052 1.00 0.00 N ATOM 1076 CZ ARG A 66 -14.582 12.577 6.275 1.00 0.00 C ATOM 1077 NH1 ARG A 66 -13.482 12.680 7.011 1.00 0.00 N ATOM 1078 NH2 ARG A 66 -15.747 12.991 6.759 1.00 0.00 N ATOM 0 H ARG A 66 -15.561 7.245 4.230 1.00 0.00 H new ATOM 0 HA ARG A 66 -12.845 7.495 5.033 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -13.981 8.979 3.368 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -14.969 9.643 4.653 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -12.675 10.173 5.817 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -11.994 9.940 4.219 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -12.498 12.309 4.628 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -13.449 11.683 3.296 1.00 0.00 H new ATOM 0 HE ARG A 66 -15.414 11.926 4.553 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -12.589 12.352 6.643 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -13.530 13.087 7.945 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -16.593 12.902 6.197 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -15.795 13.398 7.693 1.00 0.00 H new ATOM 1092 N ARG A 67 -15.197 8.194 7.231 1.00 0.00 N ATOM 1093 CA ARG A 67 -15.440 8.617 8.607 1.00 0.00 C ATOM 1094 C ARG A 67 -15.237 7.472 9.593 1.00 0.00 C ATOM 1095 O ARG A 67 -15.394 7.649 10.805 1.00 0.00 O ATOM 1096 CB ARG A 67 -16.846 9.209 8.765 1.00 0.00 C ATOM 1097 CG ARG A 67 -17.976 8.218 8.542 1.00 0.00 C ATOM 1098 CD ARG A 67 -19.327 8.848 8.843 1.00 0.00 C ATOM 1099 NE ARG A 67 -20.433 7.928 8.585 1.00 0.00 N ATOM 1100 CZ ARG A 67 -21.692 8.133 8.975 1.00 0.00 C ATOM 1101 NH1 ARG A 67 -22.002 9.168 9.747 1.00 0.00 N ATOM 1102 NH2 ARG A 67 -22.639 7.281 8.609 1.00 0.00 N ATOM 0 H ARG A 67 -16.028 7.892 6.723 1.00 0.00 H new ATOM 0 HA ARG A 67 -14.709 9.393 8.835 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -16.940 9.628 9.767 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -16.960 10.035 8.062 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -17.957 7.867 7.510 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -17.829 7.345 9.178 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -19.355 9.164 9.886 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -19.452 9.744 8.235 1.00 0.00 H new ATOM 0 HE ARG A 67 -20.228 7.071 8.072 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -21.274 9.816 10.048 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -22.968 9.315 10.039 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -22.403 6.474 8.032 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -23.603 7.433 8.904 1.00 0.00 H new ATOM 1116 N VAL A 68 -14.884 6.302 9.085 1.00 0.00 N ATOM 1117 CA VAL A 68 -14.592 5.177 9.952 1.00 0.00 C ATOM 1118 C VAL A 68 -13.086 5.085 10.201 1.00 0.00 C ATOM 1119 O VAL A 68 -12.294 4.926 9.275 1.00 0.00 O ATOM 1120 CB VAL A 68 -15.147 3.839 9.386 1.00 0.00 C ATOM 1121 CG1 VAL A 68 -14.455 3.422 8.104 1.00 0.00 C ATOM 1122 CG2 VAL A 68 -15.052 2.736 10.427 1.00 0.00 C ATOM 0 H VAL A 68 -14.794 6.110 8.087 1.00 0.00 H new ATOM 0 HA VAL A 68 -15.099 5.349 10.902 1.00 0.00 H new ATOM 0 HB VAL A 68 -16.196 4.007 9.143 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -14.879 2.482 7.751 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -14.598 4.192 7.346 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -13.389 3.291 8.292 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -15.445 1.808 10.011 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -14.010 2.593 10.711 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -15.633 3.015 11.306 1.00 0.00 H new ATOM 1132 N SER A 69 -12.687 5.231 11.453 1.00 0.00 N ATOM 1133 CA SER A 69 -11.278 5.169 11.807 1.00 0.00 C ATOM 1134 C SER A 69 -10.826 3.719 11.943 1.00 0.00 C ATOM 1135 O SER A 69 -9.650 3.404 11.773 1.00 0.00 O ATOM 1136 CB SER A 69 -11.036 5.935 13.108 1.00 0.00 C ATOM 1137 OG SER A 69 -11.509 7.268 12.994 1.00 0.00 O ATOM 0 H SER A 69 -13.316 5.393 12.240 1.00 0.00 H new ATOM 0 HA SER A 69 -10.692 5.633 11.013 1.00 0.00 H new ATOM 0 HB2 SER A 69 -11.542 5.432 13.932 1.00 0.00 H new ATOM 0 HB3 SER A 69 -9.971 5.939 13.342 1.00 0.00 H new ATOM 0 HG SER A 69 -11.349 7.745 13.835 1.00 0.00 H new ATOM 1143 N SER A 70 -11.776 2.843 12.238 1.00 0.00 N ATOM 1144 CA SER A 70 -11.496 1.426 12.385 1.00 0.00 C ATOM 1145 C SER A 70 -11.335 0.771 11.011 1.00 0.00 C ATOM 1146 O SER A 70 -12.277 0.738 10.217 1.00 0.00 O ATOM 1147 CB SER A 70 -12.637 0.776 13.163 1.00 0.00 C ATOM 1148 OG SER A 70 -13.113 1.656 14.169 1.00 0.00 O ATOM 0 H SER A 70 -12.754 3.094 12.381 1.00 0.00 H new ATOM 0 HA SER A 70 -10.563 1.289 12.932 1.00 0.00 H new ATOM 0 HB2 SER A 70 -13.449 0.518 12.483 1.00 0.00 H new ATOM 0 HB3 SER A 70 -12.293 -0.154 13.617 1.00 0.00 H new ATOM 0 HG SER A 70 -13.845 1.227 14.659 1.00 0.00 H new ATOM 1154 N PRO A 71 -10.133 0.247 10.714 1.00 0.00 N ATOM 1155 CA PRO A 71 -9.808 -0.329 9.400 1.00 0.00 C ATOM 1156 C PRO A 71 -10.707 -1.503 9.023 1.00 0.00 C ATOM 1157 O PRO A 71 -11.367 -1.495 7.984 1.00 0.00 O ATOM 1158 CB PRO A 71 -8.361 -0.809 9.564 1.00 0.00 C ATOM 1159 CG PRO A 71 -7.822 -0.039 10.717 1.00 0.00 C ATOM 1160 CD PRO A 71 -8.985 0.183 11.637 1.00 0.00 C ATOM 0 HA PRO A 71 -9.949 0.402 8.604 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -8.321 -1.882 9.754 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -7.780 -0.623 8.661 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -7.026 -0.590 11.218 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -7.396 0.909 10.389 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -9.091 -0.629 12.356 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -8.876 1.104 12.210 1.00 0.00 H new ATOM 1168 N MET A 72 -10.755 -2.496 9.898 1.00 0.00 N ATOM 1169 CA MET A 72 -11.449 -3.745 9.606 1.00 0.00 C ATOM 1170 C MET A 72 -12.956 -3.528 9.460 1.00 0.00 C ATOM 1171 O MET A 72 -13.644 -4.316 8.813 1.00 0.00 O ATOM 1172 CB MET A 72 -11.158 -4.771 10.702 1.00 0.00 C ATOM 1173 CG MET A 72 -11.468 -6.201 10.292 1.00 0.00 C ATOM 1174 SD MET A 72 -10.979 -7.397 11.546 1.00 0.00 S ATOM 1175 CE MET A 72 -11.218 -8.924 10.643 1.00 0.00 C ATOM 0 H MET A 72 -10.320 -2.462 10.820 1.00 0.00 H new ATOM 0 HA MET A 72 -11.079 -4.125 8.654 1.00 0.00 H new ATOM 0 HB2 MET A 72 -10.107 -4.702 10.983 1.00 0.00 H new ATOM 0 HB3 MET A 72 -11.742 -4.521 11.587 1.00 0.00 H new ATOM 0 HG2 MET A 72 -12.537 -6.297 10.099 1.00 0.00 H new ATOM 0 HG3 MET A 72 -10.954 -6.428 9.358 1.00 0.00 H new ATOM 0 HE1 MET A 72 -10.958 -9.769 11.281 1.00 0.00 H new ATOM 0 HE2 MET A 72 -12.261 -9.007 10.338 1.00 0.00 H new ATOM 0 HE3 MET A 72 -10.580 -8.927 9.759 1.00 0.00 H new ATOM 1185 N VAL A 73 -13.465 -2.451 10.048 1.00 0.00 N ATOM 1186 CA VAL A 73 -14.882 -2.130 9.946 1.00 0.00 C ATOM 1187 C VAL A 73 -15.211 -1.631 8.542 1.00 0.00 C ATOM 1188 O VAL A 73 -16.259 -1.959 7.985 1.00 0.00 O ATOM 1189 CB VAL A 73 -15.308 -1.077 10.991 1.00 0.00 C ATOM 1190 CG1 VAL A 73 -16.782 -0.723 10.840 1.00 0.00 C ATOM 1191 CG2 VAL A 73 -15.025 -1.582 12.396 1.00 0.00 C ATOM 0 H VAL A 73 -12.919 -1.788 10.598 1.00 0.00 H new ATOM 0 HA VAL A 73 -15.440 -3.045 10.147 1.00 0.00 H new ATOM 0 HB VAL A 73 -14.724 -0.173 10.819 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -17.056 0.021 11.588 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -16.959 -0.318 9.844 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -17.387 -1.619 10.980 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -15.331 -0.829 13.122 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -15.583 -2.502 12.571 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -13.958 -1.778 12.504 1.00 0.00 H new ATOM 1201 N ALA A 74 -14.294 -0.861 7.964 1.00 0.00 N ATOM 1202 CA ALA A 74 -14.450 -0.380 6.597 1.00 0.00 C ATOM 1203 C ALA A 74 -14.534 -1.556 5.637 1.00 0.00 C ATOM 1204 O ALA A 74 -15.401 -1.602 4.759 1.00 0.00 O ATOM 1205 CB ALA A 74 -13.293 0.530 6.216 1.00 0.00 C ATOM 0 H ALA A 74 -13.435 -0.557 8.422 1.00 0.00 H new ATOM 0 HA ALA A 74 -15.374 0.194 6.533 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -13.427 0.879 5.192 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -13.266 1.386 6.891 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -12.356 -0.022 6.292 1.00 0.00 H new ATOM 1211 N ALA A 75 -13.635 -2.512 5.824 1.00 0.00 N ATOM 1212 CA ALA A 75 -13.645 -3.735 5.040 1.00 0.00 C ATOM 1213 C ALA A 75 -14.938 -4.510 5.274 1.00 0.00 C ATOM 1214 O ALA A 75 -15.553 -5.004 4.332 1.00 0.00 O ATOM 1215 CB ALA A 75 -12.434 -4.589 5.383 1.00 0.00 C ATOM 0 H ALA A 75 -12.887 -2.462 6.516 1.00 0.00 H new ATOM 0 HA ALA A 75 -13.594 -3.473 3.983 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -12.453 -5.503 4.789 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -11.523 -4.033 5.164 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -12.457 -4.845 6.442 1.00 0.00 H new ATOM 1221 N ARG A 76 -15.357 -4.579 6.532 1.00 0.00 N ATOM 1222 CA ARG A 76 -16.548 -5.330 6.912 1.00 0.00 C ATOM 1223 C ARG A 76 -17.795 -4.800 6.207 1.00 0.00 C ATOM 1224 O ARG A 76 -18.488 -5.546 5.518 1.00 0.00 O ATOM 1225 CB ARG A 76 -16.748 -5.275 8.427 1.00 0.00 C ATOM 1226 CG ARG A 76 -17.836 -6.211 8.922 1.00 0.00 C ATOM 1227 CD ARG A 76 -18.036 -6.091 10.423 1.00 0.00 C ATOM 1228 NE ARG A 76 -18.903 -7.145 10.942 1.00 0.00 N ATOM 1229 CZ ARG A 76 -19.386 -7.172 12.183 1.00 0.00 C ATOM 1230 NH1 ARG A 76 -19.141 -6.175 13.022 1.00 0.00 N ATOM 1231 NH2 ARG A 76 -20.126 -8.201 12.575 1.00 0.00 N ATOM 0 H ARG A 76 -14.886 -4.120 7.312 1.00 0.00 H new ATOM 0 HA ARG A 76 -16.398 -6.364 6.603 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -15.809 -5.527 8.920 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -16.996 -4.254 8.717 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -18.772 -5.985 8.410 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -17.575 -7.239 8.670 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -17.069 -6.137 10.923 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -18.469 -5.118 10.655 1.00 0.00 H new ATOM 0 HE ARG A 76 -19.155 -7.909 10.315 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -18.579 -5.380 12.719 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -19.515 -6.203 13.971 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -20.322 -8.965 11.928 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -20.499 -8.229 13.524 1.00 0.00 H new ATOM 1245 N MET A 77 -18.071 -3.510 6.366 1.00 0.00 N ATOM 1246 CA MET A 77 -19.274 -2.920 5.785 1.00 0.00 C ATOM 1247 C MET A 77 -19.125 -2.740 4.278 1.00 0.00 C ATOM 1248 O MET A 77 -20.113 -2.601 3.559 1.00 0.00 O ATOM 1249 CB MET A 77 -19.613 -1.581 6.451 1.00 0.00 C ATOM 1250 CG MET A 77 -18.577 -0.491 6.230 1.00 0.00 C ATOM 1251 SD MET A 77 -19.043 1.064 7.013 1.00 0.00 S ATOM 1252 CE MET A 77 -17.660 2.103 6.553 1.00 0.00 C ATOM 0 H MET A 77 -17.485 -2.857 6.887 1.00 0.00 H new ATOM 0 HA MET A 77 -20.097 -3.610 5.968 1.00 0.00 H new ATOM 0 HB2 MET A 77 -20.575 -1.234 6.073 1.00 0.00 H new ATOM 0 HB3 MET A 77 -19.731 -1.741 7.523 1.00 0.00 H new ATOM 0 HG2 MET A 77 -17.616 -0.821 6.625 1.00 0.00 H new ATOM 0 HG3 MET A 77 -18.444 -0.331 5.160 1.00 0.00 H new ATOM 0 HE1 MET A 77 -17.803 3.102 6.965 1.00 0.00 H new ATOM 0 HE2 MET A 77 -16.738 1.676 6.947 1.00 0.00 H new ATOM 0 HE3 MET A 77 -17.597 2.164 5.467 1.00 0.00 H new ATOM 1262 N GLY A 78 -17.887 -2.746 3.802 1.00 0.00 N ATOM 1263 CA GLY A 78 -17.642 -2.632 2.376 1.00 0.00 C ATOM 1264 C GLY A 78 -17.508 -3.989 1.718 1.00 0.00 C ATOM 1265 O GLY A 78 -17.269 -4.089 0.517 1.00 0.00 O ATOM 0 H GLY A 78 -17.048 -2.828 4.376 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -18.459 -2.081 1.910 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -16.732 -2.055 2.208 1.00 0.00 H new ATOM 1269 N ARG A 79 -17.636 -5.035 2.526 1.00 0.00 N ATOM 1270 CA ARG A 79 -17.626 -6.409 2.040 1.00 0.00 C ATOM 1271 C ARG A 79 -18.996 -6.764 1.459 1.00 0.00 C ATOM 1272 O ARG A 79 -19.220 -7.880 0.990 1.00 0.00 O ATOM 1273 CB ARG A 79 -17.283 -7.346 3.199 1.00 0.00 C ATOM 1274 CG ARG A 79 -16.698 -8.688 2.795 1.00 0.00 C ATOM 1275 CD ARG A 79 -16.438 -9.533 4.030 1.00 0.00 C ATOM 1276 NE ARG A 79 -15.624 -10.718 3.757 1.00 0.00 N ATOM 1277 CZ ARG A 79 -15.467 -11.713 4.629 1.00 0.00 C ATOM 1278 NH1 ARG A 79 -16.131 -11.697 5.778 1.00 0.00 N ATOM 1279 NH2 ARG A 79 -14.651 -12.722 4.355 