USER MOD reduce.3.24.130724 H: found=0, std=0, add=1056, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1056 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 70 SER OG : rot -165:sc= 0.55 USER MOD Set 1.2: A 90 LYS NZ :NH3+ -164:sc= 0.0129 (180deg=0.000425) USER MOD Set 2.1: A 13 MET CE :methyl -146:sc= -0.0052 (180deg=-1.62) USER MOD Set 2.2: A 32 THR OG1 : rot 180:sc=-0.00589 USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ -173:sc= 0.0141 (180deg=-0.0122) USER MOD Single : A 15 SER OG : rot 112:sc= -4.19! USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= -0.104 X(o=-0.1,f=0) USER MOD Single : A 20 ASN : amide:sc= -0.341 K(o=-0.34,f=-1.1) USER MOD Single : A 24 SER OG : rot -140:sc= -1.25 USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot -86:sc= 0.976 USER MOD Single : A 33 THR OG1 : rot 180:sc= -1.08 USER MOD Single : A 35 SER OG : rot -37:sc= 0.299 USER MOD Single : A 36 ASN : amide:sc= -6.49! C(o=-6.5!,f=-7.3!) USER MOD Single : A 39 LYS NZ :NH3+ -131:sc= -0.535 (180deg=-2.59) USER MOD Single : A 41 ASN : amide:sc= -5.32! C(o=-5.3!,f=-11!) USER MOD Single : A 47 SER OG : rot -88:sc= 1.23 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 57 GLN : amide:sc= -0.322 X(o=-0.32,f=-0.47) USER MOD Single : A 61 HIS : no HE2:sc= -2.96 X(o=-3,f=-2.7!) USER MOD Single : A 63 GLN : amide:sc= -1.83 K(o=-1.8,f=-2.8!) USER MOD Single : A 66 SER OG : rot -120:sc= 1.31 USER MOD Single : A 68 MET CE :methyl -172:sc= -0.502 (180deg=-0.733) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 78 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 SER OG : rot 180:sc=0.000686 USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 105 HIS : no HE2:sc= -0.546! C(o=-0.55!,f=-4.7!) USER MOD Single : A 106 HIS : no HD1:sc= -5.85! C(o=-5.9!,f=-8!) USER MOD Single : A 109 ASN : amide:sc= -2.71! C(o=-2.7!,f=-5.9!) USER MOD Single : A 112 ASN : amide:sc= -0.0153 X(o=-0.015,f=-0.098) USER MOD Single : A 114 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 GLN :FLIP amide:sc= -0.192 F(o=-2.3,f=-0.19) USER MOD Single : A 120 SER OG : rot 30:sc= 0.109 USER MOD Single : A 124 GLN : amide:sc= -0.296 X(o=-0.3,f=-0.25) USER MOD Single : A 129 GLN : amide:sc= -0.0534 X(o=-0.053,f=0) USER MOD Single : A 133 GLN :FLIP amide:sc= -2.5 F(o=-3!,f=-2.5) USER MOD Single : A 136 GLN : amide:sc= -3.57 K(o=-3.6,f=-6.6!) USER MOD ----------------------------------------------------------------- ATOM 59 N GLY A 7 -14.157 -8.201 3.457 1.00 0.00 N ATOM 60 CA GLY A 7 -13.670 -7.492 2.288 1.00 0.00 C ATOM 61 C GLY A 7 -12.186 -7.194 2.367 1.00 0.00 C ATOM 62 O GLY A 7 -11.516 -7.586 3.322 1.00 0.00 O ATOM 0 HA2 GLY A 7 -13.871 -8.086 1.397 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -14.220 -6.557 2.179 1.00 0.00 H new ATOM 66 N VAL A 8 -11.669 -6.497 1.359 1.00 0.00 N ATOM 67 CA VAL A 8 -10.254 -6.147 1.319 1.00 0.00 C ATOM 68 C VAL A 8 -9.981 -4.873 2.111 1.00 0.00 C ATOM 69 O VAL A 8 -10.829 -3.984 2.188 1.00 0.00 O ATOM 70 CB VAL A 8 -9.766 -5.952 -0.129 1.00 0.00 C ATOM 71 CG1 VAL A 8 -10.726 -5.062 -0.902 1.00 0.00 C ATOM 72 CG2 VAL A 8 -8.360 -5.373 -0.143 1.00 0.00 C ATOM 0 H VAL A 8 -12.209 -6.164 0.560 1.00 0.00 H new ATOM 0 HA VAL A 8 -9.709 -6.976 1.770 1.00 0.00 H new ATOM 0 HB VAL A 8 -9.739 -6.925 -0.619 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -10.364 -4.936 -1.922 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -11.714 -5.523 -0.922 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -10.790 -4.088 -0.417 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -8.031 -5.242 -1.174 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -8.359 -4.408 0.364 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -7.681 -6.054 0.371 1.00 0.00 H new ATOM 82 N ARG A 9 -8.791 -4.792 2.698 1.00 0.00 N ATOM 83 CA ARG A 9 -8.406 -3.627 3.485 1.00 0.00 C ATOM 84 C ARG A 9 -7.475 -2.717 2.689 1.00 0.00 C ATOM 85 O ARG A 9 -7.129 -3.013 1.545 1.00 0.00 O ATOM 86 CB ARG A 9 -7.722 -4.065 4.782 1.00 0.00 C ATOM 87 CG ARG A 9 -8.678 -4.663 5.802 1.00 0.00 C ATOM 88 CD ARG A 9 -9.239 -3.598 6.731 1.00 0.00 C ATOM 89 NE ARG A 9 -9.852 -4.179 7.922 1.00 0.00 N ATOM 90 CZ ARG A 9 -10.059 -3.503 9.047 1.00 0.00 C ATOM 91 NH1 ARG A 9 -9.703 -2.229 9.133 1.00 0.00 N ATOM 92 NH2 ARG A 9 -10.623 -4.101 10.088 1.00 0.00 N ATOM 0 H ARG A 9 -8.078 -5.519 2.643 1.00 0.00 H new ATOM 0 HA ARG A 9 -9.310 -3.069 3.729 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -6.950 -4.798 4.546 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -7.220 -3.205 5.227 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -9.496 -5.164 5.285 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -8.159 -5.422 6.388 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -8.440 -2.919 7.029 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -9.979 -3.003 6.196 1.00 0.00 H new ATOM 0 HE ARG A 9 -10.137 -5.158 7.889 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -9.269 -1.766 8.335 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -9.863 -1.712 9.998 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -10.898 -5.081 10.026 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -10.781 -3.581 10.951 1.00 0.00 H new ATOM 106 N TYR A 10 -7.073 -1.609 3.302 1.00 0.00 N ATOM 107 CA TYR A 10 -6.185 -0.654 2.650 1.00 0.00 C ATOM 108 C TYR A 10 -5.190 -0.067 3.646 1.00 0.00 C ATOM 109 O TYR A 10 -5.530 0.194 4.800 1.00 0.00 O ATOM 110 CB TYR A 10 -6.997 0.469 2.002 1.00 0.00 C ATOM 111 CG TYR A 10 -8.053 -0.025 1.040 1.00 0.00 C ATOM 112 CD1 TYR A 10 -9.138 -0.768 1.489 1.00 0.00 C ATOM 113 CD2 TYR A 10 -7.968 0.253 -0.319 1.00 0.00 C ATOM 114 CE1 TYR A 10 -10.105 -1.222 0.614 1.00 0.00 C ATOM 115 CE2 TYR A 10 -8.931 -0.196 -1.202 1.00 0.00 C ATOM 116 CZ TYR A 10 -9.997 -0.933 -0.731 1.00 0.00 C ATOM 117 OH TYR A 10 -10.959 -1.383 -1.606 1.00 0.00 O ATOM 0 H TYR A 10 -7.348 -1.350 4.249 1.00 0.00 H new ATOM 0 HA TYR A 10 -5.628 -1.184 1.877 1.00 0.00 H new ATOM 0 HB2 TYR A 10 -7.477 1.057 2.784 1.00 0.00 H new ATOM 0 HB3 TYR A 10 -6.318 1.137 1.472 1.00 0.00 H new ATOM 0 HD1 TYR A 10 -9.227 -0.994 2.541 1.00 0.00 H new ATOM 0 HD2 TYR A 10 -7.135 0.830 -0.691 1.00 0.00 H new ATOM 0 HE1 TYR A 10 -10.941 -1.800 0.980 1.00 0.00 H new ATOM 0 HE2 TYR A 10 -8.849 0.029 -2.255 1.00 0.00 H new ATOM 0 HH TYR A 10 -10.735 -1.093 -2.515 1.00 0.00 H new ATOM 127 N PHE A 11 -3.958 0.137 3.192 1.00 0.00 N ATOM 128 CA PHE A 11 -2.912 0.692 4.042 1.00 0.00 C ATOM 129 C PHE A 11 -1.872 1.437 3.209 1.00 0.00 C ATOM 130 O PHE A 11 -1.436 0.952 2.164 1.00 0.00 O ATOM 131 CB PHE A 11 -2.236 -0.419 4.847 1.00 0.00 C ATOM 132 CG PHE A 11 -3.206 -1.321 5.555 1.00 0.00 C ATOM 133 CD1 PHE A 11 -3.643 -1.021 6.835 1.00 0.00 C ATOM 134 CD2 PHE A 11 -3.679 -2.469 4.941 1.00 0.00 C ATOM 135 CE1 PHE A 11 -4.536 -1.848 7.490 1.00 0.00 C ATOM 136 CE2 PHE A 11 -4.573 -3.300 5.591 1.00 0.00 C ATOM 137 CZ PHE A 11 -5.001 -2.990 6.867 1.00 0.00 C ATOM 0 H PHE A 11 -3.660 -0.074 2.240 1.00 0.00 H new ATOM 0 HA PHE A 11 -3.375 1.399 4.730 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -1.618 -1.017 4.178 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -1.568 0.030 5.581 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -3.282 -0.130 7.327 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -3.346 -2.718 3.944 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -4.870 -1.602 8.487 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -4.936 -4.191 5.101 1.00 0.00 H new ATOM 0 HZ PHE A 11 -5.698 -3.639 7.377 1.00 0.00 H new ATOM 147 N ILE A 12 -1.480 2.616 3.679 1.00 0.00 N ATOM 148 CA ILE A 12 -0.492 3.427 2.978 1.00 0.00 C ATOM 149 C ILE A 12 0.922 3.093 3.442 1.00 0.00 C ATOM 150 O ILE A 12 1.255 3.253 4.616 1.00 0.00 O ATOM 151 CB ILE A 12 -0.747 4.931 3.189 1.00 0.00 C ATOM 152 CG1 ILE A 12 -2.075 5.340 2.548 1.00 0.00 C ATOM 153 CG2 ILE A 12 0.399 5.749 2.612 1.00 0.00 C ATOM 154 CD1 ILE A 12 -2.047 5.322 1.035 1.00 0.00 C ATOM 0 H ILE A 12 -1.831 3.031 4.542 1.00 0.00 H new ATOM 0 HA ILE A 12 -0.588 3.195 1.917 1.00 0.00 H new ATOM 0 HB ILE A 12 -0.805 5.128 4.260 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -2.860 4.668 2.897 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -2.339 6.342 2.887 1.00 0.00 H new ATOM 0 HG21 ILE A 12 0.204 6.810 2.769 1.00 0.00 H new ATOM 0 HG22 ILE A 12 1.329 5.474 3.109 1.00 0.00 H new ATOM 0 HG23 ILE A 12 0.486 5.550 1.544 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -3.021 5.623 0.649 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -1.286 6.015 0.677 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -1.814 4.316 0.687 1.00 0.00 H new ATOM 166 N MET A 13 1.749 2.629 2.512 1.00 0.00 N ATOM 167 CA MET A 13 3.129 2.276 2.824 1.00 0.00 C ATOM 168 C MET A 13 4.105 3.175 2.072 1.00 0.00 C ATOM 169 O MET A 13 4.230 3.088 0.850 1.00 0.00 O ATOM 170 CB MET A 13 3.394 0.810 2.474 1.00 0.00 C ATOM 171 CG MET A 13 2.229 -0.112 2.794 1.00 0.00 C ATOM 172 SD MET A 13 1.418 0.309 4.349 1.00 0.00 S ATOM 173 CE MET A 13 2.547 -0.425 5.530 1.00 0.00 C ATOM 0 H MET A 13 1.488 2.489 1.536 1.00 0.00 H new ATOM 0 HA MET A 13 3.281 2.421 3.894 1.00 0.00 H new ATOM 0 HB2 MET A 13 3.625 0.735 1.411 1.00 0.00 H new ATOM 0 HB3 MET A 13 4.276 0.469 3.017 1.00 0.00 H new ATOM 0 HG2 MET A 13 1.501 -0.065 1.984 1.00 0.00 H new ATOM 0 HG3 MET A 13 2.587 -1.140 2.842 1.00 0.00 H new ATOM 0 HE1 MET A 13 1.986 -0.796 6.388 1.00 0.00 H new ATOM 0 HE2 MET A 13 3.079 -1.252 5.059 1.00 0.00 H new ATOM 0 HE3 MET A 13 3.264 0.325 5.863 1.00 0.00 H new ATOM 183 N LYS A 14 4.795 4.039 2.809 1.00 0.00 N ATOM 184 CA LYS A 14 5.761 4.954 2.213 1.00 0.00 C ATOM 185 C LYS A 14 7.153 4.330 2.179 1.00 0.00 C ATOM 186 O LYS A 14 7.497 3.512 3.032 1.00 0.00 O ATOM 187 CB LYS A 14 5.798 6.269 2.994 1.00 0.00 C ATOM 188 CG LYS A 14 4.430 6.744 3.451 1.00 0.00 C ATOM 189 CD LYS A 14 3.631 7.333 2.301 1.00 0.00 C ATOM 190 CE LYS A 14 4.282 8.597 1.760 1.00 0.00 C ATOM 191 NZ LYS A 14 3.347 9.379 0.904 1.00 0.00 N ATOM 0 H LYS A 14 4.703 4.125 3.821 1.00 0.00 H new ATOM 0 HA LYS A 14 5.448 5.156 1.189 1.00 0.00 H new ATOM 0 HB2 LYS A 14 6.440 6.146 3.866 1.00 0.00 H new ATOM 0 HB3 LYS A 14 6.251 7.040 2.370 1.00 0.00 H new ATOM 0 HG2 LYS A 14 3.881 5.909 3.887 1.00 0.00 H new ATOM 0 HG3 LYS A 14 4.547 7.492 4.235 1.00 0.00 H new ATOM 0 HD2 LYS A 14 3.544 6.597 1.502 1.00 0.00 H new ATOM 0 HD3 LYS A 14 2.619 7.559 2.638 1.00 0.00 H new ATOM 0 HE2 LYS A 14 4.618 9.217 2.591 1.00 0.00 H new ATOM 0 HE3 LYS A 14 5.167 8.331 1.182 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 3.860 10.167 0.460 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 2.954 8.761 0.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 2.573 9.755 1.489 1.00 0.00 H new ATOM 205 N SER A 15 7.949 4.723 1.190 1.00 0.00 N ATOM 206 CA SER A 15 9.302 4.200 1.045 1.00 0.00 C ATOM 207 C SER A 15 10.325 5.333 1.046 1.00 0.00 C ATOM 208 O SER A 15 10.070 6.414 0.516 1.00 0.00 O ATOM 209 CB SER A 15 9.423 3.390 -0.247 1.00 0.00 C ATOM 210 OG SER A 15 9.507 4.242 -1.377 1.00 0.00 O ATOM 0 H SER A 15 7.680 5.402 0.477 1.00 0.00 H new ATOM 0 HA SER A 15 9.506 3.548 1.894 1.00 0.00 H new ATOM 0 HB2 SER A 15 10.307 2.755 -0.200 1.00 0.00 H new ATOM 0 HB3 SER A 15 8.561 2.730 -0.348 1.00 0.00 H new ATOM 0 HG SER A 15 10.403 4.177 -1.770 1.00 0.00 H new ATOM 216 N SER A 16 11.483 5.076 1.645 1.00 0.00 N ATOM 217 CA SER A 16 12.543 6.074 1.720 1.00 0.00 C ATOM 218 C SER A 16 13.028 6.456 0.324 1.00 0.00 C ATOM 219 O SER A 16 13.088 7.634 -0.023 1.00 0.00 O ATOM 220 CB SER A 16 13.713 5.544 2.552 1.00 0.00 C ATOM 221 OG SER A 16 13.425 5.611 3.937 1.00 0.00 O ATOM 0 H SER A 16 11.711 4.185 2.086 1.00 0.00 H new ATOM 0 HA SER A 16 12.138 6.964 2.202 1.00 0.00 H new ATOM 0 HB2 SER A 16 13.925 4.512 2.271 1.00 0.00 H new ATOM 0 HB3 SER A 16 14.610 6.124 2.335 1.00 0.00 H new ATOM 0 HG SER A 16 14.187 5.265 4.447 1.00 0.00 H new ATOM 227 N ASN A 17 13.374 5.449 -0.471 1.00 0.00 N ATOM 228 CA ASN A 17 13.855 5.678 -1.829 1.00 0.00 C ATOM 229 C ASN A 17 13.076 4.832 -2.832 1.00 0.00 C ATOM 230 O ASN A 17 12.251 4.001 -2.451 1.00 0.00 O ATOM 231 CB ASN A 17 15.348 5.356 -1.925 1.00 0.00 C ATOM 232 CG ASN A 17 16.210 6.406 -1.252 1.00 0.00 C ATOM 233 OD1 ASN A 17 16.973 6.104 -0.334 1.00 0.00 O ATOM 234 ND2 ASN A 17 16.092 7.648 -1.706 1.00 0.00 N ATOM 0 H ASN A 17 13.330 4.467 -0.199 1.00 0.00 H new ATOM 0 HA ASN A 17 13.701 6.730 -2.070 1.00 0.00 H new ATOM 0 HB2 ASN A 17 15.538 4.386 -1.466 1.00 0.00 H new ATOM 0 HB3 ASN A 17 15.633 5.274 -2.974 1.00 0.00 H new ATOM 0 HD21 ASN A 17 16.646 8.397 -1.292 1.00 0.00 H new ATOM 0 HD22 ASN A 17 15.447 7.853 -2.469 1.00 0.00 H new ATOM 241 N LEU A 18 13.343 5.050 -4.115 1.00 0.00 N ATOM 242 CA LEU A 18 12.668 4.309 -5.174 1.00 0.00 C ATOM 243 C LEU A 18 13.263 2.912 -5.325 1.00 0.00 C ATOM 244 O LEU A 18 12.540 1.916 -5.329 1.00 0.00 O ATOM 245 CB LEU A 18 12.770 5.065 -6.499 1.00 0.00 C ATOM 246 CG LEU A 18 11.808 4.623 -7.601 1.00 0.00 C ATOM 247 CD1 LEU A 18 11.403 3.170 -7.405 1.00 0.00 C ATOM 248 CD2 LEU A 18 10.580 5.521 -7.630 1.00 0.00 C ATOM 0 H LEU A 18 14.023 5.734 -4.447 1.00 0.00 H new ATOM 0 HA LEU A 18 11.618 4.209 -4.901 1.00 0.00 H new ATOM 0 HB2 LEU A 18 12.604 6.124 -6.303 1.00 0.00 H new ATOM 0 HB3 LEU A 18 13.789 4.966 -6.873 1.00 0.00 H new ATOM 0 HG LEU A 18 12.320 4.710 -8.559 1.00 0.00 H new ATOM 0 HD11 LEU A 18 10.718 2.873 -8.199 1.00 0.00 H new ATOM 0 HD12 LEU A 18 12.290 2.538 -7.436 1.00 0.00 H new ATOM 0 HD13 LEU A 18 10.910 3.057 -6.439 1.00 0.00 H new ATOM 0 HD21 LEU A 18 9.907 5.191 -8.421 1.00 0.00 H new ATOM 0 HD22 LEU A 18 10.067 5.466 -6.670 1.00 0.00 H new ATOM 0 HD23 LEU A 18 10.886 6.550 -7.820 1.00 0.00 H new ATOM 260 N ARG A 19 14.584 2.848 -5.447 1.00 0.00 N ATOM 261 CA ARG A 19 15.277 1.574 -5.598 1.00 0.00 C ATOM 262 C ARG A 19 14.637 0.501 -4.721 1.00 0.00 C ATOM 263 O ARG A 19 14.133 -0.504 -5.221 1.00 0.00 O ATOM 264 CB ARG A 19 16.756 1.727 -5.238 1.00 0.00 C ATOM 265 CG ARG A 19 17.474 0.403 -5.037 1.00 0.00 C ATOM 266 CD ARG A 19 17.323 -0.503 -6.249 1.00 0.00 C ATOM 267 NE ARG A 19 18.437 -1.438 -6.376 1.00 0.00 N ATOM 268 CZ ARG A 19 19.654 -1.082 -6.772 1.00 0.00 C ATOM 269 NH1 ARG A 19 19.912 0.182 -7.078 1.00 0.00 N ATOM 270 NH2 ARG A 19 20.616 -1.991 -6.863 1.00 0.00 N ATOM 0 H ARG A 19 15.197 3.664 -5.444 1.00 0.00 H new ATOM 0 HA ARG A 19 15.195 1.265 -6.640 1.00 0.00 H new ATOM 0 HB2 ARG A 19 17.257 2.286 -6.028 1.00 0.00 H new ATOM 0 HB3 ARG A 19 16.840 2.318 -4.326 1.00 0.00 H new ATOM 0 HG2 ARG A 19 18.532 0.587 -4.848 1.00 0.00 H new ATOM 0 HG3 ARG A 19 17.075 -0.098 -4.155 1.00 0.00 H new ATOM 0 HD2 ARG A 19 16.389 -1.060 -6.171 1.00 0.00 H new ATOM 0 HD3 ARG A 19 17.256 0.106 -7.151 1.00 0.00 H new ATOM 0 HE ARG A 19 18.272 -2.418 -6.148 1.00 0.00 H new ATOM 0 HH11 ARG A 19 19.175 0.884 -7.010 1.00 0.00 H new ATOM 0 HH12 ARG A 19 20.847 0.452 -7.382 1.00 0.00 H new ATOM 0 HH21 ARG A 19 20.422 -2.965 -6.629 1.00 0.00 H new ATOM 0 HH22 ARG A 19 21.550 -1.716 -7.167 1.00 0.00 H new ATOM 284 N ASN A 20 14.663 0.722 -3.411 1.00 0.00 N ATOM 285 CA ASN A 20 14.087 -0.226 -2.464 1.00 0.00 C ATOM 286 C ASN A 20 12.787 -0.813 -3.005 1.00 0.00 C ATOM 287 O ASN A 20 12.525 -2.008 -2.862 1.00 0.00 O ATOM 288 CB ASN A 20 13.831 0.456 -1.119 1.00 0.00 C ATOM 289 CG ASN A 20 14.990 1.332 -0.684 1.00 0.00 C ATOM 290 OD1 ASN A 20 16.142 1.073 -1.032 1.00 0.00 O ATOM 291 ND2 ASN A 20 14.690 2.375 0.081 1.00 0.00 N ATOM 0 H ASN A 20 15.077 1.549 -2.981 1.00 0.00 H new ATOM 0 HA ASN A 20 14.800 -1.038 -2.322 1.00 0.00 H new ATOM 0 HB2 ASN A 20 12.928 1.062 -1.188 1.00 0.00 H new ATOM 0 HB3 ASN A 20 13.648 -0.303 -0.359 1.00 0.00 H new ATOM 0 HD21 ASN A 20 15.429 3.000 