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 129 GLN : amide:sc= -3.35 K(o=-8,f=-9.8!) USER MOD Set 1.2: A 133 GLN : amide:sc= -4.67 K(o=-8,f=-9.8!) USER MOD Set 2.1: A 109 ASN : amide:sc= -9.05! C(o=-16!,f=-28!) USER MOD Set 2.2: A 112 ASN : amide:sc= -6.99! C(o=-16!,f=-16!) USER MOD Set 3.1: A 25 GLN : amide:sc= -0.522 K(o=0.15,f=-6.1!) USER MOD Set 3.2: A 96 LYS NZ :NH3+ -156:sc= 0.673 (180deg=0) USER MOD Set 4.1: A 14 LYS NZ :NH3+ 171:sc= 0.769 (180deg=0.481) USER MOD Set 4.2: A 57 GLN : amide:sc= -1.92 K(o=-1.2,f=-6.1!) USER MOD Set 5.1: A 13 MET CE :methyl 162:sc= -0.274 (180deg=-0.593) USER MOD Set 5.2: A 32 THR OG1 : rot 111:sc= 1.38 USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot -104:sc= 0.473 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= 0 K(o=0,f=-2.2!) USER MOD Single : A 20 ASN : amide:sc= -0.443 K(o=-0.44,f=-2.2) USER MOD Single : A 24 SER OG : rot 54:sc= 0.0315 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 150:sc= -0.81 USER MOD Single : A 33 THR OG1 : rot 180:sc= -1.26 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 36 ASN :FLIP amide:sc= -3.6! C(o=-6!,f=-3.6!) USER MOD Single : A 39 LYS NZ :NH3+ -158:sc= -0.132 (180deg=-0.943) USER MOD Single : A 41 ASN : amide:sc= -0.533 K(o=-0.53,f=-4.6!) USER MOD Single : A 47 SER OG : rot -107:sc= 0.429 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= -0.0397 USER MOD Single : A 61 HIS : no HE2:sc= -2.75! C(o=-2.7!,f=-4.8!) USER MOD Single : A 63 GLN : amide:sc= -2.19 X(o=-2.2,f=-1.9) USER MOD Single : A 66 SER OG : rot -129:sc= 1.14 USER MOD Single : A 68 MET CE :methyl 156:sc= -3.59 (180deg=-4.52!) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot -170:sc= 0 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 SER OG : rot -160:sc= 0 USER MOD Single : A 78 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 102 GLN : amide:sc=-0.00794 K(o=-0.0079,f=-1.6!) USER MOD Single : A 105 HIS : no HE2:sc= -1.24 K(o=-1.2,f=-7.2!) USER MOD Single : A 106 HIS : no HD1:sc= -4.94! C(o=-4.9!,f=-7.7!) USER MOD Single : A 114 ASN : amide:sc= -1.14 K(o=-1.1,f=-3.8!) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 LYS NZ :NH3+ -107:sc= -0.445 (180deg=-1.5) USER MOD Single : A 118 GLN : amide:sc= -8.69! C(o=-8.7!,f=-10!) USER MOD Single : A 120 SER OG : rot -87:sc= -1.61! USER MOD Single : A 124 GLN : amide:sc= -0.755 X(o=-0.76,f=-0.34) USER MOD Single : A 136 GLN : amide:sc= -2.06! C(o=-2.1!,f=-2.7!) USER MOD ----------------------------------------------------------------- ATOM 59 N GLY A 7 -14.143 -7.890 3.762 1.00 0.00 N ATOM 60 CA GLY A 7 -13.672 -7.159 2.600 1.00 0.00 C ATOM 61 C GLY A 7 -12.187 -6.865 2.663 1.00 0.00 C ATOM 62 O GLY A 7 -11.542 -7.103 3.684 1.00 0.00 O ATOM 0 HA2 GLY A 7 -13.887 -7.735 1.700 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -14.222 -6.221 2.517 1.00 0.00 H new ATOM 66 N VAL A 8 -11.640 -6.347 1.567 1.00 0.00 N ATOM 67 CA VAL A 8 -10.221 -6.021 1.502 1.00 0.00 C ATOM 68 C VAL A 8 -9.927 -4.700 2.204 1.00 0.00 C ATOM 69 O VAL A 8 -10.760 -3.793 2.216 1.00 0.00 O ATOM 70 CB VAL A 8 -9.731 -5.934 0.044 1.00 0.00 C ATOM 71 CG1 VAL A 8 -10.695 -5.110 -0.795 1.00 0.00 C ATOM 72 CG2 VAL A 8 -8.328 -5.350 -0.013 1.00 0.00 C ATOM 0 H VAL A 8 -12.159 -6.144 0.712 1.00 0.00 H new ATOM 0 HA VAL A 8 -9.689 -6.825 2.010 1.00 0.00 H new ATOM 0 HB VAL A 8 -9.697 -6.942 -0.370 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -10.332 -5.060 -1.822 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -11.680 -5.576 -0.781 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -10.765 -4.102 -0.385 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -7.998 -5.296 -1.051 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -8.333 -4.349 0.419 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -7.646 -5.986 0.552 1.00 0.00 H new ATOM 82 N ARG A 9 -8.738 -4.597 2.788 1.00 0.00 N ATOM 83 CA ARG A 9 -8.335 -3.387 3.493 1.00 0.00 C ATOM 84 C ARG A 9 -7.388 -2.550 2.638 1.00 0.00 C ATOM 85 O ARG A 9 -7.058 -2.922 1.512 1.00 0.00 O ATOM 86 CB ARG A 9 -7.661 -3.744 4.819 1.00 0.00 C ATOM 87 CG ARG A 9 -8.467 -4.711 5.671 1.00 0.00 C ATOM 88 CD ARG A 9 -9.407 -3.973 6.612 1.00 0.00 C ATOM 89 NE ARG A 9 -10.033 -4.874 7.576 1.00 0.00 N ATOM 90 CZ ARG A 9 -10.533 -4.472 8.740 1.00 0.00 C ATOM 91 NH1 ARG A 9 -10.480 -3.192 9.081 1.00 0.00 N ATOM 92 NH2 ARG A 9 -11.088 -5.351 9.564 1.00 0.00 N ATOM 0 H ARG A 9 -8.037 -5.338 2.787 1.00 0.00 H new ATOM 0 HA ARG A 9 -9.230 -2.799 3.695 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -6.684 -4.181 4.614 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -7.488 -2.830 5.387 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -9.043 -5.374 5.025 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -7.790 -5.339 6.250 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -8.854 -3.200 7.145 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -10.180 -3.469 6.031 1.00 0.00 H new ATOM 0 HE ARG A 9 -10.090 -5.866 7.343 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -10.055 -2.513 8.449 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -10.864 -2.886 9.975 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -11.131 -6.336 9.305 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -11.471 -5.041 10.457 1.00 0.00 H new ATOM 106 N TYR A 10 -6.954 -1.417 3.181 1.00 0.00 N ATOM 107 CA TYR A 10 -6.048 -0.526 2.468 1.00 0.00 C ATOM 108 C TYR A 10 -5.014 0.073 3.416 1.00 0.00 C ATOM 109 O TYR A 10 -5.310 0.357 4.577 1.00 0.00 O ATOM 110 CB TYR A 10 -6.834 0.592 1.781 1.00 0.00 C ATOM 111 CG TYR A 10 -7.869 0.090 0.799 1.00 0.00 C ATOM 112 CD1 TYR A 10 -9.033 -0.526 1.241 1.00 0.00 C ATOM 113 CD2 TYR A 10 -7.682 0.233 -0.570 1.00 0.00 C ATOM 114 CE1 TYR A 10 -9.980 -0.987 0.348 1.00 0.00 C ATOM 115 CE2 TYR A 10 -8.625 -0.224 -1.471 1.00 0.00 C ATOM 116 CZ TYR A 10 -9.772 -0.834 -1.007 1.00 0.00 C ATOM 117 OH TYR A 10 -10.714 -1.290 -1.900 1.00 0.00 O ATOM 0 H TYR A 10 -7.216 -1.095 4.113 1.00 0.00 H new ATOM 0 HA TYR A 10 -5.525 -1.111 1.712 1.00 0.00 H new ATOM 0 HB2 TYR A 10 -7.329 1.196 2.541 1.00 0.00 H new ATOM 0 HB3 TYR A 10 -6.137 1.247 1.258 1.00 0.00 H new ATOM 0 HD1 TYR A 10 -9.200 -0.646 2.301 1.00 0.00 H new ATOM 0 HD2 TYR A 10 -6.785 0.709 -0.936 1.00 0.00 H new ATOM 0 HE1 TYR A 10 -10.879 -1.465 0.709 1.00 0.00 H new ATOM 0 HE2 TYR A 10 -8.465 -0.104 -2.532 1.00 0.00 H new ATOM 0 HH TYR A 10 -10.415 -1.104 -2.814 1.00 0.00 H new ATOM 127 N PHE A 11 -3.799 0.263 2.913 1.00 0.00 N ATOM 128 CA PHE A 11 -2.719 0.828 3.714 1.00 0.00 C ATOM 129 C PHE A 11 -1.785 1.672 2.851 1.00 0.00 C ATOM 130 O PHE A 11 -1.808 1.582 1.623 1.00 0.00 O ATOM 131 CB PHE A 11 -1.928 -0.287 4.401 1.00 0.00 C ATOM 132 CG PHE A 11 -2.748 -1.097 5.365 1.00 0.00 C ATOM 133 CD1 PHE A 11 -3.106 -0.576 6.598 1.00 0.00 C ATOM 134 CD2 PHE A 11 -3.159 -2.379 5.038 1.00 0.00 C ATOM 135 CE1 PHE A 11 -3.860 -1.318 7.487 1.00 0.00 C ATOM 136 CE2 PHE A 11 -3.914 -3.125 5.923 1.00 0.00 C ATOM 137 CZ PHE A 11 -4.264 -2.595 7.150 1.00 0.00 C ATOM 0 H PHE A 11 -3.537 0.034 1.954 1.00 0.00 H new ATOM 0 HA PHE A 11 -3.163 1.471 4.474 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -1.515 -0.950 3.641 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -1.084 0.152 4.933 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -2.792 0.422 6.867 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -2.886 -2.800 4.081 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -4.133 -0.900 8.445 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -4.230 -4.122 5.656 1.00 0.00 H new ATOM 0 HZ PHE A 11 -4.852 -3.178 7.844 1.00 0.00 H new ATOM 147 N ILE A 12 -0.966 2.490 3.502 1.00 0.00 N ATOM 148 CA ILE A 12 -0.024 3.349 2.795 1.00 0.00 C ATOM 149 C ILE A 12 1.414 3.029 3.188 1.00 0.00 C ATOM 150 O ILE A 12 1.860 3.371 4.283 1.00 0.00 O ATOM 151 CB ILE A 12 -0.301 4.838 3.074 1.00 0.00 C ATOM 152 CG1 ILE A 12 -1.692 5.224 2.566 1.00 0.00 C ATOM 153 CG2 ILE A 12 0.766 5.706 2.424 1.00 0.00 C ATOM 154 CD1 ILE A 12 -1.779 5.325 1.059 1.00 0.00 C ATOM 0 H ILE A 12 -0.935 2.576 4.518 1.00 0.00 H new ATOM 0 HA ILE A 12 -0.159 3.156 1.731 1.00 0.00 H new ATOM 0 HB ILE A 12 -0.269 5.003 4.151 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -2.415 4.486 2.915 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -1.977 6.181 3.003 1.00 0.00 H new ATOM 0 HG21 ILE A 12 0.556 6.756 2.630 1.00 0.00 H new ATOM 0 HG22 ILE A 12 1.744 5.445 2.829 1.00 0.00 H new ATOM 0 HG23 ILE A 12 0.763 5.540 1.347 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -2.793 5.602 0.771 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -1.081 6.083 0.704 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -1.526 4.362 0.615 1.00 0.00 H new ATOM 166 N MET A 13 2.136 2.372 2.286 1.00 0.00 N ATOM 167 CA MET A 13 3.525 2.008 2.537 1.00 0.00 C ATOM 168 C MET A 13 4.475 3.023 1.909 1.00 0.00 C ATOM 169 O MET A 13 4.637 3.066 0.690 1.00 0.00 O ATOM 170 CB MET A 13 3.817 0.611 1.986 1.00 0.00 C ATOM 171 CG MET A 13 3.563 -0.503 2.989 1.00 0.00 C ATOM 172 SD MET A 13 4.390 -0.220 4.566 1.00 0.00 S ATOM 173 CE MET A 13 3.057 -0.557 5.713 1.00 0.00 C ATOM 0 H MET A 13 1.782 2.081 1.375 1.00 0.00 H new ATOM 0 HA MET A 13 3.684 2.006 3.615 1.00 0.00 H new ATOM 0 HB2 MET A 13 3.201 0.441 1.103 1.00 0.00 H new ATOM 0 HB3 MET A 13 4.857 0.567 1.662 1.00 0.00 H new ATOM 0 HG2 MET A 13 2.490 -0.597 3.158 1.00 0.00 H new ATOM 0 HG3 MET A 13 3.904 -1.449 2.569 1.00 0.00 H new ATOM 0 HE1 MET A 13 3.469 -0.739 6.706 1.00 0.00 H new ATOM 0 HE2 MET A 13 2.384 0.300 5.751 1.00 0.00 H new ATOM 0 HE3 MET A 13 2.506 -1.437 5.382 1.00 0.00 H new ATOM 183 N LYS A 14 5.101 3.840 2.750 1.00 0.00 N ATOM 184 CA LYS A 14 6.036 4.854 2.279 1.00 0.00 C ATOM 185 C LYS A 14 7.459 4.306 2.236 1.00 0.00 C ATOM 186 O LYS A 14 7.856 3.517 3.093 1.00 0.00 O ATOM 187 CB LYS A 14 5.981 6.088 3.183 1.00 0.00 C ATOM 188 CG LYS A 14 4.582 6.655 3.353 1.00 0.00 C ATOM 189 CD LYS A 14 4.051 7.229 2.050 1.00 0.00 C ATOM 190 CE LYS A 14 4.514 8.663 1.843 1.00 0.00 C ATOM 191 NZ LYS A 14 3.557 9.645 2.425 1.00 0.00 N ATOM 0 H LYS A 14 4.977 3.819 3.762 1.00 0.00 H new ATOM 0 HA LYS A 14 5.744 5.138 1.268 1.00 0.00 H new ATOM 0 HB2 LYS A 14 6.380 5.828 4.163 1.00 0.00 H new ATOM 0 HB3 LYS A 14 6.629 6.860 2.769 1.00 0.00 H new ATOM 0 HG2 LYS A 14 3.911 5.872 3.707 1.00 0.00 H new ATOM 0 HG3 LYS A 14 4.594 7.433 4.116 1.00 0.00 H new ATOM 0 HD2 LYS A 14 4.387 6.613 1.216 1.00 0.00 H new ATOM 0 HD3 LYS A 14 2.962 7.194 2.053 1.00 0.00 H new ATOM 0 HE2 LYS A 14 5.495 8.797 2.300 1.00 0.00 H new ATOM 0 HE3 LYS A 14 4.630 8.857 0.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 3.977 10.596 2.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 2.676 9.641 1.872 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 3.348 9.385 3.410 1.00 0.00 H new ATOM 205 N SER A 15 8.221 4.729 1.233 1.00 0.00 N ATOM 206 CA SER A 15 9.600 4.279 1.078 1.00 0.00 C ATOM 207 C SER A 15 10.542 5.464 0.895 1.00 0.00 C ATOM 208 O SER A 15 10.263 6.379 0.120 1.00 0.00 O ATOM 209 CB SER A 15 9.716 3.330 -0.117 1.00 0.00 C ATOM 210 OG SER A 15 11.036 2.828 -0.243 1.00 0.00 O ATOM 0 H SER A 15 7.907 5.383 0.515 1.00 0.00 H new ATOM 0 HA SER A 15 9.887 3.748 1.985 1.00 0.00 H new ATOM 0 HB2 SER A 15 9.018 2.501 0.004 1.00 0.00 H new ATOM 0 HB3 SER A 15 9.434 3.854 -1.030 1.00 0.00 H new ATOM 0 HG SER A 15 11.488 3.279 -0.986 1.00 0.00 H new ATOM 216 N SER A 16 11.659 5.441 1.614 1.00 0.00 N ATOM 217 CA SER A 16 12.642 6.515 1.535 1.00 0.00 C ATOM 218 C SER A 16 12.999 6.819 0.083 1.00 0.00 C ATOM 219 O SER A 16 12.816 7.939 -0.391 1.00 0.00 O ATOM 220 CB SER A 16 13.904 6.139 2.314 1.00 0.00 C ATOM 221 OG SER A 16 13.705 6.288 3.709 1.00 0.00 O ATOM 0 H SER A 16 11.906 4.690 2.258 1.00 0.00 H new ATOM 0 HA SER A 16 12.203 7.409 1.978 1.00 0.00 H new ATOM 0 HB2 SER A 16 14.179 5.108 2.091 1.00 0.00 H new ATOM 0 HB3 SER A 16 14.734 6.768 1.993 1.00 0.00 H new ATOM 0 HG SER A 16 14.525 6.040 4.185 1.00 0.00 H new ATOM 227 N ASN A 17 13.511 5.812 -0.617 1.00 0.00 N ATOM 228 CA ASN A 17 13.895 5.970 -2.015 1.00 0.00 C ATOM 229 C ASN A 17 13.046 5.079 -2.917 1.00 0.00 C ATOM 230 O ASN A 17 12.349 4.181 -2.442 1.00 0.00 O ATOM 231 CB ASN A 17 15.377 5.637 -2.200 1.00 0.00 C ATOM 232 CG ASN A 17 16.285 6.722 -1.655 1.00 0.00 C ATOM 233 OD1 ASN A 17 15.823 7.683 -1.040 1.00 0.00 O ATOM 234 ND2 ASN A 17 17.586 6.572 -1.880 1.00 0.00 N ATOM 0 H ASN A 17 13.670 4.878 -0.239 1.00 0.00 H new ATOM 0 HA ASN A 17 13.725 7.009 -2.297 1.00 0.00 H new ATOM 0 HB2 ASN A 17 15.600 4.695 -1.700 1.00 0.00 H new ATOM 0 HB3 ASN A 17 15.584 5.492 -3.260 1.00 0.00 H new ATOM 0 HD21 ASN A 17 18.247 7.270 -1.538 1.00 0.00 H new ATOM 0 HD22 ASN A 17 17.924 5.759 -2.395 1.00 0.00 H new ATOM 241 N LEU A 18 13.109 5.333 -4.219 1.00 0.00 N ATOM 242 CA LEU A 18 12.347 4.554 -5.189 1.00 0.00 C ATOM 243 C LEU A 18 12.953 3.167 -5.370 1.00 0.00 C ATOM 244 O LEU A 18 12.240 2.164 -5.387 1.00 0.00 O ATOM 245 CB LEU A 18 12.299 5.282 -6.533 1.00 0.00 C ATOM 246 CG LEU A 18 11.212 4.824 -7.506 1.00 0.00 C ATOM 247 CD1 LEU A 18 10.827 3.378 -7.234 1.00 0.00 C ATOM 248 CD2 LEU A 18 9.993 5.730 -7.410 1.00 0.00 C ATOM 0 H LEU A 18 13.680 6.073 -4.628 