1.00 0.00 N ATOM 0 H ARG A 79 -17.750 -4.954 3.536 1.00 0.00 H new ATOM 0 HA ARG A 79 -16.878 -6.517 1.255 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -16.574 -6.841 3.855 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -18.187 -7.523 3.782 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -17.385 -9.207 2.127 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -15.769 -8.538 2.244 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -15.938 -8.922 4.782 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -17.391 -9.845 4.456 1.00 0.00 H new ATOM 0 HE ARG A 79 -15.154 -10.786 2.854 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -16.761 -10.924 5.992 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -16.012 -12.458 6.447 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -14.139 -12.739 3.473 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -14.535 -13.481 5.027 1.00 0.00 H new ATOM 1293 N ASP A 80 -19.909 -5.799 1.514 1.00 0.00 N ATOM 1294 CA ASP A 80 -21.256 -5.974 0.990 1.00 0.00 C ATOM 1295 C ASP A 80 -21.262 -5.896 -0.530 1.00 0.00 C ATOM 1296 O ASP A 80 -20.762 -4.937 -1.118 1.00 0.00 O ATOM 1297 CB ASP A 80 -22.201 -4.920 1.567 1.00 0.00 C ATOM 1298 CG ASP A 80 -23.558 -4.937 0.897 1.00 0.00 C ATOM 1299 OD1 ASP A 80 -24.250 -5.979 0.959 1.00 0.00 O ATOM 1300 OD2 ASP A 80 -23.934 -3.916 0.286 1.00 0.00 O ATOM 0 H ASP A 80 -19.736 -4.880 1.921 1.00 0.00 H new ATOM 0 HA ASP A 80 -21.604 -6.962 1.290 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -22.324 -5.092 2.636 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -21.754 -3.933 1.452 1.00 0.00 H new ATOM 1305 N ARG A 81 -21.847 -6.905 -1.156 1.00 0.00 N ATOM 1306 CA ARG A 81 -21.849 -7.014 -2.605 1.00 0.00 C ATOM 1307 C ARG A 81 -23.166 -6.496 -3.184 1.00 0.00 C ATOM 1308 O ARG A 81 -23.429 -6.626 -4.381 1.00 0.00 O ATOM 1309 CB ARG A 81 -21.632 -8.476 -3.000 1.00 0.00 C ATOM 1310 CG ARG A 81 -21.063 -8.674 -4.397 1.00 0.00 C ATOM 1311 CD ARG A 81 -20.948 -10.150 -4.727 1.00 0.00 C ATOM 1312 NE ARG A 81 -20.181 -10.396 -5.945 1.00 0.00 N ATOM 1313 CZ ARG A 81 -20.509 -11.309 -6.858 1.00 0.00 C ATOM 1314 NH1 ARG A 81 -21.657 -11.971 -6.754 1.00 0.00 N ATOM 1315 NH2 ARG A 81 -19.696 -11.546 -7.880 1.00 0.00 N ATOM 0 H ARG A 81 -22.330 -7.666 -0.678 1.00 0.00 H new ATOM 0 HA ARG A 81 -21.041 -6.405 -3.010 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -20.959 -8.938 -2.278 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -22.584 -9.003 -2.931 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -21.704 -8.182 -5.129 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -20.082 -8.204 -4.465 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -20.475 -10.669 -3.893 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -21.947 -10.572 -4.840 1.00 0.00 H new ATOM 0 HE ARG A 81 -19.344 -9.835 -6.106 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -22.287 -11.780 -5.975 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -21.908 -12.670 -7.453 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -18.821 -11.029 -7.966 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -19.946 -12.245 -8.579 1.00 0.00 H new ATOM 1329 N SER A 82 -23.993 -5.902 -2.329 1.00 0.00 N ATOM 1330 CA SER A 82 -25.278 -5.367 -2.756 1.00 0.00 C ATOM 1331 C SER A 82 -25.101 -3.973 -3.351 1.00 0.00 C ATOM 1332 O SER A 82 -25.991 -3.447 -4.023 1.00 0.00 O ATOM 1333 CB SER A 82 -26.239 -5.308 -1.572 1.00 0.00 C ATOM 1334 OG SER A 82 -26.174 -6.500 -0.807 1.00 0.00 O ATOM 0 H SER A 82 -23.794 -5.780 -1.336 1.00 0.00 H new ATOM 0 HA SER A 82 -25.693 -6.025 -3.520 1.00 0.00 H new ATOM 0 HB2 SER A 82 -25.994 -4.453 -0.942 1.00 0.00 H new ATOM 0 HB3 SER A 82 -27.257 -5.157 -1.932 1.00 0.00 H new ATOM 0 HG SER A 82 -25.682 -6.330 0.023 1.00 0.00 H new ATOM 1340 N LYS A 83 -23.945 -3.379 -3.095 1.00 0.00 N ATOM 1341 CA LYS A 83 -23.631 -2.056 -3.611 1.00 0.00 C ATOM 1342 C LYS A 83 -23.201 -2.150 -5.067 1.00 0.00 C ATOM 1343 O LYS A 83 -22.659 -3.172 -5.488 1.00 0.00 O ATOM 1344 CB LYS A 83 -22.522 -1.413 -2.776 1.00 0.00 C ATOM 1345 CG LYS A 83 -22.878 -1.257 -1.310 1.00 0.00 C ATOM 1346 CD LYS A 83 -24.043 -0.301 -1.116 1.00 0.00 C ATOM 1347 CE LYS A 83 -24.540 -0.316 0.318 1.00 0.00 C ATOM 1348 NZ LYS A 83 -25.149 -1.623 0.683 1.00 0.00 N ATOM 0 H LYS A 83 -23.205 -3.796 -2.530 1.00 0.00 H new ATOM 0 HA LYS A 83 -24.524 -1.434 -3.547 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -21.619 -2.018 -2.860 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -22.289 -0.432 -3.191 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -23.132 -2.231 -0.891 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -22.010 -0.890 -0.761 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -23.735 0.709 -1.385 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -24.857 -0.576 -1.787 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -23.710 -0.102 0.992 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -25.275 0.477 0.455 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -25.696 -1.518 1.562 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -25.780 -1.938 -0.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -24.398 -2.328 0.825 1.00 0.00 H new ATOM 1362 N PRO A 84 -23.457 -1.098 -5.856 1.00 0.00 N ATOM 1363 CA PRO A 84 -23.069 -1.056 -7.269 1.00 0.00 C ATOM 1364 C PRO A 84 -21.567 -1.234 -7.463 1.00 0.00 C ATOM 1365 O PRO A 84 -20.769 -0.364 -7.099 1.00 0.00 O ATOM 1366 CB PRO A 84 -23.510 0.339 -7.733 1.00 0.00 C ATOM 1367 CG PRO A 84 -23.716 1.122 -6.483 1.00 0.00 C ATOM 1368 CD PRO A 84 -24.152 0.130 -5.446 1.00 0.00 C ATOM 0 HA PRO A 84 -23.528 -1.866 -7.836 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -22.752 0.801 -8.366 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -24.427 0.287 -8.320 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -22.797 1.625 -6.181 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -24.471 1.895 -6.626 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -23.864 0.442 -4.442 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -25.234 -0.000 -5.441 1.00 0.00 H new ATOM 1376 N LEU A 85 -21.188 -2.374 -8.019 1.00 0.00 N ATOM 1377 CA LEU A 85 -19.791 -2.669 -8.281 1.00 0.00 C ATOM 1378 C LEU A 85 -19.386 -2.093 -9.630 1.00 0.00 C ATOM 1379 O LEU A 85 -19.972 -2.428 -10.661 1.00 0.00 O ATOM 1380 CB LEU A 85 -19.548 -4.182 -8.258 1.00 0.00 C ATOM 1381 CG LEU A 85 -19.931 -4.889 -6.953 1.00 0.00 C ATOM 1382 CD1 LEU A 85 -19.695 -6.386 -7.071 1.00 0.00 C ATOM 1383 CD2 LEU A 85 -19.147 -4.317 -5.779 1.00 0.00 C ATOM 0 H LEU A 85 -21.833 -3.113 -8.298 1.00 0.00 H new ATOM 0 HA LEU A 85 -19.184 -2.211 -7.500 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -20.109 -4.636 -9.075 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -18.492 -4.366 -8.455 1.00 0.00 H new ATOM 0 HG LEU A 85 -20.992 -4.718 -6.770 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -19.972 -6.873 -6.136 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -20.302 -6.787 -7.883 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -18.642 -6.573 -7.279 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -19.435 -4.833 -4.863 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -18.080 -4.454 -5.953 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -19.365 -3.254 -5.680 1.00 0.00 H new ATOM 1395 N ARG A 86 -18.397 -1.212 -9.617 1.00 0.00 N ATOM 1396 CA ARG A 86 -17.942 -0.571 -10.840 1.00 0.00 C ATOM 1397 C ARG A 86 -17.253 -1.589 -11.747 1.00 0.00 C ATOM 1398 O ARG A 86 -16.425 -2.381 -11.303 1.00 0.00 O ATOM 1399 CB ARG A 86 -17.026 0.618 -10.522 1.00 0.00 C ATOM 1400 CG ARG A 86 -15.701 0.250 -9.872 1.00 0.00 C ATOM 1401 CD ARG A 86 -14.993 1.483 -9.324 1.00 0.00 C ATOM 1402 NE ARG A 86 -14.954 2.581 -10.294 1.00 0.00 N ATOM 1403 CZ ARG A 86 -14.466 3.795 -10.026 1.00 0.00 C ATOM 1404 NH1 ARG A 86 -13.941 4.064 -8.833 1.00 0.00 N ATOM 1405 NH2 ARG A 86 -14.507 4.744 -10.956 1.00 0.00 N ATOM 0 H ARG A 86 -17.896 -0.926 -8.776 1.00 0.00 H new ATOM 0 HA ARG A 86 -18.807 -0.180 -11.375 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -16.823 1.159 -11.446 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -17.560 1.303 -9.863 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -15.875 -0.461 -9.065 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -15.061 -0.246 -10.602 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -15.501 1.818 -8.420 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -13.975 1.218 -9.038 1.00 0.00 H new ATOM 0 HE ARG A 86 -15.321 2.408 -11.230 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -13.909 3.340 -8.115 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -13.571 4.994 -8.637 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -14.910 4.544 -11.871 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -14.135 5.672 -10.754 1.00 0.00 H new ATOM 1419 N LYS A 87 -17.605 -1.559 -13.024 1.00 0.00 N ATOM 1420 CA LYS A 87 -17.183 -2.590 -13.967 1.00 0.00 C ATOM 1421 C LYS A 87 -15.691 -2.495 -14.266 1.00 0.00 C ATOM 1422 O LYS A 87 -15.041 -3.499 -14.566 1.00 0.00 O ATOM 1423 CB LYS A 87 -17.989 -2.496 -15.269 1.00 0.00 C ATOM 1424 CG LYS A 87 -19.426 -3.005 -15.165 1.00 0.00 C ATOM 1425 CD LYS A 87 -20.237 -2.233 -14.134 1.00 0.00 C ATOM 1426 CE LYS A 87 -21.699 -2.646 -14.133 1.00 0.00 C ATOM 1427 NZ LYS A 87 -22.410 -2.180 -15.352 1.00 0.00 N ATOM 0 H LYS A 87 -18.185 -0.828 -13.435 1.00 0.00 H new ATOM 0 HA LYS A 87 -17.374 -3.557 -13.502 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -18.008 -1.456 -15.595 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -17.472 -3.063 -16.043 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -19.909 -2.925 -16.139 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -19.417 -4.062 -14.900 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -19.813 -2.397 -13.143 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -20.162 -1.165 -14.340 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -21.769 -3.732 -14.065 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -22.190 -2.239 -13.249 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -23.431 -2.347 -15.244 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -22.238 -1.163 -15.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -22.060 -2.703 -16.180 1.00 0.00 H new ATOM 1441 N ASN A 88 -15.146 -1.293 -14.169 1.00 0.00 N ATOM 1442 CA ASN A 88 -13.730 -1.083 -14.434 1.00 0.00 C ATOM 1443 C ASN A 88 -12.898 -1.223 -13.169 1.00 0.00 C ATOM 1444 O ASN A 88 -11.745 -0.803 -13.133 1.00 0.00 O ATOM 1445 CB ASN A 88 -13.485 0.284 -15.079 1.00 0.00 C ATOM 1446 CG ASN A 88 -13.803 0.283 -16.561 1.00 0.00 C ATOM 1447 OD1 ASN A 88 -14.921 0.598 -16.972 1.00 0.00 O ATOM 1448 ND2 ASN A 88 -12.826 -0.091 -17.376 1.00 0.00 N ATOM 0 H ASN A 88 -15.659 -0.450 -13.910 1.00 0.00 H new ATOM 0 HA ASN A 88 -13.417 -1.858 -15.134 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -14.096 1.035 -14.578 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -12.444 0.572 -14.933 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -12.987 -0.125 -18.383 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -11.914 -0.344 -16.996 1.00 0.00 H new ATOM 1455 N TRP A 89 -13.478 -1.834 -12.137 1.00 0.00 N ATOM 1456 CA TRP A 89 -12.742 -2.130 -10.912 1.00 0.00 C ATOM 1457 C TRP A 89 -11.544 -3.021 -11.229 1.00 0.00 C ATOM 1458 O TRP A 89 -10.486 -2.916 -10.607 1.00 0.00 O ATOM 1459 CB TRP A 89 -13.658 -2.809 -9.886 1.00 0.00 C ATOM 1460 CG TRP A 89 -12.956 -3.197 -8.620 1.00 0.00 C ATOM 1461 CD1 TRP A 89 -12.864 -4.449 -8.082 1.00 0.00 C ATOM 1462 CD2 TRP A 89 -12.237 -2.327 -7.737 1.00 0.00 C ATOM 1463 NE1 TRP A 89 -12.140 -4.409 -6.917 1.00 0.00 N ATOM 1464 CE2 TRP A 89 -11.739 -3.119 -6.687 1.00 0.00 C ATOM 1465 CE3 TRP A 89 -11.961 -0.955 -7.737 1.00 0.00 C ATOM 1466 CZ2 TRP A 89 -10.989 -2.582 -5.645 1.00 0.00 C ATOM 1467 CZ3 TRP A 89 -11.214 -0.425 -6.702 1.00 0.00 C ATOM 1468 CH2 TRP A 89 -10.734 -1.238 -5.671 1.00 0.00 C ATOM 0 H TRP A 89 -14.453 -2.133 -12.126 1.00 0.00 H new ATOM 0 HA TRP A 89 -12.383 -1.195 -10.483 1.00 0.00 H new ATOM 0 HB2 TRP A 89 -14.481 -2.136 -9.644 1.00 0.00 H new ATOM 0 HB3 TRP A 89 -14.097 -3.700 -10.336 1.00 0.00 H new ATOM 0 HD1 TRP A 89 -13.298 -5.340 -8.511 1.00 0.00 H new ATOM 0 HE1 TRP A 89 -11.934 -5.209 -6.319 