0.404 1.00 0.00 H new ATOM 0 HD22 ASN A 20 13.721 2.552 0.345 1.00 0.00 H new ATOM 298 N LEU A 21 11.975 0.035 -3.628 1.00 0.00 N ATOM 299 CA LEU A 21 10.702 -0.399 -4.192 1.00 0.00 C ATOM 300 C LEU A 21 10.921 -1.362 -5.355 1.00 0.00 C ATOM 301 O LEU A 21 10.207 -2.354 -5.494 1.00 0.00 O ATOM 302 CB LEU A 21 9.891 0.810 -4.661 1.00 0.00 C ATOM 303 CG LEU A 21 8.394 0.576 -4.863 1.00 0.00 C ATOM 304 CD1 LEU A 21 7.677 0.521 -3.523 1.00 0.00 C ATOM 305 CD2 LEU A 21 7.798 1.665 -5.744 1.00 0.00 C ATOM 0 H LEU A 21 12.176 1.027 -3.755 1.00 0.00 H new ATOM 0 HA LEU A 21 10.147 -0.921 -3.413 1.00 0.00 H new ATOM 0 HB2 LEU A 21 10.018 1.612 -3.934 1.00 0.00 H new ATOM 0 HB3 LEU A 21 10.313 1.163 -5.602 1.00 0.00 H new ATOM 0 HG LEU A 21 8.260 -0.383 -5.364 1.00 0.00 H new ATOM 0 HD11 LEU A 21 6.612 0.354 -3.687 1.00 0.00 H new ATOM 0 HD12 LEU A 21 8.085 -0.294 -2.925 1.00 0.00 H new ATOM 0 HD13 LEU A 21 7.819 1.464 -2.995 1.00 0.00 H new ATOM 0 HD21 LEU A 21 6.732 1.482 -5.877 1.00 0.00 H new ATOM 0 HD22 LEU A 21 7.944 2.636 -5.271 1.00 0.00 H new ATOM 0 HD23 LEU A 21 8.291 1.657 -6.716 1.00 0.00 H new ATOM 317 N GLU A 22 11.915 -1.061 -6.186 1.00 0.00 N ATOM 318 CA GLU A 22 12.228 -1.901 -7.336 1.00 0.00 C ATOM 319 C GLU A 22 12.291 -3.372 -6.934 1.00 0.00 C ATOM 320 O GLU A 22 11.876 -4.251 -7.690 1.00 0.00 O ATOM 321 CB GLU A 22 13.558 -1.474 -7.960 1.00 0.00 C ATOM 322 CG GLU A 22 13.539 -0.064 -8.527 1.00 0.00 C ATOM 323 CD GLU A 22 14.682 0.192 -9.491 1.00 0.00 C ATOM 324 OE1 GLU A 22 15.792 0.518 -9.021 1.00 0.00 O ATOM 325 OE2 GLU A 22 14.466 0.066 -10.715 1.00 0.00 O ATOM 0 H GLU A 22 12.516 -0.243 -6.084 1.00 0.00 H new ATOM 0 HA GLU A 22 11.433 -1.777 -8.072 1.00 0.00 H new ATOM 0 HB2 GLU A 22 14.342 -1.543 -7.206 1.00 0.00 H new ATOM 0 HB3 GLU A 22 13.818 -2.173 -8.755 1.00 0.00 H new ATOM 0 HG2 GLU A 22 12.592 0.105 -9.039 1.00 0.00 H new ATOM 0 HG3 GLU A 22 13.591 0.654 -7.708 1.00 0.00 H new ATOM 332 N ILE A 23 12.814 -3.631 -5.741 1.00 0.00 N ATOM 333 CA ILE A 23 12.931 -4.994 -5.238 1.00 0.00 C ATOM 334 C ILE A 23 11.570 -5.679 -5.185 1.00 0.00 C ATOM 335 O ILE A 23 11.452 -6.872 -5.465 1.00 0.00 O ATOM 336 CB ILE A 23 13.565 -5.025 -3.835 1.00 0.00 C ATOM 337 CG1 ILE A 23 15.044 -4.642 -3.910 1.00 0.00 C ATOM 338 CG2 ILE A 23 13.400 -6.402 -3.209 1.00 0.00 C ATOM 339 CD1 ILE A 23 15.275 -3.177 -4.210 1.00 0.00 C ATOM 0 H ILE A 23 13.164 -2.915 -5.104 1.00 0.00 H new ATOM 0 HA ILE A 23 13.578 -5.531 -5.931 1.00 0.00 H new ATOM 0 HB ILE A 23 13.053 -4.297 -3.206 1.00 0.00 H new ATOM 0 HG12 ILE A 23 15.524 -4.891 -2.963 1.00 0.00 H new ATOM 0 HG13 ILE A 23 15.528 -5.243 -4.680 1.00 0.00 H new ATOM 0 HG21 ILE A 23 13.853 -6.408 -2.218 1.00 0.00 H new ATOM 0 HG22 ILE A 23 12.339 -6.638 -3.124 1.00 0.00 H new ATOM 0 HG23 ILE A 23 13.889 -7.148 -3.836 1.00 0.00 H new ATOM 0 HD11 ILE A 23 16.346 -2.978 -4.248 1.00 0.00 H new ATOM 0 HD12 ILE A 23 14.825 -2.927 -5.171 1.00 0.00 H new ATOM 0 HD13 ILE A 23 14.821 -2.569 -3.427 1.00 0.00 H new ATOM 351 N SER A 24 10.543 -4.916 -4.824 1.00 0.00 N ATOM 352 CA SER A 24 9.189 -5.450 -4.731 1.00 0.00 C ATOM 353 C SER A 24 8.550 -5.552 -6.113 1.00 0.00 C ATOM 354 O SER A 24 7.557 -6.255 -6.298 1.00 0.00 O ATOM 355 CB SER A 24 8.331 -4.566 -3.824 1.00 0.00 C ATOM 356 OG SER A 24 7.038 -5.119 -3.649 1.00 0.00 O ATOM 0 H SER A 24 10.623 -3.926 -4.591 1.00 0.00 H new ATOM 0 HA SER A 24 9.247 -6.450 -4.302 1.00 0.00 H new ATOM 0 HB2 SER A 24 8.817 -4.454 -2.855 1.00 0.00 H new ATOM 0 HB3 SER A 24 8.248 -3.569 -4.256 1.00 0.00 H new ATOM 0 HG SER A 24 6.370 -4.402 -3.666 1.00 0.00 H new ATOM 362 N GLN A 25 9.128 -4.845 -7.079 1.00 0.00 N ATOM 363 CA GLN A 25 8.615 -4.856 -8.444 1.00 0.00 C ATOM 364 C GLN A 25 9.213 -6.009 -9.241 1.00 0.00 C ATOM 365 O GLN A 25 8.563 -6.567 -10.126 1.00 0.00 O ATOM 366 CB GLN A 25 8.923 -3.527 -9.137 1.00 0.00 C ATOM 367 CG GLN A 25 7.964 -2.409 -8.762 1.00 0.00 C ATOM 368 CD GLN A 25 8.372 -1.070 -9.345 1.00 0.00 C ATOM 369 OE1 GLN A 25 8.045 -0.753 -10.489 1.00 0.00 O ATOM 370 NE2 GLN A 25 9.089 -0.276 -8.559 1.00 0.00 N ATOM 0 H GLN A 25 9.951 -4.258 -6.942 1.00 0.00 H new ATOM 0 HA GLN A 25 7.535 -4.993 -8.398 1.00 0.00 H new ATOM 0 HB2 GLN A 25 9.939 -3.223 -8.886 1.00 0.00 H new ATOM 0 HB3 GLN A 25 8.892 -3.674 -10.217 1.00 0.00 H new ATOM 0 HG2 GLN A 25 6.963 -2.662 -9.110 1.00 0.00 H new ATOM 0 HG3 GLN A 25 7.913 -2.328 -7.676 1.00 0.00 H new ATOM 0 HE21 GLN A 25 9.337 -0.580 -7.617 1.00 0.00 H new ATOM 0 HE22 GLN A 25 9.392 0.638 -8.897 1.00 0.00 H new ATOM 379 N GLN A 26 10.454 -6.362 -8.923 1.00 0.00 N ATOM 380 CA GLN A 26 11.140 -7.449 -9.611 1.00 0.00 C ATOM 381 C GLN A 26 11.059 -8.741 -8.805 1.00 0.00 C ATOM 382 O GLN A 26 10.572 -9.761 -9.293 1.00 0.00 O ATOM 383 CB GLN A 26 12.603 -7.081 -9.861 1.00 0.00 C ATOM 384 CG GLN A 26 12.787 -5.703 -10.476 1.00 0.00 C ATOM 385 CD GLN A 26 12.769 -5.734 -11.992 1.00 0.00 C ATOM 386 OE1 GLN A 26 13.717 -6.197 -12.626 1.00 0.00 O ATOM 387 NE2 GLN A 26 11.687 -5.238 -12.581 1.00 0.00 N ATOM 0 H GLN A 26 11.005 -5.911 -8.193 1.00 0.00 H new ATOM 0 HA GLN A 26 10.644 -7.608 -10.569 1.00 0.00 H new ATOM 0 HB2 GLN A 26 13.146 -7.124 -8.917 1.00 0.00 H new ATOM 0 HB3 GLN A 26 13.049 -7.826 -10.520 1.00 0.00 H new ATOM 0 HG2 GLN A 26 11.997 -5.042 -10.120 1.00 0.00 H new ATOM 0 HG3 GLN A 26 13.733 -5.281 -10.136 1.00 0.00 H new ATOM 0 HE21 GLN A 26 10.925 -4.864 -12.016 1.00 0.00 H new ATOM 0 HE22 GLN A 26 11.618 -5.231 -13.599 1.00 0.00 H new ATOM 396 N LYS A 27 11.539 -8.691 -7.567 1.00 0.00 N ATOM 397 CA LYS A 27 11.520 -9.857 -6.691 1.00 0.00 C ATOM 398 C LYS A 27 10.089 -10.251 -6.340 1.00 0.00 C ATOM 399 O LYS A 27 9.779 -11.432 -6.191 1.00 0.00 O ATOM 400 CB LYS A 27 12.311 -9.571 -5.412 1.00 0.00 C ATOM 401 CG LYS A 27 13.608 -8.820 -5.653 1.00 0.00 C ATOM 402 CD LYS A 27 14.484 -9.532 -6.670 1.00 0.00 C ATOM 403 CE LYS A 27 15.945 -9.135 -6.524 1.00 0.00 C ATOM 404 NZ LYS A 27 16.863 -10.235 -6.931 1.00 0.00 N ATOM 0 H LYS A 27 11.946 -7.855 -7.147 1.00 0.00 H new ATOM 0 HA LYS A 27 11.986 -10.687 -7.221 1.00 0.00 H new ATOM 0 HB2 LYS A 27 11.687 -8.992 -4.731 1.00 0.00 H new ATOM 0 HB3 LYS A 27 12.535 -10.515 -4.915 1.00 0.00 H new ATOM 0 HG2 LYS A 27 13.386 -7.812 -6.005 1.00 0.00 H new ATOM 0 HG3 LYS A 27 14.150 -8.717 -4.713 1.00 0.00 H new ATOM 0 HD2 LYS A 27 14.385 -10.610 -6.545 1.00 0.00 H new ATOM 0 HD3 LYS A 27 14.140 -9.295 -7.677 1.00 0.00 H new ATOM 0 HE2 LYS A 27 16.144 -8.253 -7.132 1.00 0.00 H new ATOM 0 HE3 LYS A 27 16.145 -8.860 -5.488 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 17.849 -9.924 -6.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 16.691 -11.069 -6.334 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 16.691 -10.480 -7.927 1.00 0.00 H new ATOM 418 N GLY A 28 9.220 -9.253 -6.210 1.00 0.00 N ATOM 419 CA GLY A 28 7.832 -9.517 -5.879 1.00 0.00 C ATOM 420 C GLY A 28 7.607 -9.651 -4.386 1.00 0.00 C ATOM 421 O GLY A 28 6.753 -10.421 -3.947 1.00 0.00 O ATOM 0 H GLY A 28 9.452 -8.267 -6.328 1.00 0.00 H new ATOM 0 HA2 GLY A 28 7.210 -8.710 -6.266 1.00 0.00 H new ATOM 0 HA3 GLY A 28 7.511 -10.433 -6.375 1.00 0.00 H new ATOM 425 N ILE A 29 8.377 -8.901 -3.604 1.00 0.00 N ATOM 426 CA ILE A 29 8.258 -8.940 -2.152 1.00 0.00 C ATOM 427 C ILE A 29 8.541 -7.572 -1.540 1.00 0.00 C ATOM 428 O ILE A 29 9.249 -6.754 -2.126 1.00 0.00 O ATOM 429 CB ILE A 29 9.219 -9.974 -1.536 1.00 0.00 C ATOM 430 CG1 ILE A 29 10.569 -9.939 -2.254 1.00 0.00 C ATOM 431 CG2 ILE A 29 8.612 -11.368 -1.605 1.00 0.00 C ATOM 432 CD1 ILE A 29 11.458 -8.797 -1.814 1.00 0.00 C ATOM 0 H ILE A 29 9.090 -8.259 -3.952 1.00 0.00 H new ATOM 0 HA ILE A 29 7.232 -9.231 -1.927 1.00 0.00 H new ATOM 0 HB ILE A 29 9.379 -9.720 -0.488 1.00 0.00 H new ATOM 0 HG12 ILE A 29 11.089 -10.881 -2.080 1.00 0.00 H new ATOM 0 HG13 ILE A 29 10.398 -9.863 -3.328 1.00 0.00 H new ATOM 0 HG21 ILE A 29 9.303 -12.088 -1.166 1.00 0.00 H new ATOM 0 HG22 ILE A 29 7.672 -11.383 -1.053 1.00 0.00 H new ATOM 0 HG23 ILE A 29 8.426 -11.633 -2.646 1.00 0.00 H new ATOM 0 HD11 ILE A 29 12.398 -8.835 -2.365 1.00 0.00 H new ATOM 0 HD12 ILE A 29 10.958 -7.849 -2.014 1.00 0.00 H new ATOM 0 HD13 ILE A 29 11.659 -8.883 -0.746 1.00 0.00 H new ATOM 444 N TRP A 30 7.984 -7.333 -0.358 1.00 0.00 N ATOM 445 CA TRP A 30 8.178 -6.064 0.335 1.00 0.00 C ATOM 446 C TRP A 30 8.399 -6.287 1.827 1.00 0.00 C ATOM 447 O TRP A 30 7.780 -7.163 2.431 1.00 0.00 O ATOM 448 CB TRP A 30 6.971 -5.150 0.116 1.00 0.00 C ATOM 449 CG TRP A 30 7.073 -3.847 0.849 1.00 0.00 C ATOM 450 CD1 TRP A 30 6.362 -3.469 1.952 1.00 0.00 C ATOM 451 CD2 TRP A 30 7.934 -2.749 0.529 1.00 0.00 C ATOM 452 NE1 TRP A 30 6.729 -2.202 2.337 1.00 0.00 N ATOM 453 CE2 TRP A 30 7.693 -1.739 1.481 1.00 0.00 C ATOM 454 CE3 TRP A 30 8.888 -2.521 -0.467 1.00 0.00 C ATOM 455 CZ2 TRP A 30 8.370 -0.523 1.463 1.00 0.00 C ATOM 456 CZ3 TRP A 30 9.558 -1.313 -0.484 1.00 0.00 C ATOM 457 CH2 TRP A 30 9.298 -0.327 0.476 1.00 0.00 C ATOM 0 H TRP A 30 7.395 -8.000 0.140 1.00 0.00 H new ATOM 0 HA TRP A 30 9.066 -5.585 -0.077 1.00 0.00 H new ATOM 0 HB2 TRP A 30 6.863 -4.951 -0.950 1.00 0.00 H new ATOM 0 HB3 TRP A 30 6.068 -5.669 0.436 1.00 0.00 H new ATOM 0 HD1 TRP A 30 5.620 -4.077 2.449 1.00 0.00 H new ATOM 0 HE1 TRP A 30 6.346 -1.689 3.131 1.00 0.00 H new ATOM 0 HE3 TRP A 30 9.098 -3.276 -1.210 1.00 0.00 H new ATOM 0 HZ2 TRP A 30 8.170 0.239 2.202 1.00 0.00 H new ATOM 0 HZ3 TRP A 30 10.295 -1.126 -1.251 1.00 0.00 H new ATOM 0 HH2 TRP A 30 9.840 0.606 0.437 1.00 0.00 H new ATOM 468 N SER A 31 9.284 -5.489 2.416 1.00 0.00 N ATOM 469 CA SER A 31 9.588 -5.603 3.838 1.00 0.00 C ATOM 470 C SER A 31 9.317 -4.285 4.558 1.00 0.00 C ATOM 471 O SER A 31 10.023 -3.297 4.356 1.00 0.00 O ATOM 472 CB SER A 31 11.047 -6.016 4.037 1.00 0.00 C ATOM 473 OG SER A 31 11.919 -5.181 3.295 1.00 0.00 O ATOM 0 H SER A 31 9.803 -4.757 1.931 1.00 0.00 H new ATOM 0 HA SER A 31 8.940 -6.369 4.263 1.00 0.00 H new ATOM 0 HB2 SER A 31 11.302 -5.964 5.096 1.00 0.00 H new ATOM 0 HB3 SER A 31 11.180 -7.053 3.728 1.00 0.00 H new ATOM 0 HG SER A 31 12.006 -5.528 2.382 1.00 0.00 H new ATOM 479 N THR A 32 8.288 -4.279 5.400 1.00 0.00 N ATOM 480 CA THR A 32 7.922 -3.084 6.150 1.00 0.00 C ATOM 481 C THR A 32 8.281 -3.229 7.625 1.00 0.00 C ATOM 482 O THR A 32 8.660 -4.309 8.079 1.00 0.00 O ATOM 483 CB THR A 32 6.416 -2.784 6.027 1.00 0.00 C ATOM 484 OG1 THR A 32 6.160 -1.418 6.372 1.00 0.00 O ATOM 485 CG2 THR A 32 5.605 -3.701 6.930 1.00 0.00 C ATOM 0 H THR A 32 7.694 -5.088 5.579 1.00 0.00 H new ATOM 0 HA THR A 32 8.487 -2.256 5.721 1.00 0.00 H new ATOM 0 HB THR A 32 6.116 -2.961 4.994 1.00 0.00 H new ATOM 0 HG1 THR A 32 5.201 -1.234 6.290 1.00 0.00 H new ATOM 0 HG21 THR A 32 4.545 -3.470 6.826 1.00 0.00 H new ATOM 0 HG22 THR A 32 5.780 -4.739 6.646 1.00 0.00 H new ATOM 0 HG23 THR A 32 5.908 -3.552 7.966 1.00 0.00 H new ATOM 493 N THR A 33 8.158 -2.135 8.369 1.00 0.00 N ATOM 494 CA THR A 33 8.470 -2.140 9.793 1.00 0.00 C ATOM 495 C THR A 33 7.625 -3.168 10.537 1.00 0.00 C ATOM 496 O THR A 33 6.442 -3.357 10.253 1.00 0.00 O ATOM 497 CB THR A 33 8.243 -0.753 10.423 1.00 0.00 C ATOM 498 OG1 THR A 33 8.946 -0.659 11.666 1.00 0.00 O ATOM 499 CG2 THR A 33 6.761 -0.499 10.652 1.00 0.00 C ATOM 0 H THR A 33 7.844 -1.234 8.009 1.00 0.00 H new ATOM 0 HA THR A 33 9.523 -2.404 9.885 1.00 0.00 H new ATOM 0 HB THR A 33 8.622 0.001 9.734 1.00 0.00 H new ATOM 0 HG1 THR A 33 8.798 0.226 12.059 1.00 0.00 H new ATOM 0 HG21 THR A 33 6.625 0.486 11.098 1.00 0.00 H new ATOM 0 HG22 THR A 33 6.233 -0.542 9.699 1.00 0.00 H new ATOM 0 HG23 THR A 33 6.361 -1.259 11.323 1.00 0.00 H new ATOM 507 N PRO A 34 8.244 -3.848 11.513 1.00 0.00 N ATOM 508 CA PRO A 34 7.566 -4.868 12.319 1.00 0.00 C ATOM 509 C PRO A 34 6.528 -4.267 13.261 1.00 0.00 C ATOM 510 O PRO A 34 5.902 -4.980 14.046 1.00 0.00 O ATOM 511 CB PRO A 34 8.706 -5.506 13.117 1.00 0.00 C ATOM 512 CG PRO A 34 9.754 -4.449 13.191 1.00 0.00 C ATOM 513 CD PRO A 34 9.652 -3.674 11.906 1.00 0.00 C ATOM 0 HA PRO A 34 7.013 -5.575 11.700 1.00 0.00 H new ATOM 0 HB2 PRO A 34 8.374 -5.805 14.111 1.00 0.00 H new ATOM 0 HB3 PRO A 34 9.082 -6.402 12.623 1.00 0.00 H new ATOM 0 HG2 PRO A 34 9.594 -3.800 14.052 1.00 0.00 H new ATOM 0 HG3 PRO A 34 10.745 -4.889 13.304 1.00 0.00 H new ATOM 0 HD2 PRO A 34 9.902 -2.623 12.050 1.00 0.00 H new ATOM 0 HD3 PRO A 34 10.332 -4.062 11.148 1.00 0.00 H new ATOM 521 N SER A 35 6.352 -2.952 13.179 1.00 0.00 N ATOM 522 CA SER A 35 5.392 -2.255 14.027 1.00 0.00 C ATOM 523 C SER A 35 4.057 -2.082 13.308 1.00 0.00 C ATOM 524 O SER A 35 3.073 -1.645 13.901 1.00 0.00 O ATOM 525 CB SER A 35 5.943 -0.889 14.440 1.00 0.00 C ATOM 526 OG SER A 35 5.110 -0.275 15.408 1.00 0.00 O ATOM 0 H SER A 35 6.862 -2.348 12.534 1.00 0.00 H new ATOM 0 HA SER A 35 5.228 -2.858 14.920 1.00 0.00 H new ATOM 0 HB2 SER A 35 6.949 -1.006 14.843 1.00 0.00 H new ATOM 0 HB3 SER A 35 6.023 -0.246 13.564 1.00 0.00 H new ATOM 0 HG SER A 35 4.172 -0.477 15.208 1.00 0.00 H new ATOM 532 N ASN A 36 4.034 -2.428 12.025 1.00 0.00 N ATOM 533 CA ASN A 36 2.821 -2.311 11.223 1.00 0.00 C ATOM 534 C ASN A 36 2.563 -3.592 10.437 1.00 0.00 C ATOM 535 O ASN A 36 1.775 -3.603 9.492 1.00 0.00 O ATOM 536 CB ASN A 36 2.932 -1.124 10.264 1.00 0.00 C ATOM 537 CG ASN A 36 3.688 0.042 10.871 1.00 0.00 C ATOM 538 OD1 ASN A 36 3.721 0.207 12.091 1.00 0.00 O ATOM 539 ND2 ASN A 36 4.300 0.858 10.021 1.00 0.00 N ATOM 0 H ASN A 36 4.841 -2.792 11.518 1.00 0.00 H new ATOM 0 HA ASN A 36 1.982 -2.146 11.899 1.00 0.00 H new ATOM 0 HB2 ASN A 36 3.435 -1.444 9.351 1.00 0.00 H new ATOM 0 HB3 ASN A 36 1.932 -0.796 9.979 1.00 0.00 H new ATOM 0 HD21 ASN A 36 4.824 1.660 10.371 1.00 0.00 H new ATOM 0 HD22 ASN A 36 4.246 0.683 9.018 1.00 0.00 H new ATOM 546 N GLU A 37 3.232 -4.670 10.836 1.00 0.00 N ATOM 547 CA GLU A 37 3.074 -5.957 10.168 1.00 0.00 C ATOM 548 C GLU A 37 1.780 -6.640 10.601 1.00 0.00 C ATOM 549 O GLU A 37 1.116 -7.299 9.801 1.00 0.00 O ATOM 550 CB GLU A 37 4.268 -6.864 10.471 1.00 0.00 C ATOM 551 CG GLU A 37 5.480 -6.587 9.597 1.00 0.00 C ATOM 552 CD GLU A 37 6.651 -7.495 9.918 1.00 0.00 C ATOM 553 OE1 GLU A 37 6.587 -8.207 10.942 1.00 0.00 O ATOM 554 OE2 GLU A 37 7.632 -7.494 9.145 1.00 0.00 O ATOM 0 H GLU A 37 3.888 -4.678 11.617 1.00 0.00 H new ATOM 0 HA GLU A 37 3.027 -5.776 9.094 1.00 0.00 H new ATOM 0 HB2 GLU A 37 4.549 -6.743 11.517 1.00 0.00 H new ATOM 0 HB3 GLU A 37 3.966 -7.903 10.341 1.00 0.00 H new ATOM 0 HG2 GLU A 37 5.204 -6.712 8.550 1.00 0.00 H new ATOM 0 HG3 GLU A 37 5.785 -5.548 9.724 1.00 0.00 H new ATOM 561 N ARG A 38 1.429 -6.477 11.873 1.00 0.00 N ATOM 562 CA ARG A 38 0.216 -7.079 12.413 1.00 0.00 C ATOM 563 C ARG A 38 -0.953 -6.906 11.449 1.00 0.00 C ATOM 564 O ARG A 38 -1.388 -7.862 10.805 1.00 0.00 O ATOM 565 CB ARG A 38 -0.129 -6.455 13.767 1.00 0.00 C ATOM 566 CG ARG A 38 -1.502 -6.847 14.286 1.00 0.00 C ATOM 567 CD ARG A 38 -2.123 -5.734 15.116 1.00 0.00 C ATOM 568 NE ARG A 38 -1.517 -5.636 16.441 1.00 0.00 N ATOM 569 CZ ARG A 38 -1.823 -6.442 17.451 1.00 0.00 C ATOM 570 NH1 ARG A 38 -2.723 -7.402 17.288 1.00 0.00 N ATOM 571 NH2 ARG A 38 -1.228 -6.290 18.627 1.00 0.00 N ATOM 0 H ARG A 38 1.967 -5.934 12.548 1.00 0.00 H new ATOM 0 HA ARG A 38 0.399 -8.145 12.547 1.00 0.00 H new ATOM 0 HB2 ARG A 38 0.624 -6.752 14.497 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -0.079 -5.370 13.681 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -2.155 -7.084 13.446 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -1.419 -7.750 14.890 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -2.007 -4.784 14.593 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -3.193 -5.913 15.219 1.00 0.00 H new ATOM 0 HE ARG A 38 -0.820 -4.908 16.599 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -3.182 -7.523 16.385 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -2.956 -8.020 18.065 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -0.535 -5.553 18.756 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -1.464 -6.910 19.402 1.00 0.00 H new ATOM 585 N LYS A 39 -1.459 -5.681 11.354 1.00 0.00 N ATOM 586 CA LYS A 39 -2.578 -5.382 10.468 1.00 0.00 C ATOM 587 C LYS A 39 -2.456 -6.153 9.158 1.00 0.00 C ATOM 588 O LYS A 39 -3.282 -7.016 8.855 1.00 0.00 O ATOM 589 CB LYS A 39 -2.641 -3.879 10.183 1.00 0.00 C ATOM 590 CG LYS A 39 -1.280 -3.246 9.952 1.00 0.00 C ATOM 591 CD LYS A 39 -1.243 -1.808 10.442 1.00 0.00 C ATOM 592 CE LYS A 39 -2.025 -0.885 9.519 1.00 0.00 C ATOM 593 NZ LYS A 39 -1.164 -0.314 8.447 1.00 0.00 N ATOM 0 H LYS A 39 -1.112 -4.879 11.880 1.00 0.00 H new ATOM 0 HA LYS A 39 -3.497 -5.691 10.967 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -3.265 -3.710 9.305 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -3.127 -3.379 11.021 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -0.515 -3.827 10.468 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -1.040 -3.275 8.889 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -1.658 -1.755 11.449 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -0.209 -1.470 10.505 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -2.850 -1.436 9.067 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -2.464 -0.075 10.102 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -1.306 0.715 8.