1.00 0.00 H new ATOM 0 HA LEU A 18 11.332 4.440 -4.809 1.00 0.00 H new ATOM 0 HB2 LEU A 18 12.163 6.346 -6.342 1.00 0.00 H new ATOM 0 HB3 LEU A 18 13.267 5.167 -7.021 1.00 0.00 H new ATOM 0 HG LEU A 18 11.608 4.889 -8.519 1.00 0.00 H new ATOM 0 HD11 LEU A 18 10.052 3.070 -7.936 1.00 0.00 H new ATOM 0 HD12 LEU A 18 11.702 2.739 -7.356 1.00 0.00 H new ATOM 0 HD13 LEU A 18 10.450 3.287 -6.215 1.00 0.00 H new ATOM 0 HD21 LEU A 18 9.230 5.389 -8.110 1.00 0.00 H new ATOM 0 HD22 LEU A 18 9.595 5.699 -6.396 1.00 0.00 H new ATOM 0 HD23 LEU A 18 10.279 6.753 -7.656 1.00 0.00 H new ATOM 260 N ARG A 19 14.275 3.117 -5.502 1.00 0.00 N ATOM 261 CA ARG A 19 14.978 1.852 -5.681 1.00 0.00 C ATOM 262 C ARG A 19 14.409 0.779 -4.758 1.00 0.00 C ATOM 263 O ARG A 19 14.010 -0.294 -5.209 1.00 0.00 O ATOM 264 CB ARG A 19 16.473 2.032 -5.411 1.00 0.00 C ATOM 265 CG ARG A 19 17.217 0.723 -5.205 1.00 0.00 C ATOM 266 CD ARG A 19 17.071 -0.195 -6.408 1.00 0.00 C ATOM 267 NE ARG A 19 18.236 -1.059 -6.581 1.00 0.00 N ATOM 268 CZ ARG A 19 19.345 -0.681 -7.207 1.00 0.00 C ATOM 269 NH1 ARG A 19 19.439 0.539 -7.716 1.00 0.00 N ATOM 270 NH2 ARG A 19 20.362 -1.525 -7.324 1.00 0.00 N ATOM 0 H ARG A 19 14.880 3.938 -5.488 1.00 0.00 H new ATOM 0 HA ARG A 19 14.839 1.530 -6.713 1.00 0.00 H new ATOM 0 HB2 ARG A 19 16.923 2.568 -6.247 1.00 0.00 H new ATOM 0 HB3 ARG A 19 16.601 2.656 -4.527 1.00 0.00 H new ATOM 0 HG2 ARG A 19 18.273 0.927 -5.028 1.00 0.00 H new ATOM 0 HG3 ARG A 19 16.835 0.222 -4.315 1.00 0.00 H new ATOM 0 HD2 ARG A 19 16.178 -0.809 -6.289 1.00 0.00 H new ATOM 0 HD3 ARG A 19 16.928 0.405 -7.307 1.00 0.00 H new ATOM 0 HE ARG A 19 18.196 -2.004 -6.200 1.00 0.00 H new ATOM 0 HH11 ARG A 19 18.659 1.190 -7.627 1.00 0.00 H new ATOM 0 HH12 ARG A 19 20.292 0.827 -8.196 1.00 0.00 H new ATOM 0 HH21 ARG A 19 20.293 -2.465 -6.933 1.00 0.00 H new ATOM 0 HH22 ARG A 19 21.213 -1.234 -7.805 1.00 0.00 H new ATOM 284 N ASN A 20 14.376 1.076 -3.463 1.00 0.00 N ATOM 285 CA ASN A 20 13.857 0.136 -2.475 1.00 0.00 C ATOM 286 C ASN A 20 12.542 -0.476 -2.946 1.00 0.00 C ATOM 287 O ASN A 20 12.247 -1.637 -2.661 1.00 0.00 O ATOM 288 CB ASN A 20 13.654 0.837 -1.131 1.00 0.00 C ATOM 289 CG ASN A 20 14.818 1.740 -0.768 1.00 0.00 C ATOM 290 OD1 ASN A 20 15.914 1.607 -1.311 1.00 0.00 O ATOM 291 ND2 ASN A 20 14.583 2.666 0.155 1.00 0.00 N ATOM 0 H ASN A 20 14.702 1.960 -3.073 1.00 0.00 H new ATOM 0 HA ASN A 20 14.587 -0.664 -2.353 1.00 0.00 H new ATOM 0 HB2 ASN A 20 12.738 1.426 -1.166 1.00 0.00 H new ATOM 0 HB3 ASN A 20 13.521 0.088 -0.350 1.00 0.00 H new ATOM 0 HD21 ASN A 20 15.327 3.303 0.440 1.00 0.00 H new ATOM 0 HD22 ASN A 20 13.658 2.740 0.579 1.00 0.00 H new ATOM 298 N LEU A 21 11.754 0.313 -3.669 1.00 0.00 N ATOM 299 CA LEU A 21 10.469 -0.151 -4.180 1.00 0.00 C ATOM 300 C LEU A 21 10.664 -1.183 -5.286 1.00 0.00 C ATOM 301 O LEU A 21 9.940 -2.176 -5.356 1.00 0.00 O ATOM 302 CB LEU A 21 9.651 1.029 -4.707 1.00 0.00 C ATOM 303 CG LEU A 21 8.152 0.782 -4.884 1.00 0.00 C ATOM 304 CD1 LEU A 21 7.469 0.657 -3.532 1.00 0.00 C ATOM 305 CD2 LEU A 21 7.520 1.899 -5.702 1.00 0.00 C ATOM 0 H LEU A 21 11.982 1.276 -3.914 1.00 0.00 H new ATOM 0 HA LEU A 21 9.928 -0.622 -3.359 1.00 0.00 H new ATOM 0 HB2 LEU A 21 9.782 1.869 -4.025 1.00 0.00 H new ATOM 0 HB3 LEU A 21 10.065 1.331 -5.669 1.00 0.00 H new ATOM 0 HG LEU A 21 8.019 -0.156 -5.423 1.00 0.00 H new ATOM 0 HD11 LEU A 21 6.403 0.482 -3.678 1.00 0.00 H new ATOM 0 HD12 LEU A 21 7.902 -0.178 -2.981 1.00 0.00 H new ATOM 0 HD13 LEU A 21 7.611 1.578 -2.966 1.00 0.00 H new ATOM 0 HD21 LEU A 21 6.453 1.706 -5.818 1.00 0.00 H new ATOM 0 HD22 LEU A 21 7.664 2.851 -5.190 1.00 0.00 H new ATOM 0 HD23 LEU A 21 7.990 1.941 -6.685 1.00 0.00 H new ATOM 317 N GLU A 22 11.647 -0.942 -6.148 1.00 0.00 N ATOM 318 CA GLU A 22 11.938 -1.852 -7.249 1.00 0.00 C ATOM 319 C GLU A 22 11.995 -3.297 -6.761 1.00 0.00 C ATOM 320 O GLU A 22 11.453 -4.200 -7.398 1.00 0.00 O ATOM 321 CB GLU A 22 13.262 -1.474 -7.917 1.00 0.00 C ATOM 322 CG GLU A 22 13.179 -0.217 -8.765 1.00 0.00 C ATOM 323 CD GLU A 22 12.780 -0.505 -10.199 1.00 0.00 C ATOM 324 OE1 GLU A 22 11.735 -1.157 -10.405 1.00 0.00 O ATOM 325 OE2 GLU A 22 13.514 -0.079 -11.116 1.00 0.00 O ATOM 0 H GLU A 22 12.255 -0.124 -6.105 1.00 0.00 H new ATOM 0 HA GLU A 22 11.134 -1.766 -7.980 1.00 0.00 H new ATOM 0 HB2 GLU A 22 14.020 -1.333 -7.147 1.00 0.00 H new ATOM 0 HB3 GLU A 22 13.593 -2.303 -8.543 1.00 0.00 H new ATOM 0 HG2 GLU A 22 12.457 0.469 -8.322 1.00 0.00 H new ATOM 0 HG3 GLU A 22 14.145 0.288 -8.755 1.00 0.00 H new ATOM 332 N ILE A 23 12.657 -3.506 -5.628 1.00 0.00 N ATOM 333 CA ILE A 23 12.785 -4.839 -5.054 1.00 0.00 C ATOM 334 C ILE A 23 11.424 -5.514 -4.921 1.00 0.00 C ATOM 335 O ILE A 23 11.318 -6.739 -4.986 1.00 0.00 O ATOM 336 CB ILE A 23 13.460 -4.794 -3.670 1.00 0.00 C ATOM 337 CG1 ILE A 23 14.922 -4.364 -3.806 1.00 0.00 C ATOM 338 CG2 ILE A 23 13.363 -6.151 -2.989 1.00 0.00 C ATOM 339 CD1 ILE A 23 15.095 -2.881 -4.048 1.00 0.00 C ATOM 0 H ILE A 23 13.113 -2.769 -5.090 1.00 0.00 H new ATOM 0 HA ILE A 23 13.409 -5.417 -5.736 1.00 0.00 H new ATOM 0 HB ILE A 23 12.941 -4.061 -3.052 1.00 0.00 H new ATOM 0 HG12 ILE A 23 15.460 -4.641 -2.899 1.00 0.00 H new ATOM 0 HG13 ILE A 23 15.379 -4.914 -4.629 1.00 0.00 H new ATOM 0 HG21 ILE A 23 13.844 -6.103 -2.012 1.00 0.00 H new ATOM 0 HG22 ILE A 23 12.314 -6.421 -2.864 1.00 0.00 H new ATOM 0 HG23 ILE A 23 13.861 -6.902 -3.602 1.00 0.00 H new ATOM 0 HD11 ILE A 23 16.156 -2.648 -4.134 1.00 0.00 H new ATOM 0 HD12 ILE A 23 14.586 -2.601 -4.970 1.00 0.00 H new ATOM 0 HD13 ILE A 23 14.668 -2.324 -3.214 1.00 0.00 H new ATOM 351 N SER A 24 10.385 -4.707 -4.737 1.00 0.00 N ATOM 352 CA SER A 24 9.030 -5.225 -4.594 1.00 0.00 C ATOM 353 C SER A 24 8.446 -5.604 -5.952 1.00 0.00 C ATOM 354 O SER A 24 7.562 -6.455 -6.043 1.00 0.00 O ATOM 355 CB SER A 24 8.134 -4.190 -3.912 1.00 0.00 C ATOM 356 OG SER A 24 6.994 -4.802 -3.335 1.00 0.00 O ATOM 0 H SER A 24 10.456 -3.691 -4.683 1.00 0.00 H new ATOM 0 HA SER A 24 9.075 -6.121 -3.974 1.00 0.00 H new ATOM 0 HB2 SER A 24 8.699 -3.667 -3.140 1.00 0.00 H new ATOM 0 HB3 SER A 24 7.820 -3.441 -4.639 1.00 0.00 H new ATOM 0 HG SER A 24 7.278 -5.527 -2.739 1.00 0.00 H new ATOM 362 N GLN A 25 8.949 -4.965 -7.003 1.00 0.00 N ATOM 363 CA GLN A 25 8.477 -5.234 -8.357 1.00 0.00 C ATOM 364 C GLN A 25 9.232 -6.407 -8.973 1.00 0.00 C ATOM 365 O GLN A 25 8.642 -7.253 -9.645 1.00 0.00 O ATOM 366 CB GLN A 25 8.640 -3.991 -9.233 1.00 0.00 C ATOM 367 CG GLN A 25 7.628 -2.898 -8.931 1.00 0.00 C ATOM 368 CD GLN A 25 7.950 -1.593 -9.634 1.00 0.00 C ATOM 369 OE1 GLN A 25 7.449 -1.322 -10.725 1.00 0.00 O ATOM 370 NE2 GLN A 25 8.791 -0.777 -9.010 1.00 0.00 N ATOM 0 H GLN A 25 9.682 -4.258 -6.944 1.00 0.00 H new ATOM 0 HA GLN A 25 7.420 -5.494 -8.301 1.00 0.00 H new ATOM 0 HB2 GLN A 25 9.645 -3.591 -9.099 1.00 0.00 H new ATOM 0 HB3 GLN A 25 8.549 -4.280 -10.280 1.00 0.00 H new ATOM 0 HG2 GLN A 25 6.636 -3.234 -9.233 1.00 0.00 H new ATOM 0 HG3 GLN A 25 7.593 -2.728 -7.855 1.00 0.00 H new ATOM 0 HE21 GLN A 25 9.183 -1.042 -8.106 1.00 0.00 H new ATOM 0 HE22 GLN A 25 9.045 0.115 -9.434 1.00 0.00 H new ATOM 379 N GLN A 26 10.540 -6.451 -8.741 1.00 0.00 N ATOM 380 CA GLN A 26 11.375 -7.520 -9.275 1.00 0.00 C ATOM 381 C GLN A 26 11.240 -8.787 -8.437 1.00 0.00 C ATOM 382 O GLN A 26 10.864 -9.843 -8.945 1.00 0.00 O ATOM 383 CB GLN A 26 12.839 -7.078 -9.320 1.00 0.00 C ATOM 384 CG GLN A 26 13.036 -5.682 -9.889 1.00 0.00 C ATOM 385 CD GLN A 26 13.135 -5.677 -11.401 1.00 0.00 C ATOM 386 OE1 GLN A 26 12.162 -5.389 -12.098 1.00 0.00 O ATOM 387 NE2 GLN A 26 14.316 -5.997 -11.919 1.00 0.00 N ATOM 0 H GLN A 26 11.044 -5.759 -8.187 1.00 0.00 H new ATOM 0 HA GLN A 26 11.037 -7.739 -10.288 1.00 0.00 H new ATOM 0 HB2 GLN A 26 13.251 -7.112 -8.311 1.00 0.00 H new ATOM 0 HB3 GLN A 26 13.406 -7.789 -9.920 1.00 0.00 H new ATOM 0 HG2 GLN A 26 12.205 -5.048 -9.581 1.00 0.00 H new ATOM 0 HG3 GLN A 26 13.942 -5.247 -9.468 1.00 0.00 H new ATOM 0 HE21 GLN A 26 15.096 -6.229 -11.305 1.00 0.00 H new ATOM 0 HE22 GLN A 26 14.442 -6.010 -12.931 1.00 0.00 H new ATOM 396 N LYS A 27 11.549 -8.675 -7.150 1.00 0.00 N ATOM 397 CA LYS A 27 11.461 -9.810 -6.239 1.00 0.00 C ATOM 398 C LYS A 27 10.006 -10.185 -5.976 1.00 0.00 C ATOM 399 O LYS A 27 9.671 -11.362 -5.852 1.00 0.00 O ATOM 400 CB LYS A 27 12.163 -9.487 -4.918 1.00 0.00 C ATOM 401 CG LYS A 27 13.510 -8.808 -5.095 1.00 0.00 C ATOM 402 CD LYS A 27 14.359 -9.518 -6.137 1.00 0.00 C ATOM 403 CE LYS A 27 15.818 -9.098 -6.047 1.00 0.00 C ATOM 404 NZ LYS A 27 16.553 -9.867 -5.004 1.00 0.00 N ATOM 0 H LYS A 27 11.863 -7.808 -6.714 1.00 0.00 H new ATOM 0 HA LYS A 27 11.958 -10.659 -6.708 1.00 0.00 H new ATOM 0 HB2 LYS A 27 11.517 -8.844 -4.321 1.00 0.00 H new ATOM 0 HB3 LYS A 27 12.302 -10.410 -4.355 1.00 0.00 H new ATOM 0 HG2 LYS A 27 13.359 -7.770 -5.393 1.00 0.00 H new ATOM 0 HG3 LYS A 27 14.039 -8.793 -4.142 1.00 0.00 H new ATOM 0 HD2 LYS A 27 14.280 -10.596 -5.999 1.00 0.00 H new ATOM 0 HD3 LYS A 27 13.976 -9.296 -7.133 1.00 0.00 H new ATOM 0 HE2 LYS A 27 16.299 -9.246 -7.014 1.00 0.00 H new ATOM 0 HE3 LYS A 27 15.876 -8.033 -5.822 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 17.544 -9.552 -4.974 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 16.110 -9.706 -4.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 16.519 -10.881 -5.232 1.00 0.00 H new ATOM 418 N GLY A 28 9.145 -9.175 -5.892 1.00 0.00 N ATOM 419 CA GLY A 28 7.736 -9.420 -5.646 1.00 0.00 C ATOM 420 C GLY A 28 7.416 -9.528 -4.168 1.00 0.00 C ATOM 421 O GLY A 28 6.413 -10.132 -3.786 1.00 0.00 O ATOM 0 H GLY A 28 9.398 -8.192 -5.990 1.00 0.00 H new ATOM 0 HA2 GLY A 28 7.148 -8.613 -6.084 1.00 0.00 H new ATOM 0 HA3 GLY A 28 7.437 -10.341 -6.148 1.00 0.00 H new ATOM 425 N ILE A 29 8.271 -8.944 -3.335 1.00 0.00 N ATOM 426 CA ILE A 29 8.075 -8.979 -1.891 1.00 0.00 C ATOM 427 C ILE A 29 8.297 -7.602 -1.273 1.00 0.00 C ATOM 428 O ILE A 29 8.935 -6.737 -1.873 1.00 0.00 O ATOM 429 CB ILE A 29 9.021 -9.990 -1.218 1.00 0.00 C ATOM 430 CG1 ILE A 29 10.405 -9.938 -1.868 1.00 0.00 C ATOM 431 CG2 ILE A 29 8.442 -11.395 -1.304 1.00 0.00 C ATOM 432 CD1 ILE A 29 11.248 -8.772 -1.402 1.00 0.00 C ATOM 0 H ILE A 29 9.106 -8.441 -3.635 1.00 0.00 H new ATOM 0 HA ILE A 29 7.044 -9.290 -1.720 1.00 0.00 H new ATOM 0 HB ILE A 29 9.124 -9.724 -0.166 1.00 0.00 H new ATOM 0 HG12 ILE A 29 10.934 -10.867 -1.653 1.00 0.00 H new ATOM 0 HG13 ILE A 29 10.287 -9.881 -2.950 1.00 0.00 H new ATOM 0 HG21 ILE A 29 9.122 -12.099 -0.824 1.00 0.00 H new ATOM 0 HG22 ILE A 29 7.476 -11.422 -0.799 1.00 0.00 H new ATOM 0 HG23 ILE A 29 8.313 -11.672 -2.350 1.00 0.00 H new ATOM 0 HD11 ILE A 29 12.215 -8.799 -1.904 1.00 0.00 H new ATOM 0 HD12 ILE A 29 10.741 -7.838 -1.641 1.00 0.00 H new ATOM 0 HD13 ILE A 29 11.397 -8.838 -0.324 1.00 0.00 H new ATOM 444 N TRP A 30 7.769 -7.408 -0.070 1.00 0.00 N ATOM 445 CA TRP A 30 7.911 -6.137 0.630 1.00 0.00 C ATOM 446 C TRP A 30 8.111 -6.359 2.126 1.00 0.00 C ATOM 447 O TRP A 30 7.402 -7.152 2.745 1.00 0.00 O ATOM 448 CB TRP A 30 6.681 -5.259 0.393 1.00 0.00 C ATOM 449 CG TRP A 30 6.791 -3.901 1.016 1.00 0.00 C ATOM 450 CD1 TRP A 30 6.080 -3.428 2.082 1.00 0.00 C ATOM 451 CD2 TRP A 30 7.663 -2.840 0.611 1.00 0.00 C ATOM 452 NE1 TRP A 30 6.457 -2.137 2.363 1.00 0.00 N ATOM 453 CE2 TRP A 30 7.427 -1.753 1.476 1.00 0.00 C ATOM 454 CE3 TRP A 30 8.621 -2.702 -0.397 1.00 0.00 C ATOM 455 CZ2 TRP A 30 8.114 -0.548 1.361 1.00 0.00 C ATOM 456 CZ3 TRP A 30 9.302 -1.505 -0.510 1.00 0.00 C ATOM 457 CH2 TRP A 30 9.047 -0.441 0.365 1.00 0.00 C ATOM 0 H TRP A 30 7.239 -8.114 0.441 1.00 0.00 H new ATOM 0 HA TRP A 30 8.792 -5.630 0.235 1.00 0.00 H new ATOM 0 HB2 TRP A 30 6.525 -5.147 -0.680 1.00 0.00 H new ATOM 0 HB3 TRP A 30 5.801 -5.764 0.792 1.00 0.00 H new ATOM 0 HD1 TRP A 30 5.332 -3.987 2.624 1.00 0.00 H new ATOM 0 HE1 TRP A 30 6.076 -1.558 3.111 1.00 0.00 H new ATOM 0 HE3 TRP A 30 8.826 -3.517 -1.076 1.00 0.00 H new ATOM 0 HZ2 TRP A 30 7.918 0.274 2.034 1.00 0.00 H new ATOM 0 HZ3 TRP A 30 10.044 -1.388 -1.286 1.00 0.00 H new ATOM 0 HH2 TRP A 30 9.597 0.481 0.252 1.00 0.00 H new ATOM 468 N SER A 31 9.080 -5.653 2.700 1.00 0.00 N ATOM 469 CA SER A 31 9.375 -5.777 4.123 1.00 0.00 C ATOM 470 C SER A 31 9.148 -4.451 4.842 1.00 0.00 C ATOM 471 O SER A 31 9.901 -3.493 4.657 1.00 0.00 O ATOM 472 CB SER A 31 10.819 -6.241 4.328 1.00 0.00 C ATOM 473 OG SER A 31 11.103 -6.429 5.703 1.00 0.00 O ATOM 0 H SER A 31 9.674 -4.990 2.202 1.00 0.00 H new ATOM 0 HA SER A 31 8.699 -6.520 4.546 1.00 0.00 H new ATOM 0 HB2 SER A 31 10.985 -7.173 3.788 1.00 0.00 H new ATOM 0 HB3 SER A 31 11.504 -5.504 3.909 1.00 0.00 H new ATOM 0 HG SER A 31 11.778 -7.132 5.804 1.00 0.00 H new ATOM 479 N THR A 32 8.104 -4.401 5.663 1.00 0.00 N ATOM 480 CA THR A 32 7.775 -3.193 6.410 1.00 0.00 C ATOM 481 C THR A 32 8.122 -3.348 7.886 1.00 0.00 C ATOM 482 O THR A 32 8.472 -4.437 8.342 1.00 0.00 O ATOM 483 CB THR A 32 6.282 -2.841 6.279 1.00 0.00 C ATOM 484 OG1 THR A 32 6.055 -1.498 6.721 1.00 0.00 O ATOM 485 CG2 THR A 32 5.426 -3.799 7.093 1.00 0.00 C ATOM 0 H THR A 32 7.471 -5.184 5.828 1.00 0.00 H new ATOM 0 HA THR A 32 8.370 -2.385 5.983 1.00 0.00 H new ATOM 0 HB THR A 32 6.001 -2.931 5.230 1.00 0.00 H new ATOM 0 HG1 THR A 32 5.823 -0.936 5.953 1.00 0.00 H new ATOM 0 HG21 THR A 32 4.375 -3.530 6.985 1.00 0.00 H new ATOM 0 HG22 THR A 32 5.579 -4.817 6.735 1.00 0.00 H new ATOM 0 HG23 THR A 32 5.710 -3.737 8.144 1.00 0.00 H new ATOM 493 N THR A 33 8.021 -2.251 8.631 1.00 0.00 N ATOM 494 CA THR A 33 8.325 -2.265 10.056 1.00 0.00 C ATOM 495 C THR A 33 7.461 -3.283 10.792 1.00 0.00 C ATOM 496 O THR A 33 6.281 -3.465 10.491 1.00 0.00 O ATOM 497 CB THR A 33 8.114 -0.876 10.689 1.00 0.00 C ATOM 498 OG1 THR A 33 8.727 -0.829 11.982 1.00 0.00 O ATOM 499 CG2 THR A 33 6.632 -0.558 10.813 1.00 0.00 C ATOM 0 H THR A 33 7.731 -1.342 8.270 1.00 0.00 H new ATOM 0 HA THR A 33 9.374 -2.545 10.153 1.00 0.00 H new ATOM 0 HB THR A 33 8.576 -0.131 10.041 1.00 0.00 H new ATOM 0 HG1 THR A 33 8.590 0.057 12.377 1.00 0.00 H new ATOM 0 HG21 THR A 33 6.508 0.427 11.262 1.00 0.00 H new ATOM 0 HG22 THR A 33 6.174 -0.566 9.824 1.00 0.00 H new ATOM 0 HG23 THR A 33 6.151 -1.307 11.442 1.00 0.00 H new ATOM 507 N PRO A 34 8.059 -3.963 11.782 1.00 0.00 N ATOM 508 CA PRO A 34 7.362 -4.973 12.582 1.00 0.00 C ATOM 509 C PRO A 34 6.314 -4.360 13.505 1.00 0.00 C ATOM 510 O PRO A 34 5.693 -5.059 14.306 1.00 0.00 O ATOM 511 CB PRO A 34 8.485 -5.615 13.400 1.00 0.00 C ATOM 512 CG PRO A 34 9.539 -4.566 13.485 1.00 0.00 C ATOM 513 CD PRO A 34 9.463 -3.797 12.195 1.00 0.00 C ATOM 0 HA PRO A 34 6.813 -5.679 11.958 1.00 0.00 H new ATOM 0 HB2 PRO A 34 8.136 -5.907 14.391 1.00 0.00 H new ATOM 0 HB3 PRO A 34 8.862 -6.516 12.916 1.00 0.00 H new ATOM 0 HG2 PRO A 34 9.370 -3.911 14.340 1.00 0.00 H new ATOM 0 HG3 PRO A 34 10.525 -5.013 13.615 1.00 0.00 H new ATOM 0 HD2 PRO A 34 9.719 -2.747 12.337 1.00 0.00 H new ATOM 0 HD3 PRO A 34 10.151 -4.194 11.449 1.00 0.00 H new ATOM 521 N SER A 35 6.123 -3.050 13.388 1.00 0.00 N ATOM 522 CA SER A 35 5.153 -2.342 14.214 1.00 0.00 C ATOM 523 C SER A 35 3.810 -2.227 13.499 1.00 0.00 C ATOM 524 O SER A 35 2.786 -1.942 14.118 1.00 0.00 O ATOM 525 CB SER A 35 5.674 -0.948 14.570 1.00 0.00 C ATOM 526 OG SER A 35 5.138 -0.502 15.803 1.00 0.00 O ATOM 0 H SER A 35 6.628 -2.457 12.729 1.00 0.00 H new ATOM 0 HA SER A 35 5.009 -2.914 15.131 1.00 0.00 H new ATOM 0 HB2 SER A 35 6.762 -0.967 14.629 1.00 0.00 H new ATOM 0 HB3 SER A 35 5.410 -0.245 13.780 1.00 0.00 H new ATOM 0 HG SER A 35 5.488 0.390 16.008 1.00 0.00 H new ATOM 532 N ASN A 36 3.824 -2.453 12.189 1.00 0.00 N ATOM 533 CA ASN A 36 2.608 -2.375 11.387 1.00 0.00 C ATOM 534 C ASN A 36 2.400 -3.658 10.589 1.00 0.00 C ATOM 535 O ASN A 36 1.732 -3.656 9.555 1.00 0.00 O ATOM 536 CB ASN A 36 2.674 -1.176 10.439 1.00 0.00 C ATOM 537 CG ASN A 36 3.386 0.012 11.056 1.00 0.00 C ATOM 538 OD1 ASN A 36 4.312 0.601 10.308 1.00 0.00 O flip ATOM 539 ND2 ASN A 36 3.107 0.395 12.192 1.00 0.00 N flip ATOM 0 H ASN A 36 4.663 -2.691 11.661 1.00 0.00 H new ATOM 0 HA ASN A 36 1.763 -2.248 12.064 1.00 0.00 H new ATOM 0 HB2 ASN A 36 3.188 -1.468 9.523 1.00 0.00 H new ATOM 0 HB3 ASN A 36 1.663 -0.883 10.157 1.00 0.00 H new ATOM 0 HD21 ASN A 36 2.388 -0.088 12.731 1.00 0.00 H new ATOM 0 HD22 ASN A 36 3.595 1.195 12.595 1.00 0.00 H new ATOM 546 N GLU A 37 2.975 -4.753 11.077 1.00 0.00 N ATOM 547 CA GLU A 37 2.852 -6.043 10.409 1.00 0.00 C ATOM 548 C GLU A 37 1.602 -6.781 10.877 1.00 0.00 C ATOM 549 O GLU A 37 0.793 -7.231 10.065 1.00 0.00 O ATOM 550 CB GLU A 37 4.093 -6.899 10.673 1.00 0.00 C ATOM 551 CG GLU A 37 5.263 -6.575 9.760 1.00 0.00 C ATOM 552 CD GLU A 37 6.375 -7.601 9.850 1.00 0.00 C ATOM 553 OE1 GLU A 37 6.480 -8.271 10.899 1.00 0.00 O ATOM 554 OE2 GLU A 37 7.141 -7.734 8.872 1.00 0.00 O ATOM 0 H GLU A 37 3.530 -4.772 11.932 1.00 0.00 H new ATOM 0 HA GLU A 37 2.766 -5.862 9.338 1.00 0.00 H new ATOM 0 HB2 GLU A 37 4.403 -6.763 11.709 1.00 0.00 H new ATOM 0 HB3 GLU A 37 3.831 -7.950 10.554 1.00 0.00 H new ATOM 0 HG2 GLU A 37 4.910 -6.517 8.730 1.00 0.00 H new ATOM 0 HG3 GLU A 37 5.659 -5.593 10.017 1.00 0.00 H new ATOM 561 N ARG A 38 1.450 -6.902 12.192 1.00 0.00 N ATOM 562 CA ARG A 38 0.300 -7.586 12.769 1.00 0.00 C ATOM 563 C ARG A 38 -0.950 -7.358 11.923 1.00 0.00 C ATOM 564 O ARG A 38 -1.704 -8.290 11.646 1.00 0.00 O ATOM 565 CB ARG A 38 0.056 -7.102 14.199 1.00 0.00 C ATOM 566 CG ARG A 38 -1.258 -7.587 14.791 1.00 0.00 C ATOM 567 CD ARG A 38 -2.390 -6.613 14.507 1.00 0.00 C ATOM 568 NE ARG A 38 -3.500 -6.776 15.443 1.00 0.00 N ATOM 569 CZ ARG A 38 -4.410 -5.837 15.674 1.00 0.00 C ATOM 570 NH1 ARG A 38 -4.343 -4.673 15.041 1.00 0.00 N ATOM 571 NH2 ARG A 38 -5.391 -6.060 16.540 1.00 0.00 N ATOM 0 H ARG A 38 2.110 -6.535 12.878 1.00 0.00 H new ATOM 0 HA ARG A 38 0.516 -8.654 12.786 1.00 0.00 H new ATOM 0 HB2 ARG A 38 0.876 -7.439 14.833 1.00 0.00 H new ATOM 0 HB3 ARG A 38 0.070 -6.012 14.212 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -1.506 -8.565 14.378 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -1.148 -7.715 15.868 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -2.013 -5.592 14.566 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -2.749 -6.762 13.489 1.00 0.00 H new ATOM 0 HE ARG A 38 -3.580 -7.659 15.947 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -3.591 -4.497 14.375 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -5.044 -3.954 15.221 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -5.446 -6.953 17.029 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -6.089 -5.338 16.717 1.00 0.00 H new ATOM 585 N LYS A 39 -1.162 -6.111 11.516 1.00 0.00 N ATOM 586 CA LYS A 39 -2.319 -5.758 10.701 1.00 0.00 C ATOM 587 C LYS A 39 -2.272 -6.471 9.353 1.00 0.00 C ATOM 588 O LYS A 39 -3.079 -7.361 9.082 1.00 0.00 O ATOM 589 CB LYS A 39 -2.375 -4.244 10.488 1.00 0.00 C ATOM 590 CG LYS A 39 -1.015 -3.570 10.547 1.00 0.00 C ATOM 591 CD LYS A 39 -0.947 -2.369 9.618 1.00 0.00 C ATOM 592 CE LYS A 39 -1.637 -1.157 10.224 1.00 0.00 C ATOM 593 NZ LYS A 39 -0.712 -0.362 11.079 1.00 0.00 N ATOM 0 H LYS A 39 -0.548 -5.327 11.737 1.00 0.00 H new ATOM 0 HA LYS A 39 -3.217 -6.078 11.230 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -2.831 -4.039 9.520 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -3.023 -3.803 11.245 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -0.809 -3.253 11.569 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -0.241 -4.287 10.274 1.00 0.00 H new ATOM 0 HD2 LYS A 39 0.095 -2.129 9.408 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -1.415 -2.617 8.665 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -2.028 -0.525 9.426 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -2.490 -1.484 10.818 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -1.264 0.208 11.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -0.085 -1.005 11.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -0.140 0.267 10.480 1.00 0.00 H new ATOM 607 N LEU A 40 -1.323 -6.075 8.512 1.00 0.00 N ATOM 608 CA LEU A 40 -1.170 -6.677 7.192 1.00 0.00 C ATOM 609 C LEU A 40 -1.289 -8.196 7.270 1.00 0.00 C ATOM 610 O LEU A 40 -1.961 -8.819 6.449 1.00 0.00 O ATOM 611 CB LEU A 40 0.180 -6.290 6.586 1.00 0.00 C ATOM 612 CG LEU A 40 0.555 -4.810 6.674 1.00 0.00 C ATOM 613 CD1 LEU A 40 1.919 -4.568 6.047 1.00 0.00 C ATOM 614 CD2 LEU A 40 -0.504 -3.951 6.000 1.00 0.00 C ATOM 0 H LEU A 40 -0.648 -5.340 8.721 1.00 0.00 H new ATOM 0 HA LEU A 40 -1.969 -6.300 6.553 1.00 0.00 H new ATOM 0 HB2 LEU A 40 0.958 -6.871 7.081 1.00 0.00 H new ATOM 0 HB3 LEU A 40 0.182 -6.583 5.536 1.00 0.00 H new ATOM 0 HG LEU A 40 0.606 -4.529 7.726 1.00 0.00 H new ATOM 0 HD11 LEU A 40 2.170 -3.510 6.118 1.00 0.00 H new ATOM 0 HD12 LEU A 40 2.671 -5.155 6.574 1.00 0.00 H new ATOM 0 HD13 LEU A 40 1.895 -4.865 4.999 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -0.221 -2.901 6.072 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -0.587 -4.233 4.950 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -1.464 -4.103 6.494 1.00 0.00 H new ATOM 626 N ASN A 41 -0.633 -8.786 8.264 1.00 0.00 N ATOM 627 CA ASN A 41 -0.666 -10.232 8.450 1.00 0.00 C ATOM 628 C ASN A 41 -2.071 -10.701 8.816 1.00 0.00 C ATOM 629 O ASN A 41 -2.702 -11.447 8.067 1.00 0.00 O ATOM 630 CB ASN A 41 0.323 -10.650 9.540 1.00 0.00 C ATOM 631 CG ASN A 41 0.850 -12.057 9.334 1.00 0.00 C ATOM 632 OD1 ASN A 41 0.560 -12.699 8.325 1.00 0.00 O ATOM 633 ND2 ASN A 41 1.628 -12.544 10.294 1.00 0.00 N ATOM 0 H ASN A 41 -0.072 -8.285 8.953 1.00 0.00 H new ATOM 0 HA ASN A 41 -0.379 -10.701 7.509 1.00 0.00 H new ATOM 0 HB2 ASN A 41 1.159 -9.951 9.556 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -0.164 -10.586 10.513 1.00 0.00 H new ATOM 0 HD21 ASN A 41 2.011 -13.486 10.211 1.00 0.00 H new ATOM 0 HD22 ASN A 41 1.843 -11.976 11.114 1.00 0.00 H new ATOM 640 N ARG A 42 -2.555 -10.258 9.972 1.00 0.00 N ATOM 641 CA ARG A 42 -3.884 -10.633 10.437 1.00 0.00 C ATOM 642 C ARG A 42 -4.937 -10.331 9.375 1.00 0.00 C ATOM 643 O ARG A 42 -5.604 -11.236 8.873 1.00 0.00 O ATOM 644 CB ARG A 42 -4.223 -9.891 11.731 1.00 0.00 C ATOM 645 CG ARG A 42 -5.297 -10.574 12.562 1.00 0.00 C ATOM 646 CD ARG A 42 -4.789 -11.870 13.173 1.00 0.00 C ATOM 647 NE ARG A 42 -3.717 -11.637 14.137 1.00 0.00 N ATOM 648 CZ ARG A 42 -3.403 -12.489 15.107 1.00 0.00 C ATOM 649 NH1 ARG A 42 -4.074 -13.624 15.240 1.00 0.00 N ATOM 650 NH2 ARG A 42 -2.414 -12.206 15.945 1.00 0.00 N ATOM 0 H ARG A 42 -2.046 -9.639 10.603 1.00 0.00 H new ATOM 0 HA ARG A 42 -3.884 -11.706 10.630 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -3.318 -9.793 12.331 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -4.553 -8.882 11.485 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -5.628 -9.902 13.354 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -6.165 -10.781 11.937 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -5.613 -12.386 13.665 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -4.428 -12.527 12.382 1.00 0.00 H new ATOM 0 HE ARG A 42 -3.180 -10.773 14.062 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -4.834 -13.846 14.597 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -3.831 -14.276 15.986 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -1.894 -11.334 15.845 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -2.173 -12.860 16.689 1.00 0.00 H new ATOM 664 N ALA A 43 -5.081 -9.054 9.038 1.00 0.00 N ATOM 665 CA ALA A 43 -6.051 -8.633 8.035 1.00 0.00 C ATOM 666 C ALA A 43 -6.087 -9.608 6.862 1.00 0.00 C ATOM 667 O ALA A 43 -7.158 -10.020 6.416 1.00 0.00 O ATOM 668 CB ALA A 43 -5.730 -7.229 7.546 1.00 0.00 C ATOM 0 H ALA A 43 -4.538 -8.293 9.445 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.037 -8.627 8.500 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -6.463 -6.928 6.797 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -5.763 -6.535 8.386 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -4.734 -7.217 7.104 1.00 0.00 H new ATOM 674 N PHE A 44 -4.909 -9.973 6.366 1.00 0.00 N ATOM 675 CA PHE A 44 -4.805 -10.898 5.244 1.00 0.00 C ATOM 676 C PHE A 44 -5.788 -12.055 5.401 1.00 0.00 C ATOM 677 O PHE A 44 -6.433 -12.470 4.438 1.00 0.00 O ATOM 678 CB PHE A 44 -3.378 -11.437 5.130 1.00 0.00 C ATOM 679 CG PHE A 44 -3.098 -12.120 3.822 1.00 0.00 C ATOM 680 CD1 PHE A 44 -3.816 -13.242 3.443 1.00 0.00 C ATOM 681 CD2 PHE A 44 -2.116 -11.639 2.971 1.00 0.00 C ATOM 682 CE1 PHE A 44 -3.560 -13.873 2.240 1.00 0.00 C ATOM 683 CE2 PHE A 44 -1.855 -12.265 1.767 1.00 0.00 C ATOM 684 CZ PHE A 44 -2.578 -13.382 1.400 1.00 0.00 C ATOM 0 H PHE A 44 -4.013 -9.642 6.724 1.00 0.00 H new ATOM 0 HA PHE A 44 -5.053 -10.354 4.332 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -2.676 -10.613 5.258 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -3.197 -12.140 5.944 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -4.585 -13.629 4.095 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -1.548 -10.765 3.252 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -4.126 -14.748 1.957 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -1.086 -11.880 1.114 1.00 0.00 H new ATOM 0 HZ PHE A 44 -2.377 -13.871 0.458 1.00 0.00 H new ATOM 694 N TRP A 45 -5.895 -12.571 6.620 1.00 0.00 N ATOM 695 CA TRP A 45 -6.798 -13.681 6.903 1.00 0.00 C ATOM 696 C TRP A 45 -8.181 -13.171 7.294 1.00 0.00 C ATOM 697 O TRP A 45 -9.186 -13.571 6.708 1.00 0.00 O ATOM 698 CB TRP A 45 -6.228 -14.556 8.021 1.00 0.00 C ATOM 699 CG TRP A 45 -4.730 -14.601 8.035 1.00 0.00 C ATOM 700 CD1 TRP A 45 -3.899 -14.580 6.951 1.00 0.00 C ATOM 701 CD2 TRP A 45 -3.886 -14.678 9.189 1.00 0.00 C ATOM 702 NE1 TRP A 45 -2.589 -14.638 7.362 1.00 0.00 N ATOM 703 CE2 TRP A 45 -2.554 -14.698 8.730 1.00 0.00 C ATOM 704 CE3 TRP A 45 -4.125 -14.729 10.565 1.00 0.00 C ATOM 705 CZ2 TRP A 45 -1.469 -14.769 9.599 1.00 0.00 C ATOM 706 CZ3 TRP A 45 -3.047 -14.800 11.426 1.00 0.00 C ATOM 707 CH2 TRP A 45 -1.732 -14.818 10.941 1.00 0.00 C ATOM 0 H TRP A 45 -5.368 -12.239 7.428 1.00 0.00 H new ATOM 0 HA TRP A 45 -6.895 -14.279 5.997 1.00 0.00 H new ATOM 0 HB2 TRP A 45 -6.582 -14.182 8.982 1.00 0.00 H new ATOM 0 HB3 TRP A 45 -6.614 -15.570 7.912 1.00 0.00 H new ATOM 0 HD1 TRP A 45 -4.224 -14.526 5.922 1.00 0.00 H new ATOM 0 HE1 TRP A 45 -1.775 -14.637 6.748 1.00 0.00 H new ATOM 0 HE3 TRP A 45 -5.135 -14.713 10.948 1.00 0.00 H new ATOM 0 HZ2 TRP A 45 -0.455 -14.785 9.227 1.00 0.00 H new ATOM 0 HZ3 TRP A 45 -3.220 -14.842 12.491 1.00 0.00 H new ATOM 