1.00 0.00 H new ATOM 0 HE3 TRP A 89 -12.325 -0.321 -8.532 1.00 0.00 H new ATOM 0 HZ2 TRP A 89 -10.621 -3.205 -4.843 1.00 0.00 H new ATOM 0 HZ3 TRP A 89 -10.998 0.633 -6.690 1.00 0.00 H new ATOM 0 HH2 TRP A 89 -10.149 -0.796 -4.878 1.00 0.00 H new ATOM 1479 N GLU A 90 -11.727 -3.883 -12.222 1.00 0.00 N ATOM 1480 CA GLU A 90 -10.661 -4.744 -12.715 1.00 0.00 C ATOM 1481 C GLU A 90 -9.462 -3.903 -13.155 1.00 0.00 C ATOM 1482 O GLU A 90 -8.316 -4.227 -12.850 1.00 0.00 O ATOM 1483 CB GLU A 90 -11.185 -5.580 -13.889 1.00 0.00 C ATOM 1484 CG GLU A 90 -10.183 -6.582 -14.441 1.00 0.00 C ATOM 1485 CD GLU A 90 -9.712 -7.564 -13.391 1.00 0.00 C ATOM 1486 OE1 GLU A 90 -10.564 -8.227 -12.767 1.00 0.00 O ATOM 1487 OE2 GLU A 90 -8.490 -7.659 -13.169 1.00 0.00 O ATOM 0 H GLU A 90 -12.616 -4.004 -12.706 1.00 0.00 H new ATOM 0 HA GLU A 90 -10.337 -5.411 -11.916 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -12.078 -6.116 -13.568 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -11.488 -4.908 -14.692 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -10.637 -7.128 -15.268 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -9.324 -6.047 -14.846 1.00 0.00 H new ATOM 1494 N SER A 91 -9.753 -2.803 -13.834 1.00 0.00 N ATOM 1495 CA SER A 91 -8.727 -1.943 -14.403 1.00 0.00 C ATOM 1496 C SER A 91 -8.135 -1.000 -13.355 1.00 0.00 C ATOM 1497 O SER A 91 -6.918 -0.807 -13.291 1.00 0.00 O ATOM 1498 CB SER A 91 -9.342 -1.117 -15.536 1.00 0.00 C ATOM 1499 OG SER A 91 -10.275 -1.886 -16.278 1.00 0.00 O ATOM 0 H SER A 91 -10.706 -2.482 -14.006 1.00 0.00 H new ATOM 0 HA SER A 91 -7.922 -2.575 -14.779 1.00 0.00 H new ATOM 0 HB2 SER A 91 -9.837 -0.238 -15.123 1.00 0.00 H new ATOM 0 HB3 SER A 91 -8.554 -0.757 -16.198 1.00 0.00 H new ATOM 0 HG SER A 91 -10.295 -1.570 -17.205 1.00 0.00 H new ATOM 1505 N VAL A 92 -9.000 -0.417 -12.532 1.00 0.00 N ATOM 1506 CA VAL A 92 -8.590 0.655 -11.628 1.00 0.00 C ATOM 1507 C VAL A 92 -8.064 0.135 -10.294 1.00 0.00 C ATOM 1508 O VAL A 92 -7.613 0.925 -9.463 1.00 0.00 O ATOM 1509 CB VAL A 92 -9.742 1.650 -11.360 1.00 0.00 C ATOM 1510 CG1 VAL A 92 -10.230 2.274 -12.660 1.00 0.00 C ATOM 1511 CG2 VAL A 92 -10.889 0.975 -10.617 1.00 0.00 C ATOM 0 H VAL A 92 -9.987 -0.667 -12.471 1.00 0.00 H new ATOM 0 HA VAL A 92 -7.777 1.169 -12.140 1.00 0.00 H new ATOM 0 HB VAL A 92 -9.356 2.447 -10.724 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -11.041 2.971 -12.447 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -9.409 2.808 -13.138 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -10.590 1.491 -13.327 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -11.685 1.699 -10.442 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -11.274 0.149 -11.215 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -10.529 0.594 -9.661 1.00 0.00 H new ATOM 1521 N LYS A 93 -8.105 -1.180 -10.085 1.00 0.00 N ATOM 1522 CA LYS A 93 -7.642 -1.754 -8.821 1.00 0.00 C ATOM 1523 C LYS A 93 -6.189 -1.368 -8.551 1.00 0.00 C ATOM 1524 O LYS A 93 -5.807 -1.106 -7.410 1.00 0.00 O ATOM 1525 CB LYS A 93 -7.786 -3.283 -8.802 1.00 0.00 C ATOM 1526 CG LYS A 93 -6.891 -4.009 -9.798 1.00 0.00 C ATOM 1527 CD LYS A 93 -6.568 -5.421 -9.330 1.00 0.00 C ATOM 1528 CE LYS A 93 -7.796 -6.317 -9.318 1.00 0.00 C ATOM 1529 NZ LYS A 93 -8.270 -6.624 -10.691 1.00 0.00 N ATOM 0 H LYS A 93 -8.449 -1.860 -10.763 1.00 0.00 H new ATOM 0 HA LYS A 93 -8.274 -1.345 -8.033 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -7.562 -3.645 -7.799 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -8.825 -3.541 -9.009 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -7.384 -4.050 -10.769 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -5.966 -3.449 -9.933 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -5.811 -5.854 -9.983 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -6.140 -5.381 -8.328 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -7.562 -7.246 -8.798 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -8.595 -5.831 -8.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -9.220 -7.045 -10.644 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -8.307 -5.748 -11.250 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -7.616 -7.295 -11.142 1.00 0.00 H new ATOM 1543 N GLU A 94 -5.385 -1.313 -9.610 1.00 0.00 N ATOM 1544 CA GLU A 94 -3.984 -0.957 -9.475 1.00 0.00 C ATOM 1545 C GLU A 94 -3.839 0.550 -9.320 1.00 0.00 C ATOM 1546 O GLU A 94 -2.957 1.018 -8.614 1.00 0.00 O ATOM 1547 CB GLU A 94 -3.169 -1.434 -10.680 1.00 0.00 C ATOM 1548 CG GLU A 94 -3.539 -0.740 -11.979 1.00 0.00 C ATOM 1549 CD GLU A 94 -2.504 -0.942 -13.061 1.00 0.00 C ATOM 1550 OE1 GLU A 94 -1.502 -0.198 -13.075 1.00 0.00 O ATOM 1551 OE2 GLU A 94 -2.697 -1.831 -13.910 1.00 0.00 O ATOM 0 H GLU A 94 -5.683 -1.510 -10.565 1.00 0.00 H new ATOM 0 HA GLU A 94 -3.598 -1.453 -8.584 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -2.110 -1.270 -10.479 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -3.308 -2.508 -10.800 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -4.501 -1.117 -12.327 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -3.662 0.327 -11.794 1.00 0.00 H new ATOM 1558 N GLN A 95 -4.720 1.303 -9.973 1.00 0.00 N ATOM 1559 CA GLN A 95 -4.661 2.756 -9.928 1.00 0.00 C ATOM 1560 C GLN A 95 -4.881 3.240 -8.502 1.00 0.00 C ATOM 1561 O GLN A 95 -4.166 4.114 -8.016 1.00 0.00 O ATOM 1562 CB GLN A 95 -5.703 3.370 -10.870 1.00 0.00 C ATOM 1563 CG GLN A 95 -5.642 4.889 -10.941 1.00 0.00 C ATOM 1564 CD GLN A 95 -6.625 5.470 -11.937 1.00 0.00 C ATOM 1565 OE1 GLN A 95 -6.307 5.641 -13.115 1.00 0.00 O ATOM 1566 NE2 GLN A 95 -7.827 5.774 -11.478 1.00 0.00 N ATOM 0 H GLN A 95 -5.482 0.929 -10.539 1.00 0.00 H new ATOM 0 HA GLN A 95 -3.674 3.076 -10.261 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -5.561 2.962 -11.871 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -6.698 3.070 -10.542 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -5.845 5.303 -9.953 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -4.632 5.195 -11.213 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -8.052 5.618 -10.496 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -8.529 6.165 -12.106 1.00 0.00 H new ATOM 1575 N VAL A 96 -5.861 2.644 -7.834 1.00 0.00 N ATOM 1576 CA VAL A 96 -6.141 2.959 -6.441 1.00 0.00 C ATOM 1577 C VAL A 96 -4.959 2.563 -5.558 1.00 0.00 C ATOM 1578 O VAL A 96 -4.480 3.363 -4.754 1.00 0.00 O ATOM 1579 CB VAL A 96 -7.417 2.245 -5.947 1.00 0.00 C ATOM 1580 CG1 VAL A 96 -7.727 2.623 -4.506 1.00 0.00 C ATOM 1581 CG2 VAL A 96 -8.597 2.574 -6.849 1.00 0.00 C ATOM 0 H VAL A 96 -6.476 1.938 -8.237 1.00 0.00 H new ATOM 0 HA VAL A 96 -6.301 4.035 -6.373 1.00 0.00 H new ATOM 0 HB VAL A 96 -7.240 1.170 -5.986 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -8.631 2.107 -4.181 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -6.893 2.333 -3.866 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -7.879 3.700 -4.437 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -9.487 2.062 -6.485 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -8.770 3.650 -6.844 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -8.380 2.246 -7.866 1.00 0.00 H new ATOM 1591 N MET A 97 -4.481 1.334 -5.736 1.00 0.00 N ATOM 1592 CA MET A 97 -3.362 0.819 -4.950 1.00 0.00 C ATOM 1593 C MET A 97 -2.093 1.640 -5.162 1.00 0.00 C ATOM 1594 O MET A 97 -1.503 2.131 -4.207 1.00 0.00 O ATOM 1595 CB MET A 97 -3.093 -0.648 -5.292 1.00 0.00 C ATOM 1596 CG MET A 97 -3.940 -1.628 -4.496 1.00 0.00 C ATOM 1597 SD MET A 97 -3.606 -1.545 -2.723 1.00 0.00 S ATOM 1598 CE MET A 97 -4.590 -2.916 -2.122 1.00 0.00 C ATOM 0 H MET A 97 -4.852 0.674 -6.420 1.00 0.00 H new ATOM 0 HA MET A 97 -3.644 0.899 -3.900 1.00 0.00 H new ATOM 0 HB2 MET A 97 -3.277 -0.803 -6.355 1.00 0.00 H new ATOM 0 HB3 MET A 97 -2.040 -0.865 -5.115 1.00 0.00 H new ATOM 0 HG2 MET A 97 -4.995 -1.420 -4.674 1.00 0.00 H new ATOM 0 HG3 MET A 97 -3.750 -2.641 -4.852 1.00 0.00 H new ATOM 0 HE1 MET A 97 -5.169 -2.596 -1.256 1.00 0.00 H new ATOM 0 HE2 MET A 97 -5.267 -3.250 -2.908 1.00 0.00 H new ATOM 0 HE3 MET A 97 -3.933 -3.737 -1.836 1.00 0.00 H new ATOM 1608 N ARG A 98 -1.687 1.803 -6.419 1.00 0.00 N ATOM 1609 CA ARG A 98 -0.439 2.495 -6.747 1.00 0.00 C ATOM 1610 C ARG A 98 -0.493 3.966 -6.331 1.00 0.00 C ATOM 1611 O ARG A 98 0.540 4.573 -6.047 1.00 0.00 O ATOM 1612 CB ARG A 98 -0.127 2.371 -8.247 1.00 0.00 C ATOM 1613 CG ARG A 98 0.123 0.936 -8.695 1.00 0.00 C ATOM 1614 CD ARG A 98 0.223 0.814 -10.210 1.00 0.00 C ATOM 1615 NE ARG A 98 1.448 1.406 -10.748 1.00 0.00 N ATOM 1616 CZ ARG A 98 1.598 1.777 -12.021 1.00 0.00 C ATOM 1617 NH1 ARG A 98 0.614 1.594 -12.896 1.00 0.00 N ATOM 1618 NH2 ARG A 98 2.747 2.300 -12.422 1.00 0.00 N ATOM 0 H ARG A 98 -2.204 1.465 -7.230 1.00 0.00 H new ATOM 0 HA ARG A 98 0.363 2.017 -6.185 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -0.958 2.783 -8.819 1.00 0.00 H new ATOM 0 HB3 ARG A 98 0.750 2.975 -8.480 1.00 0.00 H new ATOM 0 HG2 ARG A 98 1.045 0.571 -8.241 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -0.684 0.299 -8.334 1.00 0.00 H new ATOM 0 HD2 ARG A 98 0.181 -0.239 -10.488 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -0.640 1.299 -10.666 1.00 0.00 H new ATOM 0 HE ARG A 98 2.234 1.543 -10.112 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -0.263 1.168 -12.596 1.00 0.00 H new ATOM 0 HH12 ARG A 98 0.736 1.880 -13.867 1.00 0.00 H new ATOM 0 HH21 ARG A 98 3.513 2.418 -11.759 1.00 0.00 H new ATOM 0 HH22 ARG A 98 2.866 2.585 -13.394 1.00 0.00 H new ATOM 1632 N LYS A 99 -1.695 4.533 -6.287 1.00 0.00 N ATOM 1633 CA LYS A 99 -1.869 5.909 -5.831 1.00 0.00 C ATOM 1634 C LYS A 99 -1.791 5.973 -4.308 1.00 0.00 C ATOM 1635 O LYS A 99 -1.097 6.826 -3.750 1.00 0.00 O ATOM 1636 CB LYS A 99 -3.211 6.473 -6.312 1.00 0.00 C ATOM 1637 CG LYS A 99 -3.433 7.933 -5.948 1.00 0.00 C ATOM 1638 CD LYS A 99 -4.798 8.421 -6.408 1.00 0.00 C ATOM 1639 CE LYS A 99 -5.021 9.878 -6.039 1.00 0.00 C ATOM 1640 NZ LYS A 99 -6.410 10.314 -6.330 1.00 0.00 N ATOM 0 H LYS A 99 -2.559 4.064 -6.560 1.00 0.00 H new ATOM 0 HA LYS A 99 -1.067 6.515 -6.254 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -3.272 6.366 -7.395 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -4.018 5.876 -5.887 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -3.346 8.057 -4.869 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -2.654 8.545 -6.403 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -4.884 8.301 -7.488 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -5.577 7.807 -5.956 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -4.810 10.021 -4.979 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -4.320 10.504 -6.591 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -6.518 11.318 -6.