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -0.166 -0.517 8.658 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -1.418 -0.741 7.533 1.00 0.00 H new ATOM 607 N LEU A 40 -1.422 -5.840 8.386 1.00 0.00 N ATOM 608 CA LEU A 40 -1.191 -6.506 7.108 1.00 0.00 C ATOM 609 C LEU A 40 -1.299 -8.020 7.256 1.00 0.00 C ATOM 610 O LEU A 40 -1.810 -8.705 6.371 1.00 0.00 O ATOM 611 CB LEU A 40 0.186 -6.132 6.558 1.00 0.00 C ATOM 612 CG LEU A 40 0.589 -4.664 6.697 1.00 0.00 C ATOM 613 CD1 LEU A 40 1.937 -4.415 6.038 1.00 0.00 C ATOM 614 CD2 LEU A 40 -0.476 -3.759 6.096 1.00 0.00 C ATOM 0 H LEU A 40 -0.730 -5.129 8.622 1.00 0.00 H new ATOM 0 HA LEU A 40 -1.957 -6.173 6.408 1.00 0.00 H new ATOM 0 HB2 LEU A 40 0.935 -6.743 7.063 1.00 0.00 H new ATOM 0 HB3 LEU A 40 0.217 -6.398 5.501 1.00 0.00 H new ATOM 0 HG LEU A 40 0.678 -4.431 7.758 1.00 0.00 H new ATOM 0 HD11 LEU A 40 2.207 -3.365 6.147 1.00 0.00 H new ATOM 0 HD12 LEU A 40 2.695 -5.036 6.515 1.00 0.00 H new ATOM 0 HD13 LEU A 40 1.876 -4.666 4.979 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -0.172 -2.718 6.204 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -0.598 -3.993 5.039 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -1.422 -3.916 6.614 1.00 0.00 H new ATOM 626 N ASN A 41 -0.816 -8.535 8.382 1.00 0.00 N ATOM 627 CA ASN A 41 -0.859 -9.969 8.646 1.00 0.00 C ATOM 628 C ASN A 41 -2.281 -10.419 8.971 1.00 0.00 C ATOM 629 O ASN A 41 -2.914 -11.124 8.185 1.00 0.00 O ATOM 630 CB ASN A 41 0.077 -10.324 9.803 1.00 0.00 C ATOM 631 CG ASN A 41 1.499 -10.573 9.340 1.00 0.00 C ATOM 632 OD1 ASN A 41 2.325 -9.660 9.317 1.00 0.00 O ATOM 633 ND2 ASN A 41 1.791 -11.814 8.968 1.00 0.00 N ATOM 0 H ASN A 41 -0.391 -7.981 9.126 1.00 0.00 H new ATOM 0 HA ASN A 41 -0.528 -10.489 7.747 1.00 0.00 H new ATOM 0 HB2 ASN A 41 0.072 -9.514 10.533 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -0.298 -11.213 10.311 1.00 0.00 H new ATOM 0 HD21 ASN A 41 2.732 -12.042 8.647 1.00 0.00 H new ATOM 0 HD22 ASN A 41 1.074 -12.539 9.004 1.00 0.00 H new ATOM 640 N ARG A 42 -2.775 -10.006 10.133 1.00 0.00 N ATOM 641 CA ARG A 42 -4.121 -10.367 10.563 1.00 0.00 C ATOM 642 C ARG A 42 -5.141 -10.055 9.472 1.00 0.00 C ATOM 643 O ARG A 42 -5.873 -10.937 9.023 1.00 0.00 O ATOM 644 CB ARG A 42 -4.487 -9.621 11.847 1.00 0.00 C ATOM 645 CG ARG A 42 -5.674 -10.220 12.582 1.00 0.00 C ATOM 646 CD ARG A 42 -5.302 -11.523 13.273 1.00 0.00 C ATOM 647 NE ARG A 42 -6.095 -11.748 14.479 1.00 0.00 N ATOM 648 CZ ARG A 42 -6.065 -12.878 15.177 1.00 0.00 C ATOM 649 NH1 ARG A 42 -5.286 -13.879 14.791 1.00 0.00 N ATOM 650 NH2 ARG A 42 -6.815 -13.008 16.264 1.00 0.00 N ATOM 0 H ARG A 42 -2.264 -9.421 10.794 1.00 0.00 H new ATOM 0 HA ARG A 42 -4.138 -11.439 10.757 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -3.624 -9.615 12.512 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -4.708 -8.582 11.603 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -6.043 -9.508 13.320 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -6.486 -10.399 11.878 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -5.448 -12.354 12.583 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -4.244 -11.506 13.533 1.00 0.00 H new ATOM 0 HE ARG A 42 -6.705 -10.997 14.803 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -4.708 -13.783 13.956 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -5.265 -14.745 15.329 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -7.415 -12.240 16.564 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -6.791 -13.876 16.799 1.00 0.00 H new ATOM 664 N ALA A 43 -5.184 -8.795 9.051 1.00 0.00 N ATOM 665 CA ALA A 43 -6.113 -8.368 8.013 1.00 0.00 C ATOM 666 C ALA A 43 -6.156 -9.373 6.867 1.00 0.00 C ATOM 667 O ALA A 43 -7.226 -9.848 6.484 1.00 0.00 O ATOM 668 CB ALA A 43 -5.728 -6.990 7.495 1.00 0.00 C ATOM 0 H ALA A 43 -4.586 -8.052 9.413 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.109 -8.314 8.452 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -6.430 -6.683 6.720 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -5.756 -6.272 8.315 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -4.721 -7.026 7.079 1.00 0.00 H new ATOM 674 N PHE A 44 -4.987 -9.692 6.322 1.00 0.00 N ATOM 675 CA PHE A 44 -4.892 -10.640 5.218 1.00 0.00 C ATOM 676 C PHE A 44 -5.798 -11.844 5.455 1.00 0.00 C ATOM 677 O PHE A 44 -6.338 -12.423 4.513 1.00 0.00 O ATOM 678 CB PHE A 44 -3.444 -11.104 5.040 1.00 0.00 C ATOM 679 CG PHE A 44 -3.256 -12.053 3.891 1.00 0.00 C ATOM 680 CD1 PHE A 44 -3.465 -11.633 2.587 1.00 0.00 C ATOM 681 CD2 PHE A 44 -2.871 -13.365 4.115 1.00 0.00 C ATOM 682 CE1 PHE A 44 -3.293 -12.504 1.527 1.00 0.00 C ATOM 683 CE2 PHE A 44 -2.697 -14.240 3.059 1.00 0.00 C ATOM 684 CZ PHE A 44 -2.909 -13.809 1.764 1.00 0.00 C ATOM 0 H PHE A 44 -4.092 -9.308 6.627 1.00 0.00 H new ATOM 0 HA PHE A 44 -5.219 -10.135 4.309 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -2.807 -10.232 4.889 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -3.110 -11.587 5.958 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -3.766 -10.613 2.396 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -2.705 -13.708 5.126 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -3.459 -12.164 0.515 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -2.395 -15.260 3.246 1.00 0.00 H new ATOM 0 HZ PHE A 44 -2.775 -14.492 0.938 1.00 0.00 H new ATOM 694 N TRP A 45 -5.959 -12.216 6.720 1.00 0.00 N ATOM 695 CA TRP A 45 -6.799 -13.352 7.082 1.00 0.00 C ATOM 696 C TRP A 45 -8.223 -12.900 7.386 1.00 0.00 C ATOM 697 O TRP A 45 -9.185 -13.452 6.854 1.00 0.00 O ATOM 698 CB TRP A 45 -6.213 -14.081 8.292 1.00 0.00 C ATOM 699 CG TRP A 45 -4.731 -14.285 8.201 1.00 0.00 C ATOM 700 CD1 TRP A 45 -3.981 -14.353 7.062 1.00 0.00 C ATOM 701 CD2 TRP A 45 -3.820 -14.451 9.293 1.00 0.00 C ATOM 702 NE1 TRP A 45 -2.659 -14.550 7.380 1.00 0.00 N ATOM 703 CE2 TRP A 45 -2.534 -14.613 8.742 1.00 0.00 C ATOM 704 CE3 TRP A 45 -3.965 -14.476 10.683 1.00 0.00 C ATOM 705 CZ2 TRP A 45 -1.403 -14.798 9.534 1.00 0.00 C ATOM 706 CZ3 TRP A 45 -2.843 -14.661 11.467 1.00 0.00 C ATOM 707 CH2 TRP A 45 -1.575 -14.819 10.891 1.00 0.00 C ATOM 0 H TRP A 45 -5.519 -11.748 7.512 1.00 0.00 H new ATOM 0 HA TRP A 45 -6.828 -14.036 6.234 1.00 0.00 H new ATOM 0 HB2 TRP A 45 -6.440 -13.513 9.194 1.00 0.00 H new ATOM 0 HB3 TRP A 45 -6.701 -15.050 8.394 1.00 0.00 H new ATOM 0 HD1 TRP A 45 -4.370 -14.265 6.058 1.00 0.00 H new ATOM 0 HE1 TRP A 45 -1.895 -14.635 6.710 1.00 0.00 H new ATOM 0 HE3 TRP A 45 -4.938 -14.353 11.136 1.00 0.00 H new ATOM 0 HZ2 TRP A 45 -0.425 -14.921 9.092 1.00 0.00 H new ATOM 0 HZ3 TRP A 45 -2.944 -14.684 12.542 1.00 0.00 H new ATOM 0 HH2 TRP A 45 -0.717 -14.960 11.531 1.00 0.00 H new ATOM 718 N GLU A 46 -8.350 -11.893 8.245 1.00 0.00 N ATOM 719 CA GLU A 46 -9.658 -11.369 8.620 1.00 0.00 C ATOM 720 C GLU A 46 -10.340 -10.705 7.427 1.00 0.00 C ATOM 721 O GLU A 46 -11.503 -10.311 7.504 1.00 0.00 O ATOM 722 CB GLU A 46 -9.521 -10.365 9.766 1.00 0.00 C ATOM 723 CG GLU A 46 -9.125 -11.002 11.088 1.00 0.00 C ATOM 724 CD GLU A 46 -9.158 -10.018 12.242 1.00 0.00 C ATOM 725 OE1 GLU A 46 -8.864 -8.826 12.013 1.00 0.00 O ATOM 726 OE2 GLU A 46 -9.477 -10.440 13.373 1.00 0.00 O ATOM 0 H GLU A 46 -7.563 -11.424 8.694 1.00 0.00 H new ATOM 0 HA GLU A 46 -10.274 -12.205 8.951 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -8.776 -9.617 9.495 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -10.468 -9.841 9.894 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -9.798 -11.832 11.303 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -8.122 -11.420 11.000 1.00 0.00 H new ATOM 733 N SER A 47 -9.606 -10.584 6.325 1.00 0.00 N ATOM 734 CA SER A 47 -10.137 -9.964 5.117 1.00 0.00 C ATOM 735 C SER A 47 -9.813 -10.806 3.887 1.00 0.00 C ATOM 736 O SER A 47 -8.952 -11.685 3.932 1.00 0.00 O ATOM 737 CB SER A 47 -9.568 -8.554 4.949 1.00 0.00 C ATOM 738 OG SER A 47 -10.380 -7.595 5.605 1.00 0.00 O ATOM 0 H SER A 47 -8.642 -10.907 6.244 1.00 0.00 H new ATOM 0 HA SER A 47 -11.221 -9.901 5.217 1.00 0.00 H new ATOM 0 HB2 SER A 47 -8.556 -8.516 5.353 1.00 0.00 H new ATOM 0 HB3 SER A 47 -9.497 -8.311 3.889 1.00 0.00 H new ATOM 0 HG SER A 47 -11.087 -7.294 4.997 1.00 0.00 H new ATOM 744 N SER A 48 -10.508 -10.529 2.788 1.00 0.00 N ATOM 745 CA SER A 48 -10.297 -11.263 1.545 1.00 0.00 C ATOM 746 C SER A 48 -8.950 -10.906 0.926 1.00 0.00 C ATOM 747 O SER A 48 -8.180 -11.785 0.539 1.00 0.00 O ATOM 748 CB SER A 48 -11.423 -10.962 0.554 1.00 0.00 C ATOM 749 OG SER A 48 -12.500 -11.869 0.714 1.00 0.00 O ATOM 0 H SER A 48 -11.222 -9.802 2.733 1.00 0.00 H new ATOM 0 HA SER A 48 -10.300 -12.328 1.775 1.00 0.00 H new ATOM 0 HB2 SER A 48 -11.778 -9.942 0.701 1.00 0.00 H new ATOM 0 HB3 SER A 48 -11.041 -11.023 -0.465 1.00 0.00 H new ATOM 0 HG SER A 48 -13.207 -11.654 0.070 1.00 0.00 H new ATOM 755 N ILE A 49 -8.672 -9.609 0.835 1.00 0.00 N ATOM 756 CA ILE A 49 -7.418 -9.135 0.263 1.00 0.00 C ATOM 757 C ILE A 49 -6.850 -7.974 1.071 1.00 0.00 C ATOM 758 O ILE A 49 -7.500 -7.461 1.982 1.00 0.00 O ATOM 759 CB ILE A 49 -7.599 -8.689 -1.199 1.00 0.00 C ATOM 760 CG1 ILE A 49 -8.546 -9.640 -1.933 1.00 0.00 C ATOM 761 CG2 ILE A 49 -6.252 -8.626 -1.904 1.00 0.00 C ATOM 762 CD1 ILE A 49 -9.105 -9.067 -3.216 1.00 0.00 C ATOM 0 H ILE A 49 -9.299 -8.868 1.150 1.00 0.00 H new ATOM 0 HA ILE A 49 -6.720 -9.972 0.294 1.00 0.00 H new ATOM 0 HB ILE A 49 -8.039 -7.692 -1.207 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -8.015 -10.565 -2.159 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -9.372 -9.900 -1.271 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -6.396 -8.309 -2.937 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -5.607 -7.912 -1.392 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -5.787 -9.612 -1.889 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -9.768 -9.796 -3.682 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -9.664 -8.158 -2.995 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -8.287 -8.833 -3.897 1.00 0.00 H new ATOM 774 N VAL A 50 -5.633 -7.562 0.730 1.00 0.00 N ATOM 775 CA VAL A 50 -4.978 -6.458 1.422 1.00 0.00 C ATOM 776 C VAL A 50 -4.341 -5.489 0.431 1.00 0.00 C ATOM 777 O VAL A 50 -3.272 -5.758 -0.117 1.00 0.00 O ATOM 778 CB VAL A 50 -3.895 -6.967 2.392 1.00 0.00 C ATOM 779 CG1 VAL A 50 -3.257 -5.805 3.138 1.00 0.00 C ATOM 780 CG2 VAL A 50 -4.485 -7.976 3.366 1.00 0.00 C ATOM 0 H VAL A 50 -5.081 -7.976 -0.021 1.00 0.00 H new ATOM 0 HA VAL A 50 -5.750 -5.938 1.990 1.00 0.00 H new ATOM 0 HB VAL A 50 -3.118 -7.466 1.812 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -2.495 -6.184 3.818 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -2.798 -5.122 2.423 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -4.021 -5.275 3.708 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -3.706 -8.325 4.044 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -5.282 -7.504 3.941 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -4.890 -8.823 2.812 1.00 0.00 H new ATOM 790 N TYR A 51 -5.006 -4.361 0.207 1.00 0.00 N ATOM 791 CA TYR A 51 -4.506 -3.352 -0.720 1.00 0.00 C ATOM 792 C TYR A 51 -3.461 -2.466 -0.049 1.00 0.00 C ATOM 793 O TYR A 51 -3.749 -1.778 0.931 1.00 0.00 O ATOM 794 CB TYR A 51 -5.659 -2.493 -1.241 1.00 0.00 C ATOM 795 CG TYR A 51 -6.442 -3.144 -2.359 1.00 0.00 C ATOM 796 CD1 TYR A 51 -5.793 -3.765 -3.418 1.00 0.00 C ATOM 797 CD2 TYR A 51 -7.832 -3.140 -2.354 1.00 0.00 C ATOM 798 CE1 TYR A 51 -6.505 -4.361 -4.442 1.00 0.00 C ATOM 799 CE2 TYR A 51 -8.552 -3.734 -3.372 1.00 0.00 C ATOM 800 CZ TYR A 51 -7.884 -4.343 -4.414 1.00 0.00 C ATOM 801 OH TYR A 51 -8.596 -4.937 -5.430 1.00 0.00 O ATOM 0 H TYR A 51 -5.891 -4.122 0.654 1.00 0.00 H new ATOM 0 HA TYR A 51 -4.036 -3.866 -1.558 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -6.336 -2.270 -0.417 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -5.261 -1.541 -1.593 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -4.713 -3.783 -3.442 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -8.358 -2.664 -1.540 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -5.985 -4.838 -5.259 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -9.632 -3.722 -3.352 1.00 0.00 H new ATOM 0 HH TYR A 51 -9.556 -4.837 -5.259 1.00 0.00 H new ATOM 811 N LEU A 52 -2.245 -2.488 -0.584 1.00 0.00 N ATOM 812 CA LEU A 52 -1.154 -1.687 -0.039 1.00 0.00 C ATOM 813 C LEU A 52 -0.684 -0.647 -1.051 1.00 0.00 C ATOM 814 O LEU A 52 0.037 -0.966 -1.996 1.00 0.00 O ATOM 815 CB LEU A 52 0.014 -2.588 0.364 1.00 0.00 C ATOM 816 CG LEU A 52 -0.342 -3.812 1.208 1.00 0.00 C ATOM 817 CD1 LEU A 52 0.761 -4.856 1.126 1.00 0.00 C ATOM 818 CD2 LEU A 52 -0.591 -3.409 2.654 1.00 0.00 C ATOM 0 H LEU A 52 -1.990 -3.052 -1.395 1.00 0.00 H new ATOM 0 HA LEU A 52 -1.524 -1.166 0.844 1.00 0.00 H new ATOM 0 HB2 LEU A 52 0.513 -2.930 -0.543 1.00 0.00 H new ATOM 0 HB3 LEU A 52 0.736 -1.987 0.918 1.00 0.00 H new ATOM 0 HG LEU A 52 -1.258 -4.249 0.811 1.00 0.00 H new ATOM 0 HD11 LEU A 52 0.490 -5.720 1.733 1.00 0.00 H new ATOM 0 HD12 LEU A 52 0.891 -5.167 0.089 1.00 0.00 H new ATOM 0 HD13 LEU A 52 1.693 -4.430 1.497 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -0.843 -4.293 3.240 1.00 0.00 H new ATOM 0 HD22 LEU A 52 0.308 -2.947 3.063 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -1.416 -2.698 2.697 1.00 0.00 H new ATOM 830 N VAL A 53 -1.096 0.600 -0.845 1.00 0.00 N ATOM 831 CA VAL A 53 -0.715 1.688 -1.737 1.00 0.00 C ATOM 832 C VAL A 53 0.677 2.211 -1.402 1.00 0.00 C ATOM 833 O VAL A 53 0.863 2.926 -0.417 1.00 0.00 O ATOM 834 CB VAL A 53 -1.720 2.853 -1.663 1.00 0.00 C ATOM 835 CG1 VAL A 53 -1.283 3.994 -2.569 1.00 0.00 C ATOM 836 CG2 VAL A 53 -3.117 2.375 -2.030 1.00 0.00 C ATOM 0 H VAL A 53 -1.694 0.882 -0.068 1.00 0.00 H new ATOM 0 HA VAL A 53 -0.714 1.282 -2.749 1.00 0.00 H new ATOM 0 HB VAL A 53 -1.745 3.224 -0.638 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -2.005 4.808 -2.503 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -0.303 4.353 -2.255 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -1.227 3.640 -3.599 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -3.814 3.211 -1.972 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -3.110 1.977 -3.045 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -3.428 