0 HH2 TRP A 45 -0.910 -14.872 11.640 1.00 0.00 H new ATOM 718 N GLU A 46 -8.223 -12.287 8.286 1.00 0.00 N ATOM 719 CA GLU A 46 -9.484 -11.725 8.754 1.00 0.00 C ATOM 720 C GLU A 46 -10.247 -11.071 7.605 1.00 0.00 C ATOM 721 O GLU A 46 -11.433 -10.764 7.729 1.00 0.00 O ATOM 722 CB GLU A 46 -9.231 -10.699 9.861 1.00 0.00 C ATOM 723 CG GLU A 46 -8.860 -11.324 11.196 1.00 0.00 C ATOM 724 CD GLU A 46 -9.105 -10.390 12.365 1.00 0.00 C ATOM 725 OE1 GLU A 46 -8.392 -9.369 12.467 1.00 0.00 O ATOM 726 OE2 GLU A 46 -10.008 -10.679 13.177 1.00 0.00 O ATOM 0 H GLU A 46 -7.399 -11.945 8.780 1.00 0.00 H new ATOM 0 HA GLU A 46 -10.089 -12.539 9.154 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -8.430 -10.029 9.548 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -10.125 -10.089 9.991 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -9.437 -12.237 11.338 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -7.809 -11.611 11.179 1.00 0.00 H new ATOM 733 N SER A 47 -9.559 -10.861 6.488 1.00 0.00 N ATOM 734 CA SER A 47 -10.169 -10.241 5.318 1.00 0.00 C ATOM 735 C SER A 47 -9.871 -11.047 4.058 1.00 0.00 C ATOM 736 O SER A 47 -9.091 -11.998 4.086 1.00 0.00 O ATOM 737 CB SER A 47 -9.663 -8.807 5.152 1.00 0.00 C ATOM 738 OG SER A 47 -10.284 -7.936 6.082 1.00 0.00 O ATOM 0 H SER A 47 -8.577 -11.111 6.368 1.00 0.00 H new ATOM 0 HA SER A 47 -11.248 -10.222 5.469 1.00 0.00 H new ATOM 0 HB2 SER A 47 -8.582 -8.781 5.291 1.00 0.00 H new ATOM 0 HB3 SER A 47 -9.863 -8.463 4.137 1.00 0.00 H new ATOM 0 HG SER A 47 -10.929 -7.365 5.615 1.00 0.00 H new ATOM 744 N SER A 48 -10.499 -10.658 2.952 1.00 0.00 N ATOM 745 CA SER A 48 -10.305 -11.346 1.681 1.00 0.00 C ATOM 746 C SER A 48 -8.951 -10.994 1.074 1.00 0.00 C ATOM 747 O SER A 48 -8.127 -11.872 0.816 1.00 0.00 O ATOM 748 CB SER A 48 -11.425 -10.982 0.704 1.00 0.00 C ATOM 749 OG SER A 48 -12.511 -11.886 0.814 1.00 0.00 O ATOM 0 H SER A 48 -11.146 -9.871 2.911 1.00 0.00 H new ATOM 0 HA SER A 48 -10.331 -12.419 1.869 1.00 0.00 H new ATOM 0 HB2 SER A 48 -11.770 -9.968 0.903 1.00 0.00 H new ATOM 0 HB3 SER A 48 -11.040 -10.993 -0.316 1.00 0.00 H new ATOM 0 HG SER A 48 -13.214 -11.631 0.181 1.00 0.00 H new ATOM 755 N ILE A 49 -8.728 -9.703 0.849 1.00 0.00 N ATOM 756 CA ILE A 49 -7.474 -9.234 0.274 1.00 0.00 C ATOM 757 C ILE A 49 -6.905 -8.066 1.072 1.00 0.00 C ATOM 758 O ILE A 49 -7.573 -7.515 1.948 1.00 0.00 O ATOM 759 CB ILE A 49 -7.655 -8.799 -1.193 1.00 0.00 C ATOM 760 CG1 ILE A 49 -8.556 -9.789 -1.934 1.00 0.00 C ATOM 761 CG2 ILE A 49 -6.304 -8.685 -1.882 1.00 0.00 C ATOM 762 CD1 ILE A 49 -9.072 -9.264 -3.256 1.00 0.00 C ATOM 0 H ILE A 49 -9.400 -8.964 1.056 1.00 0.00 H new ATOM 0 HA ILE A 49 -6.777 -10.071 0.313 1.00 0.00 H new ATOM 0 HB ILE A 49 -8.133 -7.820 -1.210 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -8.002 -10.711 -2.110 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -9.404 -10.043 -1.297 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -6.449 -8.377 -2.918 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -5.693 -7.945 -1.365 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -5.801 -9.651 -1.858 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -9.703 -10.018 -3.726 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -9.654 -8.358 -3.086 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -8.231 -9.037 -3.911 1.00 0.00 H new ATOM 774 N VAL A 50 -5.668 -7.692 0.764 1.00 0.00 N ATOM 775 CA VAL A 50 -5.009 -6.587 1.451 1.00 0.00 C ATOM 776 C VAL A 50 -4.346 -5.640 0.457 1.00 0.00 C ATOM 777 O VAL A 50 -3.273 -5.930 -0.071 1.00 0.00 O ATOM 778 CB VAL A 50 -3.949 -7.096 2.445 1.00 0.00 C ATOM 779 CG1 VAL A 50 -3.231 -5.929 3.105 1.00 0.00 C ATOM 780 CG2 VAL A 50 -4.588 -8.000 3.489 1.00 0.00 C ATOM 0 H VAL A 50 -5.101 -8.138 0.043 1.00 0.00 H new ATOM 0 HA VAL A 50 -5.782 -6.049 2.000 1.00 0.00 H new ATOM 0 HB VAL A 50 -3.211 -7.680 1.895 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -2.486 -6.309 3.804 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -2.739 -5.326 2.342 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -3.953 -5.315 3.643 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -3.824 -8.351 4.183 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -5.348 -7.443 4.037 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -5.050 -8.855 2.996 1.00 0.00 H new ATOM 790 N TYR A 51 -4.991 -4.506 0.209 1.00 0.00 N ATOM 791 CA TYR A 51 -4.465 -3.515 -0.723 1.00 0.00 C ATOM 792 C TYR A 51 -3.423 -2.630 -0.046 1.00 0.00 C ATOM 793 O TYR A 51 -3.646 -2.117 1.052 1.00 0.00 O ATOM 794 CB TYR A 51 -5.600 -2.653 -1.278 1.00 0.00 C ATOM 795 CG TYR A 51 -6.391 -3.328 -2.376 1.00 0.00 C ATOM 796 CD1 TYR A 51 -5.750 -3.951 -3.439 1.00 0.00 C ATOM 797 CD2 TYR A 51 -7.780 -3.342 -2.349 1.00 0.00 C ATOM 798 CE1 TYR A 51 -6.470 -4.568 -4.445 1.00 0.00 C ATOM 799 CE2 TYR A 51 -8.508 -3.958 -3.349 1.00 0.00 C ATOM 800 CZ TYR A 51 -7.848 -4.569 -4.395 1.00 0.00 C ATOM 801 OH TYR A 51 -8.568 -5.183 -5.394 1.00 0.00 O ATOM 0 H TYR A 51 -5.879 -4.250 0.640 1.00 0.00 H new ATOM 0 HA TYR A 51 -3.985 -4.046 -1.546 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -6.276 -2.389 -0.465 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -5.184 -1.722 -1.662 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -4.671 -3.953 -3.480 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -8.300 -2.863 -1.532 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -5.956 -5.047 -5.266 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -9.587 -3.961 -3.312 1.00 0.00 H new ATOM 0 HH TYR A 51 -9.526 -5.095 -5.208 1.00 0.00 H new ATOM 811 N LEU A 52 -2.285 -2.455 -0.708 1.00 0.00 N ATOM 812 CA LEU A 52 -1.207 -1.631 -0.172 1.00 0.00 C ATOM 813 C LEU A 52 -0.760 -0.589 -1.193 1.00 0.00 C ATOM 814 O LEU A 52 -0.161 -0.923 -2.215 1.00 0.00 O ATOM 815 CB LEU A 52 -0.021 -2.508 0.231 1.00 0.00 C ATOM 816 CG LEU A 52 -0.363 -3.799 0.976 1.00 0.00 C ATOM 817 CD1 LEU A 52 0.788 -4.789 0.885 1.00 0.00 C ATOM 818 CD2 LEU A 52 -0.702 -3.503 2.429 1.00 0.00 C ATOM 0 H LEU A 52 -2.085 -2.873 -1.617 1.00 0.00 H new ATOM 0 HA LEU A 52 -1.583 -1.112 0.710 1.00 0.00 H new ATOM 0 HB2 LEU A 52 0.535 -2.768 -0.670 1.00 0.00 H new ATOM 0 HB3 LEU A 52 0.646 -1.916 0.858 1.00 0.00 H new ATOM 0 HG LEU A 52 -1.238 -4.247 0.505 1.00 0.00 H new ATOM 0 HD11 LEU A 52 0.526 -5.701 1.421 1.00 0.00 H new ATOM 0 HD12 LEU A 52 0.983 -5.026 -0.161 1.00 0.00 H new ATOM 0 HD13 LEU A 52 1.681 -4.350 1.330 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -0.943 -4.433 2.943 1.00 0.00 H new ATOM 0 HD22 LEU A 52 0.153 -3.031 2.913 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -1.560 -2.832 2.473 1.00 0.00 H new ATOM 830 N VAL A 53 -1.052 0.676 -0.906 1.00 0.00 N ATOM 831 CA VAL A 53 -0.677 1.768 -1.797 1.00 0.00 C ATOM 832 C VAL A 53 0.705 2.311 -1.449 1.00 0.00 C ATOM 833 O VAL A 53 0.859 3.085 -0.504 1.00 0.00 O ATOM 834 CB VAL A 53 -1.699 2.918 -1.736 1.00 0.00 C ATOM 835 CG1 VAL A 53 -1.265 4.067 -2.633 1.00 0.00 C ATOM 836 CG2 VAL A 53 -3.084 2.421 -2.124 1.00 0.00 C ATOM 0 H VAL A 53 -1.547 0.970 -0.064 1.00 0.00 H new ATOM 0 HA VAL A 53 -0.660 1.361 -2.808 1.00 0.00 H new ATOM 0 HB VAL A 53 -1.744 3.287 -0.711 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -2.000 4.870 -2.577 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -0.295 4.439 -2.304 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -1.189 3.716 -3.662 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -3.794 3.247 -2.075 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -3.057 2.025 -3.139 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -3.394 1.635 -1.436 1.00 0.00 H new ATOM 846 N PHE A 54 1.707 1.901 -2.219 1.00 0.00 N ATOM 847 CA PHE A 54 3.077 2.346 -1.992 1.00 0.00 C ATOM 848 C PHE A 54 3.354 3.652 -2.732 1.00 0.00 C ATOM 849 O PHE A 54 2.935 3.831 -3.876 1.00 0.00 O ATOM 850 CB PHE A 54 4.066 1.271 -2.445 1.00 0.00 C ATOM 851 CG PHE A 54 3.778 -0.088 -1.873 1.00 0.00 C ATOM 852 CD1 PHE A 54 2.817 -0.906 -2.445 1.00 0.00 C ATOM 853 CD2 PHE A 54 4.468 -0.547 -0.762 1.00 0.00 C ATOM 854 CE1 PHE A 54 2.550 -2.157 -1.921 1.00 0.00 C ATOM 855 CE2 PHE A 54 4.205 -1.797 -0.234 1.00 0.00 C ATOM 856 CZ PHE A 54 3.244 -2.602 -0.814 1.00 0.00 C ATOM 0 H PHE A 54 1.596 1.261 -3.006 1.00 0.00 H new ATOM 0 HA PHE A 54 3.204 2.520 -0.923 1.00 0.00 H new ATOM 0 HB2 PHE A 54 4.050 1.209 -3.533 1.00 0.00 H new ATOM 0 HB3 PHE A 54 5.074 1.571 -2.158 1.00 0.00 H new ATOM 0 HD1 PHE A 54 2.270 -0.562 -3.310 1.00 0.00 H new ATOM 0 HD2 PHE A 54 5.219 0.079 -0.304 1.00 0.00 H new ATOM 0 HE1 PHE A 54 1.799 -2.785 -2.377 1.00 0.00 H new ATOM 0 HE2 PHE A 54 4.750 -2.144 0.631 1.00 0.00 H new ATOM 0 HZ PHE A 54 3.036 -3.578 -0.402 1.00 0.00 H new ATOM 866 N SER A 55 4.062 4.561 -2.070 1.00 0.00 N ATOM 867 CA SER A 55 4.392 5.852 -2.662 1.00 0.00 C ATOM 868 C SER A 55 5.668 6.421 -2.049 1.00 0.00 C ATOM 869 O SER A 55 5.692 6.803 -0.879 1.00 0.00 O ATOM 870 CB SER A 55 3.237 6.836 -2.468 1.00 0.00 C ATOM 871 OG SER A 55 3.297 7.888 -3.416 1.00 0.00 O ATOM 0 H SER A 55 4.418 4.427 -1.124 1.00 0.00 H new ATOM 0 HA SER A 55 4.558 5.703 -3.729 1.00 0.00 H new ATOM 0 HB2 SER A 55 2.287 6.310 -2.564 1.00 0.00 H new ATOM 0 HB3 SER A 55 3.272 7.249 -1.460 1.00 0.00 H new ATOM 0 HG SER A 55 2.547 8.502 -3.271 1.00 0.00 H new ATOM 877 N VAL A 56 6.729 6.474 -2.849 1.00 0.00 N ATOM 878 CA VAL A 56 8.009 6.997 -2.387 1.00 0.00 C ATOM 879 C VAL A 56 7.905 8.477 -2.040 1.00 0.00 C ATOM 880 O VAL A 56 7.290 9.254 -2.770 1.00 0.00 O ATOM 881 CB VAL A 56 9.109 6.805 -3.448 1.00 0.00 C ATOM 882 CG1 VAL A 56 10.422 7.408 -2.971 1.00 0.00 C ATOM 883 CG2 VAL A 56 9.279 5.330 -3.778 1.00 0.00 C ATOM 0 H VAL A 56 6.727 6.161 -3.820 1.00 0.00 H new ATOM 0 HA VAL A 56 8.276 6.436 -1.492 1.00 0.00 H new ATOM 0 HB VAL A 56 8.807 7.325 -4.357 1.00 0.00 H new ATOM 0 HG11 VAL A 56 11.187 7.263 -3.733 1.00 0.00 H new ATOM 0 HG12 VAL A 56 10.288 8.474 -2.790 1.00 0.00 H new ATOM 0 HG13 VAL A 56 10.733 6.919 -2.048 1.00 0.00 H new ATOM 0 HG21 VAL A 56 10.060 5.213 -4.529 1.00 0.00 H new ATOM 0 HG22 VAL A 56 9.558 4.785 -2.876 1.00 0.00 H new ATOM 0 HG23 VAL A 56 8.341 4.933 -4.165 1.00 0.00 H new ATOM 893 N GLN A 57 8.511 8.861 -0.921 1.00 0.00 N ATOM 894 CA GLN A 57 8.486 10.250 -0.477 1.00 0.00 C ATOM 895 C GLN A 57 9.045 11.175 -1.553 1.00 0.00 C ATOM 896 O GLN A 57 8.497 12.247 -1.810 1.00 0.00 O ATOM 897 CB GLN A 57 9.289 10.409 0.815 1.00 0.00 C ATOM 898 CG GLN A 57 8.515 10.020 2.064 1.00 0.00 C ATOM 899 CD GLN A 57 7.407 11.000 2.393 1.00 0.00 C ATOM 900 OE1 GLN A 57 6.262 10.826 1.973 1.00 0.00 O ATOM 901 NE2 GLN A 57 7.741 12.040 3.149 1.00 0.00 N ATOM 0 H GLN A 57 9.025 8.230 -0.306 1.00 0.00 H new ATOM 0 HA GLN A 57 7.449 10.526 -0.288 1.00 0.00 H new ATOM 0 HB2 GLN A 57 10.190 9.798 0.751 1.00 0.00 H new ATOM 0 HB3 GLN A 57 9.613 11.446 0.906 1.00 0.00 H new ATOM 0 HG2 GLN A 57 8.087 9.027 1.927 1.00 0.00 H new ATOM 0 HG3 GLN A 57 9.202 9.958 2.908 1.00 0.00 H new ATOM 0 HE21 GLN A 57 8.702 12.146 3.476 1.00 0.00 H new ATOM 0 HE22 GLN A 57 7.037 12.733 3.403 1.00 0.00 H new ATOM 935 N HIS A 61 4.085 11.341 -7.837 1.00 0.00 N ATOM 936 CA HIS A 61 2.934 10.500 -8.149 1.00 0.00 C ATOM 937 C HIS A 61 2.927 9.246 -7.281 1.00 0.00 C ATOM 938 O HIS A 61 3.886 8.972 -6.559 1.00 0.00 O ATOM 939 CB HIS A 61 2.946 10.112 -9.628 1.00 0.00 C ATOM 940 CG HIS A 61 2.796 11.278 -10.555 1.00 0.00 C ATOM 941 ND1 HIS A 61 3.356 12.514 -10.307 1.00 0.00 N ATOM 942 CD2 HIS A 61 2.147 11.392 -11.737 1.00 0.00 C ATOM 943 CE1 HIS A 61 3.055 13.337 -11.295 1.00 0.00 C ATOM 944 NE2 HIS A 61 2.322 12.681 -12.176 1.00 0.00 N ATOM 0 HA HIS A 61 2.029 11.071 -7.939 1.00 0.00 H new ATOM 0 HB2 HIS A 61 3.881 9.598 -9.853 1.00 0.00 H new ATOM 0 HB3 HIS A 61 2.139 9.403 -9.816 1.00 0.00 H new ATOM 0 HD1 HIS A 61 3.915 12.755 -9.489 1.00 0.00 H new ATOM 0 HD2 HIS A 61 1.594 10.613 -12.241 1.00 0.00 H new ATOM 0 HE1 HIS A 61 3.357 14.371 -11.370 1.00 0.00 H new ATOM 952 N PHE A 62 1.838 8.487 -7.356 1.00 0.00 N ATOM 953 CA PHE A 62 1.705 7.262 -6.576 1.00 0.00 C ATOM 954 C PHE A 62 2.413 6.099 -7.264 1.00 0.00 C ATOM 955 O PHE A 62 1.954 5.600 -8.291 1.00 0.00 O ATOM 956 CB PHE A 62 0.228 6.923 -6.368 1.00 0.00 C ATOM 957 CG PHE A 62 -0.369 7.566 -5.148 1.00 0.00 C ATOM 958 CD1 PHE A 62 -0.338 6.920 -3.923 1.00 0.00 C ATOM 959 CD2 PHE A 62 -0.962 8.816 -5.228 1.00 0.00 C ATOM 960 CE1 PHE A 62 -0.886 7.509 -2.799 1.00 0.00 C ATOM 961 CE2 PHE A 62 -1.511 9.410 -4.107 1.00 0.00 C ATOM 962 CZ PHE A 62 -1.474 8.755 -2.891 1.00 0.00 C ATOM 0 H PHE A 62 1.035 8.699 -7.949 1.00 0.00 H new ATOM 0 HA PHE A 62 2.173 7.426 -5.606 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -0.336 7.236 -7.247 1.00 0.00 H new ATOM 0 HB3 PHE A 62 0.119 5.841 -6.289 1.00 0.00 H new ATOM 0 HD1 PHE A 62 0.120 5.945 -3.845 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -0.996 9.332 -6.176 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -0.854 6.995 -1.850 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -1.969 10.385 -4.182 1.00 0.00 H new ATOM 0 HZ PHE A 62 -1.904 9.217 -2.014 1.00 0.00 H new ATOM 972 N GLN A 63 3.534 5.674 -6.690 1.00 0.00 N ATOM 973 CA GLN A 63 4.307 4.571 -7.249 1.00 0.00 