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -6.609 10.185 -7.343 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -7.077 9.745 -5.771 1.00 0.00 H new ATOM 1654 N ALA A 100 -2.495 5.059 -3.646 1.00 0.00 N ATOM 1655 CA ALA A 100 -2.497 4.998 -2.190 1.00 0.00 C ATOM 1656 C ALA A 100 -1.103 4.677 -1.661 1.00 0.00 C ATOM 1657 O ALA A 100 -0.647 5.271 -0.686 1.00 0.00 O ATOM 1658 CB ALA A 100 -3.503 3.967 -1.701 1.00 0.00 C ATOM 0 H ALA A 100 -3.072 4.349 -4.097 1.00 0.00 H new ATOM 0 HA ALA A 100 -2.790 5.976 -1.808 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -3.491 3.935 -0.612 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -4.501 4.240 -2.045 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -3.239 2.986 -2.096 1.00 0.00 H new ATOM 1664 N LEU A 101 -0.428 3.743 -2.320 1.00 0.00 N ATOM 1665 CA LEU A 101 0.927 3.371 -1.943 1.00 0.00 C ATOM 1666 C LEU A 101 1.883 4.538 -2.150 1.00 0.00 C ATOM 1667 O LEU A 101 2.794 4.749 -1.348 1.00 0.00 O ATOM 1668 CB LEU A 101 1.395 2.152 -2.743 1.00 0.00 C ATOM 1669 CG LEU A 101 0.671 0.847 -2.414 1.00 0.00 C ATOM 1670 CD1 LEU A 101 1.136 -0.267 -3.341 1.00 0.00 C ATOM 1671 CD2 LEU A 101 0.901 0.470 -0.957 1.00 0.00 C ATOM 0 H LEU A 101 -0.799 3.229 -3.119 1.00 0.00 H new ATOM 0 HA LEU A 101 0.925 3.110 -0.885 1.00 0.00 H new ATOM 0 HB2 LEU A 101 1.268 2.363 -3.805 1.00 0.00 H new ATOM 0 HB3 LEU A 101 2.462 2.011 -2.571 1.00 0.00 H new ATOM 0 HG LEU A 101 -0.399 0.991 -2.567 1.00 0.00 H new ATOM 0 HD11 LEU A 101 0.611 -1.189 -3.093 1.00 0.00 H new ATOM 0 HD12 LEU A 101 0.922 0.006 -4.374 1.00 0.00 H new ATOM 0 HD13 LEU A 101 2.209 -0.417 -3.220 1.00 0.00 H new ATOM 0 HD21 LEU A 101 0.380 -0.461 -0.736 1.00 0.00 H new ATOM 0 HD22 LEU A 101 1.968 0.340 -0.779 1.00 0.00 H new ATOM 0 HD23 LEU A 101 0.520 1.261 -0.312 1.00 0.00 H new ATOM 1683 N ARG A 102 1.673 5.307 -3.215 1.00 0.00 N ATOM 1684 CA ARG A 102 2.501 6.479 -3.462 1.00 0.00 C ATOM 1685 C ARG A 102 2.312 7.486 -2.338 1.00 0.00 C ATOM 1686 O ARG A 102 3.281 8.024 -1.815 1.00 0.00 O ATOM 1687 CB ARG A 102 2.178 7.127 -4.813 1.00 0.00 C ATOM 1688 CG ARG A 102 3.054 8.337 -5.113 1.00 0.00 C ATOM 1689 CD ARG A 102 2.728 8.971 -6.453 1.00 0.00 C ATOM 1690 NE ARG A 102 3.003 8.073 -7.574 1.00 0.00 N ATOM 1691 CZ ARG A 102 3.879 8.335 -8.543 1.00 0.00 C ATOM 1692 NH1 ARG A 102 4.654 9.412 -8.476 1.00 0.00 N ATOM 1693 NH2 ARG A 102 4.009 7.497 -9.561 1.00 0.00 N ATOM 0 H ARG A 102 0.946 5.141 -3.911 1.00 0.00 H new ATOM 0 HA ARG A 102 3.542 6.157 -3.493 1.00 0.00 H new ATOM 0 HB2 ARG A 102 2.304 6.388 -5.604 1.00 0.00 H new ATOM 0 HB3 ARG A 102 1.131 7.431 -4.824 1.00 0.00 H new ATOM 0 HG2 ARG A 102 2.928 9.078 -4.324 1.00 0.00 H new ATOM 0 HG3 ARG A 102 4.101 8.035 -5.102 1.00 0.00 H new ATOM 0 HD2 ARG A 102 1.677 9.258 -6.470 1.00 0.00 H new ATOM 0 HD3 ARG A 102 3.310 9.885 -6.571 1.00 0.00 H new ATOM 0 HE ARG A 102 2.492 7.191 -7.617 1.00 0.00 H new ATOM 0 HH11 ARG A 102 4.581 10.044 -7.679 1.00 0.00 H new ATOM 0 HH12 ARG A 102 5.323 9.606 -9.221 1.00 0.00 H new ATOM 0 HH21 ARG A 102 3.439 6.652 -9.602 1.00 0.00 H new ATOM 0 HH22 ARG A 102 4.679 7.697 -10.303 1.00 0.00 H new ATOM 1707 N ALA A 103 1.063 7.717 -1.951 1.00 0.00 N ATOM 1708 CA ALA A 103 0.766 8.625 -0.853 1.00 0.00 C ATOM 1709 C ALA A 103 1.357 8.094 0.447 1.00 0.00 C ATOM 1710 O ALA A 103 1.862 8.856 1.264 1.00 0.00 O ATOM 1711 CB ALA A 103 -0.736 8.822 -0.719 1.00 0.00 C ATOM 0 H ALA A 103 0.243 7.289 -2.381 1.00 0.00 H new ATOM 0 HA ALA A 103 1.220 9.592 -1.068 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -0.941 9.504 0.106 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -1.132 9.242 -1.644 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -1.213 7.862 -0.524 1.00 0.00 H new ATOM 1717 N LYS A 104 1.289 6.781 0.614 1.00 0.00 N ATOM 1718 CA LYS A 104 1.865 6.097 1.768 1.00 0.00 C ATOM 1719 C LYS A 104 3.345 6.442 1.943 1.00 0.00 C ATOM 1720 O LYS A 104 3.760 6.932 2.997 1.00 0.00 O ATOM 1721 CB LYS A 104 1.683 4.583 1.584 1.00 0.00 C ATOM 1722 CG LYS A 104 2.420 3.710 2.590 1.00 0.00 C ATOM 1723 CD LYS A 104 1.854 3.833 3.994 1.00 0.00 C ATOM 1724 CE LYS A 104 1.828 2.482 4.692 1.00 0.00 C ATOM 1725 NZ LYS A 104 3.077 1.707 4.461 1.00 0.00 N ATOM 0 H LYS A 104 0.831 6.155 -0.049 1.00 0.00 H new ATOM 0 HA LYS A 104 1.350 6.428 2.670 1.00 0.00 H new ATOM 0 HB2 LYS A 104 0.619 4.353 1.639 1.00 0.00 H new ATOM 0 HB3 LYS A 104 2.016 4.313 0.582 1.00 0.00 H new ATOM 0 HG2 LYS A 104 2.367 2.669 2.270 1.00 0.00 H new ATOM 0 HG3 LYS A 104 3.474 3.986 2.602 1.00 0.00 H new ATOM 0 HD2 LYS A 104 2.456 4.534 4.573 1.00 0.00 H new ATOM 0 HD3 LYS A 104 0.845 4.242 3.948 1.00 0.00 H new ATOM 0 HE2 LYS A 104 1.687 2.631 5.763 1.00 0.00 H new ATOM 0 HE3 LYS A 104 0.974 1.907 4.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 3.106 0.894 5.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 3.098 1.367 3.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 3.901 2.317 4.634 1.00 0.00 H new ATOM 1739 N PHE A 105 4.130 6.200 0.903 1.00 0.00 N ATOM 1740 CA PHE A 105 5.574 6.391 0.982 1.00 0.00 C ATOM 1741 C PHE A 105 5.982 7.854 0.811 1.00 0.00 C ATOM 1742 O PHE A 105 6.775 8.367 1.590 1.00 0.00 O ATOM 1743 CB PHE A 105 6.277 5.509 -0.050 1.00 0.00 C ATOM 1744 CG PHE A 105 6.133 4.043 0.243 1.00 0.00 C ATOM 1745 CD1 PHE A 105 6.838 3.469 1.284 1.00 0.00 C ATOM 1746 CD2 PHE A 105 5.294 3.240 -0.515 1.00 0.00 C ATOM 1747 CE1 PHE A 105 6.714 2.127 1.569 1.00 0.00 C ATOM 1748 CE2 PHE A 105 5.165 1.892 -0.235 1.00 0.00 C ATOM 1749 CZ PHE A 105 5.876 1.335 0.810 1.00 0.00 C ATOM 0 H PHE A 105 3.795 5.872 -0.003 1.00 0.00 H new ATOM 0 HA PHE A 105 5.887 6.094 1.983 1.00 0.00 H new ATOM 0 HB2 PHE A 105 5.869 5.719 -1.039 1.00 0.00 H new ATOM 0 HB3 PHE A 105 7.336 5.767 -0.080 1.00 0.00 H new ATOM 0 HD1 PHE A 105 7.496 4.082 1.883 1.00 0.00 H new ATOM 0 HD2 PHE A 105 4.736 3.672 -1.332 1.00 0.00 H new ATOM 0 HE1 PHE A 105 7.272 1.695 2.386 1.00 0.00 H new ATOM 0 HE2 PHE A 105 4.509 1.276 -0.832 1.00 0.00 H new ATOM 0 HZ PHE A 105 5.777 0.283 1.033 1.00 0.00 H new ATOM 1759 N GLU A 106 5.429 8.532 -0.185 1.00 0.00 N ATOM 1760 CA GLU A 106 5.826 9.912 -0.480 1.00 0.00 C ATOM 1761 C GLU A 106 5.449 10.870 0.653 1.00 0.00 C ATOM 1762 O GLU A 106 6.026 11.952 0.767 1.00 0.00 O ATOM 1763 CB GLU A 106 5.202 10.386 -1.795 1.00 0.00 C ATOM 1764 CG GLU A 106 5.796 9.728 -3.034 1.00 0.00 C ATOM 1765 CD GLU A 106 7.179 10.248 -3.373 1.00 0.00 C ATOM 1766 OE1 GLU A 106 7.275 11.306 -4.021 1.00 0.00 O ATOM 1767 OE2 GLU A 106 8.184 9.612 -2.992 1.00 0.00 O ATOM 0 H GLU A 106 4.708 8.157 -0.802 1.00 0.00 H new ATOM 0 HA GLU A 106 6.912 9.919 -0.577 1.00 0.00 H new ATOM 0 HB2 GLU A 106 4.130 10.188 -1.769 1.00 0.00 H new ATOM 0 HB3 GLU A 106 5.325 11.466 -1.875 1.00 0.00 H new ATOM 0 HG2 GLU A 106 5.847 8.650 -2.878 1.00 0.00 H new ATOM 0 HG3 GLU A 106 5.132 9.896 -3.882 1.00 0.00 H new ATOM 1774 N GLN A 107 4.484 10.482 1.481 1.00 0.00 N ATOM 1775 CA GLN A 107 4.077 11.310 2.613 1.00 0.00 C ATOM 1776 C GLN A 107 5.060 11.156 3.768 1.00 0.00 C ATOM 1777 O GLN A 107 5.463 12.136 4.395 1.00 0.00 O ATOM 1778 CB GLN A 107 2.679 10.919 3.092 1.00 0.00 C ATOM 1779 CG GLN A 107 1.965 12.013 3.867 1.00 0.00 C ATOM 1780 CD GLN A 107 1.499 13.146 2.973 1.00 0.00 C ATOM 1781 OE1 GLN A 107 1.161 12.821 1.733 1.00 0.00 O flip ATOM 1782 NE2 GLN A 107 1.429 14.301 3.397 1.00 0.00 N flip ATOM 0 H GLN A 107 3.971 9.605 1.391 1.00 0.00 H new ATOM 0 HA GLN A 107 4.067 12.348 2.281 1.00 0.00 H new ATOM 0 HB2 GLN A 107 2.073 10.645 2.228 1.00 0.00 H new ATOM 0 HB3 GLN A 107 2.756 10.033 3.722 1.00 0.00 H new ATOM 0 HG2 GLN A 107 1.106 11.586 4.385 1.00 0.00 H new ATOM 0 HG3 GLN A 107 2.634 12.409 4.631 1.00 0.00 H new ATOM 0 HE21 GLN A 107 1.699 14.509 4.358 1.00 0.00 H new ATOM 0 HE22 GLN A 107 1.101 15.049 2.786 1.00 0.00 H new ATOM 1791 N HIS A 108 5.438 9.916 4.044 1.00 0.00 N ATOM 1792 CA HIS A 108 6.317 9.617 5.166 1.00 0.00 C ATOM 1793 C HIS A 108 7.747 9.432 4.699 1.00 0.00 C ATOM 1794 O HIS A 108 8.057 8.457 4.024 1.00 0.00 O ATOM 1795 CB HIS A 108 5.859 8.350 5.894 1.00 0.00 C ATOM 1796 CG HIS A 108 4.634 8.532 6.732 1.00 0.00 C ATOM 1797 ND1 HIS A 108 4.686 8.754 8.089 1.00 0.00 N ATOM 1798 CD2 HIS A 108 3.321 8.517 6.403 1.00 0.00 C ATOM 1799 CE1 HIS A 108 3.458 8.872 8.559 1.00 0.00 C ATOM 1800 NE2 HIS A 108 2.607 8.733 7.556 1.00 0.00 N ATOM 0 H HIS A 108 5.149 9.099 3.505 1.00 0.00 H new ATOM 0 HA HIS A 108 6.271 10.463 5.852 1.00 0.00 H new ATOM 0 HB2 HIS A 108 5.668 7.570 5.157 1.00 0.00 H new ATOM 0 HB3 HIS A 108 6.671 7.996 6.530 1.00 0.00 H new ATOM 0 HD1 HIS A 108 5.539 8.817 8.644 1.00 0.00 H new ATOM 0 HD2 HIS A 108 2.911 8.363 5.416 1.00 0.00 H new ATOM 0 HE1 HIS A 108 3.193 9.052 9.590 1.00 0.00 H new ATOM 0 HE2 HIS A 108 1.591 8.779 7.627 1.00 0.00 H new ATOM 1809 N ALA A 109 8.618 10.357 5.082 1.00 0.00 N ATOM 1810 CA ALA A 109 10.028 10.282 4.718 1.00 0.00 C ATOM 1811 C ALA A 109 10.646 8.992 5.251 1.00 0.00 C ATOM 1812 O ALA A 109 11.544 8.418 4.631 1.00 0.00 O ATOM 1813 CB ALA A 109 10.775 11.495 5.251 1.00 0.00 C ATOM 0 H ALA A 109 8.372 11.170 5.646 1.00 0.00 H new ATOM 0 HA ALA A 109 10.109 10.278 3.631 1.00 0.00 H new ATOM 0 HB1 ALA A 109 11.826 11.426 4.972 1.00 0.00 H new ATOM 0 HB2 ALA A 109 10.346 12.402 4.826 1.00 0.00 H new ATOM 0 HB3 ALA A 109 10.689 11.527 6.337 1.00 0.00 H new ATOM 1819 N GLU A 110 10.140 8.542 6.396 1.00 0.00 N ATOM 1820 CA GLU A 110 10.584 7.294 7.007 1.00 0.00 C ATOM 1821 C GLU A 110 10.376 6.136 6.039 1.00 0.00 C ATOM 1822 O GLU A 110 11.326 5.465 5.627 1.00 0.00 O ATOM 1823 CB GLU A 110 9.801 6.996 8.297 1.00 0.00 C ATOM 1824 CG GLU A 110 9.477 8.215 9.150 1.00 0.00 C ATOM 1825 CD GLU A 110 8.212 8.932 8.699 1.00 0.00 C ATOM 1826 OE1 GLU A 110 7.111 8.565 9.167 1.00 0.00 O ATOM 1827 OE2 GLU A 110 8.313 9.853 7.864 1.00 0.00 O ATOM 0 H GLU A 110 9.415 9.029 6.923 1.00 0.00 H new ATOM 0 HA GLU A 110 11.642 7.403 7.247 1.00 0.00 H new ATOM 0 HB2 GLU A 110 8.868 6.499 8.031 1.00 0.00 H new ATOM 0 HB3 GLU A 110 10.376 6.293 8.899 1.00 0.00 H new ATOM 0 HG2 GLU A 110 9.363 7.906 10.189 1.00 0.00 H new ATOM 0 HG3 GLU A 110 10.315 8.911 9.115 1.00 0.00 H new ATOM 1834 N LEU A 111 9.120 5.937 5.662 1.00 0.00 N ATOM 1835 CA LEU A 111 8.722 4.822 4.813 1.00 0.00 C ATOM 1836 C LEU A 111 9.259 5.010 3.398 1.00 0.00 C ATOM 1837 O LEU A 111 9.615 4.046 2.722 1.00 0.00 O ATOM 1838 CB LEU A 111 7.193 4.719 4.784 1.00 0.00 C ATOM 1839 CG LEU A 111 6.497 4.929 6.135 1.00 0.00 C ATOM 1840 CD1 LEU A 111 4.991 4.799 5.986 1.00 0.00 C ATOM 1841 CD2 LEU A 111 7.013 3.948 7.179 1.00 0.00 C ATOM 0 H LEU A 111 8.348 6.544 5.936 1.00 0.00 H new ATOM 0 HA LEU A 111 9.139 3.901 5.221 1.00 0.00 H new ATOM 0 HB2 LEU A 111 6.809 5.455 4.078 1.00 0.00 H new ATOM 0 HB3 LEU A 111 6.919 3.736 4.401 1.00 0.00 H new ATOM 0 HG LEU A 111 6.729 5.938 6.476 1.00 0.00 H new ATOM 0 HD11 LEU A 111 4.515 4.951 6.955 1.00 0.00 H new ATOM 0 HD12 LEU A 111 4.629 5.548 5.282 1.00 0.00 H new ATOM 0 HD13 LEU A 111 4.747 3.804 5.614 1.00 0.00 H new ATOM 0 HD21 LEU A 111 6.501 4.121 8.126 1.00 0.00 H new ATOM 0 HD22 LEU A 111 6.823 2.928 6.845 1.00 0.00 H new ATOM 0 HD23 LEU A 111 8.085 4.091 7.315 1.00 0.00 H new ATOM 1853 N ARG A 112 9.313 6.265 2.967 1.00 0.00 N ATOM 1854 CA ARG A 112 9.833 6.626 1.651 1.00 0.00 C ATOM 1855 C ARG A 112 11.242 6.071 1.473 1.00 0.00 C ATOM 1856 O ARG A 112 11.532 5.346 0.515 1.00 0.00 O ATOM 1857 CB ARG A 112 9.870 8.148 1.531 1.00 0.00 C ATOM 1858 CG ARG A 112 9.705 8.694 0.124 1.00 0.00 C ATOM 1859 CD ARG A 112 9.897 10.202 0.130 1.00 0.00 C ATOM 1860 NE ARG A 112 9.255 10.877 -0.993 1.00 0.00 N ATOM 1861 CZ ARG A 112 9.139 12.204 -1.088 1.00 0.00 C ATOM 1862 NH1 ARG A 112 9.664 12.986 -0.151 1.00 0.00 N ATOM 1863 NH2 ARG A 112 8.501 12.753 -2.115 1.00 0.00 N ATOM 0 H ARG A 112 8.998 7.062 3.520 1.00 0.00 H new ATOM 0 HA ARG A 112 9.187 6.205 0.881 1.00 0.00 H new ATOM 0 HB2 ARG A 112 9.082 8.564 2.159 1.00 0.00 H new ATOM 0 HB3 ARG A 112 10.819 8.504 1.932 1.00 0.00 H new ATOM 0 HG2 ARG A 112 10.430 8.229 -0.544 1.00 0.00 H new ATOM 0 HG3 ARG A 112 8.715 8.446 -0.258 1.00 0.00 H new ATOM 0 HD2 ARG A 112 9.500 10.607 1.061 1.00 0.00 H new ATOM 0 HD3 ARG A 112 10.964 10.424 0.115 1.00 0.00 H new ATOM 0 HE ARG A 112 8.874 10.304 -1.746 1.00 0.00 H new ATOM 0 HH11 ARG A 112 10.156 12.573 0.641 1.00 0.00 H new ATOM 0 HH12 ARG A 112 9.575 14.000 -0.224 1.00 0.00 H new ATOM 0 HH21 ARG A 112 8.095 12.160 -2.839 1.00 0.00 H new ATOM 0 HH22 ARG A 112 8.417 13.767 -2.180 1.00 0.00 H new ATOM 1877 N ALA A 113 12.113 6.415 2.419 1.00 0.00 N ATOM 1878 CA ALA A 113 13.494 5.961 2.393 1.00 0.00 C ATOM 1879 C ALA A 113 13.568 4.459 2.634 1.00 0.00 C ATOM 1880 O ALA A 113 14.391 3.768 2.035 1.00 0.00 O ATOM 1881 CB ALA A 113 14.316 6.706 3.433 1.00 0.00 C ATOM 0 H ALA A 113 11.882 7.009 3.215 1.00 0.00 H new ATOM 0 HA ALA A 113 13.908 6.172 1.407 1.00 0.00 H new ATOM 0 HB1 ALA A 113 15.347 6.355 3.401 1.00 0.00 H new ATOM 0 HB2 ALA A 113 14.290 7.775 3.220 1.00 0.00 H new ATOM 0 HB3 ALA A 113 13.901 6.523 4.424 1.00 0.00 H new ATOM 1887 N LEU A 114 12.692 3.969 3.505 1.00 0.00 N ATOM 1888 CA LEU A 114 12.622 2.548 3.823 1.00 0.00 C ATOM 1889 C LEU A 114 12.361 1.723 2.565 1.00 0.00 C ATOM 1890 O LEU A 114 13.053 0.737 2.305 1.00 0.00 O ATOM 1891 CB LEU A 114 11.526 2.300 4.863 1.00 0.00 C ATOM 1892 CG LEU A 114 11.321 0.842 5.270 1.00 0.00 C ATOM 1893 CD1 LEU A 114 12.622 0.235 5.761 1.00 0.00 C ATOM 1894 CD2 LEU A 114 10.254 0.739 6.348 1.00 0.00 C ATOM 0 H LEU A 114 12.014 4.542 4.008 1.00 0.00 H new ATOM 0 HA LEU A 114 13.581 2.237 4.238 1.00 0.00 H new ATOM 0 HB2 LEU A 114 11.760 2.879 5.757 1.00 0.00 H new ATOM 0 HB3 LEU A 114 10.584 2.685 4.471 1.00 0.00 H new ATOM 0 HG LEU A 114 10.989 0.285 4.393 1.00 0.00 H new ATOM 0 HD11 LEU A 114 12.454 -0.804 6.046 1.00 0.00 H new ATOM 0 HD12 LEU A 114 13.366 0.277 4.966 1.00 0.00 H new ATOM 0 HD13 LEU A 114 12.981 0.795 