1.594 -1.336 1.00 0.00 H new ATOM 846 N PHE A 54 1.654 1.850 -2.228 1.00 0.00 N ATOM 847 CA PHE A 54 3.031 2.283 -2.019 1.00 0.00 C ATOM 848 C PHE A 54 3.288 3.624 -2.699 1.00 0.00 C ATOM 849 O PHE A 54 2.798 3.879 -3.799 1.00 0.00 O ATOM 850 CB PHE A 54 4.004 1.231 -2.555 1.00 0.00 C ATOM 851 CG PHE A 54 3.761 -0.146 -2.006 1.00 0.00 C ATOM 852 CD1 PHE A 54 2.725 -0.927 -2.493 1.00 0.00 C ATOM 853 CD2 PHE A 54 4.568 -0.659 -1.004 1.00 0.00 C ATOM 854 CE1 PHE A 54 2.498 -2.194 -1.991 1.00 0.00 C ATOM 855 CE2 PHE A 54 4.346 -1.926 -0.498 1.00 0.00 C ATOM 856 CZ PHE A 54 3.309 -2.694 -0.991 1.00 0.00 C ATOM 0 H PHE A 54 1.518 1.259 -3.048 1.00 0.00 H new ATOM 0 HA PHE A 54 3.190 2.403 -0.947 1.00 0.00 H new ATOM 0 HB2 PHE A 54 3.929 1.199 -3.642 1.00 0.00 H new ATOM 0 HB3 PHE A 54 5.023 1.534 -2.315 1.00 0.00 H new ATOM 0 HD1 PHE A 54 2.087 -0.541 -3.274 1.00 0.00 H new ATOM 0 HD2 PHE A 54 5.379 -0.063 -0.614 1.00 0.00 H new ATOM 0 HE1 PHE A 54 1.688 -2.793 -2.380 1.00 0.00 H new ATOM 0 HE2 PHE A 54 4.983 -2.315 0.282 1.00 0.00 H new ATOM 0 HZ PHE A 54 3.133 -3.683 -0.595 1.00 0.00 H new ATOM 866 N SER A 55 4.061 4.478 -2.036 1.00 0.00 N ATOM 867 CA SER A 55 4.381 5.795 -2.573 1.00 0.00 C ATOM 868 C SER A 55 5.717 6.294 -2.030 1.00 0.00 C ATOM 869 O SER A 55 5.839 6.613 -0.847 1.00 0.00 O ATOM 870 CB SER A 55 3.273 6.793 -2.230 1.00 0.00 C ATOM 871 OG SER A 55 3.205 7.831 -3.192 1.00 0.00 O ATOM 0 H SER A 55 4.477 4.281 -1.126 1.00 0.00 H new ATOM 0 HA SER A 55 4.459 5.708 -3.657 1.00 0.00 H new ATOM 0 HB2 SER A 55 2.315 6.275 -2.181 1.00 0.00 H new ATOM 0 HB3 SER A 55 3.456 7.219 -1.243 1.00 0.00 H new ATOM 0 HG SER A 55 2.488 8.454 -2.951 1.00 0.00 H new ATOM 877 N VAL A 56 6.717 6.359 -2.903 1.00 0.00 N ATOM 878 CA VAL A 56 8.044 6.819 -2.513 1.00 0.00 C ATOM 879 C VAL A 56 8.012 8.278 -2.071 1.00 0.00 C ATOM 880 O VAL A 56 7.367 9.114 -2.705 1.00 0.00 O ATOM 881 CB VAL A 56 9.053 6.666 -3.666 1.00 0.00 C ATOM 882 CG1 VAL A 56 10.399 7.260 -3.281 1.00 0.00 C ATOM 883 CG2 VAL A 56 9.199 5.202 -4.055 1.00 0.00 C ATOM 0 H VAL A 56 6.633 6.099 -3.886 1.00 0.00 H new ATOM 0 HA VAL A 56 8.362 6.196 -1.677 1.00 0.00 H new ATOM 0 HB VAL A 56 8.676 7.213 -4.530 1.00 0.00 H new ATOM 0 HG11 VAL A 56 11.099 7.142 -4.108 1.00 0.00 H new ATOM 0 HG12 VAL A 56 10.278 8.320 -3.056 1.00 0.00 H new ATOM 0 HG13 VAL A 56 10.786 6.744 -2.402 1.00 0.00 H new ATOM 0 HG21 VAL A 56 9.916 5.112 -4.871 1.00 0.00 H new ATOM 0 HG22 VAL A 56 9.553 4.631 -3.197 1.00 0.00 H new ATOM 0 HG23 VAL A 56 8.233 4.813 -4.376 1.00 0.00 H new ATOM 893 N GLN A 57 8.712 8.576 -0.981 1.00 0.00 N ATOM 894 CA GLN A 57 8.763 9.935 -0.455 1.00 0.00 C ATOM 895 C GLN A 57 9.169 10.925 -1.542 1.00 0.00 C ATOM 896 O GLN A 57 9.863 10.568 -2.493 1.00 0.00 O ATOM 897 CB GLN A 57 9.743 10.015 0.716 1.00 0.00 C ATOM 898 CG GLN A 57 9.399 11.098 1.725 1.00 0.00 C ATOM 899 CD GLN A 57 8.034 10.898 2.354 1.00 0.00 C ATOM 900 OE1 GLN A 57 7.667 9.784 2.726 1.00 0.00 O ATOM 901 NE2 GLN A 57 7.274 11.980 2.476 1.00 0.00 N ATOM 0 H GLN A 57 9.251 7.895 -0.446 1.00 0.00 H new ATOM 0 HA GLN A 57 7.766 10.199 -0.103 1.00 0.00 H new ATOM 0 HB2 GLN A 57 9.768 9.051 1.224 1.00 0.00 H new ATOM 0 HB3 GLN A 57 10.745 10.197 0.328 1.00 0.00 H new ATOM 0 HG2 GLN A 57 10.157 11.113 2.508 1.00 0.00 H new ATOM 0 HG3 GLN A 57 9.429 12.070 1.233 1.00 0.00 H new ATOM 0 HE21 GLN A 57 7.619 12.884 2.154 1.00 0.00 H new ATOM 0 HE22 GLN A 57 6.346 11.907 2.892 1.00 0.00 H new ATOM 935 N HIS A 61 3.923 11.487 -7.390 1.00 0.00 N ATOM 936 CA HIS A 61 2.872 10.577 -7.832 1.00 0.00 C ATOM 937 C HIS A 61 2.857 9.311 -6.981 1.00 0.00 C ATOM 938 O HIS A 61 3.710 9.123 -6.113 1.00 0.00 O ATOM 939 CB HIS A 61 3.069 10.213 -9.304 1.00 0.00 C ATOM 940 CG HIS A 61 3.136 11.403 -10.211 1.00 0.00 C ATOM 941 ND1 HIS A 61 4.042 12.429 -10.040 1.00 0.00 N ATOM 942 CD2 HIS A 61 2.405 11.727 -11.303 1.00 0.00 C ATOM 943 CE1 HIS A 61 3.864 13.333 -10.987 1.00 0.00 C ATOM 944 NE2 HIS A 61 2.876 12.931 -11.766 1.00 0.00 N ATOM 0 HA HIS A 61 1.914 11.084 -7.716 1.00 0.00 H new ATOM 0 HB2 HIS A 61 3.988 9.636 -9.407 1.00 0.00 H new ATOM 0 HB3 HIS A 61 2.250 9.569 -9.623 1.00 0.00 H new ATOM 0 HD1 HIS A 61 4.740 12.482 -9.298 1.00 0.00 H new ATOM 0 HD2 HIS A 61 1.601 11.147 -11.731 1.00 0.00 H new ATOM 0 HE1 HIS A 61 4.430 14.245 -11.104 1.00 0.00 H new ATOM 952 N PHE A 62 1.881 8.445 -7.234 1.00 0.00 N ATOM 953 CA PHE A 62 1.754 7.197 -6.490 1.00 0.00 C ATOM 954 C PHE A 62 2.500 6.067 -7.192 1.00 0.00 C ATOM 955 O PHE A 62 2.048 5.552 -8.214 1.00 0.00 O ATOM 956 CB PHE A 62 0.279 6.825 -6.325 1.00 0.00 C ATOM 957 CG PHE A 62 -0.373 7.469 -5.135 1.00 0.00 C ATOM 958 CD1 PHE A 62 -0.232 6.920 -3.870 1.00 0.00 C ATOM 959 CD2 PHE A 62 -1.127 8.622 -5.280 1.00 0.00 C ATOM 960 CE1 PHE A 62 -0.830 7.510 -2.773 1.00 0.00 C ATOM 961 CE2 PHE A 62 -1.727 9.216 -4.186 1.00 0.00 C ATOM 962 CZ PHE A 62 -1.579 8.659 -2.931 1.00 0.00 C ATOM 0 H PHE A 62 1.167 8.585 -7.948 1.00 0.00 H new ATOM 0 HA PHE A 62 2.197 7.344 -5.505 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -0.263 7.113 -7.226 1.00 0.00 H new ATOM 0 HB3 PHE A 62 0.194 5.742 -6.234 1.00 0.00 H new ATOM 0 HD1 PHE A 62 0.352 6.021 -3.740 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -1.247 9.062 -6.259 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -0.712 7.073 -1.793 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -2.311 10.115 -4.312 1.00 0.00 H new ATOM 0 HZ PHE A 62 -2.048 9.121 -2.075 1.00 0.00 H new ATOM 972 N GLN A 63 3.645 5.686 -6.635 1.00 0.00 N ATOM 973 CA GLN A 63 4.455 4.618 -7.208 1.00 0.00 C ATOM 974 C GLN A 63 3.585 3.432 -7.611 1.00 0.00 C ATOM 975 O GLN A 63 3.973 2.622 -8.453 1.00 0.00 O ATOM 976 CB GLN A 63 5.523 4.167 -6.210 1.00 0.00 C ATOM 977 CG GLN A 63 6.817 4.959 -6.303 1.00 0.00 C ATOM 978 CD GLN A 63 7.289 5.139 -7.732 1.00 0.00 C ATOM 979 OE1 GLN A 63 7.882 4.235 -8.321 1.00 0.00 O ATOM 980 NE2 GLN A 63 7.029 6.312 -8.298 1.00 0.00 N ATOM 0 H GLN A 63 4.032 6.101 -5.788 1.00 0.00 H new ATOM 0 HA GLN A 63 4.944 5.007 -8.101 1.00 0.00 H new ATOM 0 HB2 GLN A 63 5.124 4.256 -5.199 1.00 0.00 H new ATOM 0 HB3 GLN A 63 5.740 3.112 -6.375 1.00 0.00 H new ATOM 0 HG2 GLN A 63 6.673 5.938 -5.846 1.00 0.00 H new ATOM 0 HG3 GLN A 63 7.592 4.450 -5.730 1.00 0.00 H new ATOM 0 HE21 GLN A 63 6.535 7.033 -7.773 1.00 0.00 H new ATOM 0 HE22 GLN A 63 7.324 6.492 -9.258 1.00 0.00 H new ATOM 989 N GLY A 64 2.406 3.335 -7.004 1.00 0.00 N ATOM 990 CA GLY A 64 1.500 2.245 -7.312 1.00 0.00 C ATOM 991 C GLY A 64 1.093 1.462 -6.079 1.00 0.00 C ATOM 992 O GLY A 64 1.628 1.681 -4.992 1.00 0.00 O ATOM 0 H GLY A 64 2.062 3.993 -6.304 1.00 0.00 H new ATOM 0 HA2 GLY A 64 0.608 2.644 -7.796 1.00 0.00 H new ATOM 0 HA3 GLY A 64 1.976 1.572 -8.025 1.00 0.00 H new ATOM 996 N PHE A 65 0.143 0.548 -6.247 1.00 0.00 N ATOM 997 CA PHE A 65 -0.337 -0.267 -5.138 1.00 0.00 C ATOM 998 C PHE A 65 -0.199 -1.753 -5.456 1.00 0.00 C ATOM 999 O PHE A 65 -0.103 -2.144 -6.620 1.00 0.00 O ATOM 1000 CB PHE A 65 -1.798 0.066 -4.828 1.00 0.00 C ATOM 1001 CG PHE A 65 -2.776 -0.616 -5.742 1.00 0.00 C ATOM 1002 CD1 PHE A 65 -3.076 -0.077 -6.983 1.00 0.00 C ATOM 1003 CD2 PHE A 65 -3.394 -1.796 -5.361 1.00 0.00 C ATOM 1004 CE1 PHE A 65 -3.976 -0.702 -7.825 1.00 0.00 C ATOM 1005 CE2 PHE A 65 -4.294 -2.426 -6.200 1.00 0.00 C ATOM 1006 CZ PHE A 65 -4.585 -1.878 -7.434 1.00 0.00 C ATOM 0 H PHE A 65 -0.309 0.353 -7.140 1.00 0.00 H new ATOM 0 HA PHE A 65 0.273 -0.042 -4.263 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -2.016 -0.218 -3.799 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -1.939 1.145 -4.898 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -2.601 0.841 -7.295 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -3.170 -2.229 -4.397 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -4.203 -0.271 -8.789 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -4.769 -3.345 -5.891 1.00 0.00 H new ATOM 0 HZ PHE A 65 -5.287 -2.368 -8.092 1.00 0.00 H new ATOM 1016 N SER A 66 -0.189 -2.577 -4.413 1.00 0.00 N ATOM 1017 CA SER A 66 -0.059 -4.020 -4.580 1.00 0.00 C ATOM 1018 C SER A 66 -0.866 -4.764 -3.521 1.00 0.00 C ATOM 1019 O SER A 66 -0.805 -4.440 -2.335 1.00 0.00 O ATOM 1020 CB SER A 66 1.412 -4.432 -4.499 1.00 0.00 C ATOM 1021 OG SER A 66 2.241 -3.505 -5.178 1.00 0.00 O ATOM 0 H SER A 66 -0.269 -2.270 -3.444 1.00 0.00 H new ATOM 0 HA SER A 66 -0.450 -4.285 -5.562 1.00 0.00 H new ATOM 0 HB2 SER A 66 1.717 -4.500 -3.455 1.00 0.00 H new ATOM 0 HB3 SER A 66 1.539 -5.424 -4.933 1.00 0.00 H new ATOM 0 HG SER A 66 2.723 -3.963 -5.897 1.00 0.00 H new ATOM 1027 N ARG A 67 -1.624 -5.765 -3.960 1.00 0.00 N ATOM 1028 CA ARG A 67 -2.446 -6.555 -3.051 1.00 0.00 C ATOM 1029 C ARG A 67 -1.644 -7.709 -2.457 1.00 0.00 C ATOM 1030 O ARG A 67 -1.158 -8.578 -3.182 1.00 0.00 O ATOM 1031 CB ARG A 67 -3.675 -7.098 -3.783 1.00 0.00 C ATOM 1032 CG ARG A 67 -3.336 -7.930 -5.008 1.00 0.00 C ATOM 1033 CD ARG A 67 -4.591 -8.406 -5.723 1.00 0.00 C ATOM 1034 NE ARG A 67 -4.287 -9.360 -6.787 1.00 0.00 N ATOM 1035 CZ ARG A 67 -5.187 -9.798 -7.660 1.00 0.00 C ATOM 1036 NH1 ARG A 67 -6.440 -9.370 -7.597 1.00 0.00 N ATOM 1037 NH2 ARG A 67 -4.834 -10.665 -8.600 1.00 0.00 N ATOM 0 H ARG A 67 -1.685 -6.047 -4.938 1.00 0.00 H new ATOM 0 HA ARG A 67 -2.772 -5.906 -2.239 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -4.260 -7.705 -3.092 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -4.306 -6.262 -4.085 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -2.727 -7.340 -5.693 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -2.737 -8.791 -4.710 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -5.265 -8.869 -5.002 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -5.116 -7.548 -6.144 1.00 0.00 H new ATOM 0 HE ARG A 67 -3.331 -9.709 -6.864 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -6.715 -8.702 -6.877 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -7.129 -9.708 -8.269 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -3.871 -10.996 -8.653 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -5.526 -11.001 -9.270 1.00 0.00 H new ATOM 1051 N MET A 68 -1.509 -7.711 -1.135 1.00 0.00 N ATOM 1052 CA MET A 68 -0.766 -8.759 -0.445 1.00 0.00 C ATOM 1053 C MET A 68 -1.143 -10.136 -0.981 1.00 0.00 C ATOM 1054 O MET A 68 -2.322 -10.443 -1.157 1.00 0.00 O ATOM 1055 CB MET A 68 -1.032 -8.694 1.061 1.00 0.00 C ATOM 1056 CG MET A 68 0.111 -9.237 1.903 1.00 0.00 C ATOM 1057 SD MET A 68 0.239 -8.424 3.507 1.00 0.00 S ATOM 1058 CE MET A 68 0.427 -9.838 4.590 1.00 0.00 C ATOM 0 H MET A 68 -1.904 -6.999 -0.520 1.00 0.00 H new ATOM 0 HA MET A 68 0.296 -8.597 -0.627 1.00 0.00 H new ATOM 0 HB2 MET A 68 -1.221 -7.659 1.344 1.00 0.00 H new ATOM 0 HB3 MET A 68 -1.938 -9.257 1.286 1.00 0.00 H new ATOM 0 HG2 MET A 68 -0.030 -10.307 2.053 1.00 0.00 H new ATOM 0 HG3 MET A 68 1.048 -9.112 1.361 1.00 0.00 H new ATOM 0 HE1 MET A 68 0.376 -9.510 5.628 1.00 0.00 H new ATOM 0 HE2 MET A 68 -0.372 -10.554 4.396 1.00 0.00 H new ATOM 0 HE3 MET A 68 1.391 -10.312 4.406 1.00 0.00 H new ATOM 1068 N SER A 69 -0.134 -10.962 -1.239 1.00 0.00 N ATOM 1069 CA SER A 69 -0.360 -12.306 -1.759 1.00 0.00 C ATOM 1070 C SER A 69 0.088 -13.361 -0.752 1.00 0.00 C ATOM 1071 O SER A 69 -0.352 -14.509 -0.802 1.00 0.00 O ATOM 1072 CB SER A 69 0.387 -12.496 -3.080 1.00 0.00 C ATOM 1073 OG SER A 69 0.378 -13.855 -3.480 1.00 0.00 O ATOM 0 H SER A 69 0.848 -10.724 -1.097 1.00 0.00 H new ATOM 0 HA SER A 69 -1.429 -12.427 -1.933 1.00 0.00 H new ATOM 0 HB2 SER A 69 -0.075 -11.883 -3.854 1.00 0.00 H new ATOM 0 HB3 SER A 69 1.416 -12.152 -2.972 1.00 0.00 H new ATOM 0 HG SER A 69 0.860 -13.950 -4.328 1.00 0.00 H new ATOM 1079 N SER A 70 0.968 -12.962 0.162 1.00 0.00 N ATOM 1080 CA SER A 70 1.479 -13.873 1.179 1.00 0.00 C ATOM 1081 C SER A 70 1.548 -13.185 2.539 1.00 0.00 C ATOM 1082 O SER A 70 1.611 -11.959 2.624 1.00 0.00 O ATOM 1083 CB SER A 70 2.866 -14.385 0.784 1.00 0.00 C ATOM 1084 OG SER A 70 3.224 -15.526 1.545 1.00 0.00 O ATOM 0 H SER A 70 1.341 -12.014 0.218 1.00 0.00 H new ATOM 0 HA SER A 70 0.794 -14.718 1.252 1.00 0.00 H new ATOM 0 HB2 SER A 70 2.877 -14.634 -0.277 1.00 0.00 H new ATOM 0 HB3 SER A 70 3.604 -13.597 0.934 1.00 0.00 H new ATOM 0 HG SER A 70 4.186 -15.691 1.454 1.00 0.00 H new ATOM 1090 N GLU A 71 1.535 -13.985 3.601 1.00 0.00 N ATOM 1091 CA GLU A 71 1.595 -13.453 4.958 1.00 0.00 C ATOM 1092 C GLU A 71 3.038 -13.180 5.372 1.00 0.00 C ATOM 1093 O GLU A 71 3.971 -13.788 4.847 1.00 0.00 O ATOM 1094 CB GLU A 71 0.947 -14.430 5.941 1.00 0.00 C ATOM 1095 CG GLU A 71 1.705 -15.739 6.087 1.00 0.00 C ATOM 1096 CD GLU A 71 1.087 -16.657 7.124 1.00 0.00 C ATOM 1097 OE1 GLU A 71 -0.108 -16.990 6.984 1.00 0.00 O ATOM 1098 OE2 GLU A 71 1.799 -17.044 8.074 1.00 0.00 O ATOM 0 H GLU A 71 1.484 -15.002 3.548 1.00 0.00 H new ATOM 0 HA GLU A 71 1.046 -12.512 4.977 1.00 0.00 H new ATOM 0 HB2 GLU A 71 0.871 -13.953 6.918 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -0.070 -14.643 5.611 1.00 0.00 H new ATOM 0 HG2 GLU A 71 1.731 -16.249 5.124 1.00 0.00 H new ATOM 0 HG3 GLU A 71 2.738 -15.528 6.363 1.00 0.00 H new ATOM 1105 N ILE A 72 3.212 -12.261 6.316 1.00 0.00 N ATOM 1106 CA ILE A 72 4.540 -11.907 6.801 1.00 0.00 C ATOM 1107 C ILE A 72 5.064 -12.952 7.780 1.00 0.00 C ATOM 1108 O ILE A 72 4.360 -13.362 8.702 1.00 0.00 O ATOM 1109 CB ILE A 72 4.540 -10.529 7.489 1.00 0.00 C ATOM 1110 CG1 ILE A 72 3.703 -9.533 6.684 1.00 0.00 C ATOM 1111 CG2 ILE A 72 5.964 -10.020 7.655 1.00 0.00 C ATOM 1112 CD1 ILE A 72 3.651 -8.152 7.299 1.00 0.00 C ATOM 0 H ILE A 72 2.450 -11.748 6.760 1.00 0.00 H new ATOM 0 HA ILE A 72 5.194 -11.868 5.930 1.00 0.00 H new ATOM 0 HB ILE A 72 4.095 -10.633 8.478 1.00 0.00 H new ATOM 0 HG12 ILE A 72 4.112 -9.458 5.676 1.00 0.00 H new ATOM 0 HG13 ILE A 72 2.688 -9.918 6.588 1.00 0.00 H new ATOM 0 HG21 ILE A 72 5.947 -9.045 8.143 1.00 0.00 H new ATOM 0 HG22 ILE A 72 6.532 -10.722 8.266 1.00 0.00 H new ATOM 0 HG23 ILE A 72 6.434 -9.928 6.676 1.00 0.00 H new ATOM 0 HD11 ILE A 72 3.041 -7.499 6.675 1.00 0.00 H new ATOM 0 HD12 ILE A 72 3.214 -8.214 8.296 1.00 0.00 H new ATOM 0 HD13 ILE A 72 4.660 -7.747 7.370 1.00 0.00 H new ATOM 1124 N GLY A 73 6.307 -13.378 7.574 1.00 0.00 N ATOM 1125 CA GLY A 73 6.905 -14.370 8.448 1.00 0.00 C ATOM 1126 C GLY A 73 8.125 -15.026 7.831 1.00 0.00 C ATOM 1127 O GLY A 73 9.070 -14.345 7.433 1.00 0.00 O ATOM 0 H GLY A 73 6.910 -13.054 6.818 1.00 0.00 H new ATOM 0 HA2 GLY A 73 7.187 -13.898 9.389 1.00 0.00 H new ATOM 0 HA3 GLY A 73 6.165 -15.135 8.684 1.00 0.00 H new ATOM 1131 N ARG A 74 8.105 -16.353 7.753 1.00 0.00 N ATOM 1132 CA ARG A 74 9.219 -17.101 7.183 1.00 0.00 C ATOM 1133 C ARG A 74 9.812 -16.365 5.986 1.00 0.00 C ATOM 1134 O ARG A 74 11.022 -16.149 5.916 1.00 0.00 O ATOM 1135 CB ARG A 74 8.759 -18.497 6.760 1.00 0.00 C ATOM 1136 CG ARG A 74 9.904 -19.448 6.451 1.00 0.00 C ATOM 1137 CD ARG A 74 10.651 -19.849 7.714 1.00 0.00 C ATOM 1138 NE ARG A 74 11.863 -20.608 7.415 1.00 0.00 N ATOM 1139 CZ ARG A 74 12.841 -20.805 8.292 1.00 0.00 C ATOM 1140 NH1 ARG A 74 12.751 -20.302 9.515 1.00 0.00 N ATOM 1141 NH2 ARG A 74 13.913 -21.507 7.945 1.00 0.00 N ATOM 0 H ARG A 74 7.330 -16.932 8.077 1.00 0.00 H new ATOM 0 HA ARG A 74 9.990 -17.196 7.948 1.00 0.00 H new ATOM 0 HB2 ARG A 74 8.147 -18.925 7.554 1.00 0.00 H new ATOM 0 HB3 ARG A 74 8.123 -18.409 5.879 1.00 0.00 H new ATOM 0 HG2 ARG A 74 9.515 -20.339 5.958 1.00 0.00 H new ATOM 0 HG3 ARG A 74 10.594 -18.974 5.754 1.00 0.00 H new ATOM 0 HD2 ARG A 74 10.913 -18.955 8.279 1.00 0.00 H new ATOM 0 HD3 ARG A 74 9.996 -20.447 8.348 1.00 0.00 H new ATOM 0 HE ARG A 74 11.964 -21.008 6.482 1.00 0.00 H new ATOM 0 HH11 ARG A 74 11.929 -19.762 9.785 1.00 0.00 H new ATOM 0 HH12 ARG A 74 13.504 -20.455 10.186 1.00 0.00 H new ATOM 0 HH21 ARG A 74 13.986 -21.895 7.005 1.00 0.00 H new ATOM 0 HH22 ARG A 74 14.664 -21.658 8.619 1.00 0.00 H new ATOM 1155 N GLU A 75 8.952 -15.983 5.047 1.00 0.00 N ATOM 1156 CA GLU A 75 9.393 -15.272 3.852 1.00 0.00 C ATOM 1157 C GLU A 75 10.476 -14.253 4.194 1.00 0.00 C ATOM 1158 O GLU A 75 10.251 -13.330 4.977 1.00 0.00 O ATOM 1159 CB GLU A 75 8.209 -14.570 3.183 1.00 0.00 C ATOM 1160 CG GLU A 75 7.497 -15.428 2.151 1.00 0.00 C ATOM 1161 CD GLU A 75 6.424 -16.307 2.764 1.00 0.00 C ATOM 1162 OE1 GLU A 75 6.352 -16.377 4.009 1.00 0.00 O ATOM 1163 OE2 GLU A 75 5.655 -16.926 1.998 1.00 0.00 O ATOM 0 H GLU A 75 7.947 -16.154 5.090 1.00 0.00 H new ATOM 0 HA GLU A 75 9.811 -16.002 3.159 1.00 0.00 H new ATOM 0 HB2 GLU A 75 7.494 -14.271 3.950 1.00 0.00 H new ATOM 0 HB3 GLU A 75 8.562 -13.657 2.703 1.00 0.00 H new ATOM 0 HG2 GLU A 75 7.046 -14.783 1.397 1.00 0.00 H new ATOM 0 HG3 GLU A 75 8.227 -16.055 1.639 1.00 0.00 H new ATOM 1170 N LYS A 76 11.652 -14.426 3.601 1.00 0.00 N ATOM 1171 CA LYS A 76 12.771 -13.523 3.840 1.00 0.00 C ATOM 1172 C LYS A 76 13.515 -13.222 2.543 1.00 0.00 C ATOM 1173 O LYS A 76 13.294 -13.877 1.524 1.00 0.00 O ATOM 1174 CB LYS A 76 13.733 -14.129 4.863 1.00 0.00 C ATOM 1175 CG LYS A 76 13.300 -13.920 6.304 1.00 0.00 C ATOM 1176 CD LYS A 76 13.719 -12.553 6.819 1.00 0.00 C ATOM 1177 CE LYS A 76 13.575 -12.459 8.330 1.00 0.00 C ATOM 1178 NZ LYS A 76 14.752 -13.035 9.037 1.00 0.00 N ATOM 0 H LYS A 76 11.855 -15.185 2.950 1.00 0.00 H new ATOM 0 HA LYS A 76 12.372 -12.588 4.235 1.00 0.00 H new ATOM 0 HB2 LYS A 76 13.827 -15.198 4.672 1.00 0.00 H new ATOM 0 HB3 LYS A 76 14.722 -13.692 4.723 1.00 0.00 H new ATOM 0 HG2 LYS A 76 12.217 -14.022 6.378 1.00 0.00 H new ATOM 0 HG3 LYS A 76 13.737 -14.696 6.932 1.00 0.00 H new ATOM 0 HD2 LYS A 76 14.754 -12.359 6.538 1.00 0.00 H new ATOM 0 HD3 LYS A 76 13.110 -11.782 6.346 1.00 0.00 H new ATOM 0 HE2 LYS A 76 13.453 -11.415 8.619 1.00 0.00 H new ATOM 0 HE3 LYS A 76 12.672 -12.983 8.