C ATOM 974 C GLN A 63 3.398 3.404 -7.624 1.00 0.00 C ATOM 975 O GLN A 63 3.762 2.558 -8.439 1.00 0.00 O ATOM 976 CB GLN A 63 5.367 4.105 -6.249 1.00 0.00 C ATOM 977 CG GLN A 63 6.705 4.809 -6.410 1.00 0.00 C ATOM 978 CD GLN A 63 6.557 6.246 -6.871 1.00 0.00 C ATOM 979 OE1 GLN A 63 7.072 6.629 -7.922 1.00 0.00 O ATOM 980 NE2 GLN A 63 5.850 7.050 -6.085 1.00 0.00 N ATOM 0 H GLN A 63 3.927 6.076 -5.839 1.00 0.00 H new ATOM 0 HA GLN A 63 4.801 4.928 -8.152 1.00 0.00 H new ATOM 0 HB2 GLN A 63 4.998 4.271 -5.237 1.00 0.00 H new ATOM 0 HB3 GLN A 63 5.515 3.031 -6.362 1.00 0.00 H new ATOM 0 HG2 GLN A 63 7.238 4.790 -5.459 1.00 0.00 H new ATOM 0 HG3 GLN A 63 7.315 4.262 -7.129 1.00 0.00 H new ATOM 0 HE21 GLN A 63 5.441 6.690 -5.223 1.00 0.00 H new ATOM 0 HE22 GLN A 63 5.716 8.028 -6.344 1.00 0.00 H new ATOM 989 N GLY A 64 2.213 3.366 -7.021 1.00 0.00 N ATOM 990 CA GLY A 64 1.271 2.299 -7.304 1.00 0.00 C ATOM 991 C GLY A 64 0.909 1.502 -6.067 1.00 0.00 C ATOM 992 O GLY A 64 1.430 1.757 -4.981 1.00 0.00 O ATOM 0 H GLY A 64 1.889 4.055 -6.342 1.00 0.00 H new ATOM 0 HA2 GLY A 64 0.365 2.724 -7.737 1.00 0.00 H new ATOM 0 HA3 GLY A 64 1.698 1.630 -8.051 1.00 0.00 H new ATOM 996 N PHE A 65 0.012 0.535 -6.230 1.00 0.00 N ATOM 997 CA PHE A 65 -0.422 -0.300 -5.116 1.00 0.00 C ATOM 998 C PHE A 65 -0.227 -1.779 -5.437 1.00 0.00 C ATOM 999 O PHE A 65 0.007 -2.150 -6.587 1.00 0.00 O ATOM 1000 CB PHE A 65 -1.891 -0.028 -4.789 1.00 0.00 C ATOM 1001 CG PHE A 65 -2.850 -0.700 -5.730 1.00 0.00 C ATOM 1002 CD1 PHE A 65 -3.081 -0.180 -6.993 1.00 0.00 C ATOM 1003 CD2 PHE A 65 -3.519 -1.853 -5.351 1.00 0.00 C ATOM 1004 CE1 PHE A 65 -3.963 -0.796 -7.860 1.00 0.00 C ATOM 1005 CE2 PHE A 65 -4.402 -2.474 -6.214 1.00 0.00 C ATOM 1006 CZ PHE A 65 -4.624 -1.945 -7.471 1.00 0.00 C ATOM 0 H PHE A 65 -0.428 0.310 -7.122 1.00 0.00 H new ATOM 0 HA PHE A 65 0.189 -0.050 -4.248 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -2.097 -0.364 -3.773 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -2.067 1.048 -4.811 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -2.566 0.717 -7.303 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -3.348 -2.271 -4.370 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -4.136 -0.379 -8.841 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -4.918 -3.372 -5.906 1.00 0.00 H new ATOM 0 HZ PHE A 65 -5.313 -2.429 -8.148 1.00 0.00 H new ATOM 1016 N SER A 66 -0.324 -2.619 -4.412 1.00 0.00 N ATOM 1017 CA SER A 66 -0.153 -4.057 -4.583 1.00 0.00 C ATOM 1018 C SER A 66 -0.923 -4.826 -3.513 1.00 0.00 C ATOM 1019 O SER A 66 -0.833 -4.517 -2.325 1.00 0.00 O ATOM 1020 CB SER A 66 1.330 -4.427 -4.525 1.00 0.00 C ATOM 1021 OG SER A 66 2.117 -3.495 -5.246 1.00 0.00 O ATOM 0 H SER A 66 -0.520 -2.329 -3.454 1.00 0.00 H new ATOM 0 HA SER A 66 -0.550 -4.331 -5.560 1.00 0.00 H new ATOM 0 HB2 SER A 66 1.660 -4.459 -3.487 1.00 0.00 H new ATOM 0 HB3 SER A 66 1.475 -5.426 -4.937 1.00 0.00 H new ATOM 0 HG SER A 66 2.703 -3.974 -5.869 1.00 0.00 H new ATOM 1027 N ARG A 67 -1.680 -5.830 -3.945 1.00 0.00 N ATOM 1028 CA ARG A 67 -2.467 -6.643 -3.026 1.00 0.00 C ATOM 1029 C ARG A 67 -1.622 -7.769 -2.436 1.00 0.00 C ATOM 1030 O ARG A 67 -1.003 -8.542 -3.166 1.00 0.00 O ATOM 1031 CB ARG A 67 -3.684 -7.229 -3.744 1.00 0.00 C ATOM 1032 CG ARG A 67 -3.326 -8.147 -4.901 1.00 0.00 C ATOM 1033 CD ARG A 67 -4.569 -8.740 -5.546 1.00 0.00 C ATOM 1034 NE ARG A 67 -4.248 -9.868 -6.416 1.00 0.00 N ATOM 1035 CZ ARG A 67 -5.130 -10.796 -6.772 1.00 0.00 C ATOM 1036 NH1 ARG A 67 -6.380 -10.730 -6.335 1.00 0.00 N ATOM 1037 NH2 ARG A 67 -4.762 -11.792 -7.567 1.00 0.00 N ATOM 0 H ARG A 67 -1.765 -6.099 -4.925 1.00 0.00 H new ATOM 0 HA ARG A 67 -2.807 -6.001 -2.213 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -4.287 -7.783 -3.025 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -4.303 -6.413 -4.117 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -2.758 -7.590 -5.646 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -2.682 -8.950 -4.544 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -5.260 -9.067 -4.769 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -5.080 -7.970 -6.124 1.00 0.00 H new ATOM 0 HE ARG A 67 -3.295 -9.948 -6.770 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -6.667 -9.965 -5.724 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -7.055 -11.444 -6.610 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -3.801 -11.846 -7.906 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -5.440 -12.504 -7.840 1.00 0.00 H new ATOM 1051 N MET A 68 -1.600 -7.852 -1.109 1.00 0.00 N ATOM 1052 CA MET A 68 -0.832 -8.883 -0.421 1.00 0.00 C ATOM 1053 C MET A 68 -1.190 -10.270 -0.947 1.00 0.00 C ATOM 1054 O MET A 68 -2.348 -10.683 -0.895 1.00 0.00 O ATOM 1055 CB MET A 68 -1.082 -8.815 1.086 1.00 0.00 C ATOM 1056 CG MET A 68 0.096 -9.291 1.920 1.00 0.00 C ATOM 1057 SD MET A 68 0.107 -8.578 3.577 1.00 0.00 S ATOM 1058 CE MET A 68 0.329 -10.048 4.576 1.00 0.00 C ATOM 0 H MET A 68 -2.105 -7.218 -0.490 1.00 0.00 H new ATOM 0 HA MET A 68 0.226 -8.703 -0.614 1.00 0.00 H new ATOM 0 HB2 MET A 68 -1.319 -7.787 1.361 1.00 0.00 H new ATOM 0 HB3 MET A 68 -1.956 -9.419 1.329 1.00 0.00 H new ATOM 0 HG2 MET A 68 0.066 -10.378 1.997 1.00 0.00 H new ATOM 0 HG3 MET A 68 1.025 -9.032 1.411 1.00 0.00 H new ATOM 0 HE1 MET A 68 0.772 -9.774 5.533 1.00 0.00 H new ATOM 0 HE2 MET A 68 -0.638 -10.522 4.746 1.00 0.00 H new ATOM 0 HE3 MET A 68 0.988 -10.744 4.057 1.00 0.00 H new ATOM 1068 N SER A 69 -0.189 -10.983 -1.452 1.00 0.00 N ATOM 1069 CA SER A 69 -0.400 -12.322 -1.991 1.00 0.00 C ATOM 1070 C SER A 69 -0.028 -13.386 -0.962 1.00 0.00 C ATOM 1071 O SER A 69 -0.662 -14.438 -0.885 1.00 0.00 O ATOM 1072 CB SER A 69 0.425 -12.518 -3.265 1.00 0.00 C ATOM 1073 OG SER A 69 0.365 -13.862 -3.708 1.00 0.00 O ATOM 0 H SER A 69 0.776 -10.656 -1.499 1.00 0.00 H new ATOM 0 HA SER A 69 -1.458 -12.428 -2.232 1.00 0.00 H new ATOM 0 HB2 SER A 69 0.054 -11.857 -4.048 1.00 0.00 H new ATOM 0 HB3 SER A 69 1.462 -12.239 -3.077 1.00 0.00 H new ATOM 0 HG SER A 69 0.899 -13.962 -4.524 1.00 0.00 H new ATOM 1079 N SER A 70 1.005 -13.103 -0.174 1.00 0.00 N ATOM 1080 CA SER A 70 1.465 -14.036 0.847 1.00 0.00 C ATOM 1081 C SER A 70 1.551 -13.352 2.209 1.00 0.00 C ATOM 1082 O SER A 70 1.679 -12.132 2.294 1.00 0.00 O ATOM 1083 CB SER A 70 2.830 -14.611 0.465 1.00 0.00 C ATOM 1084 OG SER A 70 3.096 -15.808 1.176 1.00 0.00 O ATOM 0 H SER A 70 1.539 -12.235 -0.224 1.00 0.00 H new ATOM 0 HA SER A 70 0.742 -14.849 0.913 1.00 0.00 H new ATOM 0 HB2 SER A 70 2.859 -14.807 -0.607 1.00 0.00 H new ATOM 0 HB3 SER A 70 3.609 -13.878 0.676 1.00 0.00 H new ATOM 0 HG SER A 70 4.030 -16.071 1.037 1.00 0.00 H new ATOM 1090 N GLU A 71 1.479 -14.149 3.270 1.00 0.00 N ATOM 1091 CA GLU A 71 1.548 -13.621 4.627 1.00 0.00 C ATOM 1092 C GLU A 71 2.980 -13.238 4.990 1.00 0.00 C ATOM 1093 O GLU A 71 3.905 -13.435 4.201 1.00 0.00 O ATOM 1094 CB GLU A 71 1.016 -14.650 5.627 1.00 0.00 C ATOM 1095 CG GLU A 71 1.761 -15.974 5.593 1.00 0.00 C ATOM 1096 CD GLU A 71 2.934 -16.008 6.553 1.00 0.00 C ATOM 1097 OE1 GLU A 71 2.703 -16.217 7.763 1.00 0.00 O ATOM 1098 OE2 GLU A 71 4.081 -15.825 6.096 1.00 0.00 O ATOM 0 H GLU A 71 1.373 -15.162 3.216 1.00 0.00 H new ATOM 0 HA GLU A 71 0.927 -12.726 4.672 1.00 0.00 H new ATOM 0 HB2 GLU A 71 1.079 -14.233 6.632 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -0.039 -14.831 5.422 1.00 0.00 H new ATOM 0 HG2 GLU A 71 1.071 -16.781 5.839 1.00 0.00 H new ATOM 0 HG3 GLU A 71 2.120 -16.159 4.580 1.00 0.00 H new ATOM 1105 N ILE A 72 3.154 -12.689 6.187 1.00 0.00 N ATOM 1106 CA ILE A 72 4.472 -12.278 6.654 1.00 0.00 C ATOM 1107 C ILE A 72 5.121 -13.370 7.498 1.00 0.00 C ATOM 1108 O ILE A 72 4.503 -13.912 8.413 1.00 0.00 O ATOM 1109 CB ILE A 72 4.397 -10.982 7.483 1.00 0.00 C ATOM 1110 CG1 ILE A 72 3.727 -9.871 6.672 1.00 0.00 C ATOM 1111 CG2 ILE A 72 5.789 -10.556 7.927 1.00 0.00 C ATOM 1112 CD1 ILE A 72 3.311 -8.680 7.507 1.00 0.00 C ATOM 0 H ILE A 72 2.399 -12.518 6.851 1.00 0.00 H new ATOM 0 HA ILE A 72 5.079 -12.098 5.767 1.00 0.00 H new ATOM 0 HB ILE A 72 3.795 -11.171 8.372 1.00 0.00 H new ATOM 0 HG12 ILE A 72 4.413 -9.537 5.893 1.00 0.00 H new ATOM 0 HG13 ILE A 72 2.849 -10.277 6.171 1.00 0.00 H new ATOM 0 HG21 ILE A 72 5.720 -9.639 8.512 1.00 0.00 H new ATOM 0 HG22 ILE A 72 6.233 -11.343 8.537 1.00 0.00 H new ATOM 0 HG23 ILE A 72 6.413 -10.381 7.050 1.00 0.00 H new ATOM 0 HD11 ILE A 72 2.843 -7.932 6.867 1.00 0.00 H new ATOM 0 HD12 ILE A 72 2.601 -9.000 8.269 1.00 0.00 H new ATOM 0 HD13 ILE A 72 4.189 -8.248 7.988 1.00 0.00 H new ATOM 1124 N GLY A 73 6.374 -13.688 7.183 1.00 0.00 N ATOM 1125 CA GLY A 73 7.087 -14.713 7.923 1.00 0.00 C ATOM 1126 C GLY A 73 7.995 -15.542 7.036 1.00 0.00 C ATOM 1127 O GLY A 73 9.088 -15.105 6.675 1.00 0.00 O ATOM 0 H GLY A 73 6.907 -13.254 6.429 1.00 0.00 H new ATOM 0 HA2 GLY A 73 7.680 -14.244 8.708 1.00 0.00 H new ATOM 0 HA3 GLY A 73 6.368 -15.368 8.415 1.00 0.00 H new ATOM 1131 N ARG A 74 7.542 -16.741 6.685 1.00 0.00 N ATOM 1132 CA ARG A 74 8.323 -17.634 5.837 1.00 0.00 C ATOM 1133 C ARG A 74 9.105 -16.845 4.792 1.00 0.00 C ATOM 1134 O ARG A 74 10.326 -16.970 4.692 1.00 0.00 O ATOM 1135 CB ARG A 74 7.407 -18.647 5.147 1.00 0.00 C ATOM 1136 CG ARG A 74 8.157 -19.722 4.378 1.00 0.00 C ATOM 1137 CD ARG A 74 8.797 -20.734 5.316 1.00 0.00 C ATOM 1138 NE ARG A 74 9.674 -21.661 4.606 1.00 0.00 N ATOM 1139 CZ ARG A 74 10.626 -22.372 5.199 1.00 0.00 C ATOM 1140 NH1 ARG A 74 10.822 -22.264 6.506 1.00 0.00 N ATOM 1141 NH2 ARG A 74 11.383 -23.195 4.485 1.00 0.00 N ATOM 0 H ARG A 74 6.639 -17.116 6.974 1.00 0.00 H new ATOM 0 HA ARG A 74 9.032 -18.168 6.470 1.00 0.00 H new ATOM 0 HB2 ARG A 74 6.775 -19.123 5.897 1.00 0.00 H new ATOM 0 HB3 ARG A 74 6.745 -18.118 4.462 1.00 0.00 H new ATOM 0 HG2 ARG A 74 7.471 -20.233 3.703 1.00 0.00 H new ATOM 0 HG3 ARG A 74 8.927 -19.259 3.760 1.00 0.00 H new ATOM 0 HD2 ARG A 74 9.369 -20.208 6.081 1.00 0.00 H new ATOM 0 HD3 ARG A 74 8.017 -21.295 5.830 1.00 0.00 H new ATOM 0 HE ARG A 74 9.548 -21.768 3.599 1.00 0.00 H new ATOM 0 HH11 ARG A 74 10.241 -21.634 7.058 1.00 0.00 H new ATOM 0 HH12 ARG A 74 11.554 -22.811 6.959 1.00 0.00 H new ATOM 0 HH21 ARG A 74 11.234 -23.282 3.480 1.00 0.00 H new ATOM 0 HH22 ARG A 74 12.114 -23.741 4.941 1.00 0.00 H new ATOM 1155 N GLU A 75 8.394 -16.034 4.015 1.00 0.00 N ATOM 1156 CA GLU A 75 9.023 -15.226 2.976 1.00 0.00 C ATOM 1157 C GLU A 75 10.134 -14.358 3.560 1.00 0.00 C ATOM 1158 O GLU A 75 9.989 -13.789 4.642 1.00 0.00 O ATOM 1159 CB GLU A 75 7.982 -14.344 2.285 1.00 0.00 C ATOM 1160 CG GLU A 75 8.504 -13.648 1.039 1.00 0.00 C ATOM 1161 CD GLU A 75 9.216 -14.598 0.095 1.00 0.00 C ATOM 1162 OE1 GLU A 75 8.618 -15.634 -0.265 1.00 0.00 O ATOM 1163 OE2 GLU A 75 10.370 -14.306 -0.282 1.00 0.00 O ATOM 0 H GLU A 75 7.383 -15.919 4.085 1.00 0.00 H new ATOM 0 HA GLU A 75 9.461 -15.902 2.242 1.00 0.00 H new ATOM 0 HB2 GLU A 75 7.121 -14.956 2.015 1.00 0.00 H new ATOM 0 HB3 GLU A 75 7.630 -13.592 2.991 1.00 0.00 H new ATOM 0 HG2 GLU A 75 7.672 -13.177 0.515 1.00 0.00 H new ATOM 0 HG3 GLU A 75 9.188 -12.852 1.332 1.00 0.00 H new ATOM 1170 N LYS A 76 11.244 -14.262 2.836 1.00 0.00 N ATOM 1171 CA LYS A 76 12.380 -13.463 3.280 1.00 0.00 C ATOM 1172 C LYS A 76 13.162 -12.920 2.088 1.00 0.00 C ATOM 1173 O LYS A 76 12.969 -13.360 0.954 1.00 0.00 O ATOM 1174 CB LYS A 76 13.303 -14.301 4.169 1.00 0.00 C ATOM 1175 CG LYS A 76 12.901 -14.300 5.634 1.00 0.00 C ATOM 1176 CD LYS A 76 13.320 -13.013 6.325 1.00 0.00 C ATOM 1177 CE LYS A 76 13.135 -13.105 7.832 1.00 0.00 C ATOM 1178 NZ LYS A 76 14.312 -13.728 8.498 1.00 0.00 N ATOM 0 H LYS A 76 11.381 -14.728 1.939 1.00 0.00 H new ATOM 0 HA LYS A 76 11.997 -12.621 3.856 1.00 0.00 H new ATOM 0 HB2 LYS A 76 13.311 -15.328 3.804 1.00 0.00 H new ATOM 0 HB3 LYS A 76 14.321 -13.923 4.080 1.00 0.00 H new ATOM 0 HG2 LYS A 76 11.821 -14.424 5.716 1.00 0.00 H new ATOM 0 HG3 LYS A 76 13.359 -15.151 6.139 1.00 0.00 H new ATOM 0 HD2 LYS A 76 14.365 -12.800 6.098 1.00 0.00 H new ATOM 0 HD3 LYS A 76 12.733 -12.181 5.935 1.00 0.00 H new ATOM 0 HE2 LYS A 76 12.973 -12.107 8.240 1.00 0.00 H new ATOM 0 HE3 LYS A 76 12.241 -13.689 8.