6.625 1.00 0.00 H new ATOM 0 HD21 LEU A 114 10.119 -0.306 6.628 1.00 0.00 H new ATOM 0 HD22 LEU A 114 10.564 1.312 7.222 1.00 0.00 H new ATOM 0 HD23 LEU A 114 9.313 1.137 5.968 1.00 0.00 H new ATOM 1906 N LEU A 115 11.372 2.136 1.781 1.00 0.00 N ATOM 1907 CA LEU A 115 11.049 1.456 0.533 1.00 0.00 C ATOM 1908 C LEU A 115 12.243 1.437 -0.410 1.00 0.00 C ATOM 1909 O LEU A 115 12.606 0.387 -0.943 1.00 0.00 O ATOM 1910 CB LEU A 115 9.858 2.127 -0.159 1.00 0.00 C ATOM 1911 CG LEU A 115 9.531 1.591 -1.556 1.00 0.00 C ATOM 1912 CD1 LEU A 115 9.222 0.102 -1.507 1.00 0.00 C ATOM 1913 CD2 LEU A 115 8.371 2.361 -2.165 1.00 0.00 C ATOM 0 H LEU A 115 10.779 2.940 1.988 1.00 0.00 H new ATOM 0 HA LEU A 115 10.785 0.428 0.781 1.00 0.00 H new ATOM 0 HB2 LEU A 115 8.978 2.010 0.473 1.00 0.00 H new ATOM 0 HB3 LEU A 115 10.057 3.196 -0.234 1.00 0.00 H new ATOM 0 HG LEU A 115 10.407 1.733 -2.189 1.00 0.00 H new ATOM 0 HD11 LEU A 115 8.993 -0.255 -2.511 1.00 0.00 H new ATOM 0 HD12 LEU A 115 10.087 -0.436 -1.119 1.00 0.00 H new ATOM 0 HD13 LEU A 115 8.365 -0.070 -0.856 1.00 0.00 H new ATOM 0 HD21 LEU A 115 8.153 1.966 -3.157 1.00 0.00 H new ATOM 0 HD22 LEU A 115 7.491 2.255 -1.531 1.00 0.00 H new ATOM 0 HD23 LEU A 115 8.636 3.415 -2.244 1.00 0.00 H new ATOM 1925 N LEU A 116 12.864 2.589 -0.600 1.00 0.00 N ATOM 1926 CA LEU A 116 13.961 2.706 -1.555 1.00 0.00 C ATOM 1927 C LEU A 116 15.208 1.970 -1.063 1.00 0.00 C ATOM 1928 O LEU A 116 16.096 1.643 -1.848 1.00 0.00 O ATOM 1929 CB LEU A 116 14.275 4.180 -1.829 1.00 0.00 C ATOM 1930 CG LEU A 116 13.087 5.010 -2.326 1.00 0.00 C ATOM 1931 CD1 LEU A 116 13.537 6.388 -2.785 1.00 0.00 C ATOM 1932 CD2 LEU A 116 12.368 4.291 -3.452 1.00 0.00 C ATOM 0 H LEU A 116 12.632 3.453 -0.111 1.00 0.00 H new ATOM 0 HA LEU A 116 13.647 2.237 -2.488 1.00 0.00 H new ATOM 0 HB2 LEU A 116 14.657 4.631 -0.914 1.00 0.00 H new ATOM 0 HB3 LEU A 116 15.073 4.235 -2.569 1.00 0.00 H new ATOM 0 HG LEU A 116 12.395 5.137 -1.493 1.00 0.00 H new ATOM 0 HD11 LEU A 116 12.674 6.956 -3.133 1.00 0.00 H new ATOM 0 HD12 LEU A 116 14.006 6.914 -1.953 1.00 0.00 H new ATOM 0 HD13 LEU A 116 14.255 6.284 -3.599 1.00 0.00 H new ATOM 0 HD21 LEU A 116 11.527 4.896 -3.792 1.00 0.00 H new ATOM 0 HD22 LEU A 116 13.058 4.131 -4.280 1.00 0.00 H new ATOM 0 HD23 LEU A 116 12.001 3.329 -3.094 1.00 0.00 H new ATOM 1944 N ALA A 117 15.253 1.690 0.233 1.00 0.00 N ATOM 1945 CA ALA A 117 16.391 1.004 0.831 1.00 0.00 C ATOM 1946 C ALA A 117 16.318 -0.505 0.613 1.00 0.00 C ATOM 1947 O ALA A 117 17.309 -1.211 0.799 1.00 0.00 O ATOM 1948 CB ALA A 117 16.468 1.316 2.318 1.00 0.00 C ATOM 0 H ALA A 117 14.512 1.928 0.892 1.00 0.00 H new ATOM 0 HA ALA A 117 17.294 1.367 0.339 1.00 0.00 H new ATOM 0 HB1 ALA A 117 17.322 0.798 2.755 1.00 0.00 H new ATOM 0 HB2 ALA A 117 16.584 2.391 2.459 1.00 0.00 H new ATOM 0 HB3 ALA A 117 15.553 0.983 2.807 1.00 0.00 H new ATOM 1954 N THR A 118 15.149 -0.998 0.215 1.00 0.00 N ATOM 1955 CA THR A 118 14.969 -2.431 0.013 1.00 0.00 C ATOM 1956 C THR A 118 15.664 -2.902 -1.257 1.00 0.00 C ATOM 1957 O THR A 118 16.123 -4.033 -1.331 1.00 0.00 O ATOM 1958 CB THR A 118 13.480 -2.827 -0.056 1.00 0.00 C ATOM 1959 OG1 THR A 118 12.849 -2.216 -1.195 1.00 0.00 O ATOM 1960 CG2 THR A 118 12.758 -2.413 1.215 1.00 0.00 C ATOM 0 H THR A 118 14.321 -0.433 0.028 1.00 0.00 H new ATOM 0 HA THR A 118 15.419 -2.918 0.878 1.00 0.00 H new ATOM 0 HB THR A 118 13.422 -3.911 -0.158 1.00 0.00 H new ATOM 0 HG1 THR A 118 12.466 -1.353 -0.933 1.00 0.00 H new ATOM 0 HG21 THR A 118 11.709 -2.701 1.148 1.00 0.00 H new ATOM 0 HG22 THR A 118 13.216 -2.908 2.071 1.00 0.00 H new ATOM 0 HG23 THR A 118 12.831 -1.333 1.339 1.00 0.00 H new ATOM 1968 N ALA A 119 15.729 -2.028 -2.256 1.00 0.00 N ATOM 1969 CA ALA A 119 16.380 -2.356 -3.522 1.00 0.00 C ATOM 1970 C ALA A 119 17.837 -2.759 -3.300 1.00 0.00 C ATOM 1971 O ALA A 119 18.549 -2.113 -2.531 1.00 0.00 O ATOM 1972 CB ALA A 119 16.302 -1.172 -4.475 1.00 0.00 C ATOM 0 H ALA A 119 15.339 -1.086 -2.215 1.00 0.00 H new ATOM 0 HA ALA A 119 15.856 -3.203 -3.964 1.00 0.00 H new ATOM 0 HB1 ALA A 119 16.791 -1.429 -5.415 1.00 0.00 H new ATOM 0 HB2 ALA A 119 15.257 -0.926 -4.665 1.00 0.00 H new ATOM 0 HB3 ALA A 119 16.802 -0.312 -4.029 1.00 0.00 H new ATOM 1978 N PRO A 120 18.305 -3.828 -3.970 1.00 0.00 N ATOM 1979 CA PRO A 120 17.510 -4.635 -4.883 1.00 0.00 C ATOM 1980 C PRO A 120 17.005 -5.945 -4.262 1.00 0.00 C ATOM 1981 O PRO A 120 17.514 -7.025 -4.565 1.00 0.00 O ATOM 1982 CB PRO A 120 18.528 -4.928 -5.986 1.00 0.00 C ATOM 1983 CG PRO A 120 19.871 -4.923 -5.307 1.00 0.00 C ATOM 1984 CD PRO A 120 19.685 -4.314 -3.934 1.00 0.00 C ATOM 0 HA PRO A 120 16.599 -4.129 -5.204 1.00 0.00 H new ATOM 0 HB2 PRO A 120 18.330 -5.891 -6.457 1.00 0.00 H new ATOM 0 HB3 PRO A 120 18.483 -4.174 -6.772 1.00 0.00 H new ATOM 0 HG2 PRO A 120 20.264 -5.937 -5.227 1.00 0.00 H new ATOM 0 HG3 PRO A 120 20.592 -4.347 -5.887 1.00 0.00 H new ATOM 0 HD2 PRO A 120 19.833 -5.050 -3.143 1.00 0.00 H new ATOM 0 HD3 PRO A 120 20.393 -3.505 -3.753 1.00 0.00 H new ATOM 1992 N ALA A 121 16.040 -5.843 -3.360 1.00 0.00 N ATOM 1993 CA ALA A 121 15.400 -7.019 -2.781 1.00 0.00 C ATOM 1994 C ALA A 121 13.951 -7.140 -3.257 1.00 0.00 C ATOM 1995 O ALA A 121 13.343 -6.149 -3.672 1.00 0.00 O ATOM 1996 CB ALA A 121 15.455 -6.957 -1.259 1.00 0.00 C ATOM 0 H ALA A 121 15.680 -4.955 -3.011 1.00 0.00 H new ATOM 0 HA ALA A 121 15.944 -7.903 -3.115 1.00 0.00 H new ATOM 0 HB1 ALA A 121 14.974 -7.841 -0.841 1.00 0.00 H new ATOM 0 HB2 ALA A 121 16.495 -6.922 -0.934 1.00 0.00 H new ATOM 0 HB3 ALA A 121 14.936 -6.063 -0.912 1.00 0.00 H new ATOM 2002 N LYS A 122 13.408 -8.353 -3.197 1.00 0.00 N ATOM 2003 CA LYS A 122 12.012 -8.590 -3.539 1.00 0.00 C ATOM 2004 C LYS A 122 11.119 -8.287 -2.342 1.00 0.00 C ATOM 2005 O LYS A 122 11.472 -8.598 -1.201 1.00 0.00 O ATOM 2006 CB LYS A 122 11.794 -10.045 -3.968 1.00 0.00 C ATOM 2007 CG LYS A 122 11.334 -10.206 -5.409 1.00 0.00 C ATOM 2008 CD LYS A 122 12.507 -10.348 -6.367 1.00 0.00 C ATOM 2009 CE LYS A 122 13.243 -11.662 -6.144 1.00 0.00 C ATOM 2010 NZ LYS A 122 14.271 -11.915 -7.183 1.00 0.00 N ATOM 0 H LYS A 122 13.918 -9.190 -2.913 1.00 0.00 H new ATOM 0 HA LYS A 122 11.754 -7.931 -4.368 1.00 0.00 H new ATOM 0 HB2 LYS A 122 12.724 -10.596 -3.831 1.00 0.00 H new ATOM 0 HB3 LYS A 122 11.054 -10.500 -3.309 1.00 0.00 H new ATOM 0 HG2 LYS A 122 10.692 -11.083 -5.489 1.00 0.00 H new ATOM 0 HG3 LYS A 122 10.733 -9.343 -5.697 1.00 0.00 H new ATOM 0 HD2 LYS A 122 12.148 -10.299 -7.395 1.00 0.00 H new ATOM 0 HD3 LYS A 122 13.196 -9.514 -6.229 1.00 0.00 H new ATOM 0 HE2 LYS A 122 13.717 -11.648 -5.163 1.00 0.00 H new ATOM 0 HE3 LYS A 122 12.525 -12.482 -6.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 14.540 -12.920 -7.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 13.886 -11.673 -8.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 15.109 -11.330 -6.992 1.00 0.00 H new ATOM 2024 N LEU A 123 9.968 -7.689 -2.601 1.00 0.00 N ATOM 2025 CA LEU A 123 9.027 -7.354 -1.542 1.00 0.00 C ATOM 2026 C LEU A 123 7.800 -8.257 -1.619 1.00 0.00 C ATOM 2027 O LEU A 123 7.046 -8.213 -2.591 1.00 0.00 O ATOM 2028 CB LEU A 123 8.608 -5.886 -1.654 1.00 0.00 C ATOM 2029 CG LEU A 123 9.762 -4.881 -1.670 1.00 0.00 C ATOM 2030 CD1 LEU A 123 9.230 -3.464 -1.789 1.00 0.00 C ATOM 2031 CD2 LEU A 123 10.613 -5.029 -0.420 1.00 0.00 C ATOM 0 H LEU A 123 9.661 -7.425 -3.537 1.00 0.00 H new ATOM 0 HA LEU A 123 9.515 -7.509 -0.580 1.00 0.00 H new ATOM 0 HB2 LEU A 123 8.024 -5.760 -2.566 1.00 0.00 H new ATOM 0 HB3 LEU A 123 7.950 -5.647 -0.818 1.00 0.00 H new ATOM 0 HG LEU A 123 10.388 -5.087 -2.538 1.00 0.00 H new ATOM 0 HD11 LEU A 123 10.064 -2.762 -1.799 1.00 0.00 H new ATOM 0 HD12 LEU A 123 8.661 -3.365 -2.714 1.00 0.00 H new ATOM 0 HD13 LEU A 123 8.582 -3.246 -0.940 1.00 0.00 H new ATOM 0 HD21 LEU A 123 11.429 -4.307 -0.448 1.00 0.00 H new ATOM 0 HD22 LEU A 123 9.998 -4.848 0.462 1.00 0.00 H new ATOM 0 HD23 LEU A 123 11.023 -6.038 -0.376 1.00 0.00 H new ATOM 2043 N VAL A 124 7.607 -9.087 -0.602 1.00 0.00 N ATOM 2044 CA VAL A 124 6.496 -10.029 -0.596 1.00 0.00 C ATOM 2045 C VAL A 124 5.701 -9.935 0.704 1.00 0.00 C ATOM 2046 O VAL A 124 6.229 -10.219 1.782 1.00 0.00 O ATOM 2047 CB VAL A 124 6.985 -11.488 -0.771 1.00 0.00 C ATOM 2048 CG1 VAL A 124 5.807 -12.447 -0.869 1.00 0.00 C ATOM 2049 CG2 VAL A 124 7.887 -11.623 -1.991 1.00 0.00 C ATOM 0 H VAL A 124 8.202 -9.127 0.225 1.00 0.00 H new ATOM 0 HA VAL A 124 5.857 -9.761 -1.437 1.00 0.00 H new ATOM 0 HB VAL A 124 7.569 -11.750 0.112 1.00 0.00 H new ATOM 0 HG11 VAL A 124 6.176 -13.465 -0.991 1.00 0.00 H new ATOM 0 HG12 VAL A 124 5.210 -12.384 0.041 1.00 0.00 H new ATOM 0 HG13 VAL A 124 5.190 -12.179 -1.727 1.00 0.00 H new ATOM 0 HG21 VAL A 124 8.215 -12.658 -2.088 1.00 0.00 H new ATOM 0 HG22 VAL A 124 7.336 -11.331 -2.885 1.00 0.00 H new ATOM 0 HG23 VAL A 124 8.757 -10.976 -1.874 1.00 0.00 H new ATOM 2059 N GLU A 125 4.439 -9.528 0.599 1.00 0.00 N ATOM 2060 CA GLU A 125 3.540 -9.563 1.743 1.00 0.00 C ATOM 2061 C GLU A 125 3.018 -10.985 1.898 1.00 0.00 C ATOM 2062 O GLU A 125 2.632 -11.624 0.915 1.00 0.00 O ATOM 2063 CB GLU A 125 2.370 -8.578 1.575 1.00 0.00 C ATOM 2064 CG GLU A 125 1.490 -8.452 2.820 1.00 0.00 C ATOM 2065 CD GLU A 125 0.341 -7.469 2.649 1.00 0.00 C ATOM 2066 OE1 GLU A 125 -0.739 -7.888 2.195 1.00 0.00 O ATOM 2067 OE2 GLU A 125 0.514 -6.275 2.979 1.00 0.00 O ATOM 0 H GLU A 125 4.020 -9.173 -0.261 1.00 0.00 H new ATOM 0 HA GLU A 125 4.086 -9.260 2.636 1.00 0.00 H new ATOM 0 HB2 GLU A 125 2.767 -7.595 1.321 1.00 0.00 H new ATOM 0 HB3 GLU A 125 1.753 -8.900 0.736 1.00 0.00 H new ATOM 0 HG2 GLU A 125 1.086 -9.433 3.071 1.00 0.00 H new ATOM 0 HG3 GLU A 125 2.107 -8.136 3.662 1.00 0.00 H new ATOM 2074 N HIS A 126 3.037 -11.490 3.117 1.00 0.00 N ATOM 2075 CA HIS A 126 2.665 -12.870 3.370 1.00 0.00 C ATOM 2076 C HIS A 126 1.508 -12.956 4.351 1.00 0.00 C ATOM 2077 O HIS A 126 1.616 -12.510 5.485 1.00 0.00 O ATOM 2078 CB HIS A 126 3.879 -13.651 3.904 1.00 0.00 C ATOM 2079 CG HIS A 126 3.561 -15.028 4.423 1.00 0.00 C ATOM 2080 ND1 HIS A 126 3.636 -16.168 3.651 1.00 0.00 N ATOM 2081 CD2 HIS A 126 3.176 -15.439 5.655 1.00 0.00 C ATOM 2082 CE1 HIS A 126 3.310 -17.215 4.384 1.00 0.00 C ATOM 2083 NE2 HIS A 126 3.028 -16.801 5.605 1.00 0.00 N ATOM 0 H HIS A 126 3.306 -10.965 3.949 1.00 0.00 H new ATOM 0 HA HIS A 126 2.339 -13.314 2.430 1.00 0.00 H new ATOM 0 HB2 HIS A 126 4.617 -13.739 3.106 1.00 0.00 H new ATOM 0 HB3 HIS A 126 4.342 -13.074 4.704 1.00 0.00 H new ATOM 0 HD2 HIS A 126 3.015 -14.810 6.518 1.00 0.00 H new ATOM 0 HE1 HIS A 126 3.279 -18.239 4.042 1.00 0.00 H new ATOM 0 HE2 HIS A 126 2.746 -17.397 6.384 1.00 0.00 H new ATOM 2092 N THR A 127 0.416 -13.532 3.903 1.00 0.00 N ATOM 2093 CA THR A 127 -0.687 -13.873 4.775 1.00 0.00 C ATOM 2094 C THR A 127 -0.927 -15.367 4.660 1.00 0.00 C ATOM 2095 O THR A 127 -0.352 -16.013 3.790 1.00 0.00 O ATOM 2096 CB THR A 127 -1.977 -13.089 4.424 1.00 0.00 C ATOM 2097 OG1 THR A 127 -3.000 -13.351 5.397 1.00 0.00 O ATOM 2098 CG2 THR A 127 -2.499 -13.458 3.043 1.00 0.00 C ATOM 0 H THR A 127 0.266 -13.778 2.924 1.00 0.00 H new ATOM 0 HA THR A 127 -0.429 -13.598 5.798 1.00 0.00 H new ATOM 0 HB THR A 127 -1.723 -12.029 4.428 1.00 0.00 H new ATOM 0 HG1 THR A 127 -3.809 -12.849 5.165 1.00 0.00 H new ATOM 0 HG21 THR A 127 -3.404 -12.888 2.832 1.00 0.00 H new ATOM 0 HG22 THR A 127 -1.742 -13.227 2.294 1.00 0.00 H new ATOM 0 HG23 THR A 127 -2.726 -14.524 3.012 1.00 0.00 H new ATOM 2106 N GLU A 128 -1.697 -15.937 5.561 1.00 0.00 N ATOM 2107 CA GLU A 128 -2.076 -17.329 5.420 1.00 0.00 C ATOM 2108 C GLU A 128 -3.580 -17.441 5.243 1.00 0.00 C ATOM 2109 O GLU A 128 -4.136 -18.536 5.176 1.00 0.00 O ATOM 2110 CB GLU A 128 -1.612 -18.167 6.612 1.00 0.00 C ATOM 2111 CG GLU A 128 -0.132 -18.016 6.933 1.00 0.00 C ATOM 2112 CD GLU A 128 0.133 -17.030 8.055 1.00 0.00 C ATOM 2113 OE1 GLU A 128 -0.297 -15.866 7.954 1.00 0.00 O ATOM 2114 OE2 GLU A 128 0.787 -17.422 9.045 1.00 0.00 O ATOM 0 H GLU A 128 -2.069 -15.469 6.387 1.00 0.00 H new ATOM 0 HA GLU A 128 -1.580 -17.724 4.533 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -2.195 -17.887 7.490 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -1.825 -19.217 6.410 1.00 0.00 H new ATOM 0 HG2 GLU A 128 0.276 -18.989 7.208 1.00 0.00 H new ATOM 0 HG3 GLU A 128 0.397 -17.690 6.038 1.00 0.00 H new ATOM 