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 14.615 -12.952 10.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 14.854 -14.038 8.782 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 15.611 -12.518 8.759 1.00 0.00 H new ATOM 1192 N SER A 77 14.398 -12.230 2.588 1.00 0.00 N ATOM 1193 CA SER A 77 15.173 -11.842 1.415 1.00 0.00 C ATOM 1194 C SER A 77 16.521 -11.255 1.825 1.00 0.00 C ATOM 1195 O SER A 77 16.794 -11.069 3.010 1.00 0.00 O ATOM 1196 CB SER A 77 14.395 -10.826 0.577 1.00 0.00 C ATOM 1197 OG SER A 77 14.779 -10.889 -0.786 1.00 0.00 O ATOM 0 H SER A 77 14.595 -11.680 3.424 1.00 0.00 H new ATOM 0 HA SER A 77 15.352 -12.735 0.816 1.00 0.00 H new ATOM 0 HB2 SER A 77 13.326 -11.019 0.666 1.00 0.00 H new ATOM 0 HB3 SER A 77 14.571 -9.821 0.962 1.00 0.00 H new ATOM 0 HG SER A 77 14.266 -10.231 -1.301 1.00 0.00 H new ATOM 1203 N GLN A 78 17.359 -10.967 0.834 1.00 0.00 N ATOM 1204 CA GLN A 78 18.678 -10.402 1.091 1.00 0.00 C ATOM 1205 C GLN A 78 18.784 -8.988 0.528 1.00 0.00 C ATOM 1206 O GLN A 78 19.168 -8.056 1.235 1.00 0.00 O ATOM 1207 CB GLN A 78 19.764 -11.289 0.479 1.00 0.00 C ATOM 1208 CG GLN A 78 21.148 -11.045 1.059 1.00 0.00 C ATOM 1209 CD GLN A 78 22.129 -12.147 0.711 1.00 0.00 C ATOM 1210 OE1 GLN A 78 22.482 -12.335 -0.453 1.00 0.00 O ATOM 1211 NE2 GLN A 78 22.576 -12.882 1.722 1.00 0.00 N ATOM 0 H GLN A 78 17.148 -11.116 -0.153 1.00 0.00 H new ATOM 0 HA GLN A 78 18.821 -10.356 2.171 1.00 0.00 H new ATOM 0 HB2 GLN A 78 19.495 -12.334 0.630 1.00 0.00 H new ATOM 0 HB3 GLN A 78 19.795 -11.120 -0.597 1.00 0.00 H new ATOM 0 HG2 GLN A 78 21.530 -10.093 0.689 1.00 0.00 H new ATOM 0 HG3 GLN A 78 21.074 -10.959 2.143 1.00 0.00 H new ATOM 0 HE21 GLN A 78 22.257 -12.691 2.672 1.00 0.00 H new ATOM 0 HE22 GLN A 78 23.239 -13.638 1.549 1.00 0.00 H new ATOM 1220 N ASP A 79 18.442 -8.837 -0.746 1.00 0.00 N ATOM 1221 CA ASP A 79 18.497 -7.536 -1.404 1.00 0.00 C ATOM 1222 C ASP A 79 17.537 -6.552 -0.743 1.00 0.00 C ATOM 1223 O ASP A 79 16.322 -6.744 -0.767 1.00 0.00 O ATOM 1224 CB ASP A 79 18.161 -7.677 -2.889 1.00 0.00 C ATOM 1225 CG ASP A 79 18.862 -6.638 -3.742 1.00 0.00 C ATOM 1226 OD1 ASP A 79 18.484 -5.451 -3.661 1.00 0.00 O ATOM 1227 OD2 ASP A 79 19.788 -7.013 -4.492 1.00 0.00 O ATOM 0 H ASP A 79 18.124 -9.599 -1.345 1.00 0.00 H new ATOM 0 HA ASP A 79 19.511 -7.149 -1.305 1.00 0.00 H new ATOM 0 HB2 ASP A 79 18.443 -8.673 -3.230 1.00 0.00 H new ATOM 0 HB3 ASP A 79 17.083 -7.587 -3.025 1.00 0.00 H new ATOM 1232 N TRP A 80 18.092 -5.499 -0.152 1.00 0.00 N ATOM 1233 CA TRP A 80 17.284 -4.485 0.517 1.00 0.00 C ATOM 1234 C TRP A 80 18.114 -3.242 0.820 1.00 0.00 C ATOM 1235 O TRP A 80 19.309 -3.334 1.096 1.00 0.00 O ATOM 1236 CB TRP A 80 16.692 -5.047 1.810 1.00 0.00 C ATOM 1237 CG TRP A 80 15.417 -5.806 1.599 1.00 0.00 C ATOM 1238 CD1 TRP A 80 15.116 -7.050 2.075 1.00 0.00 C ATOM 1239 CD2 TRP A 80 14.274 -5.371 0.856 1.00 0.00 C ATOM 1240 NE1 TRP A 80 13.854 -7.415 1.673 1.00 0.00 N ATOM 1241 CE2 TRP A 80 13.316 -6.402 0.924 1.00 0.00 C ATOM 1242 CE3 TRP A 80 13.965 -4.211 0.141 1.00 0.00 C ATOM 1243 CZ2 TRP A 80 12.073 -6.305 0.304 1.00 0.00 C ATOM 1244 CZ3 TRP A 80 12.731 -4.116 -0.475 1.00 0.00 C ATOM 1245 CH2 TRP A 80 11.797 -5.158 -0.390 1.00 0.00 C ATOM 0 H TRP A 80 19.097 -5.325 -0.122 1.00 0.00 H new ATOM 0 HA TRP A 80 16.472 -4.202 -0.152 1.00 0.00 H new ATOM 0 HB2 TRP A 80 17.424 -5.704 2.281 1.00 0.00 H new ATOM 0 HB3 TRP A 80 16.507 -4.226 2.503 1.00 0.00 H new ATOM 0 HD1 TRP A 80 15.774 -7.658 2.679 1.00 0.00 H new ATOM 0 HE1 TRP A 80 13.393 -8.297 1.896 1.00 0.00 H new ATOM 0 HE3 TRP A 80 14.678 -3.403 0.071 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 11.352 -7.107 0.368 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 12.482 -3.224 -1.031 1.00 0.00 H new ATOM 0 HH2 TRP A 80 10.841 -5.054 -0.882 1.00 0.00 H new ATOM 1291 N LEU A 85 15.199 -4.284 9.308 1.00 0.00 N ATOM 1292 CA LEU A 85 13.919 -4.884 8.947 1.00 0.00 C ATOM 1293 C LEU A 85 13.694 -6.187 9.708 1.00 0.00 C ATOM 1294 O LEU A 85 14.578 -6.663 10.419 1.00 0.00 O ATOM 1295 CB LEU A 85 13.862 -5.144 7.440 1.00 0.00 C ATOM 1296 CG LEU A 85 13.971 -3.911 6.542 1.00 0.00 C ATOM 1297 CD1 LEU A 85 14.396 -4.310 5.137 1.00 0.00 C ATOM 1298 CD2 LEU A 85 12.649 -3.158 6.507 1.00 0.00 C ATOM 0 HA LEU A 85 13.129 -4.185 9.219 1.00 0.00 H new ATOM 0 HB2 LEU A 85 14.667 -5.831 7.179 1.00 0.00 H new ATOM 0 HB3 LEU A 85 12.924 -5.652 7.214 1.00 0.00 H new ATOM 0 HG LEU A 85 14.732 -3.250 6.956 1.00 0.00 H new ATOM 0 HD11 LEU A 85 14.468 -3.420 4.512 1.00 0.00 H new ATOM 0 HD12 LEU A 85 15.366 -4.805 5.177 1.00 0.00 H new ATOM 0 HD13 LEU A 85 13.658 -4.992 4.713 1.00 0.00 H new ATOM 0 HD21 LEU A 85 12.745 -2.284 5.863 1.00 0.00 H new ATOM 0 HD22 LEU A 85 11.868 -3.811 6.117 1.00 0.00 H new ATOM 0 HD23 LEU A 85 12.385 -2.839 7.515 1.00 0.00 H new ATOM 1310 N GLY A 86 12.505 -6.760 9.551 1.00 0.00 N ATOM 1311 CA GLY A 86 12.186 -8.003 10.228 1.00 0.00 C ATOM 1312 C GLY A 86 10.856 -8.580 9.785 1.00 0.00 C ATOM 1313 O GLY A 86 9.809 -8.235 10.331 1.00 0.00 O ATOM 0 H GLY A 86 11.757 -6.386 8.967 1.00 0.00 H new ATOM 0 HA2 GLY A 86 12.975 -8.730 10.037 1.00 0.00 H new ATOM 0 HA3 GLY A 86 12.164 -7.832 11.304 1.00 0.00 H new ATOM 1317 N GLY A 87 10.896 -9.461 8.790 1.00 0.00 N ATOM 1318 CA GLY A 87 9.678 -10.071 8.289 1.00 0.00 C ATOM 1319 C GLY A 87 9.327 -9.601 6.891 1.00 0.00 C ATOM 1320 O GLY A 87 8.818 -8.494 6.710 1.00 0.00 O ATOM 0 H GLY A 87 11.750 -9.763 8.322 1.00 0.00 H new ATOM 0 HA2 GLY A 87 9.793 -11.155 8.287 1.00 0.00 H new ATOM 0 HA3 GLY A 87 8.855 -9.839 8.964 1.00 0.00 H new ATOM 1324 N VAL A 88 9.599 -10.443 5.899 1.00 0.00 N ATOM 1325 CA VAL A 88 9.308 -10.107 4.510 1.00 0.00 C ATOM 1326 C VAL A 88 8.085 -10.864 4.007 1.00 0.00 C ATOM 1327 O VAL A 88 7.813 -11.985 4.439 1.00 0.00 O ATOM 1328 CB VAL A 88 10.506 -10.421 3.595 1.00 0.00 C ATOM 1329 CG1 VAL A 88 10.109 -10.290 2.132 1.00 0.00 C ATOM 1330 CG2 VAL A 88 11.679 -9.509 3.921 1.00 0.00 C ATOM 0 H VAL A 88 10.020 -11.362 6.031 1.00 0.00 H new ATOM 0 HA VAL A 88 9.107 -9.036 4.478 1.00 0.00 H new ATOM 0 HB VAL A 88 10.816 -11.451 3.772 1.00 0.00 H new ATOM 0 HG11 VAL A 88 10.968 -10.516 1.500 1.00 0.00 H new ATOM 0 HG12 VAL A 88 9.302 -10.988 1.910 1.00 0.00 H new ATOM 0 HG13 VAL A 88 9.772 -9.272 1.936 1.00 0.00 H new ATOM 0 HG21 VAL A 88 12.517 -9.745 3.265 1.00 0.00 H new ATOM 0 HG22 VAL A 88 11.384 -8.470 3.774 1.00 0.00 H new ATOM 0 HG23 VAL A 88 11.978 -9.658 4.959 1.00 0.00 H new ATOM 1340 N PHE A 89 7.349 -10.245 3.089 1.00 0.00 N ATOM 1341 CA PHE A 89 6.153 -10.861 2.525 1.00 0.00 C ATOM 1342 C PHE A 89 6.000 -10.501 1.050 1.00 0.00 C ATOM 1343 O PHE A 89 6.495 -9.469 0.596 1.00 0.00 O ATOM 1344 CB PHE A 89 4.912 -10.418 3.302 1.00 0.00 C ATOM 1345 CG PHE A 89 4.622 -8.949 3.182 1.00 0.00 C ATOM 1346 CD1 PHE A 89 5.385 -8.020 3.873 1.00 0.00 C ATOM 1347 CD2 PHE A 89 3.589 -8.496 2.378 1.00 0.00 C ATOM 1348 CE1 PHE A 89 5.120 -6.668 3.765 1.00 0.00 C ATOM 1349 CE2 PHE A 89 3.319 -7.145 2.266 1.00 0.00 C ATOM 1350 CZ PHE A 89 4.087 -6.230 2.960 1.00 0.00 C ATOM 0 H PHE A 89 7.560 -9.318 2.720 1.00 0.00 H new ATOM 0 HA PHE A 89 6.258 -11.943 2.607 1.00 0.00 H new ATOM 0 HB2 PHE A 89 4.050 -10.981 2.945 1.00 0.00 H new ATOM 0 HB3 PHE A 89 5.043 -10.669 4.354 1.00 0.00 H new ATOM 0 HD1 PHE A 89 6.195 -8.357 4.503 1.00 0.00 H new ATOM 0 HD2 PHE A 89 2.987 -9.207 1.832 1.00 0.00 H new ATOM 0 HE1 PHE A 89 5.720 -5.954 4.310 1.00 0.00 H new ATOM 0 HE2 PHE A 89 2.509 -6.805 1.637 1.00 0.00 H new ATOM 0 HZ PHE A 89 3.880 -5.174 2.873 1.00 0.00 H new ATOM 1360 N LYS A 90 5.310 -11.359 0.307 1.00 0.00 N ATOM 1361 CA LYS A 90 5.090 -11.134 -1.117 1.00 0.00 C ATOM 1362 C LYS A 90 3.988 -10.102 -1.340 1.00 0.00 C ATOM 1363 O LYS A 90 3.186 -9.832 -0.446 1.00 0.00 O ATOM 1364 CB LYS A 90 4.721 -12.447 -1.811 1.00 0.00 C ATOM 1365 CG LYS A 90 5.922 -13.212 -2.340 1.00 0.00 C ATOM 1366 CD LYS A 90 5.612 -14.691 -2.503 1.00 0.00 C ATOM 1367 CE LYS A 90 5.882 -15.461 -1.219 1.00 0.00 C ATOM 1368 NZ LYS A 90 5.276 -16.821 -1.250 1.00 0.00 N ATOM 0 H LYS A 90 4.893 -12.217 0.667 1.00 0.00 H new ATOM 0 HA LYS A 90 6.016 -10.751 -1.546 1.00 0.00 H new ATOM 0 HB2 LYS A 90 4.178 -13.080 -1.109 1.00 0.00 H new ATOM 0 HB3 LYS A 90 4.043 -12.234 -2.638 1.00 0.00 H new ATOM 0 HG2 LYS A 90 6.226 -12.795 -3.300 1.00 0.00 H new ATOM 0 HG3 LYS A 90 6.763 -13.088 -1.658 1.00 0.00 H new ATOM 0 HD2 LYS A 90 4.568 -14.816 -2.791 1.00 0.00 H new ATOM 0 HD3 LYS A 90 6.217 -15.104 -3.310 1.00 0.00 H new ATOM 0 HE2 LYS A 90 6.958 -15.546 -1.066 1.00 0.00 H new ATOM 0 HE3 LYS A 90 5.483 -14.905 -0.371 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 5.241 -17.208 -0.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 4.311 -16.763 -1.635 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 5.852 -17.444 -1.852 1.00 0.00 H new ATOM 1382 N VAL A 91 3.955 -9.529 -2.539 1.00 0.00 N ATOM 1383 CA VAL A 91 2.950 -8.529 -2.880 1.00 0.00 C ATOM 1384 C VAL A 91 2.614 -8.573 -4.367 1.00 0.00 C ATOM 1385 O VAL A 91 3.506 -8.629 -5.213 1.00 0.00 O ATOM 1386 CB VAL A 91 3.423 -7.110 -2.513 1.00 0.00 C ATOM 1387 CG1 VAL A 91 3.356 -6.897 -1.009 1.00 0.00 C ATOM 1388 CG2 VAL A 91 4.833 -6.868 -3.032 1.00 0.00 C ATOM 0 H VAL A 91 4.612 -9.740 -3.290 1.00 0.00 H new ATOM 0 HA VAL A 91 2.057 -8.767 -2.302 1.00 0.00 H new ATOM 0 HB VAL A 91 2.757 -6.389 -2.988 1.00 0.00 H new ATOM 0 HG11 VAL A 91 3.694 -5.889 -0.769 1.00 0.00 H new ATOM 0 HG12 VAL A 91 2.329 -7.026 -0.669 1.00 0.00 H new ATOM 0 HG13 VAL A 91 3.997 -7.623 -0.510 1.00 0.00 H new ATOM 0 HG21 VAL A 91 5.151 -5.861 -2.764 1.00 0.00 H new ATOM 0 HG22 VAL A 91 5.514 -7.594 -2.588 1.00 0.00 H new ATOM 0 HG23 VAL A 91 4.845 -6.976 -4.117 1.00 0.00 H new ATOM 1398 N GLU A 92 1.322 -8.545 -4.677 1.00 0.00 N ATOM 1399 CA GLU A 92 0.868 -8.582 -6.062 1.00 0.00 C ATOM 1400 C GLU A 92 0.716 -7.171 -6.622 1.00 0.00 C ATOM 1401 O GLU A 92 -0.101 -6.386 -6.142 1.00 0.00 O ATOM 1402 CB GLU A 92 -0.462 -9.330 -6.167 1.00 0.00 C ATOM 1403 CG GLU A 92 -0.668 -10.021 -7.504 1.00 0.00 C ATOM 1404 CD GLU A 92 0.539 -10.831 -7.935 1.00 0.00 C ATOM 1405 OE1 GLU A 92 1.047 -11.621 -7.111 1.00 0.00 O ATOM 1406 OE2 GLU A 92 0.977 -10.676 -9.094 1.00 0.00 O ATOM 0 H GLU A 92 0.571 -8.497 -3.988 1.00 0.00 H new ATOM 0 HA GLU A 92 1.620 -9.109 -6.650 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -0.515 -10.073 -5.372 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -1.278 -8.627 -6.001 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -1.536 -10.677 -7.440 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -0.889 -9.273 -8.265 1.00 0.00 H new ATOM 1413 N TRP A 93 1.509 -6.856 -7.640 1.00 0.00 N ATOM 1414 CA TRP A 93 1.463 -5.540 -8.266 1.00 0.00 C ATOM 1415 C TRP A 93 0.373 -5.480 -9.331 1.00 0.00 C ATOM 1416 O TRP A 93 0.294 -6.349 -10.200 1.00 0.00 O ATOM 1417 CB TRP A 93 2.819 -5.200 -8.888 1.00 0.00 C ATOM 1418 CG TRP A 93 3.833 -4.738 -7.885 1.00 0.00 C ATOM 1419 CD1 TRP A 93 4.685 -5.521 -7.160 1.00 0.00 C ATOM 1420 CD2 TRP A 93 4.098 -3.386 -7.496 1.00 0.00 C ATOM 1421 NE1 TRP A 93 5.464 -4.738 -6.344 1.00 0.00 N ATOM 1422 CE2 TRP A 93 5.125 -3.424 -6.532 1.00 0.00 C ATOM 1423 CE3 TRP A 93 3.571 -2.147 -7.870 1.00 0.00 C ATOM 1424 CZ2 TRP A 93 5.630 -2.271 -5.937 1.00 0.00 C ATOM 1425 CZ3 TRP A 93 4.074 -1.004 -7.279 1.00 0.00 C ATOM 1426 CH2 TRP A 93 5.095 -1.072 -6.322 1.00 0.00 C ATOM 0 H TRP A 93 2.191 -7.494 -8.049 1.00 0.00 H new ATOM 0 HA TRP A 93 1.231 -4.807 -7.494 1.00 0.00 H new ATOM 0 HB2 TRP A 93 3.204 -6.079 -9.405 1.00 0.00 H new ATOM 0 HB3 TRP A 93 2.681 -4.423 -9.640 1.00 0.00 H new ATOM 0 HD1 TRP A 93 4.738 -6.598 -7.220 1.00 0.00 H new ATOM 0 HE1 TRP A 93 6.179 -5.079 -5.702 1.00 0.00 H new ATOM 0 HE3 TRP A 93 2.785 -2.084 -8.608 1.00 0.00 H new ATOM 0 HZ2 TRP A 93 6.416 -2.321 -5.198 1.00 0.00 H new ATOM 0 HZ3 TRP A 93 3.673 -0.041 -7.560 1.00 0.00 H new ATOM 0 HH2 TRP A 93 5.467 -0.160 -5.879 1.00 0.00 H new ATOM 1437 N ILE A 94 -0.465 -4.452 -9.257 1.00 0.00 N ATOM 1438 CA ILE A 94 -1.549 -4.280 -10.216 1.00 0.00 C ATOM 1439 C ILE A 94 -1.188 -3.243 -11.274 1.00 0.00 C ATOM 1440 O ILE A 94 -1.146 -3.546 -12.466 1.00 0.00 O ATOM 1441 CB ILE A 94 -2.854 -3.853 -9.519 1.00 0.00 C ATOM 1442 CG1 ILE A 94 -3.201 -4.831 -8.395 1.00 0.00 C ATOM 1443 CG2 ILE A 94 -3.991 -3.771 -10.527 1.00 0.00 C ATOM 1444 CD1 ILE A 94 -2.424 -4.587 -7.120 1.00 0.00 C ATOM 0 H ILE A 94 -0.414 -3.725 -8.543 1.00 0.00 H new ATOM 0 HA ILE A 94 -1.702 -5.247 -10.696 1.00 0.00 H new ATOM 0 HB ILE A 94 -2.709 -2.864 -9.083 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -4.267 -4.761 -8.180 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -3.011 -5.848 -8.738 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -4.907 -3.468 -10.019 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -3.743 -3.039 -11.296 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -4.139 -4.747 -10.989 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -2.721 -5.317 -6.367 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -1.357 -4.686 -7.320 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -2.633 -3.582 -6.753 1.00 0.00 H new ATOM 1456 N ARG A 95 -0.926 -2.018 -10.829 1.00 0.00 N ATOM 1457 CA ARG A 95 -0.568 -0.936 -11.737 1.00 0.00 C ATOM 1458 C ARG A 95 0.831 -0.409 -11.431 1.00 0.00 C ATOM 1459 O ARG A 95 1.189 -0.205 -10.270 1.00 0.00 O ATOM 1460 CB ARG A 95 -1.586 0.202 -11.637 1.00 0.00 C ATOM 1461 CG ARG A 95 -3.030 -0.273 -11.615 1.00 0.00 C ATOM 1462 CD ARG A 95 -3.342 -1.163 -12.808 1.00 0.00 C ATOM 1463 NE ARG A 95 -3.050 -0.499 -14.076 1.00 0.00 N ATOM 1464 CZ ARG A 95 -3.476 -0.943 -15.253 1.00 0.00 C ATOM 1465 NH1 ARG A 95 -4.210 -2.045 -15.323 1.00 0.00 N ATOM 1466 NH2 ARG A 95 -3.169 -0.284 -16.363 1.00 0.00 N ATOM 0 H ARG A 95 -0.955 -1.751 -9.845 1.00 0.00 H new ATOM 0 HA ARG A 95 -0.575 -1.332 -12.753 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -1.388 0.777 -10.733 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -1.447 0.878 -12.481 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -3.220 -0.820 -10.692 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -3.698 0.589 -11.618 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -2.760 -2.082 -12.737 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -4.393 -1.449 -12.782 1.00 0.00 H new ATOM 0 HE ARG A 95 -2.488 0.352 -14.056 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -4.449 -2.554 -14.472 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -4.536 -2.384 -16.228 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -2.605 0.565 -16.313 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -3.497 -0.626 -17.266 1.00 0.00 H new ATOM 1480 N LYS A 96 1.618 -0.191 -12.478 1.00 0.00 N ATOM 1481 CA LYS A 96 2.978 0.313 -12.323 1.00 0.00 C ATOM 1482 C LYS A 96 3.092 1.741 -12.845 1.00 0.00 C ATOM 1483 O LYS A 96 4.165 2.342 -12.804 1.00 0.00 O ATOM 1484 CB LYS A 96 3.967 -0.593 -13.061 1.00 0.00 C ATOM 1485 CG LYS A 96 4.300 -1.870 -12.309 1.00 0.00 C ATOM 1486 CD LYS A 96 5.125 -2.820 -13.162 1.00 0.00 C ATOM 1487 CE LYS A 96 5.637 -3.997 -12.348 1.00 0.00 C ATOM 1488 NZ LYS A 96 6.615 -4.818 -13.114 1.00 0.00 N ATOM 0 H LYS A 96 1.338 -0.355 -13.445 1.00 0.00 H new ATOM 0 HA LYS A 96 3.220 0.314 -11.260 1.00 0.00 H new ATOM 0 HB2 LYS A 96 3.552 -0.853 -14.035 1.00 0.00 H new ATOM 0 HB3 LYS A 96 4.887 -0.039 -13.244 1.00 0.00 H new ATOM 0 HG2 LYS A 96 4.849 -1.625 -11.400 1.00 0.00 H new ATOM 0 HG3 LYS A 96 3.378 -2.363 -12.001 1.00 0.00 H new ATOM 0 HD2 LYS A 96 4.519 -3.186 -13.991 1.00 0.00 H new ATOM 0 HD3 LYS A 96 5.968 -2.282 -13.596 1.00 0.00 H new ATOM 0 HE2 LYS A 96 6.107 -3.630 -11.435 1.00 0.00 H new ATOM 0 HE3 LYS A 96 4.797 -4.622 -12.