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 14.147 -13.773 9.524 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 14.452 -14.690 8.128 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 15.161 -13.157 8.308 1.00 0.00 H new ATOM 1192 N SER A 77 14.046 -11.963 2.352 1.00 0.00 N ATOM 1193 CA SER A 77 14.855 -11.358 1.300 1.00 0.00 C ATOM 1194 C SER A 77 16.129 -10.750 1.877 1.00 0.00 C ATOM 1195 O SER A 77 16.268 -10.610 3.092 1.00 0.00 O ATOM 1196 CB SER A 77 14.052 -10.284 0.564 1.00 0.00 C ATOM 1197 OG SER A 77 14.526 -10.111 -0.760 1.00 0.00 O ATOM 0 H SER A 77 14.220 -11.590 3.285 1.00 0.00 H new ATOM 0 HA SER A 77 15.134 -12.141 0.594 1.00 0.00 H new ATOM 0 HB2 SER A 77 12.999 -10.564 0.543 1.00 0.00 H new ATOM 0 HB3 SER A 77 14.121 -9.340 1.104 1.00 0.00 H new ATOM 0 HG SER A 77 14.236 -9.239 -1.100 1.00 0.00 H new ATOM 1203 N GLN A 78 17.058 -10.391 0.996 1.00 0.00 N ATOM 1204 CA GLN A 78 18.322 -9.799 1.418 1.00 0.00 C ATOM 1205 C GLN A 78 18.414 -8.341 0.977 1.00 0.00 C ATOM 1206 O GLN A 78 18.608 -7.445 1.798 1.00 0.00 O ATOM 1207 CB GLN A 78 19.497 -10.592 0.845 1.00 0.00 C ATOM 1208 CG GLN A 78 20.765 -10.487 1.677 1.00 0.00 C ATOM 1209 CD GLN A 78 21.986 -11.014 0.949 1.00 0.00 C ATOM 1210 OE1 GLN A 78 22.533 -10.350 0.069 1.00 0.00 O ATOM 1211 NE2 GLN A 78 22.420 -12.215 1.314 1.00 0.00 N ATOM 0 H GLN A 78 16.959 -10.500 -0.013 1.00 0.00 H new ATOM 0 HA GLN A 78 18.365 -9.834 2.507 1.00 0.00 H new ATOM 0 HB2 GLN A 78 19.212 -11.641 0.764 1.00 0.00 H new ATOM 0 HB3 GLN A 78 19.705 -10.239 -0.165 1.00 0.00 H new ATOM 0 HG2 GLN A 78 20.931 -9.445 1.950 1.00 0.00 H new ATOM 0 HG3 GLN A 78 20.633 -11.042 2.606 1.00 0.00 H new ATOM 0 HE21 GLN A 78 21.936 -12.731 2.049 1.00 0.00 H new ATOM 0 HE22 GLN A 78 23.238 -12.622 0.860 1.00 0.00 H new ATOM 1220 N ASP A 79 18.274 -8.112 -0.324 1.00 0.00 N ATOM 1221 CA ASP A 79 18.341 -6.764 -0.874 1.00 0.00 C ATOM 1222 C ASP A 79 17.274 -5.869 -0.251 1.00 0.00 C ATOM 1223 O ASP A 79 16.084 -6.183 -0.294 1.00 0.00 O ATOM 1224 CB ASP A 79 18.169 -6.801 -2.394 1.00 0.00 C ATOM 1225 CG ASP A 79 18.895 -5.664 -3.086 1.00 0.00 C ATOM 1226 OD1 ASP A 79 20.035 -5.353 -2.681 1.00 0.00 O ATOM 1227 OD2 ASP A 79 18.324 -5.086 -4.035 1.00 0.00 O ATOM 0 H ASP A 79 18.113 -8.843 -1.017 1.00 0.00 H new ATOM 0 HA ASP A 79 19.321 -6.350 -0.637 1.00 0.00 H new ATOM 0 HB2 ASP A 79 18.541 -7.752 -2.776 1.00 0.00 H new ATOM 0 HB3 ASP A 79 17.108 -6.753 -2.638 1.00 0.00 H new ATOM 1232 N TRP A 80 17.708 -4.755 0.327 1.00 0.00 N ATOM 1233 CA TRP A 80 16.789 -3.815 0.961 1.00 0.00 C ATOM 1234 C TRP A 80 17.493 -2.503 1.288 1.00 0.00 C ATOM 1235 O TRP A 80 18.683 -2.487 1.601 1.00 0.00 O ATOM 1236 CB TRP A 80 16.202 -4.425 2.235 1.00 0.00 C ATOM 1237 CG TRP A 80 15.027 -5.319 1.978 1.00 0.00 C ATOM 1238 CD1 TRP A 80 14.851 -6.593 2.437 1.00 0.00 C ATOM 1239 CD2 TRP A 80 13.866 -5.006 1.201 1.00 0.00 C ATOM 1240 NE1 TRP A 80 13.650 -7.091 1.992 1.00 0.00 N ATOM 1241 CE2 TRP A 80 13.026 -6.137 1.233 1.00 0.00 C ATOM 1242 CE3 TRP A 80 13.452 -3.881 0.484 1.00 0.00 C ATOM 1243 CZ2 TRP A 80 11.801 -6.173 0.573 1.00 0.00 C ATOM 1244 CZ3 TRP A 80 12.235 -3.918 -0.171 1.00 0.00 C ATOM 1245 CH2 TRP A 80 11.421 -5.057 -0.122 1.00 0.00 C ATOM 0 H TRP A 80 18.689 -4.480 0.370 1.00 0.00 H new ATOM 0 HA TRP A 80 15.980 -3.607 0.261 1.00 0.00 H new ATOM 0 HB2 TRP A 80 16.977 -4.994 2.747 1.00 0.00 H new ATOM 0 HB3 TRP A 80 15.899 -3.622 2.907 1.00 0.00 H new ATOM 0 HD1 TRP A 80 15.552 -7.130 3.058 1.00 0.00 H new ATOM 0 HE1 TRP A 80 13.283 -8.021 2.194 1.00 0.00 H new ATOM 0 HE3 TRP A 80 14.072 -2.998 0.442 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 11.173 -7.051 0.608 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 11.906 -3.054 -0.730 1.00 0.00 H new ATOM 0 HH2 TRP A 80 10.475 -5.054 -0.643 1.00 0.00 H new ATOM 1291 N LEU A 85 14.670 -4.449 9.576 1.00 0.00 N ATOM 1292 CA LEU A 85 13.446 -5.140 9.185 1.00 0.00 C ATOM 1293 C LEU A 85 13.242 -6.401 10.019 1.00 0.00 C ATOM 1294 O LEU A 85 14.097 -6.771 10.823 1.00 0.00 O ATOM 1295 CB LEU A 85 13.492 -5.500 7.699 1.00 0.00 C ATOM 1296 CG LEU A 85 13.780 -4.346 6.738 1.00 0.00 C ATOM 1297 CD1 LEU A 85 14.275 -4.876 5.401 1.00 0.00 C ATOM 1298 CD2 LEU A 85 12.538 -3.488 6.547 1.00 0.00 C ATOM 0 HA LEU A 85 12.606 -4.468 9.364 1.00 0.00 H new ATOM 0 HB2 LEU A 85 14.254 -6.266 7.555 1.00 0.00 H new ATOM 0 HB3 LEU A 85 12.536 -5.946 7.424 1.00 0.00 H new ATOM 0 HG LEU A 85 14.563 -3.724 7.172 1.00 0.00 H new ATOM 0 HD11 LEU A 85 14.475 -4.041 4.730 1.00 0.00 H new ATOM 0 HD12 LEU A 85 15.191 -5.447 5.553 1.00 0.00 H new ATOM 0 HD13 LEU A 85 13.514 -5.521 4.961 1.00 0.00 H new ATOM 0 HD21 LEU A 85 12.762 -2.672 5.860 1.00 0.00 H new ATOM 0 HD22 LEU A 85 11.734 -4.098 6.136 1.00 0.00 H new ATOM 0 HD23 LEU A 85 12.227 -3.078 7.508 1.00 0.00 H new ATOM 1310 N GLY A 86 12.104 -7.059 9.821 1.00 0.00 N ATOM 1311 CA GLY A 86 11.810 -8.272 10.560 1.00 0.00 C ATOM 1312 C GLY A 86 10.548 -8.957 10.072 1.00 0.00 C ATOM 1313 O GLY A 86 9.485 -8.817 10.675 1.00 0.00 O ATOM 0 H GLY A 86 11.380 -6.773 9.162 1.00 0.00 H new ATOM 0 HA2 GLY A 86 12.651 -8.960 10.472 1.00 0.00 H new ATOM 0 HA3 GLY A 86 11.704 -8.032 11.618 1.00 0.00 H new ATOM 1317 N GLY A 87 10.665 -9.699 8.975 1.00 0.00 N ATOM 1318 CA GLY A 87 9.517 -10.395 8.424 1.00 0.00 C ATOM 1319 C GLY A 87 9.105 -9.852 7.070 1.00 0.00 C ATOM 1320 O GLY A 87 8.567 -8.749 6.973 1.00 0.00 O ATOM 0 H GLY A 87 11.534 -9.830 8.458 1.00 0.00 H new ATOM 0 HA2 GLY A 87 9.749 -11.456 8.331 1.00 0.00 H new ATOM 0 HA3 GLY A 87 8.679 -10.312 9.116 1.00 0.00 H new ATOM 1324 N VAL A 88 9.359 -10.628 6.021 1.00 0.00 N ATOM 1325 CA VAL A 88 9.011 -10.218 4.665 1.00 0.00 C ATOM 1326 C VAL A 88 7.756 -10.934 4.180 1.00 0.00 C ATOM 1327 O VAL A 88 7.330 -11.929 4.767 1.00 0.00 O ATOM 1328 CB VAL A 88 10.162 -10.500 3.681 1.00 0.00 C ATOM 1329 CG1 VAL A 88 9.813 -9.990 2.291 1.00 0.00 C ATOM 1330 CG2 VAL A 88 11.455 -9.871 4.180 1.00 0.00 C ATOM 0 H VAL A 88 9.804 -11.544 6.084 1.00 0.00 H new ATOM 0 HA VAL A 88 8.824 -9.145 4.697 1.00 0.00 H new ATOM 0 HB VAL A 88 10.309 -11.578 3.620 1.00 0.00 H new ATOM 0 HG11 VAL A 88 10.638 -10.198 1.609 1.00 0.00 H new ATOM 0 HG12 VAL A 88 8.913 -10.491 1.935 1.00 0.00 H new ATOM 0 HG13 VAL A 88 9.638 -8.915 2.331 1.00 0.00 H new ATOM 0 HG21 VAL A 88 12.258 -10.080 3.473 1.00 0.00 H new ATOM 0 HG22 VAL A 88 11.323 -8.793 4.271 1.00 0.00 H new ATOM 0 HG23 VAL A 88 11.711 -10.289 5.154 1.00 0.00 H new ATOM 1340 N PHE A 89 7.168 -10.422 3.104 1.00 0.00 N ATOM 1341 CA PHE A 89 5.960 -11.012 2.539 1.00 0.00 C ATOM 1342 C PHE A 89 5.825 -10.664 1.059 1.00 0.00 C ATOM 1343 O PHE A 89 6.288 -9.615 0.612 1.00 0.00 O ATOM 1344 CB PHE A 89 4.725 -10.528 3.303 1.00 0.00 C ATOM 1345 CG PHE A 89 4.446 -9.063 3.124 1.00 0.00 C ATOM 1346 CD1 PHE A 89 5.124 -8.118 3.877 1.00 0.00 C ATOM 1347 CD2 PHE A 89 3.506 -8.631 2.202 1.00 0.00 C ATOM 1348 CE1 PHE A 89 4.869 -6.770 3.714 1.00 0.00 C ATOM 1349 CE2 PHE A 89 3.246 -7.284 2.036 1.00 0.00 C ATOM 1350 CZ PHE A 89 3.929 -6.352 2.792 1.00 0.00 C ATOM 0 H PHE A 89 7.508 -9.600 2.606 1.00 0.00 H new ATOM 0 HA PHE A 89 6.036 -12.095 2.634 1.00 0.00 H new ATOM 0 HB2 PHE A 89 3.857 -11.098 2.973 1.00 0.00 H new ATOM 0 HB3 PHE A 89 4.859 -10.737 4.364 1.00 0.00 H new ATOM 0 HD1 PHE A 89 5.860 -8.439 4.599 1.00 0.00 H new ATOM 0 HD2 PHE A 89 2.970 -9.355 1.606 1.00 0.00 H new ATOM 0 HE1 PHE A 89 5.404 -6.043 4.307 1.00 0.00 H new ATOM 0 HE2 PHE A 89 2.509 -6.961 1.316 1.00 0.00 H new ATOM 0 HZ PHE A 89 3.729 -5.299 2.663 1.00 0.00 H new ATOM 1360 N LYS A 90 5.190 -11.554 0.305 1.00 0.00 N ATOM 1361 CA LYS A 90 4.993 -11.343 -1.125 1.00 0.00 C ATOM 1362 C LYS A 90 3.855 -10.360 -1.378 1.00 0.00 C ATOM 1363 O LYS A 90 2.977 -10.179 -0.534 1.00 0.00 O ATOM 1364 CB LYS A 90 4.695 -12.673 -1.821 1.00 0.00 C ATOM 1365 CG LYS A 90 5.938 -13.388 -2.323 1.00 0.00 C ATOM 1366 CD LYS A 90 5.625 -14.808 -2.763 1.00 0.00 C ATOM 1367 CE LYS A 90 5.564 -15.758 -1.577 1.00 0.00 C ATOM 1368 NZ LYS A 90 5.434 -17.177 -2.009 1.00 0.00 N ATOM 0 H LYS A 90 4.803 -12.428 0.660 1.00 0.00 H new ATOM 0 HA LYS A 90 5.911 -10.922 -1.535 1.00 0.00 H new ATOM 0 HB2 LYS A 90 4.166 -13.326 -1.127 1.00 0.00 H new ATOM 0 HB3 LYS A 90 4.026 -12.492 -2.662 1.00 0.00 H new ATOM 0 HG2 LYS A 90 6.366 -12.833 -3.158 1.00 0.00 H new ATOM 0 HG3 LYS A 90 6.691 -13.408 -1.535 1.00 0.00 H new ATOM 0 HD2 LYS A 90 4.673 -14.824 -3.293 1.00 0.00 H new ATOM 0 HD3 LYS A 90 6.386 -15.149 -3.465 1.00 0.00 H new ATOM 0 HE2 LYS A 90 6.464 -15.643 -0.973 1.00 0.00 H new ATOM 0 HE3 LYS A 90 4.718 -15.493 -0.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 5.396 -17.793 -1.172 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 4.562 -17.292 -2.564 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 6.253 -17.438 -2.594 1.00 0.00 H new ATOM 1382 N VAL A 91 3.875 -9.726 -2.547 1.00 0.00 N ATOM 1383 CA VAL A 91 2.843 -8.763 -2.912 1.00 0.00 C ATOM 1384 C VAL A 91 2.569 -8.793 -4.411 1.00 0.00 C ATOM 1385 O VAL A 91 3.477 -9.007 -5.213 1.00 0.00 O ATOM 1386 CB VAL A 91 3.241 -7.332 -2.503 1.00 0.00 C ATOM 1387 CG1 VAL A 91 3.160 -7.167 -0.993 1.00 0.00 C ATOM 1388 CG2 VAL A 91 4.637 -7.002 -3.010 1.00 0.00 C ATOM 0 H VAL A 91 4.595 -9.862 -3.257 1.00 0.00 H new ATOM 0 HA VAL A 91 1.939 -9.049 -2.374 1.00 0.00 H new ATOM 0 HB VAL A 91 2.540 -6.633 -2.959 1.00 0.00 H new ATOM 0 HG11 VAL A 91 3.445 -6.150 -0.722 1.00 0.00 H new ATOM 0 HG12 VAL A 91 2.140 -7.359 -0.660 1.00 0.00 H new ATOM 0 HG13 VAL A 91 3.837 -7.873 -0.513 1.00 0.00 H new ATOM 0 HG21 VAL A 91 4.902 -5.988 -2.712 1.00 0.00 H new ATOM 0 HG22 VAL A 91 5.354 -7.704 -2.584 1.00 0.00 H new ATOM 0 HG23 VAL A 91 4.657 -7.078 -4.097 1.00 0.00 H new ATOM 1398 N GLU A 92 1.311 -8.576 -4.782 1.00 0.00 N ATOM 1399 CA GLU A 92 0.918 -8.579 -6.186 1.00 0.00 C ATOM 1400 C GLU A 92 0.745 -7.155 -6.706 1.00 0.00 C ATOM 1401 O GLU A 92 -0.063 -6.387 -6.185 1.00 0.00 O ATOM 1402 CB GLU A 92 -0.383 -9.363 -6.373 1.00 0.00 C ATOM 1403 CG GLU A 92 -0.630 -9.800 -7.807 1.00 0.00 C ATOM 1404 CD GLU A 92 -0.153 -8.776 -8.819 1.00 0.00 C ATOM 1405 OE1 GLU A 92 1.032 -8.837 -9.210 1.00 0.00 O ATOM 1406 OE2 GLU A 92 -0.963 -7.915 -9.220 1.00 0.00 O ATOM 0 H GLU A 92 0.547 -8.396 -4.130 1.00 0.00 H new ATOM 0 HA GLU A 92 1.711 -9.062 -6.757 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -0.361 -10.244 -5.732 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -1.219 -8.748 -6.041 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -0.122 -10.747 -7.987 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -1.696 -9.978 -7.950 1.00 0.00 H new ATOM 1413 N TRP A 93 1.511 -6.810 -7.735 1.00 0.00 N ATOM 1414 CA TRP A 93 1.443 -5.478 -8.325 1.00 0.00 C ATOM 1415 C TRP A 93 0.388 -5.423 -9.424 1.00 0.00 C ATOM 1416 O TRP A 93 0.490 -6.125 -10.431 1.00 0.00 O ATOM 1417 CB TRP A 93 2.808 -5.079 -8.890 1.00 0.00 C ATOM 1418 CG TRP A 93 3.782 -4.642 -7.838 1.00 0.00 C ATOM 1419 CD1 TRP A 93 4.651 -5.436 -7.146 1.00 0.00 C ATOM 1420 CD2 TRP A 93 3.983 -3.309 -7.357 1.00 0.00 C ATOM 1421 NE1 TRP A 93 5.381 -4.676 -6.264 1.00 0.00 N ATOM 1422 CE2 TRP A 93 4.991 -3.368 -6.375 1.00 0.00 C ATOM 1423 CE3 TRP A 93 3.412 -2.070 -7.662 1.00 0.00 C ATOM 1424 CZ2 TRP A 93 5.437 -2.236 -5.697 1.00 0.00 C ATOM 1425 CZ3 TRP A 93 3.855 -0.948 -6.989 1.00 0.00 C ATOM 1426 CH2 TRP A 93 4.860 -1.037 -6.016 1.00 0.00 C ATOM 0 H TRP A 93 2.186 -7.434 -8.178 1.00 0.00 H new ATOM 0 HA TRP A 93 1.161 -4.774 -7.542 1.00 0.00 H new ATOM 0 HB2 TRP A 93 3.228 -5.924 -9.436 1.00 0.00 H new ATOM 0 HB3 TRP A 93 2.673 -4.271 -9.609 1.00 0.00 H new ATOM 0 HD1 TRP A 93 4.750 -6.504 -7.273 1.00 0.00 H new ATOM 0 HE1 TRP A 93 6.097 -5.029 -5.629 1.00 0.00 H new ATOM 0 HE3 TRP A 93 2.638 -1.991 -8.411 1.00 0.00 H new ATOM 0 HZ2 TRP A 93 6.211 -2.302 -4.946 1.00 0.00 H new ATOM 0 HZ3 TRP A 93 3.420 0.014 -7.216 1.00 0.00 H new ATOM 0 HH2 TRP A 93 5.185 -0.141 -5.508 1.00 0.00 H new ATOM 1437 N ILE A 94 -0.624 -4.584 -9.225 1.00 0.00 N ATOM 1438 CA ILE A 94 -1.696 -4.437 -10.201 1.00 0.00 C ATOM 1439 C ILE A 94 -1.376 -3.339 -11.209 1.00 0.00 C ATOM 1440 O ILE A 94 -1.467 -3.548 -12.419 1.00 0.00 O ATOM 1441 CB ILE A 94 -3.039 -4.115 -9.517 1.00 0.00 C ATOM 1442 CG1 ILE A 94 -3.319 -5.118 -8.396 1.00 0.00 C ATOM 1443 CG2 ILE A 94 -4.167 -4.123 -10.537 1.00 0.00 C ATOM 1444 CD1 ILE A 94 -2.583 -4.809 -7.111 1.00 0.00 C ATOM 0 H ILE A 94 -0.723 -3.996 -8.397 1.00 0.00 H new ATOM 0 HA ILE A 94 -1.781 -5.391 -10.722 1.00 0.00 H new ATOM 0 HB ILE A 94 -2.978 -3.119 -9.079 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -4.390 -5.137 -8.196 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -3.040 -6.116 -8.734 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -5.109 -3.894 -10.039 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -3.970 -3.373 -11.303 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -4.231 -5.107 -11.001 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -2.829 -5.561 -6.361 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -1.509 -4.818 -7.296 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -2.880 -3.825 -6.749 1.00 0.00 H new ATOM 1456 N ARG A 95 -0.998 -2.170 -10.702 1.00 0.00 N ATOM 1457 CA ARG A 95 -0.663 -1.039 -11.558 1.00 0.00 C ATOM 1458 C ARG A 95 0.698 -0.459 -11.186 1.00 0.00 C ATOM 1459 O ARG A 95 0.945 -0.120 -10.028 1.00 0.00 O ATOM 1460 CB ARG A 95 -1.737 0.045 -11.451 1.00 0.00 C ATOM 1461 CG ARG A 95 -3.138 -0.452 -11.769 1.00 0.00 C ATOM 1462 CD ARG A 95 -3.388 -0.490 -13.269 1.00 0.00 C ATOM 1463 NE ARG A 95 -2.683 -1.594 -13.914 1.00 0.00 N ATOM 1464 CZ ARG A 95 -2.341 -1.598 -15.197 1.00 0.00 C ATOM 1465 NH1 ARG A 95 -2.636 -0.561 -15.969 1.00 0.00 N ATOM 1466 NH2 ARG A 95 -1.700 -2.640 -15.711 1.00 0.00 N ATOM 0 H ARG A 95 -0.916 -1.982 -9.703 1.00 0.00 H new ATOM 0 HA ARG A 95 -0.618 -1.396 -12.587 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -1.727 0.456 -10.442 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -1.487 0.860 -12.130 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -3.275 -1.449 -11.351 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -3.873 0.197 -11.293 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -4.458 -0.585 -13.456 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -3.069 0.453 -13.714 1.00 0.00 H new ATOM 0 HE ARG A 95 -2.440 -2.407 -13.348 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -3.127 0.243 -15.578 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -2.372 -0.567 -16.954 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -1.470 -3.439 -15.120 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -1.438 -2.642 -16.697 1.00 0.00 H new ATOM 1480 N LYS A 96 1.580 -0.350 -12.174 1.00 0.00 N ATOM 1481 CA LYS A 96 2.916 0.189 -11.952 1.00 0.00 C ATOM 1482 C LYS A 96 2.975 1.668 -12.319 1.00 0.00 C ATOM 1483 O LYS A 96 3.871 2.389 -11.883 1.00 0.00 O ATOM 1484 CB LYS A 96 3.946 -0.593 -12.771 1.00 0.00 C ATOM 1485 CG LYS A 96 4.492 -1.816 -12.055 1.00 0.00 C ATOM 1486 CD LYS A 96 4.875 -2.911 -13.037 1.00 0.00 C ATOM 1487 CE LYS A 96 6.035 -3.745 -12.516 1.00 0.00 C ATOM 1488 NZ LYS A 96 7.350 -3.200 -12.953 1.00 0.00 N ATOM 0 H LYS A 96 1.393 -0.628 -13.137 1.00 0.00 H new ATOM 0 HA LYS A 96 3.150 0.087 -10.892 1.00 0.00 H new ATOM 0 HB2 LYS A 96 3.489 -0.906 -13.710 1.00 0.00 H new ATOM 0 HB3 LYS A 96 4.774 0.069 -13.025 1.00 0.00 H new ATOM 0 HG2 LYS A 96 5.364 -1.534 -11.464 1.00 0.00 H new ATOM 0 HG3 LYS A 96 3.744 -2.195 -11.359 1.00 0.00 H new ATOM 0 HD2 LYS A 96 4.015 -3.555 -13.219 1.00 0.00 H new ATOM 0 HD3 LYS A 96 5.147 -2.465 -13.994 1.00 0.00 H new ATOM 0 HE2 LYS A 96 5.999 -3.777 -11.427 1.00 0.00 H new ATOM 0 HE3 LYS A 96 5.932 -4.771 -12.