2121 N ASN A 129 -4.236 -16.296 5.147 1.00 0.00 N ATOM 2122 CA ASN A 129 -5.670 -16.265 4.941 1.00 0.00 C ATOM 2123 C ASN A 129 -6.013 -15.448 3.709 1.00 0.00 C ATOM 2124 O ASN A 129 -5.824 -14.233 3.691 1.00 0.00 O ATOM 2125 CB ASN A 129 -6.396 -15.702 6.163 1.00 0.00 C ATOM 2126 CG ASN A 129 -7.905 -15.789 6.017 1.00 0.00 C ATOM 2127 OD1 ASN A 129 -8.558 -14.846 5.569 1.00 0.00 O ATOM 2128 ND2 ASN A 129 -8.467 -16.932 6.382 1.00 0.00 N ATOM 0 H ASN A 129 -3.796 -15.378 5.209 1.00 0.00 H new ATOM 0 HA ASN A 129 -6.005 -17.291 4.791 1.00 0.00 H new ATOM 0 HB2 ASN A 129 -6.086 -16.249 7.053 1.00 0.00 H new ATOM 0 HB3 ASN A 129 -6.105 -14.662 6.310 1.00 0.00 H new ATOM 0 HD21 ASN A 129 -9.476 -17.054 6.296 1.00 0.00 H new ATOM 0 HD22 ASN A 129 -7.891 -17.689 6.749 1.00 0.00 H new ATOM 2135 N ASP A 130 -6.488 -16.153 2.686 1.00 0.00 N ATOM 2136 CA ASP A 130 -6.944 -15.557 1.428 1.00 0.00 C ATOM 2137 C ASP A 130 -5.778 -15.092 0.565 1.00 0.00 C ATOM 2138 O ASP A 130 -5.052 -14.162 0.906 1.00 0.00 O ATOM 2139 CB ASP A 130 -7.926 -14.406 1.658 1.00 0.00 C ATOM 2140 CG ASP A 130 -8.666 -14.032 0.388 1.00 0.00 C ATOM 2141 OD1 ASP A 130 -9.224 -14.942 -0.266 1.00 0.00 O ATOM 2142 OD2 ASP A 130 -8.714 -12.837 0.044 1.00 0.00 O ATOM 0 H ASP A 130 -6.569 -17.170 2.705 1.00 0.00 H new ATOM 0 HA ASP A 130 -7.471 -16.346 0.891 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -8.645 -14.690 2.427 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -7.385 -13.537 2.033 1.00 0.00 H new ATOM 2147 N ALA A 131 -5.613 -15.768 -0.556 1.00 0.00 N ATOM 2148 CA ALA A 131 -4.570 -15.453 -1.518 1.00 0.00 C ATOM 2149 C ALA A 131 -5.061 -14.370 -2.487 1.00 0.00 C ATOM 2150 O ALA A 131 -5.972 -14.623 -3.279 1.00 0.00 O ATOM 2151 CB ALA A 131 -4.222 -16.714 -2.287 1.00 0.00 C ATOM 0 H ALA A 131 -6.201 -16.556 -0.828 1.00 0.00 H new ATOM 0 HA ALA A 131 -3.688 -15.080 -0.998 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -3.440 -16.493 -3.013 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -3.868 -17.477 -1.594 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -5.108 -17.079 -2.807 1.00 0.00 H new ATOM 2157 N TYR A 132 -4.480 -13.174 -2.434 1.00 0.00 N ATOM 2158 CA TYR A 132 -4.951 -12.078 -3.286 1.00 0.00 C ATOM 2159 C TYR A 132 -3.848 -11.049 -3.534 1.00 0.00 C ATOM 2160 O TYR A 132 -3.363 -10.911 -4.657 1.00 0.00 O ATOM 2161 CB TYR A 132 -6.176 -11.414 -2.643 1.00 0.00 C ATOM 2162 CG TYR A 132 -6.897 -10.422 -3.534 1.00 0.00 C ATOM 2163 CD1 TYR A 132 -6.853 -10.532 -4.920 1.00 0.00 C ATOM 2164 CD2 TYR A 132 -7.632 -9.381 -2.983 1.00 0.00 C ATOM 2165 CE1 TYR A 132 -7.518 -9.629 -5.729 1.00 0.00 C ATOM 2166 CE2 TYR A 132 -8.300 -8.475 -3.785 1.00 0.00 C ATOM 2167 CZ TYR A 132 -8.239 -8.603 -5.156 1.00 0.00 C ATOM 2168 OH TYR A 132 -8.903 -7.703 -5.960 1.00 0.00 O ATOM 0 H TYR A 132 -3.697 -12.938 -1.824 1.00 0.00 H new ATOM 0 HA TYR A 132 -5.234 -12.492 -4.254 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -6.879 -12.191 -2.344 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -5.860 -10.903 -1.734 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -6.290 -11.336 -5.372 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -7.683 -9.277 -1.909 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -7.473 -9.727 -6.804 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -8.867 -7.671 -3.340 1.00 0.00 H new ATOM 0 HH TYR A 132 -9.364 -7.043 -5.401 1.00 0.00 H new ATOM 2178 N TRP A 133 -3.464 -10.324 -2.495 1.00 0.00 N ATOM 2179 CA TRP A 133 -2.381 -9.352 -2.597 1.00 0.00 C ATOM 2180 C TRP A 133 -1.177 -9.850 -1.815 1.00 0.00 C ATOM 2181 O TRP A 133 -0.681 -9.184 -0.912 1.00 0.00 O ATOM 2182 CB TRP A 133 -2.820 -7.979 -2.078 1.00 0.00 C ATOM 2183 CG TRP A 133 -3.824 -7.287 -2.951 1.00 0.00 C ATOM 2184 CD1 TRP A 133 -5.136 -7.049 -2.663 1.00 0.00 C ATOM 2185 CD2 TRP A 133 -3.595 -6.736 -4.256 1.00 0.00 C ATOM 2186 NE1 TRP A 133 -5.737 -6.387 -3.708 1.00 0.00 N ATOM 2187 CE2 TRP A 133 -4.812 -6.184 -4.695 1.00 0.00 C ATOM 2188 CE3 TRP A 133 -2.478 -6.656 -5.095 1.00 0.00 C ATOM 2189 CZ2 TRP A 133 -4.945 -5.561 -5.935 1.00 0.00 C ATOM 2190 CZ3 TRP A 133 -2.611 -6.038 -6.325 1.00 0.00 C ATOM 2191 CH2 TRP A 133 -3.836 -5.497 -6.734 1.00 0.00 C ATOM 0 H TRP A 133 -3.886 -10.389 -1.569 1.00 0.00 H new ATOM 0 HA TRP A 133 -2.112 -9.241 -3.647 1.00 0.00 H new ATOM 0 HB2 TRP A 133 -3.243 -8.098 -1.080 1.00 0.00 H new ATOM 0 HB3 TRP A 133 -1.941 -7.342 -1.978 1.00 0.00 H new ATOM 0 HD1 TRP A 133 -5.631 -7.338 -1.748 1.00 0.00 H new ATOM 0 HE1 TRP A 133 -6.714 -6.095 -3.742 1.00 0.00 H new ATOM 0 HE3 TRP A 133 -1.529 -7.070 -4.787 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 -5.889 -5.144 -6.253 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 -1.756 -5.972 -6.981 1.00 0.00 H new ATOM 0 HH2 TRP A 133 -3.907 -5.019 -7.700 1.00 0.00 H new ATOM 2202 N GLY A 134 -0.702 -11.020 -2.188 1.00 0.00 N ATOM 2203 CA GLY A 134 0.313 -11.688 -1.412 1.00 0.00 C ATOM 2204 C GLY A 134 -0.075 -13.123 -1.173 1.00 0.00 C ATOM 2205 O GLY A 134 -1.260 -13.457 -1.236 1.00 0.00 O ATOM 0 H GLY A 134 -1.004 -11.524 -3.022 1.00 0.00 H new ATOM 0 HA2 GLY A 134 1.268 -11.644 -1.935 1.00 0.00 H new ATOM 0 HA3 GLY A 134 0.448 -11.177 -0.459 1.00 0.00 H new ATOM 2209 N ASP A 135 0.909 -13.972 -0.912 1.00 0.00 N ATOM 2210 CA ASP A 135 0.666 -15.409 -0.791 1.00 0.00 C ATOM 2211 C ASP A 135 -0.411 -15.713 0.240 1.00 0.00 C ATOM 2212 O ASP A 135 -0.426 -15.123 1.314 1.00 0.00 O ATOM 2213 CB ASP A 135 1.952 -16.148 -0.428 1.00 0.00 C ATOM 2214 CG ASP A 135 1.706 -17.618 -0.156 1.00 0.00 C ATOM 2215 OD1 ASP A 135 0.965 -18.262 -0.933 1.00 0.00 O ATOM 2216 OD2 ASP A 135 2.233 -18.135 0.850 1.00 0.00 O ATOM 0 H ASP A 135 1.882 -13.695 -0.780 1.00 0.00 H new ATOM 0 HA ASP A 135 0.315 -15.758 -1.762 1.00 0.00 H new ATOM 0 HB2 ASP A 135 2.671 -16.045 -1.241 1.00 0.00 H new ATOM 0 HB3 ASP A 135 2.399 -15.686 0.453 1.00 0.00 H new ATOM 2221 N GLY A 136 -1.301 -16.644 -0.102 1.00 0.00 N ATOM 2222 CA GLY A 136 -2.373 -17.035 0.797 1.00 0.00 C ATOM 2223 C GLY A 136 -1.950 -18.148 1.734 1.00 0.00 C ATOM 2224 O GLY A 136 -2.758 -18.985 2.135 1.00 0.00 O ATOM 0 H GLY A 136 -1.297 -17.138 -0.995 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -2.690 -16.171 1.381 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -3.235 -17.360 0.214 1.00 0.00 H new ATOM 2228 N GLY A 137 -0.674 -18.141 2.061 1.00 0.00 N ATOM 2229 CA GLY A 137 -0.108 -19.097 2.995 1.00 0.00 C ATOM 2230 C GLY A 137 0.164 -20.465 2.393 1.00 0.00 C ATOM 2231 O GLY A 137 -0.308 -21.470 2.922 1.00 0.00 O ATOM 0 H GLY A 137 0.001 -17.473 1.688 1.00 0.00 H new ATOM 0 HA2 GLY A 137 0.824 -18.694 3.391 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -0.789 -19.212 3.838 1.00 0.00 H new ATOM 2235 N HIS A 138 0.924 -20.516 1.294 1.00 0.00 N ATOM 2236 CA HIS A 138 1.297 -21.796 0.670 1.00 0.00 C ATOM 2237 C HIS A 138 2.272 -21.627 -0.499 1.00 0.00 C ATOM 2238 O HIS A 138 3.171 -22.448 -0.675 1.00 0.00 O ATOM 2239 CB HIS A 138 0.066 -22.605 0.210 1.00 0.00 C ATOM 2240 CG HIS A 138 -1.043 -21.789 -0.382 1.00 0.00 C ATOM 2241 ND1 HIS A 138 -2.223 -21.403 0.150 1.00 0.00 N flip ATOM 2242 CD2 HIS A 138 -1.005 -21.254 -1.650 1.00 0.00 C flip ATOM 2243 CE1 HIS A 138 -2.867 -20.642 -0.791 1.00 0.00 C flip ATOM 2244 NE2 HIS A 138 -2.110 -20.564 -1.865 1.00 0.00 N flip ATOM 0 H HIS A 138 1.293 -19.692 0.818 1.00 0.00 H new ATOM 0 HA HIS A 138 1.807 -22.356 1.454 1.00 0.00 H new ATOM 0 HB2 HIS A 138 0.388 -23.341 -0.526 1.00 0.00 H new ATOM 0 HB3 HIS A 138 -0.326 -23.158 1.063 1.00 0.00 H new ATOM 0 HD1 HIS A 138 -2.571 -21.635 1.080 1.00 0.00 H new ATOM 0 HD2 HIS A 138 -0.198 -21.379 -2.357 1.00 0.00 H new ATOM 0 HE1 HIS A 138 -3.837 -20.182 -0.671 1.00 0.00 H new ATOM 2253 N GLY A 139 2.113 -20.572 -1.289 1.00 0.00 N ATOM 2254 CA GLY A 139 2.941 -20.415 -2.477 1.00 0.00 C ATOM 2255 C GLY A 139 2.138 -20.000 -3.700 1.00 0.00 C ATOM 2256 O GLY A 139 2.545 -20.255 -4.835 1.00 0.00 O ATOM 0 H GLY A 139 1.433 -19.827 -1.134 1.00 0.00 H new ATOM 0 HA2 GLY A 139 3.711 -19.669 -2.282 1.00 0.00 H new ATOM 0 HA3 GLY A 139 3.453 -21.354 -2.685 1.00 0.00 H new ATOM 2260 N LYS A 140 1.003 -19.352 -3.459 1.00 0.00 N ATOM 2261 CA LYS A 140 0.116 -18.871 -4.515 1.00 0.00 C ATOM 2262 C LYS A 140 -0.719 -17.734 -3.966 1.00 0.00 C ATOM 2263 O LYS A 140 -1.772 -17.972 -3.385 1.00 0.00 O ATOM 2264 CB LYS A 140 -0.850 -19.953 -5.013 1.00 0.00 C ATOM 2265 CG LYS A 140 -0.245 -21.037 -5.879 1.00 0.00 C ATOM 2266 CD LYS A 140 -1.336 -21.982 -6.346 1.00 0.00 C ATOM 2267 CE LYS A 140 -0.794 -23.145 -7.151 1.00 0.00 C ATOM 2268 NZ LYS A 140 -1.887 -24.072 -7.544 1.00 0.00 N ATOM 0 H LYS A 140 0.669 -19.144 -2.518 1.00 0.00 H new ATOM 0 HA LYS A 140 0.745 -18.560 -5.349 1.00 0.00 H new ATOM 0 HB2 LYS A 140 -1.313 -20.425 -4.146 1.00 0.00 H new ATOM 0 HB3 LYS A 140 -1.647 -19.468 -5.577 1.00 0.00 H new ATOM 0 HG2 LYS A 140 0.257 -20.592 -6.738 1.00 0.00 H new ATOM 0 HG3 LYS A 140 0.510 -21.586 -5.317 1.00 0.00 H new ATOM 0 HD2 LYS A 140 -1.875 -22.365 -5.480 1.00 0.00 H new ATOM 0 HD3 LYS A 140 -2.055 -21.430 -6.951 1.00 0.00 H new ATOM 0 HE2 LYS A 140 -0.290 -22.772 -8.042 1.00 0.00 H new ATOM 0 HE3 LYS A 140 -0.049 -23.683 -6.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 -1.492 -24.861 -8.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 -2.351 -24.443 -6.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 -2.584 -23.561 -8.122 1.00 0.00 H new ATOM 2282 N GLY A 141 -0.248 -16.517 -4.102 1.00 0.00 N ATOM 2283 CA GLY A 141 -0.988 -15.399 -3.558 1.00 0.00 C ATOM 2284 C GLY A 141 -0.962 -14.153 -4.411 1.00 0.00 C ATOM 2285 O GLY A 141 -1.546 -13.145 -4.029 1.00 0.00 O ATOM 0 H GLY A 141 0.624 -16.276 -4.573 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -2.025 -15.703 -3.413 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -0.586 -15.158 -2.574 1.00 0.00 H new ATOM 2289 N LYS A 142 -0.300 -14.218 -5.555 1.00 0.00 N ATOM 2290 CA LYS A 142 -0.150 -13.051 -6.418 1.00 0.00 C ATOM 2291 C LYS A 142 0.691 -11.981 -5.724 1.00 0.00 C ATOM 2292 O LYS A 142 0.177 -11.109 -5.026 1.00 0.00 O ATOM 2293 CB LYS A 142 -1.512 -12.477 -6.836 1.00 0.00 C ATOM 2294 CG LYS A 142 -2.228 -13.296 -7.897 1.00 0.00 C ATOM 2295 CD LYS A 142 -3.671 -12.847 -8.058 1.00 0.00 C ATOM 2296 CE LYS A 142 -4.584 -13.524 -7.049 1.00 0.00 C ATOM 2297 NZ LYS A 142 -4.744 -14.975 -7.343 1.00 0.00 N ATOM 0 H LYS A 142 0.143 -15.065 -5.910 1.00 0.00 H new ATOM 0 HA LYS A 142 0.364 -13.372 -7.324 1.00 0.00 H new ATOM 0 HB2 LYS A 142 -2.150 -12.405 -5.955 1.00 0.00 H new ATOM 0 HB3 LYS A 142 -1.368 -11.463 -7.210 1.00 0.00 H new ATOM 0 HG2 LYS A 142 -1.706 -13.199 -8.849 1.00 0.00 H new ATOM 0 HG3 LYS A 142 -2.201 -14.351 -7.625 1.00 0.00 H new ATOM 0 HD2 LYS A 142 -3.732 -11.766 -7.936 1.00 0.00 H new ATOM 0 HD3 LYS A 142 -4.013 -13.074 -9.068 1.00 0.00 H new ATOM 0 HE2 LYS A 142 -4.176 -13.398 -6.046 1.00 0.00 H new ATOM 0 HE3 LYS A 142 -5.561 -13.040 -7.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 -5.611 -15.327 -6.890 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 -4.809 -15.116 -8.