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 6.940 -5.610 -12.524 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 6.160 -5.189 -13.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 7.429 -4.229 -13.381 1.00 0.00 H new ATOM 1502 N GLU A 97 1.980 2.278 -13.336 1.00 0.00 N ATOM 1503 CA GLU A 97 1.957 3.636 -13.866 1.00 0.00 C ATOM 1504 C GLU A 97 1.929 4.661 -12.735 1.00 0.00 C ATOM 1505 O GLU A 97 1.294 4.445 -11.703 1.00 0.00 O ATOM 1506 CB GLU A 97 0.743 3.832 -14.776 1.00 0.00 C ATOM 1507 CG GLU A 97 0.878 5.010 -15.726 1.00 0.00 C ATOM 1508 CD GLU A 97 1.769 4.703 -16.914 1.00 0.00 C ATOM 1509 OE1 GLU A 97 1.708 3.565 -17.423 1.00 0.00 O ATOM 1510 OE2 GLU A 97 2.527 5.603 -17.334 1.00 0.00 O ATOM 0 H GLU A 97 1.083 1.794 -13.378 1.00 0.00 H new ATOM 0 HA GLU A 97 2.866 3.787 -14.448 1.00 0.00 H new ATOM 0 HB2 GLU A 97 0.585 2.924 -15.357 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -0.144 3.974 -14.159 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -0.110 5.299 -16.083 1.00 0.00 H new ATOM 0 HG3 GLU A 97 1.283 5.864 -15.184 1.00 0.00 H new ATOM 1517 N SER A 98 2.622 5.776 -12.938 1.00 0.00 N ATOM 1518 CA SER A 98 2.681 6.833 -11.935 1.00 0.00 C ATOM 1519 C SER A 98 1.443 7.722 -12.009 1.00 0.00 C ATOM 1520 O SER A 98 1.205 8.393 -13.015 1.00 0.00 O ATOM 1521 CB SER A 98 3.942 7.678 -12.127 1.00 0.00 C ATOM 1522 OG SER A 98 4.983 6.915 -12.710 1.00 0.00 O ATOM 0 H SER A 98 3.151 5.971 -13.788 1.00 0.00 H new ATOM 0 HA SER A 98 2.713 6.365 -10.951 1.00 0.00 H new ATOM 0 HB2 SER A 98 3.716 8.535 -12.761 1.00 0.00 H new ATOM 0 HB3 SER A 98 4.270 8.071 -11.165 1.00 0.00 H new ATOM 0 HG SER A 98 5.777 7.478 -12.824 1.00 0.00 H new ATOM 1528 N LEU A 99 0.658 7.722 -10.938 1.00 0.00 N ATOM 1529 CA LEU A 99 -0.557 8.529 -10.879 1.00 0.00 C ATOM 1530 C LEU A 99 -0.305 9.840 -10.141 1.00 0.00 C ATOM 1531 O LEU A 99 0.146 9.859 -8.996 1.00 0.00 O ATOM 1532 CB LEU A 99 -1.678 7.749 -10.190 1.00 0.00 C ATOM 1533 CG LEU A 99 -3.019 8.472 -10.064 1.00 0.00 C ATOM 1534 CD1 LEU A 99 -3.781 8.416 -11.379 1.00 0.00 C ATOM 1535 CD2 LEU A 99 -3.847 7.867 -8.940 1.00 0.00 C ATOM 0 H LEU A 99 0.840 7.173 -10.098 1.00 0.00 H new ATOM 0 HA LEU A 99 -0.859 8.761 -11.900 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -1.838 6.821 -10.739 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -1.341 7.474 -9.191 1.00 0.00 H new ATOM 0 HG LEU A 99 -2.825 9.517 -9.824 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -4.733 8.936 -11.270 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -3.193 8.896 -12.161 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -3.964 7.376 -11.649 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -4.798 8.394 -8.865 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -4.031 6.814 -9.150 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -3.305 7.960 -7.999 1.00 0.00 H new ATOM 1547 N PRO A 100 -0.605 10.963 -10.810 1.00 0.00 N ATOM 1548 CA PRO A 100 -0.422 12.299 -10.236 1.00 0.00 C ATOM 1549 C PRO A 100 -1.412 12.587 -9.112 1.00 0.00 C ATOM 1550 O PRO A 100 -2.594 12.258 -9.212 1.00 0.00 O ATOM 1551 CB PRO A 100 -0.674 13.233 -11.422 1.00 0.00 C ATOM 1552 CG PRO A 100 -1.554 12.453 -12.337 1.00 0.00 C ATOM 1553 CD PRO A 100 -1.147 11.015 -12.178 1.00 0.00 C ATOM 0 HA PRO A 100 0.563 12.417 -9.785 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -1.155 14.158 -11.103 1.00 0.00 H new ATOM 0 HB3 PRO A 100 0.259 13.512 -11.912 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -2.604 12.592 -12.080 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -1.432 12.781 -13.369 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -1.995 10.341 -12.300 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -0.401 10.725 -12.917 1.00 0.00 H new ATOM 1561 N PHE A 101 -0.922 13.204 -8.042 1.00 0.00 N ATOM 1562 CA PHE A 101 -1.764 13.537 -6.898 1.00 0.00 C ATOM 1563 C PHE A 101 -3.047 14.227 -7.350 1.00 0.00 C ATOM 1564 O PHE A 101 -4.127 13.954 -6.828 1.00 0.00 O ATOM 1565 CB PHE A 101 -1.003 14.437 -5.923 1.00 0.00 C ATOM 1566 CG PHE A 101 0.012 13.702 -5.095 1.00 0.00 C ATOM 1567 CD1 PHE A 101 -0.323 12.520 -4.453 1.00 0.00 C ATOM 1568 CD2 PHE A 101 1.301 14.191 -4.960 1.00 0.00 C ATOM 1569 CE1 PHE A 101 0.609 11.842 -3.690 1.00 0.00 C ATOM 1570 CE2 PHE A 101 2.237 13.517 -4.199 1.00 0.00 C ATOM 1571 CZ PHE A 101 1.891 12.341 -3.564 1.00 0.00 C ATOM 0 H PHE A 101 0.054 13.484 -7.943 1.00 0.00 H new ATOM 0 HA PHE A 101 -2.031 12.609 -6.392 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -0.500 15.224 -6.485 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -1.717 14.925 -5.259 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -1.323 12.124 -4.550 1.00 0.00 H new ATOM 0 HD2 PHE A 101 1.578 15.110 -5.455 1.00 0.00 H new ATOM 0 HE1 PHE A 101 0.335 10.923 -3.193 1.00 0.00 H new ATOM 0 HE2 PHE A 101 3.238 13.910 -4.101 1.00 0.00 H new ATOM 0 HZ PHE A 101 2.621 11.812 -2.970 1.00 0.00 H new ATOM 1581 N GLN A 102 -2.919 15.124 -8.323 1.00 0.00 N ATOM 1582 CA GLN A 102 -4.068 15.855 -8.844 1.00 0.00 C ATOM 1583 C GLN A 102 -5.267 14.929 -9.021 1.00 0.00 C ATOM 1584 O GLN A 102 -6.416 15.365 -8.951 1.00 0.00 O ATOM 1585 CB GLN A 102 -3.717 16.514 -10.179 1.00 0.00 C ATOM 1586 CG GLN A 102 -4.924 17.063 -10.923 1.00 0.00 C ATOM 1587 CD GLN A 102 -4.560 18.180 -11.881 1.00 0.00 C ATOM 1588 OE1 GLN A 102 -4.075 17.933 -12.985 1.00 0.00 O ATOM 1589 NE2 GLN A 102 -4.794 19.419 -11.462 1.00 0.00 N ATOM 0 H GLN A 102 -2.032 15.362 -8.766 1.00 0.00 H new ATOM 0 HA GLN A 102 -4.332 16.629 -8.123 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -3.011 17.325 -10.000 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -3.211 15.785 -10.812 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -5.403 16.256 -11.477 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -5.654 17.431 -10.202 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -5.198 19.577 -10.539 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -4.570 20.212 -12.064 1.00 0.00 H new ATOM 1598 N PHE A 103 -4.992 13.649 -9.251 1.00 0.00 N ATOM 1599 CA PHE A 103 -6.048 12.662 -9.439 1.00 0.00 C ATOM 1600 C PHE A 103 -6.690 12.291 -8.105 1.00 0.00 C ATOM 1601 O PHE A 103 -7.910 12.167 -8.004 1.00 0.00 O ATOM 1602 CB PHE A 103 -5.490 11.409 -10.116 1.00 0.00 C ATOM 1603 CG PHE A 103 -5.504 11.480 -11.616 1.00 0.00 C ATOM 1604 CD1 PHE A 103 -4.927 12.553 -12.277 1.00 0.00 C ATOM 1605 CD2 PHE A 103 -6.095 10.476 -12.365 1.00 0.00 C ATOM 1606 CE1 PHE A 103 -4.938 12.622 -13.657 1.00 0.00 C ATOM 1607 CE2 PHE A 103 -6.108 10.539 -13.746 1.00 0.00 C ATOM 1608 CZ PHE A 103 -5.530 11.614 -14.393 1.00 0.00 C ATOM 0 H PHE A 103 -4.046 13.271 -9.312 1.00 0.00 H new ATOM 0 HA PHE A 103 -6.812 13.102 -10.080 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -4.466 11.249 -9.778 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -6.071 10.544 -9.796 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -4.463 13.344 -11.707 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -6.551 9.634 -11.865 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -4.484 13.463 -14.160 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -6.570 9.748 -14.319 1.00 0.00 H new ATOM 0 HZ PHE A 103 -5.541 11.666 -15.472 1.00 0.00 H new ATOM 1618 N ALA A 104 -5.857 12.114 -7.084 1.00 0.00 N ATOM 1619 CA ALA A 104 -6.342 11.758 -5.757 1.00 0.00 C ATOM 1620 C ALA A 104 -6.398 12.980 -4.847 1.00 0.00 C ATOM 1621 O ALA A 104 -6.288 12.864 -3.626 1.00 0.00 O ATOM 1622 CB ALA A 104 -5.458 10.681 -5.143 1.00 0.00 C ATOM 0 H ALA A 104 -4.844 12.211 -7.151 1.00 0.00 H new ATOM 0 HA ALA A 104 -7.354 11.367 -5.860 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -5.832 10.425 -4.152 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -5.472 9.794 -5.777 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -4.436 11.052 -5.061 1.00 0.00 H new ATOM 1628 N HIS A 105 -6.569 14.153 -5.449 1.00 0.00 N ATOM 1629 CA HIS A 105 -6.639 15.398 -4.692 1.00 0.00 C ATOM 1630 C HIS A 105 -7.953 15.492 -3.923 1.00 0.00 C ATOM 1631 O HIS A 105 -7.964 15.790 -2.728 1.00 0.00 O ATOM 1632 CB HIS A 105 -6.496 16.598 -5.629 1.00 0.00 C ATOM 1633 CG HIS A 105 -6.351 17.904 -4.912 1.00 0.00 C ATOM 1634 ND1 HIS A 105 -6.772 18.101 -3.614 1.00 0.00 N ATOM 1635 CD2 HIS A 105 -5.824 19.083 -5.318 1.00 0.00 C ATOM 1636 CE1 HIS A 105 -6.513 19.345 -3.253 1.00 0.00 C ATOM 1637 NE2 HIS A 105 -5.937 19.962 -4.269 1.00 0.00 N ATOM 0 H HIS A 105 -6.662 14.267 -6.458 1.00 0.00 H new ATOM 0 HA HIS A 105 -5.817 15.406 -3.976 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -5.627 16.446 -6.270 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -7.369 16.646 -6.281 1.00 0.00 H new ATOM 0 HD1 HIS A 105 -7.214 17.396 -3.024 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -5.395 19.293 -6.286 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -6.734 19.783 -2.291 1.00 0.00 H new ATOM 1645 N HIS A 106 -9.059 15.237 -4.615 1.00 0.00 N ATOM 1646 CA HIS A 106 -10.378 15.293 -3.996 1.00 0.00 C ATOM 1647 C HIS A 106 -10.509 14.241 -2.900 1.00 0.00 C ATOM 1648 O HIS A 106 -11.216 14.444 -1.911 1.00 0.00 O ATOM 1649 CB HIS A 106 -11.468 15.088 -5.049 1.00 0.00 C ATOM 1650 CG HIS A 106 -11.489 13.707 -5.628 1.00 0.00 C ATOM 1651 ND1 HIS A 106 -10.442 13.179 -6.354 1.00 0.00 N ATOM 1652 CD2 HIS A 106 -12.437 12.742 -5.583 1.00 0.00 C ATOM 1653 CE1 HIS A 106 -10.747 11.950 -6.732 1.00 0.00 C ATOM 1654 NE2 HIS A 106 -11.952 11.661 -6.276 1.00 0.00 N ATOM 0 H HIS A 106 -9.068 14.990 -5.605 1.00 0.00 H new ATOM 0 HA HIS A 106 -10.499 16.278 -3.546 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -12.439 15.300 -4.601 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -11.324 15.809 -5.854 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -13.397 12.810 -5.093 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -10.118 11.294 -7.315 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -12.443 10.778 -6.416 1.00 0.00 H new ATOM 1662 N LEU A 107 -9.825 13.117 -3.080 1.00 0.00 N ATOM 1663 CA LEU A 107 -9.866 12.031 -2.107 1.00 0.00 C ATOM 1664 C LEU A 107 -9.137 12.423 -0.825 1.00 0.00 C ATOM 1665 O LEU A 107 -8.119 13.114 -0.863 1.00 0.00 O ATOM 1666 CB LEU A 107 -9.239 10.767 -2.697 1.00 0.00 C ATOM 1667 CG LEU A 107 -9.778 10.323 -4.057 1.00 0.00 C ATOM 1668 CD1 LEU A 107 -9.107 9.033 -4.502 1.00 0.00 C ATOM 1669 CD2 LEU A 107 -11.289 10.148 -4.001 1.00 0.00 C ATOM 0 H LEU A 107 -9.235 12.933 -3.891 1.00 0.00 H new ATOM 0 HA LEU A 107 -10.910 11.832 -1.865 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -8.165 10.927 -2.789 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -9.380 9.951 -1.989 1.00 0.00 H new ATOM 0 HG LEU A 107 -9.549 11.099 -4.788 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -9.503 8.733 -5.472 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -8.032 9.191 -4.583 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -9.304 8.249 -3.771 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -11.655 9.832 -4.978 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -11.540 9.392 -3.257 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -11.755 11.095 -3.728 1.00 0.00 H new ATOM 1681 N LEU A 108 -9.664 11.974 0.309 1.00 0.00 N ATOM 1682 CA LEU A 108 -9.063 12.275 1.604 1.00 0.00 C ATOM 1683 C LEU A 108 -9.199 11.091 2.556 1.00 0.00 C ATOM 1684 O LEU A 108 -9.803 10.075 2.216 1.00 0.00 O ATOM 1685 CB LEU A 108 -9.717 13.515 2.216 1.00 0.00 C ATOM 1686 CG LEU A 108 -9.872 14.720 1.288 1.00 0.00 C ATOM 1687 CD1 LEU A 108 -10.932 15.671 1.821 1.00 0.00 C ATOM 1688 CD2 LEU A 108 -8.541 15.439 1.121 1.00 0.00 C ATOM 0 H LEU A 108 -10.506 11.400 0.358 1.00 0.00 H new ATOM 0 HA LEU A 108 -8.002 12.471 1.448 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -10.704 13.236 2.584 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -9.129 13.821 3.081 1.00 0.00 H new ATOM 0 HG LEU A 108 -10.194 14.363 0.310 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -11.028 16.523 1.148 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -11.887 15.151 1.887 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -10.641 16.022 2.811 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -8.670 16.294 0.457 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -8.189 15.784 2.093 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -7.809 14.754 0.693 1.00 0.00 H new ATOM 1700 N ASN A 109 -8.636 11.232 3.752 1.00 0.00 N ATOM 1701 CA ASN A 109 -8.697 10.175 4.754 1.00 0.00 C ATOM 1702 C ASN A 109 -9.256 10.705 6.071 1.00 0.00 C ATOM 1703 O ASN A 109 -8.592 11.437 6.806 1.00 0.00 O ATOM 1704 CB ASN A 109 -7.306 9.578 4.981 1.00 0.00 C ATOM 1705 CG ASN A 109 -7.312 8.478 6.025 1.00 0.00 C ATOM 1706 OD1 ASN A 109 -6.575 8.538 7.010 1.00 0.00 O ATOM 1707 ND2 ASN A 109 -8.146 7.467 5.815 1.00 0.00 N ATOM 0 H ASN A 109 -8.133 12.068 4.050 1.00 0.00 H new ATOM 0 HA ASN A 109 -9.364 9.396 4.384 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -6.927 9.180 4.040 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -6.621 10.367 5.292 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -8.194 6.698 6.484 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -8.739 7.459 4.985 1.00 0.00 H new ATOM 1714 N PRO A 110 -10.505 10.327 6.379 1.00 0.00 N ATOM 1715 CA PRO A 110 -11.181 10.751 7.608 1.00 0.00 C ATOM 1716 C PRO A 110 -10.576 10.111 8.853 1.00 0.00 C ATOM 1717 O PRO A 110 -11.043 10.338 9.969 1.00 0.00 O ATOM 1718 CB PRO A 110 -12.620 10.271 7.406 1.00 0.00 C ATOM 1719 CG PRO A 110 -12.509 9.129 6.457 1.00 0.00 C ATOM 1720 CD PRO A 110 -11.354 9.455 5.550 1.00 0.00 C ATOM 0 HA PRO A 110 -11.095 11.825 7.770 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -13.069 