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 8.060 -3.960 -12.947 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 7.264 -2.814 -13.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 7.646 -2.444 -12.303 1.00 0.00 H new ATOM 1502 N GLU A 97 2.013 2.112 -13.122 1.00 0.00 N ATOM 1503 CA GLU A 97 1.957 3.506 -13.546 1.00 0.00 C ATOM 1504 C GLU A 97 1.943 4.442 -12.341 1.00 0.00 C ATOM 1505 O GLU A 97 1.557 4.048 -11.240 1.00 0.00 O ATOM 1506 CB GLU A 97 0.717 3.750 -14.409 1.00 0.00 C ATOM 1507 CG GLU A 97 0.886 4.879 -15.412 1.00 0.00 C ATOM 1508 CD GLU A 97 2.171 4.765 -16.208 1.00 0.00 C ATOM 1509 OE1 GLU A 97 2.181 4.031 -17.219 1.00 0.00 O ATOM 1510 OE2 GLU A 97 3.168 5.410 -15.820 1.00 0.00 O ATOM 0 H GLU A 97 1.263 1.528 -13.491 1.00 0.00 H new ATOM 0 HA GLU A 97 2.849 3.715 -14.136 1.00 0.00 H new ATOM 0 HB2 GLU A 97 0.471 2.833 -14.945 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -0.129 3.976 -13.759 1.00 0.00 H new ATOM 0 HG2 GLU A 97 0.038 4.881 -16.097 1.00 0.00 H new ATOM 0 HG3 GLU A 97 0.873 5.833 -14.885 1.00 0.00 H new ATOM 1517 N SER A 98 2.367 5.683 -12.557 1.00 0.00 N ATOM 1518 CA SER A 98 2.408 6.674 -11.489 1.00 0.00 C ATOM 1519 C SER A 98 1.231 7.639 -11.597 1.00 0.00 C ATOM 1520 O SER A 98 1.102 8.370 -12.580 1.00 0.00 O ATOM 1521 CB SER A 98 3.725 7.451 -11.535 1.00 0.00 C ATOM 1522 OG SER A 98 4.767 6.657 -12.077 1.00 0.00 O ATOM 0 H SER A 98 2.687 6.026 -13.463 1.00 0.00 H new ATOM 0 HA SER A 98 2.338 6.148 -10.537 1.00 0.00 H new ATOM 0 HB2 SER A 98 3.599 8.351 -12.137 1.00 0.00 H new ATOM 0 HB3 SER A 98 3.995 7.775 -10.530 1.00 0.00 H new ATOM 0 HG SER A 98 5.598 7.177 -12.097 1.00 0.00 H new ATOM 1528 N LEU A 99 0.376 7.635 -10.581 1.00 0.00 N ATOM 1529 CA LEU A 99 -0.792 8.509 -10.561 1.00 0.00 C ATOM 1530 C LEU A 99 -0.451 9.858 -9.935 1.00 0.00 C ATOM 1531 O LEU A 99 0.072 9.940 -8.824 1.00 0.00 O ATOM 1532 CB LEU A 99 -1.934 7.849 -9.787 1.00 0.00 C ATOM 1533 CG LEU A 99 -3.216 8.672 -9.650 1.00 0.00 C ATOM 1534 CD1 LEU A 99 -3.998 8.663 -10.955 1.00 0.00 C ATOM 1535 CD2 LEU A 99 -4.072 8.141 -8.510 1.00 0.00 C ATOM 0 H LEU A 99 0.469 7.037 -9.760 1.00 0.00 H new ATOM 0 HA LEU A 99 -1.108 8.676 -11.591 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -2.181 6.907 -10.277 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -1.575 7.604 -8.787 1.00 0.00 H new ATOM 0 HG LEU A 99 -2.941 9.702 -9.422 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -4.907 9.253 -10.839 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -3.386 9.091 -11.749 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -4.262 7.638 -11.214 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -4.980 8.739 -8.428 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -4.338 7.103 -8.708 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -3.512 8.201 -7.577 1.00 0.00 H new ATOM 1547 N PRO A 100 -0.755 10.942 -10.664 1.00 0.00 N ATOM 1548 CA PRO A 100 -0.492 12.307 -10.199 1.00 0.00 C ATOM 1549 C PRO A 100 -1.399 12.710 -9.041 1.00 0.00 C ATOM 1550 O PRO A 100 -2.608 12.484 -9.079 1.00 0.00 O ATOM 1551 CB PRO A 100 -0.786 13.165 -11.433 1.00 0.00 C ATOM 1552 CG PRO A 100 -1.748 12.357 -12.235 1.00 0.00 C ATOM 1553 CD PRO A 100 -1.379 10.919 -11.997 1.00 0.00 C ATOM 0 HA PRO A 100 0.523 12.419 -9.817 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -1.214 14.128 -11.153 1.00 0.00 H new ATOM 0 HB3 PRO A 100 0.123 13.372 -11.997 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -2.775 12.553 -11.926 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -1.680 12.607 -13.294 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -2.255 10.271 -12.019 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -0.690 10.550 -12.757 1.00 0.00 H new ATOM 1561 N PHE A 101 -0.807 13.310 -8.013 1.00 0.00 N ATOM 1562 CA PHE A 101 -1.562 13.744 -6.844 1.00 0.00 C ATOM 1563 C PHE A 101 -2.832 14.482 -7.259 1.00 0.00 C ATOM 1564 O PHE A 101 -3.839 14.451 -6.553 1.00 0.00 O ATOM 1565 CB PHE A 101 -0.700 14.647 -5.960 1.00 0.00 C ATOM 1566 CG PHE A 101 0.116 13.894 -4.949 1.00 0.00 C ATOM 1567 CD1 PHE A 101 0.519 12.591 -5.195 1.00 0.00 C ATOM 1568 CD2 PHE A 101 0.480 14.488 -3.751 1.00 0.00 C ATOM 1569 CE1 PHE A 101 1.268 11.896 -4.266 1.00 0.00 C ATOM 1570 CE2 PHE A 101 1.230 13.798 -2.818 1.00 0.00 C ATOM 1571 CZ PHE A 101 1.626 12.500 -3.076 1.00 0.00 C ATOM 0 H PHE A 101 0.193 13.506 -7.966 1.00 0.00 H new ATOM 0 HA PHE A 101 -1.847 12.857 -6.277 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -0.031 15.230 -6.593 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -1.345 15.355 -5.440 1.00 0.00 H new ATOM 0 HD1 PHE A 101 0.244 12.114 -6.124 1.00 0.00 H new ATOM 0 HD2 PHE A 101 0.174 15.503 -3.544 1.00 0.00 H new ATOM 0 HE1 PHE A 101 1.574 10.880 -4.470 1.00 0.00 H new ATOM 0 HE2 PHE A 101 1.506 14.273 -1.888 1.00 0.00 H new ATOM 0 HZ PHE A 101 2.214 11.959 -2.349 1.00 0.00 H new ATOM 1581 N GLN A 102 -2.774 15.145 -8.410 1.00 0.00 N ATOM 1582 CA GLN A 102 -3.918 15.893 -8.919 1.00 0.00 C ATOM 1583 C GLN A 102 -5.168 15.020 -8.948 1.00 0.00 C ATOM 1584 O GLN A 102 -6.249 15.453 -8.548 1.00 0.00 O ATOM 1585 CB GLN A 102 -3.621 16.427 -10.321 1.00 0.00 C ATOM 1586 CG GLN A 102 -2.322 17.211 -10.411 1.00 0.00 C ATOM 1587 CD GLN A 102 -2.442 18.609 -9.838 1.00 0.00 C ATOM 1588 OE1 GLN A 102 -3.546 19.112 -9.625 1.00 0.00 O ATOM 1589 NE2 GLN A 102 -1.305 19.245 -9.585 1.00 0.00 N ATOM 0 H GLN A 102 -1.948 15.179 -9.007 1.00 0.00 H new ATOM 0 HA GLN A 102 -4.099 16.733 -8.249 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -3.580 15.590 -11.018 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -4.444 17.066 -10.639 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -1.539 16.671 -9.879 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -2.013 17.276 -11.454 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -0.413 18.790 -9.777 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -1.324 20.189 -9.199 1.00 0.00 H new ATOM 1598 N PHE A 103 -5.014 13.789 -9.425 1.00 0.00 N ATOM 1599 CA PHE A 103 -6.132 12.856 -9.508 1.00 0.00 C ATOM 1600 C PHE A 103 -6.667 12.524 -8.119 1.00 0.00 C ATOM 1601 O PHE A 103 -7.878 12.487 -7.901 1.00 0.00 O ATOM 1602 CB PHE A 103 -5.700 11.573 -10.221 1.00 0.00 C ATOM 1603 CG PHE A 103 -5.724 11.682 -11.719 1.00 0.00 C ATOM 1604 CD1 PHE A 103 -5.063 12.716 -12.362 1.00 0.00 C ATOM 1605 CD2 PHE A 103 -6.407 10.750 -12.483 1.00 0.00 C ATOM 1606 CE1 PHE A 103 -5.083 12.819 -13.740 1.00 0.00 C ATOM 1607 CE2 PHE A 103 -6.430 10.848 -13.862 1.00 0.00 C ATOM 1608 CZ PHE A 103 -5.768 11.884 -14.491 1.00 0.00 C ATOM 0 H PHE A 103 -4.126 13.414 -9.760 1.00 0.00 H new ATOM 0 HA PHE A 103 -6.929 13.331 -10.080 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -4.692 11.310 -9.900 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -6.355 10.758 -9.914 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -4.526 13.450 -11.780 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -6.927 9.938 -11.996 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -4.564 13.630 -14.229 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -6.965 10.115 -14.447 1.00 0.00 H new ATOM 0 HZ PHE A 103 -5.786 11.963 -15.568 1.00 0.00 H new ATOM 1618 N ALA A 104 -5.756 12.283 -7.182 1.00 0.00 N ATOM 1619 CA ALA A 104 -6.135 11.956 -5.813 1.00 0.00 C ATOM 1620 C ALA A 104 -6.116 13.196 -4.926 1.00 0.00 C ATOM 1621 O ALA A 104 -6.033 13.095 -3.702 1.00 0.00 O ATOM 1622 CB ALA A 104 -5.210 10.887 -5.250 1.00 0.00 C ATOM 0 H ALA A 104 -4.750 12.308 -7.346 1.00 0.00 H new ATOM 0 HA ALA A 104 -7.154 11.568 -5.828 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -5.505 10.653 -4.227 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -5.278 9.988 -5.862 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -4.184 11.254 -5.257 1.00 0.00 H new ATOM 1628 N HIS A 105 -6.192 14.366 -5.552 1.00 0.00 N ATOM 1629 CA HIS A 105 -6.184 15.627 -4.819 1.00 0.00 C ATOM 1630 C HIS A 105 -7.516 15.853 -4.110 1.00 0.00 C ATOM 1631 O HIS A 105 -7.574 16.508 -3.069 1.00 0.00 O ATOM 1632 CB HIS A 105 -5.893 16.791 -5.767 1.00 0.00 C ATOM 1633 CG HIS A 105 -5.461 18.042 -5.065 1.00 0.00 C ATOM 1634 ND1 HIS A 105 -5.729 18.289 -3.735 1.00 0.00 N ATOM 1635 CD2 HIS A 105 -4.775 19.118 -5.516 1.00 0.00 C ATOM 1636 CE1 HIS A 105 -5.227 19.464 -3.399 1.00 0.00 C ATOM 1637 NE2 HIS A 105 -4.643 19.987 -4.462 1.00 0.00 N ATOM 0 H HIS A 105 -6.260 14.467 -6.565 1.00 0.00 H new ATOM 0 HA HIS A 105 -5.397 15.576 -4.067 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -5.115 16.491 -6.469 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -6.787 17.003 -6.353 1.00 0.00 H new ATOM 0 HD1 HIS A 105 -6.235 17.663 -3.109 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -4.401 19.265 -6.518 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -5.284 19.919 -2.421 1.00 0.00 H new ATOM 1645 N HIS A 106 -8.585 15.308 -4.682 1.00 0.00 N ATOM 1646 CA HIS A 106 -9.917 15.450 -4.105 1.00 0.00 C ATOM 1647 C HIS A 106 -10.146 14.418 -3.005 1.00 0.00 C ATOM 1648 O HIS A 106 -10.814 14.695 -2.009 1.00 0.00 O ATOM 1649 CB HIS A 106 -10.984 15.302 -5.190 1.00 0.00 C ATOM 1650 CG HIS A 106 -11.082 13.915 -5.748 1.00 0.00 C ATOM 1651 ND1 HIS A 106 -10.091 13.341 -6.515 1.00 0.00 N ATOM 1652 CD2 HIS A 106 -12.062 12.987 -5.645 1.00 0.00 C ATOM 1653 CE1 HIS A 106 -10.457 12.120 -6.861 1.00 0.00 C ATOM 1654 NE2 HIS A 106 -11.649 11.880 -6.346 1.00 0.00 N ATOM 0 H HIS A 106 -8.555 14.764 -5.544 1.00 0.00 H new ATOM 0 HA HIS A 106 -9.992 16.445 -3.666 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -11.952 15.588 -4.778 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -10.765 15.997 -6.001 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -12.995 13.096 -5.111 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -9.879 11.434 -7.463 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -12.177 11.014 -6.451 1.00 0.00 H new ATOM 1662 N LEU A 107 -9.587 13.227 -3.193 1.00 0.00 N ATOM 1663 CA LEU A 107 -9.731 12.152 -2.217 1.00 0.00 C ATOM 1664 C LEU A 107 -9.049 12.516 -0.902 1.00 0.00 C ATOM 1665 O LEU A 107 -7.910 12.984 -0.889 1.00 0.00 O ATOM 1666 CB LEU A 107 -9.140 10.854 -2.768 1.00 0.00 C ATOM 1667 CG LEU A 107 -9.691 10.384 -4.115 1.00 0.00 C ATOM 1668 CD1 LEU A 107 -8.978 9.122 -4.573 1.00 0.00 C ATOM 1669 CD2 LEU A 107 -11.192 10.149 -4.025 1.00 0.00 C ATOM 0 H LEU A 107 -9.030 12.982 -4.012 1.00 0.00 H new ATOM 0 HA LEU A 107 -10.794 12.008 -2.026 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -8.062 10.981 -2.864 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -9.304 10.064 -2.035 1.00 0.00 H new ATOM 0 HG LEU A 107 -9.510 11.166 -4.852 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -9.384 8.803 -5.533 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -7.912 9.324 -4.679 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -9.126 8.333 -3.836 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -11.567 9.815 -4.993 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -11.396 9.386 -3.274 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -11.689 11.077 -3.744 1.00 0.00 H new ATOM 1681 N LEU A 108 -9.752 12.297 0.204 1.00 0.00 N ATOM 1682 CA LEU A 108 -9.214 12.599 1.525 1.00 0.00 C ATOM 1683 C LEU A 108 -9.456 11.442 2.490 1.00 0.00 C ATOM 1684 O LEU A 108 -10.170 10.494 2.169 1.00 0.00 O ATOM 1685 CB LEU A 108 -9.849 13.878 2.075 1.00 0.00 C ATOM 1686 CG LEU A 108 -10.038 15.018 1.074 1.00 0.00 C ATOM 1687 CD1 LEU A 108 -11.006 16.055 1.623 1.00 0.00 C ATOM 1688 CD2 LEU A 108 -8.700 15.660 0.738 1.00 0.00 C ATOM 0 H LEU A 108 -10.696 11.911 0.212 1.00 0.00 H new ATOM 0 HA LEU A 108 -8.139 12.747 1.427 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -10.823 13.625 2.495 