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 -3.924 -15.497 -6.973 1.00 0.00 H new ATOM 2311 N ASN A 143 1.998 -12.076 -5.922 1.00 0.00 N ATOM 2312 CA ASN A 143 2.969 -11.127 -5.366 1.00 0.00 C ATOM 2313 C ASN A 143 2.823 -9.739 -6.004 1.00 0.00 C ATOM 2314 O ASN A 143 3.596 -8.829 -5.721 1.00 0.00 O ATOM 2315 CB ASN A 143 4.395 -11.663 -5.585 1.00 0.00 C ATOM 2316 CG ASN A 143 5.476 -10.818 -4.926 1.00 0.00 C ATOM 2317 OD1 ASN A 143 5.183 -10.260 -3.758 1.00 0.00 O flip ATOM 2318 ND2 ASN A 143 6.578 -10.685 -5.454 1.00 0.00 N flip ATOM 0 H ASN A 143 2.424 -12.818 -6.477 1.00 0.00 H new ATOM 0 HA ASN A 143 2.776 -11.024 -4.298 1.00 0.00 H new ATOM 0 HB2 ASN A 143 4.455 -12.680 -5.197 1.00 0.00 H new ATOM 0 HB3 ASN A 143 4.592 -11.718 -6.656 1.00 0.00 H new ATOM 0 HD21 ASN A 143 6.770 -11.128 -6.353 1.00 0.00 H new ATOM 0 HD22 ASN A 143 7.301 -10.132 -4.993 1.00 0.00 H new ATOM 2325 N ARG A 144 1.808 -9.581 -6.849 1.00 0.00 N ATOM 2326 CA ARG A 144 1.576 -8.334 -7.572 1.00 0.00 C ATOM 2327 C ARG A 144 1.491 -7.119 -6.649 1.00 0.00 C ATOM 2328 O ARG A 144 1.769 -6.005 -7.080 1.00 0.00 O ATOM 2329 CB ARG A 144 0.313 -8.441 -8.426 1.00 0.00 C ATOM 2330 CG ARG A 144 0.545 -9.200 -9.720 1.00 0.00 C ATOM 2331 CD ARG A 144 1.530 -8.454 -10.606 1.00 0.00 C ATOM 2332 NE ARG A 144 1.999 -9.260 -11.730 1.00 0.00 N ATOM 2333 CZ ARG A 144 1.919 -8.877 -13.005 1.00 0.00 C ATOM 2334 NH1 ARG A 144 1.271 -7.764 -13.329 1.00 0.00 N ATOM 2335 NH2 ARG A 144 2.472 -9.619 -13.956 1.00 0.00 N ATOM 0 H ARG A 144 1.125 -10.311 -7.051 1.00 0.00 H new ATOM 0 HA ARG A 144 2.440 -8.180 -8.218 1.00 0.00 H new ATOM 0 HB2 ARG A 144 -0.468 -8.940 -7.852 1.00 0.00 H new ATOM 0 HB3 ARG A 144 -0.051 -7.440 -8.657 1.00 0.00 H new ATOM 0 HG2 ARG A 144 0.927 -10.197 -9.500 1.00 0.00 H new ATOM 0 HG3 ARG A 144 -0.400 -9.330 -10.247 1.00 0.00 H new ATOM 0 HD2 ARG A 144 1.057 -7.548 -10.986 1.00 0.00 H new ATOM 0 HD3 ARG A 144 2.385 -8.140 -10.007 1.00 0.00 H new ATOM 0 HE ARG A 144 2.412 -10.170 -11.528 1.00 0.00 H new ATOM 0 HH11 ARG A 144 0.833 -7.199 -12.602 1.00 0.00 H new ATOM 0 HH12 ARG A 144 1.212 -7.474 -14.305 1.00 0.00 H new ATOM 0 HH21 ARG A 144 2.958 -10.482 -13.712 1.00 0.00 H new ATOM 0 HH22 ARG A 144 2.411 -9.326 -14.931 1.00 0.00 H new ATOM 2349 N LEU A 145 1.130 -7.324 -5.387 1.00 0.00 N ATOM 2350 CA LEU A 145 1.127 -6.221 -4.425 1.00 0.00 C ATOM 2351 C LEU A 145 2.552 -5.733 -4.191 1.00 0.00 C ATOM 2352 O LEU A 145 2.850 -4.548 -4.336 1.00 0.00 O ATOM 2353 CB LEU A 145 0.502 -6.635 -3.092 1.00 0.00 C ATOM 2354 CG LEU A 145 0.433 -5.515 -2.051 1.00 0.00 C ATOM 2355 CD1 LEU A 145 -0.522 -4.420 -2.503 1.00 0.00 C ATOM 2356 CD2 LEU A 145 0.018 -6.065 -0.697 1.00 0.00 C ATOM 0 H LEU A 145 0.840 -8.226 -5.008 1.00 0.00 H new ATOM 0 HA LEU A 145 0.524 -5.416 -4.845 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -0.506 -7.005 -3.277 1.00 0.00 H new ATOM 0 HB3 LEU A 145 1.075 -7.465 -2.678 1.00 0.00 H new ATOM 0 HG LEU A 145 1.428 -5.080 -1.951 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -0.557 -3.633 -1.749 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -0.175 -4.002 -3.448 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -1.519 -4.839 -2.636 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -0.025 -5.252 0.028 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -0.964 -6.530 -0.779 1.00 0.00 H new ATOM 0 HD23 LEU A 145 0.745 -6.807 -0.368 1.00 0.00 H new ATOM 2368 N GLY A 146 3.434 -6.665 -3.850 1.00 0.00 N ATOM 2369 CA GLY A 146 4.834 -6.339 -3.666 1.00 0.00 C ATOM 2370 C GLY A 146 5.484 -5.918 -4.964 1.00 0.00 C ATOM 2371 O GLY A 146 6.438 -5.142 -4.971 1.00 0.00 O ATOM 0 H GLY A 146 3.202 -7.646 -3.697 1.00 0.00 H new ATOM 0 HA2 GLY A 146 4.928 -5.536 -2.935 1.00 0.00 H new ATOM 0 HA3 GLY A 146 5.359 -7.204 -3.260 1.00 0.00 H new ATOM 2375 N TYR A 147 4.958 -6.434 -6.066 1.00 0.00 N ATOM 2376 CA TYR A 147 5.420 -6.057 -7.391 1.00 0.00 C ATOM 2377 C TYR A 147 5.118 -4.583 -7.639 1.00 0.00 C ATOM 2378 O TYR A 147 5.916 -3.874 -8.248 1.00 0.00 O ATOM 2379 CB TYR A 147 4.748 -6.929 -8.457 1.00 0.00 C ATOM 2380 CG TYR A 147 5.403 -6.856 -9.818 1.00 0.00 C ATOM 2381 CD1 TYR A 147 6.524 -7.624 -10.105 1.00 0.00 C ATOM 2382 CD2 TYR A 147 4.898 -6.032 -10.815 1.00 0.00 C ATOM 2383 CE1 TYR A 147 7.127 -7.569 -11.345 1.00 0.00 C ATOM 2384 CE2 TYR A 147 5.497 -5.969 -12.060 1.00 0.00 C ATOM 2385 CZ TYR A 147 6.610 -6.742 -12.321 1.00 0.00 C ATOM 2386 OH TYR A 147 7.210 -6.687 -13.561 1.00 0.00 O ATOM 0 H TYR A 147 4.204 -7.121 -6.066 1.00 0.00 H new ATOM 0 HA TYR A 147 6.497 -6.213 -7.452 1.00 0.00 H new ATOM 0 HB2 TYR A 147 4.752 -7.965 -8.119 1.00 0.00 H new ATOM 0 HB3 TYR A 147 3.704 -6.629 -8.551 1.00 0.00 H new ATOM 0 HD1 TYR A 147 6.931 -8.275 -9.345 1.00 0.00 H new ATOM 0 HD2 TYR A 147 4.023 -5.431 -10.615 1.00 0.00 H new ATOM 0 HE1 TYR A 147 8.000 -8.171 -11.551 1.00 0.00 H new ATOM 0 HE2 TYR A 147 5.096 -5.319 -12.823 1.00 0.00 H new ATOM 0 HH TYR A 147 6.723 -6.058 -14.133 1.00 0.00 H new ATOM 2396 N LEU A 148 3.964 -4.126 -7.154 1.00 0.00 N ATOM 2397 CA LEU A 148 3.601 -2.715 -7.240 1.00 0.00 C ATOM 2398 C LEU A 148 4.482 -1.883 -6.315 1.00 0.00 C ATOM 2399 O LEU A 148 4.842 -0.753 -6.639 1.00 0.00 O ATOM 2400 CB LEU A 148 2.127 -2.502 -6.879 1.00 0.00 C ATOM 2401 CG LEU A 148 1.113 -3.168 -7.812 1.00 0.00 C ATOM 2402 CD1 LEU A 148 -0.306 -2.900 -7.333 1.00 0.00 C ATOM 2403 CD2 LEU A 148 1.294 -2.681 -9.243 1.00 0.00 C ATOM 0 H LEU A 148 3.266 -4.713 -6.698 1.00 0.00 H new ATOM 0 HA LEU A 148 3.756 -2.393 -8.270 1.00 0.00 H new ATOM 0 HB2 LEU A 148 1.962 -2.874 -5.868 1.00 0.00 H new ATOM 0 HB3 LEU A 148 1.927 -1.431 -6.861 1.00 0.00 H new ATOM 0 HG LEU A 148 1.288 -4.244 -7.794 1.00 0.00 H new ATOM 0 HD11 LEU A 148 -1.015 -3.381 -8.008 1.00 0.00 H new ATOM 0 HD12 LEU A 148 -0.433 -3.302 -6.328 1.00 0.00 H new ATOM 0 HD13 LEU A 148 -0.489 -1.826 -7.320 1.00 0.00 H new ATOM 0 HD21 LEU A 148 0.563 -3.168 -9.888 1.00 0.00 H new ATOM 0 HD22 LEU A 148 1.150 -1.601 -9.281 1.00 0.00 H new ATOM 0 HD23 LEU A 148 2.300 -2.925 -9.586 1.00 0.00 H new ATOM 2415 N LEU A 149 4.823 -2.451 -5.162 1.00 0.00 N ATOM 2416 CA LEU A 149 5.728 -1.798 -4.223 1.00 0.00 C ATOM 2417 C LEU A 149 7.091 -1.584 -4.869 1.00 0.00 C ATOM 2418 O LEU A 149 7.679 -0.511 -4.759 1.00 0.00 O ATOM 2419 CB LEU A 149 5.883 -2.634 -2.950 1.00 0.00 C ATOM 2420 CG LEU A 149 4.618 -2.788 -2.104 1.00 0.00 C ATOM 2421 CD1 LEU A 149 4.871 -3.730 -0.935 1.00 0.00 C ATOM 2422 CD2 LEU A 149 4.150 -1.431 -1.605 1.00 0.00 C ATOM 0 H LEU A 149 4.485 -3.363 -4.856 1.00 0.00 H new ATOM 0 HA LEU A 149 5.303 -0.831 -3.955 1.00 0.00 H new ATOM 0 HB2 LEU A 149 6.235 -3.627 -3.229 1.00 0.00 H new ATOM 0 HB3 LEU A 149 6.659 -2.183 -2.332 1.00 0.00 H new ATOM 0 HG LEU A 149 3.833 -3.218 -2.726 1.00 0.00 H new ATOM 0 HD11 LEU A 149 3.961 -3.828 -0.343 1.00 0.00 H new ATOM 0 HD12 LEU A 149 5.165 -4.709 -1.314 1.00 0.00 H new ATOM 0 HD13 LEU A 149 5.668 -3.328 -0.310 1.00 0.00 H new ATOM 0 HD21 LEU A 149 3.249 -1.555 -1.004 1.00 0.00 H new ATOM 0 HD22 LEU A 149 4.932 -0.978 -0.996 1.00 0.00 H new ATOM 0 HD23 LEU A 149 3.933 -0.786 -2.456 1.00 0.00 H new ATOM 2434 N MET A 150 7.579 -2.613 -5.549 1.00 0.00 N ATOM 2435 CA MET A 150 8.860 -2.538 -6.244 1.00 0.00 C ATOM 2436 C MET A 150 8.748 -1.670 -7.493 1.00 0.00 C ATOM 2437 O MET A 150 9.709 -1.015 -7.893 1.00 0.00 O ATOM 2438 CB MET A 150 9.360 -3.942 -6.601 1.00 0.00 C ATOM 2439 CG MET A 150 9.723 -4.776 -5.381 1.00 0.00 C ATOM 2440 SD MET A 150 10.308 -6.432 -5.798 1.00 0.00 S ATOM 2441 CE MET A 150 8.837 -7.148 -6.527 1.00 0.00 C ATOM 0 H MET A 150 7.106 -3.513 -5.635 1.00 0.00 H new ATOM 0 HA MET A 150 9.586 -2.075 -5.575 1.00 0.00 H new ATOM 0 HB2 MET A 150 8.590 -4.461 -7.172 1.00 0.00 H new ATOM 0 HB3 MET A 150 10.233 -3.856 -7.248 1.00 0.00 H new ATOM 0 HG2 MET A 150 10.495 -4.258 -4.812 1.00 0.00 H new ATOM 0 HG3 MET A 150 8.850 -4.859 -4.733 1.00 0.00 H new ATOM 0 HE1 MET A 150 8.952 -8.230 -6.589 1.00 0.00 H new ATOM 0 HE2 MET A 150 7.972 -6.910 -5.909 1.00 0.00 H new ATOM 0 HE3 MET A 150 8.691 -6.740 -7.527 1.00 0.00 H new ATOM 2451 N GLU A 151 7.569 -1.663 -8.103 1.00 0.00 N ATOM 2452 CA GLU A 151 7.294 -0.794 -9.241 1.00 0.00 C ATOM 2453 C GLU A 151 7.416 0.660 -8.800 1.00 0.00 C ATOM 2454 O GLU A 151 8.181 1.439 -9.376 1.00 0.00 O ATOM 2455 CB GLU A 151 5.886 -1.086 -9.785 1.00 0.00 C ATOM 2456 CG GLU A 151 5.564 -0.457 -11.136 1.00 0.00 C ATOM 2457 CD GLU A 151 5.315 1.039 -11.073 1.00 0.00 C ATOM 2458 OE1 GLU A 151 4.407 1.469 -10.327 1.00 0.00 O ATOM 2459 OE2 GLU A 151 6.006 1.790 -11.793 1.00 0.00 O ATOM 0 H GLU A 151 6.784 -2.253 -7.827 1.00 0.00 H new ATOM 0 HA GLU A 151 8.014 -0.981 -10.038 1.00 0.00 H new ATOM 0 HB2 GLU A 151 5.763 -2.166 -9.868 1.00 0.00 H new ATOM 0 HB3 GLU A 151 5.154 -0.737 -9.057 1.00 0.00 H new ATOM 0 HG2 GLU A 151 6.389 -0.650 -11.822 1.00 0.00 H new ATOM 0 HG3 GLU A 151 4.683 -0.945 -11.552 1.00 0.00 H new ATOM 2466 N LEU A 152 6.678 1.001 -7.752 1.00 0.00 N ATOM 2467 CA LEU A 152 6.705 2.340 -7.188 1.00 0.00 C ATOM 2468 C LEU A 152 8.101 2.689 -6.686 1.00 0.00 C ATOM 2469 O LEU A 152 8.557 3.815 -6.851 1.00 0.00 O ATOM 2470 CB LEU A 152 5.697 2.451 -6.045 1.00 0.00 C ATOM 2471 CG LEU A 152 5.618 3.824 -5.377 1.00 0.00 C ATOM 2472 CD1 LEU A 152 5.098 4.868 -6.354 1.00 0.00 C ATOM 2473 CD2 LEU A 152 4.737 3.761 -4.143 1.00 0.00 C ATOM 0 H LEU A 152 6.047 0.359 -7.272 1.00 0.00 H new ATOM 0 HA LEU A 152 6.434 3.046 -7.973 1.00 0.00 H new ATOM 0 HB2 LEU A 152 4.709 2.193 -6.427 1.00 0.00 H new ATOM 0 HB3 LEU A 152 5.949 1.710 -5.287 1.00 0.00 H new ATOM 0 HG LEU A 152 6.622 4.116 -5.070 1.00 0.00 H new ATOM 0 HD11 LEU A 152 5.049 5.838 -5.859 1.00 0.00 H new ATOM 0 HD12 LEU A 152 5.769 4.931 -7.210 1.00 0.00 H new ATOM 0 HD13 LEU A 152 4.102 4.584 -6.694 1.00 0.00 H new ATOM 0 HD21 LEU A 152 4.691 4.746 -3.678 1.00 0.00 H new ATOM 0 HD22 LEU A 152 3.733 3.447 -4.428 1.00 0.00 H new ATOM 0 HD23 LEU A 152 5.154 3.045 -3.435 1.00 0.00 H new ATOM 2485 N ARG A 153 8.772 1.712 -6.080 1.00 0.00 N ATOM 2486 CA ARG A 153 10.122 1.905 -5.558 1.00 0.00 C ATOM 2487 C ARG A 153 11.049 2.468 -6.631 1.00 0.00 C ATOM 2488 O ARG A 153 11.669 3.517 -6.443 1.00 0.00 O ATOM 2489 CB ARG A 153 10.684 0.581 -5.035 1.00 0.00 C ATOM 2490 CG ARG A 153 12.060 0.711 -4.407 1.00 0.00 C ATOM 2491 CD ARG A 153 12.607 -0.637 -3.963 1.00 0.00 C ATOM 2492 NE ARG A 153 12.861 -1.529 -5.097 1.00 0.00 N ATOM 2493 CZ ARG A 153 12.954 -2.858 -5.004 1.00 0.00 C ATOM 2494 NH1 ARG A 153 12.838 -3.457 -3.822 1.00 0.00 N ATOM 2495 NH2 ARG A 153 13.178 -3.583 -6.095 1.00 0.00 N ATOM 0 H ARG A 153 8.399 0.773 -5.938 1.00 0.00 H new ATOM 0 HA ARG A 153 10.065 2.621 -4.738 1.00 0.00 H new ATOM 0 HB2 ARG A 153 9.995 0.169 -4.298 1.00 0.00 H new ATOM 0 HB3 ARG A 153 10.735 -0.133 -5.857 1.00 0.00 H new ATOM 0 HG2 ARG A 153 12.745 1.163 -5.124 1.00 0.00 H new ATOM 0 HG3 ARG A 153 12.007 1.382 -3.550 1.00 0.00 H new ATOM 0 HD2 ARG A 153 13.532 -0.487 -3.406 1.00 0.00 H new ATOM 0 HD3 ARG A 153 11.898 -1.109 -3.283 1.00 0.00 H new ATOM 0 HE ARG A 153 12.974 -1.107 -6.019 1.00 0.00 H new ATOM 0 HH11 ARG A 153 12.677 -2.901 -2.982 1.00 0.00 H new ATOM 0 HH12 ARG A 153 12.910 -4.472 -3.756 1.00 0.00 H new ATOM 0 HH21 ARG A 153 13.278 -3.124 -7.000 1.00 0.00 H new ATOM 0 HH22 ARG A 153 13.250 -4.598 -6.027 1.00 0.00 H new ATOM 2509 N GLU A 154 11.129 1.776 -7.759 1.00 0.00 N ATOM 2510 CA GLU A 154 11.985 2.208 -8.855 1.00 0.00 C ATOM 2511 C GLU A 154 11.528 3.565 -9.377 1.00 0.00 C ATOM 2512 O GLU A 154 12.345 4.430 -9.691 1.00 0.00 O ATOM 2513 CB GLU A 154 11.972 1.183 -9.989 1.00 0.00 C ATOM 2514 CG GLU A 154 12.215 -0.246 -9.530 1.00 0.00 C ATOM 2515 CD GLU A 154 13.488 -0.406 -8.725 1.00 0.00 C ATOM 2516 OE1 GLU A 154 14.574 -0.496 -9.335 1.00 0.00 O ATOM 2517 OE2 GLU A 154 13.405 -0.471 -7.482 1.00 0.00 O ATOM 0 H GLU A 154 10.613 0.915 -7.939 1.00 0.00 H new ATOM 0 HA GLU A 154 13.004 2.295 -8.478 1.00 0.00 H new ATOM 0 HB2 GLU A 154 11.010 1.232 -10.499 1.00 0.00 H new ATOM 0 HB3 GLU A 154 12.734 1.454 -10.720 1.00 0.00 H new ATOM 0 HG2 GLU A 154 11.368 -0.576 -8.928 1.00 0.00 H new ATOM 0 HG3 GLU A 154 12.260 -0.898 -10.402 1.00 0.00 H new ATOM 2524 N GLN A 155 10.213 3.748 -9.442 1.00 0.00 N ATOM 2525 CA GLN A 155 9.627 4.995 -9.913 1.00 0.00 C ATOM 2526 C GLN A 155 10.047 6.157 -9.014 1.00 0.00 C ATOM 2527 O GLN A 155 10.454 7.214 -9.498 1.00 0.00 O ATOM 2528 CB GLN A 155 8.101 4.877 -9.946 1.00 0.00 C ATOM 2529 CG GLN A 155 7.393 6.100 -10.516 1.00 0.00 C ATOM 2530 CD GLN A 155 7.467 6.199 -12.034 1.00 0.00 C ATOM 2531 OE1 GLN A 155 8.533 5.685 -12.633 1.00 0.00 O flip ATOM 2532 NE2 GLN A 155 6.563 6.736 -12.668 1.00 0.00 N flip ATOM 0 H GLN A 155 9.529 3.041 -9.172 1.00 0.00 H new ATOM 0 HA GLN A 155 9.989 5.191 -10.922 1.00 0.00 H new ATOM 0 HB2 GLN A 155 7.828 4.004 -10.538 1.00 0.00 H new ATOM 0 HB3 GLN A 155 7.739 4.701 -8.933 1.00 0.00 H new ATOM 0 HG2 GLN A 155 6.346 6.077 -10.213 1.00 0.00 H new ATOM 0 HG3 GLN A 155 7.831 6.998 -10.081 1.00 0.00 H new ATOM 0 HE21 GLN A 155 5.756 7.122 -12.178 1.00 0.00 H new ATOM 0 HE22 GLN A 155 6.619 6.796 -13.685 1.00 0.00 H new ATOM 2541 N LEU A 156 9.969 5.943 -7.704 1.00 0.00 N ATOM 2542 CA LEU A 156 10.326 6.966 -6.737 1.00 0.00 C ATOM 2543 C LEU A 156 11.804 7.298 -6.837 1.00 0.00 C ATOM 2544 O LEU A 156 12.183 8.467 -6.832 1.00 0.00 O ATOM 2545 CB LEU A 156 10.001 6.500 -5.317 1.00 0.00 C ATOM 2546 CG LEU A 156 8.519 6.282 -5.018 1.00 0.00 C ATOM 2547 CD1 LEU A 156 8.328 5.810 -3.584 1.00 0.00 C ATOM 2548 CD2 LEU A 156 7.740 7.560 -5.265 