9.960 8.349 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -13.248 11.064 7.000 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -12.335 8.194 6.990 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -13.430 9.004 5.887 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -10.823 8.556 5.237 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -11.685 9.961 4.643 1.00 0.00 H new ATOM 1728 N TRP A 111 -9.534 9.311 8.654 1.00 0.00 N ATOM 1729 CA TRP A 111 -8.865 8.638 9.762 1.00 0.00 C ATOM 1730 C TRP A 111 -7.570 9.353 10.131 1.00 0.00 C ATOM 1731 O TRP A 111 -6.907 8.993 11.102 1.00 0.00 O ATOM 1732 CB TRP A 111 -8.572 7.182 9.399 1.00 0.00 C ATOM 1733 CG TRP A 111 -9.809 6.367 9.167 1.00 0.00 C ATOM 1734 CD1 TRP A 111 -11.050 6.836 8.840 1.00 0.00 C ATOM 1735 CD2 TRP A 111 -9.924 4.943 9.246 1.00 0.00 C ATOM 1736 NE1 TRP A 111 -11.929 5.788 8.711 1.00 0.00 N ATOM 1737 CE2 TRP A 111 -11.263 4.616 8.954 1.00 0.00 C ATOM 1738 CE3 TRP A 111 -9.027 3.911 9.532 1.00 0.00 C ATOM 1739 CZ2 TRP A 111 -11.723 3.302 8.943 1.00 0.00 C ATOM 1740 CZ3 TRP A 111 -9.485 2.607 9.521 1.00 0.00 C ATOM 1741 CH2 TRP A 111 -10.823 2.312 9.227 1.00 0.00 C ATOM 0 H TRP A 111 -9.134 9.113 7.737 1.00 0.00 H new ATOM 0 HA TRP A 111 -9.531 8.663 10.625 1.00 0.00 H new ATOM 0 HB2 TRP A 111 -7.955 7.156 8.501 1.00 0.00 H new ATOM 0 HB3 TRP A 111 -7.990 6.726 10.199 1.00 0.00 H new ATOM 0 HD1 TRP A 111 -11.303 7.877 8.703 1.00 0.00 H new ATOM 0 HE1 TRP A 111 -12.917 5.869 8.473 1.00 0.00 H new ATOM 0 HE3 TRP A 111 -7.993 4.128 9.758 1.00 0.00 H new ATOM 0 HZ2 TRP A 111 -12.754 3.073 8.718 1.00 0.00 H new ATOM 0 HZ3 TRP A 111 -8.800 1.802 9.743 1.00 0.00 H new ATOM 0 HH2 TRP A 111 -11.150 1.283 9.225 1.00 0.00 H new ATOM 1752 N ASN A 112 -7.216 10.368 9.349 1.00 0.00 N ATOM 1753 CA ASN A 112 -5.999 11.133 9.594 1.00 0.00 C ATOM 1754 C ASN A 112 -6.282 12.632 9.556 1.00 0.00 C ATOM 1755 O ASN A 112 -5.607 13.384 8.852 1.00 0.00 O ATOM 1756 CB ASN A 112 -4.931 10.778 8.558 1.00 0.00 C ATOM 1757 CG ASN A 112 -3.534 11.153 9.015 1.00 0.00 C ATOM 1758 OD1 ASN A 112 -3.104 10.777 10.106 1.00 0.00 O ATOM 1759 ND2 ASN A 112 -2.819 11.898 8.181 1.00 0.00 N ATOM 0 H ASN A 112 -7.755 10.679 8.541 1.00 0.00 H new ATOM 0 HA ASN A 112 -5.632 10.875 10.587 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -4.968 9.708 8.354 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -5.153 11.289 7.621 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -1.873 12.182 8.434 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -3.216 12.187 7.287 1.00 0.00 H new ATOM 1766 N ASP A 113 -7.283 13.059 10.317 1.00 0.00 N ATOM 1767 CA ASP A 113 -7.655 14.468 10.372 1.00 0.00 C ATOM 1768 C ASP A 113 -8.128 14.959 9.007 1.00 0.00 C ATOM 1769 O ASP A 113 -7.700 16.011 8.533 1.00 0.00 O ATOM 1770 CB ASP A 113 -6.471 15.312 10.849 1.00 0.00 C ATOM 1771 CG ASP A 113 -5.791 14.718 12.067 1.00 0.00 C ATOM 1772 OD1 ASP A 113 -5.032 13.740 11.905 1.00 0.00 O ATOM 1773 OD2 ASP A 113 -6.018 15.231 13.183 1.00 0.00 O ATOM 0 H ASP A 113 -7.852 12.450 10.905 1.00 0.00 H new ATOM 0 HA ASP A 113 -8.476 14.574 11.081 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -5.746 15.405 10.041 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -6.817 16.318 11.084 1.00 0.00 H new ATOM 1778 N ASN A 114 -9.012 14.190 8.381 1.00 0.00 N ATOM 1779 CA ASN A 114 -9.542 14.545 7.070 1.00 0.00 C ATOM 1780 C ASN A 114 -8.435 15.071 6.160 1.00 0.00 C ATOM 1781 O ASN A 114 -8.657 15.970 5.349 1.00 0.00 O ATOM 1782 CB ASN A 114 -10.644 15.597 7.210 1.00 0.00 C ATOM 1783 CG ASN A 114 -11.944 15.007 7.721 1.00 0.00 C ATOM 1784 OD1 ASN A 114 -12.239 15.066 8.915 1.00 0.00 O ATOM 1785 ND2 ASN A 114 -12.730 14.435 6.816 1.00 0.00 N ATOM 0 H ASN A 114 -9.377 13.316 8.761 1.00 0.00 H new ATOM 0 HA ASN A 114 -9.962 13.646 6.620 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -10.311 16.380 7.891 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -10.817 16.069 6.243 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -13.618 14.022 7.100 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -12.445 14.409 5.837 1.00 0.00 H new ATOM 1792 N LYS A 115 -7.242 14.502 6.300 1.00 0.00 N ATOM 1793 CA LYS A 115 -6.100 14.910 5.491 1.00 0.00 C ATOM 1794 C LYS A 115 -6.020 14.088 4.209 1.00 0.00 C ATOM 1795 O LYS A 115 -6.304 12.890 4.208 1.00 0.00 O ATOM 1796 CB LYS A 115 -4.803 14.758 6.288 1.00 0.00 C ATOM 1797 CG LYS A 115 -4.568 15.879 7.286 1.00 0.00 C ATOM 1798 CD LYS A 115 -4.311 17.203 6.586 1.00 0.00 C ATOM 1799 CE LYS A 115 -3.742 18.239 7.543 1.00 0.00 C ATOM 1800 NZ LYS A 115 -2.253 18.203 7.580 1.00 0.00 N ATOM 0 H LYS A 115 -7.041 13.757 6.967 1.00 0.00 H new ATOM 0 HA LYS A 115 -6.233 15.958 5.223 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -4.823 13.807 6.820 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -3.963 14.718 5.595 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -5.436 15.974 7.939 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -3.717 15.630 7.920 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -3.617 17.050 5.759 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -5.241 17.575 6.157 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -4.074 19.233 7.241 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -4.134 18.062 8.544 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -1.905 18.924 8.244 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -1.936 17.263 7.892 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -1.877 18.397 6.630 1.00 0.00 H new ATOM 1814 N LYS A 116 -5.631 14.738 3.117 1.00 0.00 N ATOM 1815 CA LYS A 116 -5.510 14.067 1.828 1.00 0.00 C ATOM 1816 C LYS A 116 -4.940 12.662 1.997 1.00 0.00 C ATOM 1817 O LYS A 116 -4.139 12.411 2.898 1.00 0.00 O ATOM 1818 CB LYS A 116 -4.619 14.881 0.888 1.00 0.00 C ATOM 1819 CG LYS A 116 -4.440 14.247 -0.481 1.00 0.00 C ATOM 1820 CD LYS A 116 -3.563 15.101 -1.381 1.00 0.00 C ATOM 1821 CE LYS A 116 -4.243 16.414 -1.740 1.00 0.00 C ATOM 1822 NZ LYS A 116 -3.376 17.273 -2.592 1.00 0.00 N ATOM 0 H LYS A 116 -5.394 15.730 3.099 1.00 0.00 H new ATOM 0 HA LYS A 116 -6.507 13.986 1.394 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -5.048 15.876 0.765 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -3.640 15.010 1.350 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -3.995 13.258 -0.370 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -5.415 14.107 -0.948 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -2.616 15.305 -0.881 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -3.329 14.550 -2.292 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -5.177 16.208 -2.263 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -4.501 16.951 -0.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -3.875 18.158 -2.815 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -2.496 17.491 -2.083 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -3.150 16.771 -3.475 1.00 0.00 H new ATOM 1836 N VAL A 117 -5.355 11.751 1.124 1.00 0.00 N ATOM 1837 CA VAL A 117 -4.883 10.372 1.175 1.00 0.00 C ATOM 1838 C VAL A 117 -3.362 10.315 1.261 1.00 0.00 C ATOM 1839 O VAL A 117 -2.803 9.911 2.280 1.00 0.00 O ATOM 1840 CB VAL A 117 -5.348 9.574 -0.057 1.00 0.00 C ATOM 1841 CG1 VAL A 117 -5.072 8.090 0.132 1.00 0.00 C ATOM 1842 CG2 VAL A 117 -6.825 9.819 -0.325 1.00 0.00 C ATOM 0 H VAL A 117 -6.017 11.942 0.372 1.00 0.00 H new ATOM 0 HA VAL A 117 -5.311 9.923 2.071 1.00 0.00 H new ATOM 0 HB VAL A 117 -4.783 9.917 -0.924 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -5.407 7.542 -0.749 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -4.002 7.934 0.271 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -5.608 7.729 1.010 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -7.136 9.247 -1.199 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -7.409 9.505 0.540 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -6.990 10.881 -0.509 1.00 0.00 H new ATOM 1852 N GLN A 118 -2.699 10.722 0.183 1.00 0.00 N ATOM 1853 CA GLN A 118 -1.242 10.717 0.137 1.00 0.00 C ATOM 1854 C GLN A 118 -0.652 11.044 1.505 1.00 0.00 C ATOM 1855 O GLN A 118 0.400 10.524 1.878 1.00 0.00 O ATOM 1856 CB GLN A 118 -0.740 11.722 -0.901 1.00 0.00 C ATOM 1857 CG GLN A 118 -0.807 13.166 -0.432 1.00 0.00 C ATOM 1858 CD GLN A 118 0.092 14.084 -1.237 1.00 0.00 C ATOM 1859 OE1 GLN A 118 -0.479 14.743 -2.238 1.00 0.00 O flip ATOM 1860 NE2 GLN A 118 1.286 14.199 -0.962 1.00 0.00 N flip ATOM 0 H GLN A 118 -3.147 11.059 -0.669 1.00 0.00 H new ATOM 0 HA GLN A 118 -0.917 9.717 -0.149 1.00 0.00 H new ATOM 0 HB2 GLN A 118 0.291 11.480 -1.160 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -1.330 11.617 -1.811 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -1.836 13.519 -0.501 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -0.523 13.216 0.619 1.00 0.00 H new ATOM 0 HE21 GLN A 118 1.683 13.673 -0.183 1.00 0.00 H new ATOM 0 HE22 GLN A 118 1.879 14.820 -1.513 1.00 0.00 H new ATOM 1869 N ILE A 119 -1.336 11.908 2.247 1.00 0.00 N ATOM 1870 CA ILE A 119 -0.880 12.303 3.574 1.00 0.00 C ATOM 1871 C ILE A 119 -1.084 11.178 4.583 1.00 0.00 C ATOM 1872 O ILE A 119 -1.957 11.257 5.447 1.00 0.00 O ATOM 1873 CB ILE A 119 -1.615 13.562 4.070 1.00 0.00 C ATOM 1874 CG1 ILE A 119 -1.568 14.659 3.005 1.00 0.00 C ATOM 1875 CG2 ILE A 119 -1.002 14.054 5.372 1.00 0.00 C ATOM 1876 CD1 ILE A 119 -2.404 15.872 3.349 1.00 0.00 C ATOM 0 H ILE A 119 -2.208 12.348 1.952 1.00 0.00 H new ATOM 0 HA ILE A 119 0.184 12.523 3.489 1.00 0.00 H new ATOM 0 HB ILE A 119 -2.658 13.307 4.256 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -0.533 14.970 2.861 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -1.912 14.248 2.056 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -1.532 14.944 5.710 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -1.082 13.274 6.129 1.00 0.00 H new ATOM 0 HG23 ILE A 119 0.048 14.296 5.211 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -2.323 16.608 2.549 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -3.446 15.575 3.464 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -2.046 16.308 4.282 1.00 0.00 H new ATOM 1888 N SER A 120 -0.272 10.132 4.468 1.00 0.00 N ATOM 1889 CA SER A 120 -0.365 8.990 5.369 1.00 0.00 C ATOM 1890 C SER A 120 0.999 8.331 5.552 1.00 0.00 C ATOM 1891 O SER A 120 1.653 7.951 4.580 1.00 0.00 O ATOM 1892 CB SER A 120 -1.369 7.969 4.831 1.00 0.00 C ATOM 1893 OG SER A 120 -2.674 8.232 5.317 1.00 0.00 O ATOM 0 H SER A 120 0.458 10.052 3.760 1.00 0.00 H new ATOM 0 HA SER A 120 -0.709 9.350 6.339 1.00 0.00 H new ATOM 0 HB2 SER A 120 -1.371 7.996 3.741 1.00 0.00 H new ATOM 0 HB3 SER A 120 -1.064 6.965 5.125 1.00 0.00 H new ATOM 0 HG SER A 120 -2.777 9.194 5.475 1.00 0.00 H new ATOM 1899 N ARG A 121 1.422 8.199 6.805 1.00 0.00 N ATOM 1900 CA ARG A 121 2.708 7.587 7.117 1.00 0.00 C ATOM 1901 C ARG A 121 2.654 6.075 6.917 1.00 0.00 C ATOM 1902 O ARG A 121 1.595 5.460 7.043 1.00 0.00 O ATOM 1903 CB ARG A 121 3.114 7.907 8.557 1.00 0.00 C ATOM 1904 CG ARG A 121 2.220 7.257 9.600 1.00 0.00 C ATOM 1905 CD ARG A 121 2.735 7.508 11.009 1.00 0.00 C ATOM 1906 NE ARG A 121 2.278 8.790 11.539 1.00 0.00 N ATOM 1907 CZ ARG A 121 2.895 9.943 11.308 1.00 0.00 C ATOM 1908 NH1 ARG A 121 3.990 9.975 10.561 1.00 0.00 N ATOM 1909 NH2 ARG A 121 2.418 11.068 11.825 1.00 0.00 N ATOM 0 H ARG A 121 0.893 8.508 7.621 1.00 0.00 H new ATOM 0 HA ARG A 121 3.452 8.000 6.436 1.00 0.00 H new ATOM 0 HB2 ARG A 121 4.142 7.580 8.717 1.00 0.00 H new ATOM 0 HB3 ARG A 121 3.097 8.988 8.699 1.00 0.00 H new ATOM 0 HG2 ARG A 121 1.207 7.648 9.507 1.00 0.00 H new ATOM 0 HG3 ARG A 121 2.166 6.184 9.417 1.00 0.00 H new ATOM 0 HD2 ARG A 121 2.401 6.705 11.665 1.00 0.00 H new ATOM 0 HD3 ARG A 121 3.825 7.485 11.006 1.00 0.00 H new ATOM 0 HE ARG A 121 1.439 8.800 12.119 1.00 0.00 H new ATOM 0 HH11 ARG A 121 4.361 9.113 10.162 1.00 0.00 H new ATOM 0 HH12 ARG A 121 4.462 10.862 10.385 1.00 0.00 H new ATOM 0 HH21 ARG A 121 1.576 11.048 12.401 1.00 0.00 H new ATOM 0 HH22 ARG A 121 2.893 11.953 11.647 1.00 0.00 H new ATOM 1923 N ASP A 122 3.801 5.483 6.605 1.00 0.00 N ATOM 1924 CA ASP A 122 3.885 4.043 6.389 1.00 0.00 C ATOM 1925 C ASP A 122 3.274 3.281 7.560 1.00 0.00 C ATOM 1926 O ASP A 122 3.759 3.362 8.688 1.00 0.00 O ATOM 1927 CB ASP A 122 5.341 3.619 6.192 1.00 0.00 C ATOM 1928 CG ASP A 122 6.033 3.301 7.503 1.00 0.00 C ATOM 1929 OD1 ASP A 122 6.545 4.241 8.147 1.00 0.00 O ATOM 1930 OD2 ASP A 122 6.064 2.112 7.885 1.00 0.00 O ATOM 0 H ASP A 122 4.686 5.978 6.496 1.00 0.00 H new ATOM 0 HA ASP A 122 3.320 3.802 5.488 1.00 0.00 H new ATOM 0 HB2 ASP A 122 5.377 2.744 5.544 1.00 0.00 H new ATOM 0 HB3 ASP A 122 5.883 4.416 5.682 1.00 0.00 H new ATOM 1935 N GLY A 123 2.204 2.541 7.285 1.00 0.00 N ATOM 1936 CA GLY A 123 1.544 1.776 8.326 1.00 0.00 C ATOM 1937 C GLY A 123 0.331 2.490 8.890 1.00 0.00 C ATOM 1938 O GLY A 123 0.031 2.373 10.077 1.00 0.00 O ATOM 0 H GLY A 123 1.783 2.458 6.360 1.00 0.00 H new ATOM 0 HA2 GLY A 123 1.239 0.810 7.924 1.00 0.00 H new ATOM 0 HA3 GLY A 123 2.252 1.578 9.131 1.00 0.00 H new ATOM 1942 N GLN A 124 -0.365 3.234 8.036 1.00 0.00 N ATOM 1943 CA GLN A 124 -1.550 3.972 8.458 1.00 0.00 C ATOM 1944 C GLN A 124 -2.812 3.370 7.849 1.00 0.00 C ATOM 1945 O GLN A 124 -2.853 3.068 6.656 1.00 0.00 O ATOM 1946 CB GLN A 124 -1.429 5.443 8.058 1.00 0.00 C ATOM 1947 CG GLN A 124 -0.761 6.308 9.116 1.00 0.00 C ATOM 1948 CD GLN A 124 -1.560 6.378 10.402 1.00 0.00 C ATOM 1949 OE1 GLN A 124 -1.049 6.077 11.481 1.00 0.00 O ATOM 1950 NE2 GLN A 124 -2.822 6.776 10.295 1.00 0.00 N ATOM 0 H GLN A 124 -0.129 3.342 7.049 1.00 0.00 H new ATOM 0 HA GLN A 124 -1.623 3.902 9.543 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -0.860 5.513 7.131 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -2.424 5.838 7.852 1.00 0.00 H new ATOM 0 HG2 GLN A 124 0.231 5.912 9.330 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -0.624 7.315 8.723 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -3.205 7.016 9.381 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -3.408 6.842 11.127 1.00 0.00 H new ATOM 1959 N GLU A 125 -3.839 3.198 8.676 1.00 0.00 N ATOM 1960 CA GLU A 125 -5.101 2.630 8.217 1.00 0.00 C ATOM 1961 C GLU A 125 -5.783 3.559 7.216 1.00 0.00 C ATOM 1962 O GLU A 125 -5.620 4.778 7.272 1.00 0.00 O ATOM 1963 CB GLU A 125 -6.030 2.372 9.405 1.00 0.00 C ATOM 1964 CG GLU A 125 -5.874 0.986 10.009 1.00 0.00 C ATOM 1965 CD GLU A 125 -6.241 0.947 11.480 1.00 0.00 C ATOM 1966 OE1 GLU A 125 -7.360 1.382 11.824 1.00 0.00 O ATOM 1967 OE2 GLU A 125 -5.409 0.483 12.287 1.00 0.00 O ATOM 0 H GLU A 125 -3.822 3.444 9.666 1.00 0.00 H new ATOM 0 HA GLU A 125 -4.886 1.684 7.720 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -5.837 3.119 10.175 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -7.063 2.505 9.083 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -6.502 0.283 9.463 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -4.843 0.654 9.886 1.00 0.00 H new ATOM 1974 N LEU A 126 -6.547 2.973 6.301 1.00 0.00 N ATOM 1975 CA LEU A 126 -7.254 3.746 5.286 1.00 0.00 C ATOM 1976 C LEU A 126 -8.645 3.171 5.034 1.00 0.00 C ATOM 1977 O LEU A 126 -8.787 2.005 4.668 1.00 0.00 O ATOM 1978 CB LEU A 126 -6.454 3.765 3.982 1.00 0.00 C ATOM 1979 CG LEU A 126 -6.950 4.731 2.905 1.00 0.00 C ATOM 1980 CD1 LEU A 126 -6.565 6.160 3.251 1.00 0.00 C ATOM 1981 CD2 LEU A 126 -6.394 4.341 1.543 1.00 0.00 C ATOM 0 H LEU A 126 -6.693 1.965 6.241 1.00 0.00 H new ATOM 0 HA LEU A 126 -7.364 4.766 5.653 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -5.419 4.015 4.217 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -6.452 2.758 3.565 1.00 0.00 H new ATOM 0 HG LEU A 126 -8.037 4.671 2.862 