1.00 0.00 C ATOM 0 H LEU A 156 9.659 5.064 -7.290 1.00 0.00 H new ATOM 0 HA LEU A 156 9.743 7.860 -6.959 1.00 0.00 H new ATOM 0 HB2 LEU A 156 10.532 5.567 -5.129 1.00 0.00 H new ATOM 0 HB3 LEU A 156 10.391 7.236 -4.614 1.00 0.00 H new ATOM 0 HG LEU A 156 8.140 5.509 -5.686 1.00 0.00 H new ATOM 0 HD11 LEU A 156 7.266 5.660 -3.389 1.00 0.00 H new ATOM 0 HD12 LEU A 156 8.861 4.870 -3.436 1.00 0.00 H new ATOM 0 HD13 LEU A 156 8.720 6.561 -2.898 1.00 0.00 H new ATOM 0 HD21 LEU A 156 6.685 7.391 -5.048 1.00 0.00 H new ATOM 0 HD22 LEU A 156 8.122 8.350 -4.618 1.00 0.00 H new ATOM 0 HD23 LEU A 156 7.853 7.859 -6.307 1.00 0.00 H new ATOM 2560 N ALA A 157 12.628 6.264 -6.931 1.00 0.00 N ATOM 2561 CA ALA A 157 14.070 6.437 -7.003 1.00 0.00 C ATOM 2562 C ALA A 157 14.467 7.240 -8.236 1.00 0.00 C ATOM 2563 O ALA A 157 15.188 8.228 -8.123 1.00 0.00 O ATOM 2564 CB ALA A 157 14.769 5.087 -6.997 1.00 0.00 C ATOM 0 H ALA A 157 12.319 5.292 -6.959 1.00 0.00 H new ATOM 0 HA ALA A 157 14.386 6.996 -6.123 1.00 0.00 H new ATOM 0 HB1 ALA A 157 15.847 5.235 -7.051 1.00 0.00 H new ATOM 0 HB2 ALA A 157 14.522 4.553 -6.079 1.00 0.00 H new ATOM 0 HB3 ALA A 157 14.439 4.503 -7.856 1.00 0.00 H new ATOM 2570 N ILE A 158 13.980 6.825 -9.405 1.00 0.00 N ATOM 2571 CA ILE A 158 14.280 7.524 -10.652 1.00 0.00 C ATOM 2572 C ILE A 158 13.885 8.998 -10.552 1.00 0.00 C ATOM 2573 O ILE A 158 14.620 9.875 -11.004 1.00 0.00 O ATOM 2574 CB ILE A 158 13.559 6.876 -11.860 1.00 0.00 C ATOM 2575 CG1 ILE A 158 14.034 5.433 -12.053 1.00 0.00 C ATOM 2576 CG2 ILE A 158 13.792 7.687 -13.129 1.00 0.00 C ATOM 2577 CD1 ILE A 158 13.310 4.695 -13.163 1.00 0.00 C ATOM 0 H ILE A 158 13.377 6.009 -9.514 1.00 0.00 H new ATOM 0 HA ILE A 158 15.355 7.447 -10.813 1.00 0.00 H new ATOM 0 HB ILE A 158 12.489 6.866 -11.654 1.00 0.00 H new ATOM 0 HG12 ILE A 158 15.102 5.438 -12.269 1.00 0.00 H new ATOM 0 HG13 ILE A 158 13.900 4.888 -11.119 1.00 0.00 H new ATOM 0 HG21 ILE A 158 13.276 7.213 -13.964 1.00 0.00 H new ATOM 0 HG22 ILE A 158 13.407 8.697 -12.991 1.00 0.00 H new ATOM 0 HG23 ILE A 158 14.860 7.732 -13.341 1.00 0.00 H new ATOM 0 HD11 ILE A 158 13.700 3.680 -13.240 1.00 0.00 H new ATOM 0 HD12 ILE A 158 12.244 4.658 -12.940 1.00 0.00 H new ATOM 0 HD13 ILE A 158 13.465 5.216 -14.108 1.00 0.00 H new ATOM 2589 N GLU A 159 12.733 9.256 -9.938 1.00 0.00 N ATOM 2590 CA GLU A 159 12.263 10.619 -9.726 1.00 0.00 C ATOM 2591 C GLU A 159 13.247 11.400 -8.858 1.00 0.00 C ATOM 2592 O GLU A 159 13.628 12.524 -9.187 1.00 0.00 O ATOM 2593 CB GLU A 159 10.891 10.606 -9.053 1.00 0.00 C ATOM 2594 CG GLU A 159 10.337 11.995 -8.781 1.00 0.00 C ATOM 2595 CD GLU A 159 9.150 11.975 -7.845 1.00 0.00 C ATOM 2596 OE1 GLU A 159 9.363 11.986 -6.617 1.00 0.00 O ATOM 2597 OE2 GLU A 159 7.999 11.958 -8.332 1.00 0.00 O ATOM 0 H GLU A 159 12.107 8.535 -9.578 1.00 0.00 H new ATOM 0 HA GLU A 159 12.185 11.106 -10.698 1.00 0.00 H new ATOM 0 HB2 GLU A 159 10.190 10.061 -9.685 1.00 0.00 H new ATOM 0 HB3 GLU A 159 10.962 10.061 -8.112 1.00 0.00 H new ATOM 0 HG2 GLU A 159 11.122 12.618 -8.353 1.00 0.00 H new ATOM 0 HG3 GLU A 159 10.044 12.456 -9.724 1.00 0.00 H new ATOM 2604 N LYS A 160 13.663 10.792 -7.750 1.00 0.00 N ATOM 2605 CA LYS A 160 14.560 11.452 -6.808 1.00 0.00 C ATOM 2606 C LYS A 160 15.933 11.669 -7.432 1.00 0.00 C ATOM 2607 O LYS A 160 16.580 12.683 -7.182 1.00 0.00 O ATOM 2608 CB LYS A 160 14.699 10.633 -5.518 1.00 0.00 C ATOM 2609 CG LYS A 160 13.375 10.285 -4.846 1.00 0.00 C ATOM 2610 CD LYS A 160 12.548 11.521 -4.537 1.00 0.00 C ATOM 2611 CE LYS A 160 11.249 11.167 -3.818 1.00 0.00 C ATOM 2612 NZ LYS A 160 10.284 10.448 -4.697 1.00 0.00 N ATOM 0 H LYS A 160 13.393 9.845 -7.484 1.00 0.00 H new ATOM 0 HA LYS A 160 14.127 12.422 -6.561 1.00 0.00 H new ATOM 0 HB2 LYS A 160 15.231 9.709 -5.744 1.00 0.00 H new ATOM 0 HB3 LYS A 160 15.315 11.191 -4.813 1.00 0.00 H new ATOM 0 HG2 LYS A 160 12.804 9.620 -5.494 1.00 0.00 H new ATOM 0 HG3 LYS A 160 13.570 9.740 -3.922 1.00 0.00 H new ATOM 0 HD2 LYS A 160 13.131 12.204 -3.919 1.00 0.00 H new ATOM 0 HD3 LYS A 160 12.319 12.047 -5.464 1.00 0.00 H new ATOM 0 HE2 LYS A 160 11.476 10.547 -2.950 1.00 0.00 H new ATOM 0 HE3 LYS A 160 10.784 12.080 -3.445 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 9.561 9.983 -4.112 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 9.826 11.127 -5.338 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 10.790 9.732 -5.256 1.00 0.00 H new ATOM 2626 N LEU A 161 16.359 10.721 -8.261 1.00 0.00 N ATOM 2627 CA LEU A 161 17.649 10.802 -8.946 1.00 0.00 C ATOM 2628 C LEU A 161 17.720 12.020 -9.864 1.00 0.00 C ATOM 2629 O LEU A 161 18.804 12.518 -10.170 1.00 0.00 O ATOM 2630 CB LEU A 161 17.892 9.530 -9.768 1.00 0.00 C ATOM 2631 CG LEU A 161 18.796 8.478 -9.116 1.00 0.00 C ATOM 2632 CD1 LEU A 161 18.262 8.064 -7.753 1.00 0.00 C ATOM 2633 CD2 LEU A 161 18.937 7.267 -10.025 1.00 0.00 C ATOM 0 H LEU A 161 15.825 9.879 -8.477 1.00 0.00 H new ATOM 0 HA LEU A 161 18.421 10.901 -8.183 1.00 0.00 H new ATOM 0 HB2 LEU A 161 16.928 9.070 -9.984 1.00 0.00 H new ATOM 0 HB3 LEU A 161 18.330 9.816 -10.724 1.00 0.00 H new ATOM 0 HG LEU A 161 19.781 8.922 -8.968 1.00 0.00 H new ATOM 0 HD11 LEU A 161 18.924 7.317 -7.315 1.00 0.00 H new ATOM 0 HD12 LEU A 161 18.216 8.936 -7.100 1.00 0.00 H new ATOM 0 HD13 LEU A 161 17.263 7.642 -7.866 1.00 0.00 H new ATOM 0 HD21 LEU A 161 19.582 6.528 -9.549 1.00 0.00 H new ATOM 0 HD22 LEU A 161 17.955 6.830 -10.204 1.00 0.00 H new ATOM 0 HD23 LEU A 161 19.376 7.574 -10.974 1.00 0.00 H new ATOM 2645 N GLU A 162 16.561 12.509 -10.278 1.00 0.00 N ATOM 2646 CA GLU A 162 16.486 13.612 -11.225 1.00 0.00 C ATOM 2647 C GLU A 162 16.667 14.971 -10.553 1.00 0.00 C ATOM 2648 O GLU A 162 16.545 16.004 -11.213 1.00 0.00 O ATOM 2649 CB GLU A 162 15.152 13.571 -11.972 1.00 0.00 C ATOM 2650 CG GLU A 162 15.042 12.413 -12.947 1.00 0.00 C ATOM 2651 CD GLU A 162 16.055 12.509 -14.065 1.00 0.00 C ATOM 2652 OE1 GLU A 162 15.780 13.216 -15.056 1.00 0.00 O ATOM 2653 OE2 GLU A 162 17.139 11.896 -13.957 1.00 0.00 O ATOM 0 H GLU A 162 15.654 12.157 -9.971 1.00 0.00 H new ATOM 0 HA GLU A 162 17.308 13.488 -11.930 1.00 0.00 H new ATOM 0 HB2 GLU A 162 14.340 13.505 -11.247 1.00 0.00 H new ATOM 0 HB3 GLU A 162 15.019 14.507 -12.515 1.00 0.00 H new ATOM 0 HG2 GLU A 162 15.183 11.474 -12.411 1.00 0.00 H new ATOM 0 HG3 GLU A 162 14.038 12.391 -13.370 1.00 0.00 H new ATOM 2660 N HIS A 163 16.962 14.986 -9.254 1.00 0.00 N ATOM 2661 CA HIS A 163 17.178 16.253 -8.559 1.00 0.00 C ATOM 2662 C HIS A 163 18.522 16.883 -8.969 1.00 0.00 C ATOM 2663 O HIS A 163 19.571 16.639 -8.372 1.00 0.00 O ATOM 2664 CB HIS A 163 17.042 16.096 -7.024 1.00 0.00 C ATOM 2665 CG HIS A 163 18.202 15.458 -6.302 1.00 0.00 C ATOM 2666 ND1 HIS A 163 18.768 16.017 -5.179 1.00 0.00 N ATOM 2667 CD2 HIS A 163 18.887 14.311 -6.530 1.00 0.00 C ATOM 2668 CE1 HIS A 163 19.747 15.250 -4.750 1.00 0.00 C ATOM 2669 NE2 HIS A 163 19.843 14.202 -5.548 1.00 0.00 N ATOM 0 H HIS A 163 17.055 14.154 -8.672 1.00 0.00 H new ATOM 0 HA HIS A 163 16.392 16.943 -8.866 1.00 0.00 H new ATOM 0 HB2 HIS A 163 16.876 17.084 -6.595 1.00 0.00 H new ATOM 0 HB3 HIS A 163 16.149 15.506 -6.820 1.00 0.00 H new ATOM 0 HD2 HIS A 163 18.714 13.612 -7.335 1.00 0.00 H new ATOM 0 HE1 HIS A 163 20.369 15.445 -3.889 1.00 0.00 H new ATOM 0 HE2 HIS A 163 20.514 13.440 -5.452 1.00 0.00 H new ATOM 2678 N HIS A 164 18.484 17.662 -10.039 1.00 0.00 N ATOM 2679 CA HIS A 164 19.669 18.346 -10.541 1.00 0.00 C ATOM 2680 C HIS A 164 19.407 19.839 -10.649 1.00 0.00 C ATOM 2681 O HIS A 164 18.329 20.258 -11.073 1.00 0.00 O ATOM 2682 CB HIS A 164 20.095 17.794 -11.906 1.00 0.00 C ATOM 2683 CG HIS A 164 20.942 16.554 -11.838 1.00 0.00 C ATOM 2684 ND1 HIS A 164 21.356 15.816 -10.781 1.00 0.00 N flip ATOM 2685 CD2 HIS A 164 21.485 15.953 -12.951 1.00 0.00 C flip ATOM 2686 CE1 HIS A 164 22.132 14.796 -11.269 1.00 0.00 C flip ATOM 2687 NE2 HIS A 164 22.192 14.901 -12.584 1.00 0.00 N flip ATOM 0 H HIS A 164 17.638 17.838 -10.581 1.00 0.00 H new ATOM 0 HA HIS A 164 20.480 18.171 -9.834 1.00 0.00 H new ATOM 0 HB2 HIS A 164 19.201 17.577 -12.491 1.00 0.00 H new ATOM 0 HB3 HIS A 164 20.647 18.567 -12.441 1.00 0.00 H new ATOM 0 HD1 HIS A 164 21.132 15.987 -9.801 1.00 0.00 H new ATOM 0 HD2 HIS A 164 21.353 16.291 -13.968 1.00 0.00 H new ATOM 0 HE1 HIS A 164 22.614 14.033 -10.676 1.00 0.00 H new ATOM 2696 N HIS A 165 20.394 20.635 -10.274 1.00 0.00 N ATOM 2697 CA HIS A 165 20.257 22.081 -10.324 1.00 0.00 C ATOM 2698 C HIS A 165 20.785 22.625 -11.643 1.00 0.00 C ATOM 2699 O HIS A 165 21.930 23.069 -11.733 1.00 0.00 O ATOM 2700 CB HIS A 165 20.982 22.752 -9.154 1.00 0.00 C ATOM 2701 CG HIS A 165 20.372 22.474 -7.813 1.00 0.00 C ATOM 2702 ND1 HIS A 165 19.287 23.163 -7.320 1.00 0.00 N ATOM 2703 CD2 HIS A 165 20.719 21.590 -6.852 1.00 0.00 C ATOM 2704 CE1 HIS A 165 18.997 22.715 -6.114 1.00 0.00 C ATOM 2705 NE2 HIS A 165 19.852 21.759 -5.801 1.00 0.00 N ATOM 0 H HIS A 165 21.297 20.306 -9.932 1.00 0.00 H new ATOM 0 HA HIS A 165 19.195 22.312 -10.244 1.00 0.00 H new ATOM 0 HB2 HIS A 165 22.020 22.419 -9.145 1.00 0.00 H new ATOM 0 HB3 HIS A 165 20.995 23.829 -9.319 1.00 0.00 H new ATOM 0 HD2 HIS A 165 21.531 20.880 -6.902 1.00 0.00 H new ATOM 0 HE1 HIS A 165 18.193 23.071 -5.487 1.00 0.00 H new ATOM 0 HE2 HIS A 165 19.866 21.235 -4.926 1.00 0.00 H new ATOM 2714 N HIS A 166 19.951 22.561 -12.671 1.00 0.00 N ATOM 2715 CA HIS A 166 20.297 23.112 -13.974 1.00 0.00 C ATOM 2716 C HIS A 166 19.285 24.191 -14.346 1.00 0.00 C ATOM 2717 O HIS A 166 19.061 24.477 -15.521 1.00 0.00 O ATOM 2718 CB HIS A 166 20.318 22.004 -15.039 1.00 0.00 C ATOM 2719 CG HIS A 166 21.008 22.393 -16.320 1.00 0.00 C ATOM 2720 ND1 HIS A 166 20.337 22.825 -17.446 1.00 0.00 N ATOM 2721 CD2 HIS A 166 22.322 22.412 -16.645 1.00 0.00 C ATOM 2722 CE1 HIS A 166 21.209 23.091 -18.401 1.00 0.00 C ATOM 2723 NE2 HIS A 166 22.421 22.849 -17.943 1.00 0.00 N ATOM 0 H HIS A 166 19.027 22.132 -12.628 1.00 0.00 H new ATOM 0 HA HIS A 166 21.293 23.552 -13.927 1.00 0.00 H new ATOM 0 HB2 HIS A 166 20.814 21.126 -14.624 1.00 0.00 H new ATOM 0 HB3 HIS A 166 19.292 21.714 -15.266 1.00 0.00 H new ATOM 0 HD2 HIS A 166 23.143 22.134 -16.001 1.00 0.00 H new ATOM 0 HE1 HIS A 166 20.969 23.447 -19.392 1.00 0.00 H new ATOM 0 HE2 HIS A 166 23.289 22.967 -18.466 1.00 0.00 H new ATOM 2732 N HIS A 167 18.685 24.802 -13.331 1.00 0.00 N ATOM 2733 CA HIS A 167 17.681 25.835 -13.549 1.00 0.00 C ATOM 2734 C HIS A 167 18.354 27.156 -13.912 1.00 0.00 C ATOM 2735 O HIS A 167 18.440 28.083 -13.100 1.00 0.00 O ATOM 2736 CB HIS A 167 16.782 25.990 -12.315 1.00 0.00 C ATOM 2737 CG HIS A 167 15.681 26.999 -12.474 1.00 0.00 C ATOM 2738 ND1 HIS A 167 14.644 26.856 -13.371 1.00 0.00 N ATOM 2739 CD2 HIS A 167 15.457 28.170 -11.834 1.00 0.00 C ATOM 2740 CE1 HIS A 167 13.834 27.891 -13.274 1.00 0.00 C ATOM 2741 NE2 HIS A 167 14.303 28.704 -12.349 1.00 0.00 N ATOM 0 H HIS A 167 18.877 24.600 -12.350 1.00 0.00 H new ATOM 0 HA HIS A 167 17.047 25.535 -14.383 1.00 0.00 H new ATOM 0 HB2 HIS A 167 16.340 25.022 -12.078 1.00 0.00 H new ATOM 0 HB3 HIS A 167 17.400 26.275 -11.464 1.00 0.00 H new ATOM 0 HD2 HIS A 167 16.073 28.604 -11.060 1.00 0.00 H new ATOM 0 HE1 HIS A 167 12.937 28.047 -13.855 1.00 0.00 H new ATOM 0 HE2 HIS A 167 13.878 29.586 -12.063 1.00 0.00 H new ATOM 2750 N HIS A 168 18.862 27.207 -15.129 1.00 0.00 N ATOM 2751 CA HIS A 168 19.486 28.397 -15.667 1.00 0.00 C ATOM 2752 C HIS A 168 19.562 28.273 -17.182 1.00 0.00 C ATOM 2753 O HIS A 168 20.647 27.944 -17.704 1.00 0.00 O ATOM 2754 CB HIS A 168 20.884 28.592 -15.067 1.00 0.00 C ATOM 2755 CG HIS A 168 21.545 29.872 -15.478 1.00 0.00 C ATOM 2756 ND1 HIS A 168 21.200 31.096 -14.952 1.00 0.00 N ATOM 2757 CD2 HIS A 168 22.533 30.112 -16.371 1.00 0.00 C ATOM 2758 CE1 HIS A 168 21.944 32.037 -15.503 1.00 0.00 C ATOM 2759 NE2 HIS A 168 22.762 31.466 -16.366 1.00 0.00 N ATOM 2760 OXT HIS A 168 18.518 28.456 -17.840 1.00 0.00 O ATOM 0 H HIS A 168 18.852 26.418 -15.775 1.00 0.00 H new ATOM 0 HA HIS A 168 18.889 29.271 -15.405 1.00 0.00 H new ATOM 0 HB2 HIS A 168 20.810 28.565 -13.980 1.00 0.00 H new ATOM 0 HB3 HIS A 168 21.517 27.756 -15.364 1.00 0.00 H new ATOM 0 HD2 HIS A 168 23.045 29.377 -16.974 1.00 0.00 H new ATOM 0 HE1 HIS A 168 21.892 33.093 -15.285 1.00 0.00 H new ATOM 0 HE2 HIS A 168 23.453 31.952 -16.937 1.00 0.00 H new TER 2769 HIS A 168