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -6.926 6.833 2.473 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -7.012 6.436 4.206 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -5.480 6.237 3.322 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -6.757 5.039 0.788 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -5.305 4.372 1.572 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -6.721 3.332 1.292 1.00 0.00 H new ATOM 1993 N GLU A 127 -9.666 3.999 5.232 1.00 0.00 N ATOM 1994 CA GLU A 127 -11.045 3.572 5.025 1.00 0.00 C ATOM 1995 C GLU A 127 -11.229 2.985 3.629 1.00 0.00 C ATOM 1996 O GLU A 127 -10.745 3.522 2.632 1.00 0.00 O ATOM 1997 CB GLU A 127 -12.002 4.750 5.224 1.00 0.00 C ATOM 1998 CG GLU A 127 -13.468 4.354 5.195 1.00 0.00 C ATOM 1999 CD GLU A 127 -13.976 3.894 6.548 1.00 0.00 C ATOM 2000 OE1 GLU A 127 -13.752 4.615 7.542 1.00 0.00 O ATOM 2001 OE2 GLU A 127 -14.597 2.812 6.611 1.00 0.00 O ATOM 0 H GLU A 127 -9.565 4.968 5.535 1.00 0.00 H new ATOM 0 HA GLU A 127 -11.273 2.799 5.759 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -11.782 5.229 6.178 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -11.819 5.491 4.446 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -14.063 5.203 4.857 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -13.610 3.555 4.467 1.00 0.00 H new ATOM 2008 N PRO A 128 -11.945 1.853 3.553 1.00 0.00 N ATOM 2009 CA PRO A 128 -12.210 1.167 2.285 1.00 0.00 C ATOM 2010 C PRO A 128 -13.168 1.948 1.392 1.00 0.00 C ATOM 2011 O PRO A 128 -13.581 1.465 0.339 1.00 0.00 O ATOM 2012 CB PRO A 128 -12.846 -0.155 2.723 1.00 0.00 C ATOM 2013 CG PRO A 128 -13.449 0.137 4.054 1.00 0.00 C ATOM 2014 CD PRO A 128 -12.552 1.157 4.700 1.00 0.00 C ATOM 0 HA PRO A 128 -11.304 1.044 1.691 1.00 0.00 H new ATOM 0 HB2 PRO A 128 -13.601 -0.486 2.010 1.00 0.00 H new ATOM 0 HB3 PRO A 128 -12.102 -0.949 2.791 1.00 0.00 H new ATOM 0 HG2 PRO A 128 -14.463 0.521 3.947 1.00 0.00 H new ATOM 0 HG3 PRO A 128 -13.513 -0.767 4.660 1.00 0.00 H new ATOM 0 HD2 PRO A 128 -13.114 1.842 5.334 1.00 0.00 H new ATOM 0 HD3 PRO A 128 -11.797 0.687 5.330 1.00 0.00 H new ATOM 2022 N GLN A 129 -13.515 3.157 1.820 1.00 0.00 N ATOM 2023 CA GLN A 129 -14.425 4.005 1.058 1.00 0.00 C ATOM 2024 C GLN A 129 -13.651 4.963 0.159 1.00 0.00 C ATOM 2025 O GLN A 129 -14.050 5.223 -0.976 1.00 0.00 O ATOM 2026 CB GLN A 129 -15.332 4.794 2.003 1.00 0.00 C ATOM 2027 CG GLN A 129 -16.667 5.179 1.385 1.00 0.00 C ATOM 2028 CD GLN A 129 -17.390 6.250 2.178 1.00 0.00 C ATOM 2029 OE1 GLN A 129 -18.493 6.029 2.679 1.00 0.00 O ATOM 2030 NE2 GLN A 129 -16.771 7.419 2.295 1.00 0.00 N ATOM 0 H GLN A 129 -13.180 3.572 2.690 1.00 0.00 H new ATOM 0 HA GLN A 129 -15.040 3.362 0.429 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -15.514 4.200 2.899 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -14.813 5.699 2.320 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -16.503 5.534 0.368 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -17.300 4.294 1.316 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -15.857 7.558 1.863 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -17.209 8.178 2.817 1.00 0.00 H new ATOM 2039 N VAL A 130 -12.542 5.485 0.673 1.00 0.00 N ATOM 2040 CA VAL A 130 -11.712 6.414 -0.084 1.00 0.00 C ATOM 2041 C VAL A 130 -10.592 5.681 -0.814 1.00 0.00 C ATOM 2042 O VAL A 130 -10.135 6.117 -1.869 1.00 0.00 O ATOM 2043 CB VAL A 130 -11.096 7.489 0.831 1.00 0.00 C ATOM 2044 CG1 VAL A 130 -12.186 8.264 1.555 1.00 0.00 C ATOM 2045 CG2 VAL A 130 -10.132 6.855 1.823 1.00 0.00 C ATOM 0 H VAL A 130 -12.198 5.280 1.611 1.00 0.00 H new ATOM 0 HA VAL A 130 -12.362 6.897 -0.814 1.00 0.00 H new ATOM 0 HB VAL A 130 -10.536 8.190 0.212 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -11.731 9.019 2.196 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -12.833 8.750 0.825 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -12.777 7.579 2.163 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -9.706 7.629 2.462 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -10.667 6.131 2.438 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -9.332 6.351 1.281 1.00 0.00 H new ATOM 2055 N GLY A 131 -10.155 4.562 -0.243 1.00 0.00 N ATOM 2056 CA GLY A 131 -9.092 3.785 -0.854 1.00 0.00 C ATOM 2057 C GLY A 131 -9.531 3.111 -2.139 1.00 0.00 C ATOM 2058 O GLY A 131 -8.764 3.032 -3.098 1.00 0.00 O ATOM 0 H GLY A 131 -10.518 4.180 0.631 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -8.243 4.436 -1.061 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -8.749 3.028 -0.149 1.00 0.00 H new ATOM 2062 N GLU A 132 -10.767 2.623 -2.157 1.00 0.00 N ATOM 2063 CA GLU A 132 -11.305 1.951 -3.334 1.00 0.00 C ATOM 2064 C GLU A 132 -11.369 2.904 -4.524 1.00 0.00 C ATOM 2065 O GLU A 132 -10.904 2.579 -5.616 1.00 0.00 O ATOM 2066 CB GLU A 132 -12.699 1.394 -3.037 1.00 0.00 C ATOM 2067 CG GLU A 132 -13.799 2.440 -3.103 1.00 0.00 C ATOM 2068 CD GLU A 132 -15.166 1.871 -2.773 1.00 0.00 C ATOM 2069 OE1 GLU A 132 -15.844 1.380 -3.699 1.00 0.00 O ATOM 2070 OE2 GLU A 132 -15.556 1.916 -1.587 1.00 0.00 O ATOM 0 H GLU A 132 -11.414 2.680 -1.371 1.00 0.00 H new ATOM 0 HA GLU A 132 -10.638 1.127 -3.587 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -12.922 0.599 -3.748 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -12.697 0.943 -2.045 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -13.569 3.248 -2.409 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -13.822 2.875 -4.102 1.00 0.00 H new ATOM 2077 N GLN A 133 -11.947 4.080 -4.302 1.00 0.00 N ATOM 2078 CA GLN A 133 -12.073 5.079 -5.357 1.00 0.00 C ATOM 2079 C GLN A 133 -10.715 5.683 -5.699 1.00 0.00 C ATOM 2080 O GLN A 133 -10.577 6.410 -6.683 1.00 0.00 O ATOM 2081 CB GLN A 133 -13.042 6.183 -4.929 1.00 0.00 C ATOM 2082 CG GLN A 133 -12.634 6.887 -3.645 1.00 0.00 C ATOM 2083 CD GLN A 133 -13.690 7.856 -3.150 1.00 0.00 C ATOM 2084 OE1 GLN A 133 -13.345 8.640 -2.135 1.00 0.00 O flip ATOM 2085 NE2 GLN A 133 -14.803 7.899 -3.674 1.00 0.00 N flip ATOM 0 H GLN A 133 -12.335 4.364 -3.403 1.00 0.00 H new ATOM 0 HA GLN A 133 -12.465 4.585 -6.246 1.00 0.00 H new ATOM 0 HB2 GLN A 133 -13.117 6.919 -5.729 1.00 0.00 H new ATOM 0 HB3 GLN A 133 -14.035 5.753 -4.798 1.00 0.00 H new ATOM 0 HG2 GLN A 133 -12.439 6.143 -2.873 1.00 0.00 H new ATOM 0 HG3 GLN A 133 -11.701 7.426 -3.811 1.00 0.00 H new ATOM 0 HE21 GLN A 133 -15.025 7.278 -4.452 1.00 0.00 H new ATOM 0 HE22 GLN A 133 -15.503 8.556 -3.330 1.00 0.00 H new ATOM 2094 N LEU A 134 -9.714 5.378 -4.880 1.00 0.00 N ATOM 2095 CA LEU A 134 -8.366 5.891 -5.096 1.00 0.00 C ATOM 2096 C LEU A 134 -7.617 5.041 -6.118 1.00 0.00 C ATOM 2097 O LEU A 134 -6.803 5.552 -6.889 1.00 0.00 O ATOM 2098 CB LEU A 134 -7.593 5.920 -3.776 1.00 0.00 C ATOM 2099 CG LEU A 134 -6.086 6.152 -3.886 1.00 0.00 C ATOM 2100 CD1 LEU A 134 -5.792 7.610 -4.204 1.00 0.00 C ATOM 2101 CD2 LEU A 134 -5.387 5.734 -2.600 1.00 0.00 C ATOM 0 H LEU A 134 -9.811 4.778 -4.061 1.00 0.00 H new ATOM 0 HA LEU A 134 -8.448 6.906 -5.485 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -8.016 6.704 -3.147 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -7.758 4.974 -3.260 1.00 0.00 H new ATOM 0 HG LEU A 134 -5.702 5.539 -4.701 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -4.714 7.756 -4.278 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -6.261 7.878 -5.151 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -6.190 8.243 -3.411 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -4.315 5.906 -2.696 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -5.775 6.321 -1.768 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -5.569 4.676 -2.414 1.00 0.00 H new ATOM 2113 N LEU A 135 -7.898 3.743 -6.120 1.00 0.00 N ATOM 2114 CA LEU A 135 -7.253 2.822 -7.049 1.00 0.00 C ATOM 2115 C LEU A 135 -7.833 2.969 -8.452 1.00 0.00 C ATOM 2116 O LEU A 135 -7.095 3.055 -9.433 1.00 0.00 O ATOM 2117 CB LEU A 135 -7.417 1.380 -6.565 1.00 0.00 C ATOM 2118 CG LEU A 135 -6.977 1.100 -5.128 1.00 0.00 C ATOM 2119 CD1 LEU A 135 -7.021 -0.392 -4.837 1.00 0.00 C ATOM 2120 CD2 LEU A 135 -5.581 1.653 -4.881 1.00 0.00 C ATOM 0 H LEU A 135 -8.568 3.304 -5.489 1.00 0.00 H new ATOM 0 HA LEU A 135 -6.192 3.067 -7.087 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -8.466 1.102 -6.663 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -6.851 0.728 -7.231 1.00 0.00 H new ATOM 0 HG LEU A 135 -7.670 1.601 -4.452 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -6.704 -0.572 -3.810 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -8.038 -0.759 -4.973 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -6.352 -0.916 -5.520 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -5.284 1.445 -3.853 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -4.876 1.181 -5.565 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -5.582 2.730 -5.047 1.00 0.00 H new ATOM 2132 N GLN A 136 -9.159 2.999 -8.538 1.00 0.00 N ATOM 2133 CA GLN A 136 -9.837 3.138 -9.822 1.00 0.00 C ATOM 2134 C GLN A 136 -9.243 4.286 -10.631 1.00 0.00 C ATOM 2135 O GLN A 136 -9.420 4.359 -11.848 1.00 0.00 O ATOM 2136 CB GLN A 136 -11.334 3.369 -9.609 1.00 0.00 C ATOM 2137 CG GLN A 136 -11.643 4.502 -8.643 1.00 0.00 C ATOM 2138 CD GLN A 136 -11.642 5.860 -9.317 1.00 0.00 C ATOM 2139 OE1 GLN A 136 -10.764 6.688 -9.069 1.00 0.00 O ATOM 2140 NE2 GLN A 136 -12.627 6.097 -10.175 1.00 0.00 N ATOM 0 H GLN A 136 -9.785 2.929 -7.735 1.00 0.00 H new ATOM 0 HA GLN A 136 -9.695 2.213 -10.381 1.00 0.00 H new ATOM 0 HB2 GLN A 136 -11.800 3.585 -10.570 1.00 0.00 H new ATOM 0 HB3 GLN A 136 -11.785 2.450 -9.235 1.00 0.00 H new ATOM 0 HG2 GLN A 136 -12.617 4.329 -8.185 1.00 0.00 H new ATOM 0 HG3 GLN A 136 -10.908 4.499 -7.839 1.00 0.00 H new ATOM 0 HE21 GLN A 136 -13.333 5.382 -10.351 1.00 0.00 H new ATOM 0 HE22 GLN A 136 -12.677 6.994 -10.659 1.00 0.00 H new ATOM 2149 N LEU A 137 -8.538 5.181 -9.948 1.00 0.00 N ATOM 2150 CA LEU A 137 -7.917 6.327 -10.603 1.00 0.00 C ATOM 2151 C LEU A 137 -6.908 5.873 -11.653 1.00 0.00 C ATOM 2152 O LEU A 137 -6.799 6.472 -12.723 1.00 0.00 O ATOM 2153 CB LEU A 137 -7.229 7.219 -9.569 1.00 0.00 C ATOM 2154 CG LEU A 137 -8.140 8.164 -8.784 1.00 0.00 C ATOM 2155 CD1 LEU A 137 -7.346 8.915 -7.727 1.00 0.00 C ATOM 2156 CD2 LEU A 137 -8.835 9.137 -9.724 1.00 0.00 C ATOM 0 H LEU A 137 -8.382 5.135 -8.941 1.00 0.00 H new ATOM 0 HA LEU A 137 -8.700 6.898 -11.102 1.00 0.00 H new ATOM 0 HB2 LEU A 137 -6.704 6.580 -8.859 1.00 0.00 H new ATOM 0 HB3 LEU A 137 -6.473 7.816 -10.079 1.00 0.00 H new ATOM 0 HG LEU A 137 -8.902 7.569 -8.281 1.00 0.00 H new ATOM 0 HD11 LEU A 137 -8.011 9.583 -7.179 1.00 0.00 H new ATOM 0 HD12 LEU A 137 -6.896 8.203 -7.036 1.00 0.00 H new ATOM 0 HD13 LEU A 137 -6.561 9.499 -8.208 1.00 0.00 H new ATOM 0 HD21 LEU A 137 -9.479 9.802 -9.148 1.00 0.00 H new ATOM 0 HD22 LEU A 137 -8.088 9.726 -10.255 1.00 0.00 H new ATOM 0 HD23 LEU A 137 -9.437 8.581 -10.443 1.00 0.00 H new ATOM 2168 N TRP A 138 -6.175 4.811 -11.340 1.00 0.00 N ATOM 2169 CA TRP A 138 -5.176 4.276 -12.258 1.00 0.00 C ATOM 2170 C TRP A 138 -5.807 3.910 -13.597 1.00 0.00 C ATOM 2171 O TRP A 138 -5.156 3.981 -14.639 1.00 0.00 O ATOM 2172 CB TRP A 138 -4.498 3.048 -11.648 1.00 0.00 C ATOM 2173 CG TRP A 138 -3.258 3.377 -10.873 1.00 0.00 C ATOM 2174 CD1 TRP A 138 -1.972 3.335 -11.328 1.00 0.00 C ATOM 2175 CD2 TRP A 138 -3.188 3.797 -9.506 1.00 0.00 C ATOM 2176 NE1 TRP A 138 -1.106 3.703 -10.327 1.00 0.00 N ATOM 2177 CE2 TRP A 138 -1.827 3.993 -9.199 1.00 0.00 C ATOM 2178 CE3 TRP A 138 -4.143 4.030 -8.512 1.00 0.00 C ATOM 2179 CZ2 TRP A 138 -1.400 4.408 -7.941 1.00 0.00 C ATOM 2180 CZ3 TRP A 138 -3.717 4.441 -7.263 1.00 0.00 C ATOM 2181 CH2 TRP A 138 -2.356 4.627 -6.986 1.00 0.00 C ATOM 0 H TRP A 138 -6.253 4.304 -10.459 1.00 0.00 H new ATOM 0 HA TRP A 138 -4.427 5.049 -12.430 1.00 0.00 H new ATOM 0 HB2 TRP A 138 -5.204 2.541 -10.991 1.00 0.00 H new ATOM 0 HB3 TRP A 138 -4.245 2.348 -12.445 1.00 0.00 H new ATOM 0 HD1 TRP A 138 -1.678 3.054 -12.328 1.00 0.00 H new ATOM 0 HE1 TRP A 138 -0.091 3.752 -10.410 1.00 0.00 H new ATOM 0 HE3 TRP A 138 -5.194 3.891 -8.716 1.00 0.00 H new ATOM 0 HZ2 TRP A 138 -0.352 4.552 -7.726 1.00 0.00 H new ATOM 0 HZ3 TRP A 138 -4.446 4.622 -6.487 1.00 0.00 H new ATOM 0 HH2 TRP A 138 -2.055 4.949 -6.000 1.00 0.00 H new ATOM 2192 N GLU A 139 -7.077 3.520 -13.561 1.00 0.00 N ATOM 2193 CA GLU A 139 -7.795 3.143 -14.773 1.00 0.00 C ATOM 2194 C GLU A 139 -8.004 4.353 -15.680 1.00 0.00 C ATOM 2195 O GLU A 139 -7.992 4.233 -16.905 1.00 0.00 O ATOM 2196 CB GLU A 139 -9.145 2.517 -14.419 1.00 0.00 C ATOM 2197 CG GLU A 139 -9.042 1.080 -13.939 1.00 0.00 C ATOM 2198 CD GLU A 139 -9.149 0.077 -15.071 1.00 0.00 C ATOM 2199 OE1 GLU A 139 -9.783 0.403 -16.096 1.00 0.00 O ATOM 2200 OE2 GLU A 139 -8.596 -1.035 -14.932 1.00 0.00 O ATOM 0 H GLU A 139 -7.630 3.457 -12.706 1.00 0.00 H new ATOM 0 HA GLU A 139 -7.192 2.409 -15.308 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -9.622 3.117 -13.644 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -9.793 2.553 -15.294 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -8.092 0.940 -13.424 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -9.830 0.887 -13.212 1.00 0.00 H new ATOM 2207 N ARG A 140 -8.196 5.517 -15.068 1.00 0.00 N ATOM 2208 CA ARG A 140 -8.410 6.748 -15.819 1.00 0.00 C ATOM 2209 C ARG A 140 -7.140 7.163 -16.557 1.00 0.00 C ATOM 2210 O ARG A 140 -7.184 7.976 -17.481 1.00 0.00 O ATOM 2211 CB ARG A 140 -8.858 7.871 -14.882 1.00 0.00 C ATOM 2212 CG ARG A 140 -10.139 7.559 -14.126 1.00 0.00 C ATOM 2213 CD ARG A 140 -10.872 8.829 -13.723 1.00 0.00 C ATOM 2214 NE ARG A 140 -10.011 9.746 -12.980 1.00 0.00 N ATOM 2215 CZ ARG A 140 -10.282 11.035 -12.812 1.00 0.00 C ATOM 2216 NH1 ARG A 140 -11.385 11.557 -13.331 1.00 0.00 N ATOM 2217 NH2 ARG A 140 -9.449 11.805 -12.124 1.00 0.00 N ATOM 0 H ARG A 140 -8.208 5.633 -14.055 1.00 0.00 H new ATOM 0 HA ARG A 140 -9.193 6.563 -16.554 1.00 0.00 H new ATOM 0 HB2 ARG A 140 -8.063 8.073 -14.164 1.00 0.00 H new ATOM 0 HB3 ARG A 140 -9.002 8.782 -15.463 1.00 0.00 H new ATOM 0 HG2 ARG A 140 -10.789 6.944 -14.748 1.00 0.00 H new ATOM 0 HG3 ARG A 140 -9.904 6.975 -13.236 1.00 0.00 H new ATOM 0 HD2 ARG A 140 -11.249 9.329 -14.615 1.00 0.00 H new ATOM 0 HD3 ARG A 140 -11.737 8.570 -13.113 1.00 0.00 H new ATOM 0 HE ARG A 140 -9.155 9.376 -12.568 1.00 0.00 H new ATOM 0 HH11 ARG A 140 -12.028 10.968 -13.861 1.00 0.00 H new ATOM 0 HH12 ARG A 140 -11.591 12.547 -13.200 1.00 0.00 H new ATOM 0 HH21 ARG A 140 -8.600 11.407 -11.724 1.00 0.00 H new ATOM 0 HH22 ARG A 140 -9.658 12.795 -11.996 1.00 0.00 H new ATOM 2231 N LEU A 141 -6.011 6.600 -16.142 1.00 0.00 N ATOM 2232 CA LEU A 141 -4.728 6.911 -16.763 1.00 0.00 C ATOM 2233 C LEU A 141 -4.687 6.417 -18.205 1.00 0.00 C ATOM 2234 O LEU A 141 -3.869 6.872 -19.005 1.00 0.00 O ATOM 2235 CB LEU A 141 -3.586 6.280 -15.963 1.00 0.00 C ATOM 2236 CG LEU A 141 -3.472 6.713 -14.501 1.00 0.00 C ATOM 2237 CD1 LEU A 141 -2.295 6.022 -13.831 1.00 0.00 C ATOM 2238 CD2 LEU A 141 -3.332 8.225 -14.402 1.00 0.00 C ATOM 0 H LEU A 141 -5.958 5.926 -15.378 1.00 0.00 H new ATOM 0 HA LEU A 141 -4.607 7.994 -16.766 1.00 0.00 H new ATOM 0 HB2 LEU A 141 -3.704 5.197 -15.992 1.00 0.00 H new ATOM 0 HB3 LEU A 141 -2.646 6.512 -16.464 1.00 0.00 H new ATOM 0 HG LEU A 141 -4.384 6.418 -13.982 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -2.229 6.342 -12.791 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -2.437 4.942 -13.870 1.00 0.00 H new ATOM 0 HD13 LEU A 141 -1.374 6.286 -14.351 1.00 0.00 H new ATOM 0 HD21 LEU A 141 -3.252 8.515 -13.354 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -2.437 8.543 -14.936 1.00 0.00 H new ATOM 0 HD23 LEU A 141 -4.207 8.701 -14.845 1.00 0.00 H new