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -9.232 14.242 2.897 1.00 0.00 H new ATOM 0 HG LEU A 108 -10.461 14.605 0.158 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -11.128 16.859 0.897 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -11.972 15.587 1.812 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -10.612 16.463 2.554 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -8.854 16.469 0.024 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -8.249 16.059 1.647 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -8.037 14.913 0.302 1.00 0.00 H new ATOM 1700 N ASN A 109 -8.857 11.530 3.673 1.00 0.00 N ATOM 1701 CA ASN A 109 -9.009 10.491 4.685 1.00 0.00 C ATOM 1702 C ASN A 109 -9.678 11.046 5.939 1.00 0.00 C ATOM 1703 O ASN A 109 -9.057 11.729 6.754 1.00 0.00 O ATOM 1704 CB ASN A 109 -7.646 9.895 5.043 1.00 0.00 C ATOM 1705 CG ASN A 109 -7.712 8.985 6.254 1.00 0.00 C ATOM 1706 OD1 ASN A 109 -7.915 9.443 7.378 1.00 0.00 O ATOM 1707 ND2 ASN A 109 -7.541 7.688 6.029 1.00 0.00 N ATOM 0 H ASN A 109 -8.262 12.309 3.954 1.00 0.00 H new ATOM 0 HA ASN A 109 -9.644 9.707 4.272 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -7.263 9.334 4.191 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -6.939 10.702 5.237 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -7.575 7.027 6.805 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -7.375 7.353 5.080 1.00 0.00 H new ATOM 1714 N PRO A 110 -10.976 10.748 6.098 1.00 0.00 N ATOM 1715 CA PRO A 110 -11.758 11.206 7.250 1.00 0.00 C ATOM 1716 C PRO A 110 -11.340 10.518 8.545 1.00 0.00 C ATOM 1717 O PRO A 110 -11.946 10.730 9.595 1.00 0.00 O ATOM 1718 CB PRO A 110 -13.193 10.822 6.880 1.00 0.00 C ATOM 1719 CG PRO A 110 -13.048 9.682 5.932 1.00 0.00 C ATOM 1720 CD PRO A 110 -11.780 9.939 5.166 1.00 0.00 C ATOM 0 HA PRO A 110 -11.622 12.271 7.437 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -13.765 10.533 7.762 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -13.719 11.657 6.418 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -12.995 8.734 6.467 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -13.904 9.622 5.260 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -11.275 9.010 4.902 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -11.974 10.472 4.235 1.00 0.00 H new ATOM 1728 N TRP A 111 -10.301 9.695 8.463 1.00 0.00 N ATOM 1729 CA TRP A 111 -9.801 8.977 9.630 1.00 0.00 C ATOM 1730 C TRP A 111 -8.704 9.770 10.330 1.00 0.00 C ATOM 1731 O TRP A 111 -8.425 9.555 11.509 1.00 0.00 O ATOM 1732 CB TRP A 111 -9.271 7.602 9.219 1.00 0.00 C ATOM 1733 CG TRP A 111 -10.318 6.531 9.239 1.00 0.00 C ATOM 1734 CD1 TRP A 111 -11.649 6.691 9.500 1.00 0.00 C ATOM 1735 CD2 TRP A 111 -10.121 5.135 8.989 1.00 0.00 C ATOM 1736 NE1 TRP A 111 -12.292 5.478 9.427 1.00 0.00 N ATOM 1737 CE2 TRP A 111 -11.377 4.508 9.115 1.00 0.00 C ATOM 1738 CE3 TRP A 111 -9.007 4.353 8.670 1.00 0.00 C ATOM 1739 CZ2 TRP A 111 -11.545 3.138 8.933 1.00 0.00 C ATOM 1740 CZ3 TRP A 111 -9.177 2.994 8.490 1.00 0.00 C ATOM 1741 CH2 TRP A 111 -10.438 2.397 8.622 1.00 0.00 C ATOM 0 H TRP A 111 -9.788 9.508 7.601 1.00 0.00 H new ATOM 0 HA TRP A 111 -10.629 8.847 10.327 1.00 0.00 H new ATOM 0 HB2 TRP A 111 -8.849 7.668 8.216 1.00 0.00 H new ATOM 0 HB3 TRP A 111 -8.459 7.319 9.889 1.00 0.00 H new ATOM 0 HD1 TRP A 111 -12.126 7.632 9.730 1.00 0.00 H new ATOM 0 HE1 TRP A 111 -13.289 5.325 9.580 1.00 0.00 H new ATOM 0 HE3 TRP A 111 -8.031 4.803 8.566 1.00 0.00 H new ATOM 0 HZ2 TRP A 111 -12.516 2.676 9.034 1.00 0.00 H new ATOM 0 HZ3 TRP A 111 -8.323 2.381 8.243 1.00 0.00 H new ATOM 0 HH2 TRP A 111 -10.538 1.332 8.475 1.00 0.00 H new ATOM 1752 N ASN A 112 -8.085 10.690 9.596 1.00 0.00 N ATOM 1753 CA ASN A 112 -7.017 11.516 10.148 1.00 0.00 C ATOM 1754 C ASN A 112 -7.242 12.988 9.817 1.00 0.00 C ATOM 1755 O ASN A 112 -6.461 13.597 9.086 1.00 0.00 O ATOM 1756 CB ASN A 112 -5.660 11.061 9.606 1.00 0.00 C ATOM 1757 CG ASN A 112 -5.443 11.482 8.166 1.00 0.00 C ATOM 1758 OD1 ASN A 112 -6.214 11.117 7.278 1.00 0.00 O ATOM 1759 ND2 ASN A 112 -4.389 12.253 7.927 1.00 0.00 N ATOM 0 H ASN A 112 -8.305 10.882 8.619 1.00 0.00 H new ATOM 0 HA ASN A 112 -7.025 11.400 11.232 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -4.866 11.476 10.227 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -5.588 9.976 9.679 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -4.192 12.567 6.977 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -3.777 12.532 8.694 1.00 0.00 H new ATOM 1766 N ASP A 113 -8.314 13.554 10.360 1.00 0.00 N ATOM 1767 CA ASP A 113 -8.642 14.955 10.125 1.00 0.00 C ATOM 1768 C ASP A 113 -8.947 15.201 8.651 1.00 0.00 C ATOM 1769 O ASP A 113 -8.469 16.168 8.060 1.00 0.00 O ATOM 1770 CB ASP A 113 -7.489 15.853 10.576 1.00 0.00 C ATOM 1771 CG ASP A 113 -7.585 16.225 12.043 1.00 0.00 C ATOM 1772 OD1 ASP A 113 -7.647 15.306 12.885 1.00 0.00 O ATOM 1773 OD2 ASP A 113 -7.600 17.436 12.348 1.00 0.00 O ATOM 0 H ASP A 113 -8.971 13.063 10.967 1.00 0.00 H new ATOM 0 HA ASP A 113 -9.531 15.198 10.707 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -6.543 15.343 10.395 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -7.482 16.761 9.973 1.00 0.00 H new ATOM 1778 N ASN A 114 -9.747 14.318 8.062 1.00 0.00 N ATOM 1779 CA ASN A 114 -10.115 14.438 6.656 1.00 0.00 C ATOM 1780 C ASN A 114 -8.964 15.019 5.840 1.00 0.00 C ATOM 1781 O ASN A 114 -9.174 15.833 4.940 1.00 0.00 O ATOM 1782 CB ASN A 114 -11.357 15.320 6.506 1.00 0.00 C ATOM 1783 CG ASN A 114 -12.215 14.913 5.323 1.00 0.00 C ATOM 1784 OD1 ASN A 114 -11.732 14.821 4.195 1.00 0.00 O ATOM 1785 ND2 ASN A 114 -13.495 14.669 5.578 1.00 0.00 N ATOM 0 H ASN A 114 -10.153 13.512 8.537 1.00 0.00 H new ATOM 0 HA ASN A 114 -10.338 13.440 6.278 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -11.951 15.265 7.418 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -11.050 16.359 6.388 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -14.122 14.392 4.822 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -13.851 14.758 6.530 1.00 0.00 H new ATOM 1792 N LYS A 115 -7.746 14.594 6.160 1.00 0.00 N ATOM 1793 CA LYS A 115 -6.561 15.069 5.456 1.00 0.00 C ATOM 1794 C LYS A 115 -6.382 14.333 4.132 1.00 0.00 C ATOM 1795 O LYS A 115 -6.589 13.122 4.050 1.00 0.00 O ATOM 1796 CB LYS A 115 -5.317 14.882 6.328 1.00 0.00 C ATOM 1797 CG LYS A 115 -5.032 16.060 7.242 1.00 0.00 C ATOM 1798 CD LYS A 115 -4.562 17.274 6.458 1.00 0.00 C ATOM 1799 CE LYS A 115 -4.598 18.535 7.308 1.00 0.00 C ATOM 1800 NZ LYS A 115 -3.865 19.659 6.663 1.00 0.00 N ATOM 0 H LYS A 115 -7.554 13.921 6.902 1.00 0.00 H new ATOM 0 HA LYS A 115 -6.695 16.130 5.246 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -5.440 13.984 6.934 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -4.454 14.716 5.684 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -5.932 16.314 7.802 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -4.272 15.780 7.971 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -3.547 17.105 6.098 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -5.193 17.408 5.580 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -5.634 18.828 7.480 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -4.159 18.328 8.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -3.913 20.500 7.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -2.871 19.389 6.522 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -4.299 19.874 5.743 1.00 0.00 H new ATOM 1814 N LYS A 116 -5.996 15.071 3.097 1.00 0.00 N ATOM 1815 CA LYS A 116 -5.786 14.489 1.777 1.00 0.00 C ATOM 1816 C LYS A 116 -5.117 13.123 1.885 1.00 0.00 C ATOM 1817 O LYS A 116 -4.134 12.957 2.607 1.00 0.00 O ATOM 1818 CB LYS A 116 -4.931 15.421 0.916 1.00 0.00 C ATOM 1819 CG LYS A 116 -4.661 14.884 -0.479 1.00 0.00 C ATOM 1820 CD LYS A 116 -3.673 15.758 -1.232 1.00 0.00 C ATOM 1821 CE LYS A 116 -4.187 17.182 -1.378 1.00 0.00 C ATOM 1822 NZ LYS A 116 -3.769 18.043 -0.237 1.00 0.00 N ATOM 0 H LYS A 116 -5.822 16.075 3.147 1.00 0.00 H new ATOM 0 HA LYS A 116 -6.760 14.361 1.305 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -5.431 16.386 0.834 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -3.980 15.596 1.419 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -4.270 13.869 -0.410 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -5.596 14.828 -1.036 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -2.719 15.767 -0.706 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -3.489 15.334 -2.219 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -3.815 17.608 -2.310 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -5.275 17.170 -1.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -4.589 18.232 0.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -3.032 17.557 0.313 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -3.393 18.942 -0.600 1.00 0.00 H new ATOM 1836 N VAL A 117 -5.656 12.146 1.161 1.00 0.00 N ATOM 1837 CA VAL A 117 -5.110 10.795 1.174 1.00 0.00 C ATOM 1838 C VAL A 117 -3.586 10.817 1.113 1.00 0.00 C ATOM 1839 O VAL A 117 -2.912 10.420 2.062 1.00 0.00 O ATOM 1840 CB VAL A 117 -5.647 9.961 -0.005 1.00 0.00 C ATOM 1841 CG1 VAL A 117 -5.271 8.497 0.161 1.00 0.00 C ATOM 1842 CG2 VAL A 117 -7.155 10.122 -0.126 1.00 0.00 C ATOM 0 H VAL A 117 -6.470 12.266 0.558 1.00 0.00 H new ATOM 0 HA VAL A 117 -5.427 10.335 2.110 1.00 0.00 H new ATOM 0 HB VAL A 117 -5.190 10.326 -0.925 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -5.659 7.924 -0.681 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -4.186 8.402 0.196 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -5.698 8.114 1.088 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -7.518 9.527 -0.964 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -7.632 9.784 0.794 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -7.396 11.171 -0.295 1.00 0.00 H new ATOM 1852 N GLN A 118 -3.051 11.285 -0.011 1.00 0.00 N ATOM 1853 CA GLN A 118 -1.607 11.359 -0.195 1.00 0.00 C ATOM 1854 C GLN A 118 -0.909 11.716 1.113 1.00 0.00 C ATOM 1855 O GLN A 118 0.150 11.173 1.431 1.00 0.00 O ATOM 1856 CB GLN A 118 -1.261 12.391 -1.270 1.00 0.00 C ATOM 1857 CG GLN A 118 -1.346 13.829 -0.783 1.00 0.00 C ATOM 1858 CD GLN A 118 -0.095 14.270 -0.047 1.00 0.00 C ATOM 1859 OE1 GLN A 118 0.784 13.460 0.247 1.00 0.00 O ATOM 1860 NE2 GLN A 118 -0.010 15.560 0.254 1.00 0.00 N ATOM 0 H GLN A 118 -3.596 11.618 -0.806 1.00 0.00 H new ATOM 0 HA GLN A 118 -1.256 10.378 -0.517 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -0.252 12.199 -1.635 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -1.936 12.262 -2.116 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -1.513 14.488 -1.635 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -2.208 13.935 -0.124 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -0.763 16.196 -0.009 1.00 0.00 H new ATOM 0 HE22 GLN A 118 0.808 15.915 0.749 1.00 0.00 H new ATOM 1869 N ILE A 119 -1.508 12.632 1.867 1.00 0.00 N ATOM 1870 CA ILE A 119 -0.943 13.061 3.140 1.00 0.00 C ATOM 1871 C ILE A 119 -1.012 11.944 4.176 1.00 0.00 C ATOM 1872 O ILE A 119 -1.781 12.018 5.134 1.00 0.00 O ATOM 1873 CB ILE A 119 -1.672 14.301 3.690 1.00 0.00 C ATOM 1874 CG1 ILE A 119 -1.651 15.431 2.659 1.00 0.00 C ATOM 1875 CG2 ILE A 119 -1.034 14.755 4.995 1.00 0.00 C ATOM 1876 CD1 ILE A 119 -2.474 16.634 3.064 1.00 0.00 C ATOM 0 H ILE A 119 -2.384 13.091 1.618 1.00 0.00 H new ATOM 0 HA ILE A 119 0.100 13.316 2.952 1.00 0.00 H new ATOM 0 HB ILE A 119 -2.710 14.035 3.889 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -0.620 15.744 2.496 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -2.022 15.051 1.707 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -1.560 15.632 5.371 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -1.096 13.952 5.729 1.00 0.00 H new ATOM 0 HG23 ILE A 119 0.012 15.007 4.820 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -2.413 17.395 2.286 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -3.514 16.335 3.198 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -2.089 17.040 4.000 1.00 0.00 H new ATOM 1888 N SER A 120 -0.201 10.909 3.977 1.00 0.00 N ATOM 1889 CA SER A 120 -0.171 9.775 4.893 1.00 0.00 C ATOM 1890 C SER A 120 1.265 9.359 5.195 1.00 0.00 C ATOM 1891 O SER A 120 2.207 9.825 4.553 1.00 0.00 O ATOM 1892 CB SER A 120 -0.942 8.593 4.300 1.00 0.00 C ATOM 1893 OG SER A 120 -0.669 8.448 2.918 1.00 0.00 O ATOM 0 H SER A 120 0.443 10.833 3.190 1.00 0.00 H new ATOM 0 HA SER A 120 -0.647 10.080 5.825 1.00 0.00 H new ATOM 0 HB2 SER A 120 -0.671 7.677 4.825 1.00 0.00 H new ATOM 0 HB3 SER A 120 -2.012 8.741 4.449 1.00 0.00 H new ATOM 0 HG SER A 120 -1.287 9.007 2.402 1.00 0.00 H new ATOM 1899 N ARG A 121 1.425 8.478 6.178 1.00 0.00 N ATOM 1900 CA ARG A 121 2.746 7.999 6.567 1.00 0.00 C ATOM 1901 C ARG A 121 2.815 6.476 6.495 1.00 0.00 C ATOM 1902 O ARG A 121 1.790 5.803 6.392 1.00 0.00 O ATOM 1903 CB ARG A 121 3.086 8.470 7.983 1.00 0.00 C ATOM 1904 CG ARG A 121 3.133 9.982 8.127 1.00 0.00 C ATOM 1905 CD ARG A 121 2.933 10.410 9.572 1.00 0.00 C ATOM 1906 NE ARG A 121 2.704 11.848 9.690 1.00 0.00 N ATOM 1907 CZ ARG A 121 2.112 12.414 10.735 1.00 0.00 C ATOM 1908 NH1 ARG A 121 1.692 11.669 11.748 1.00 0.00 N ATOM 1909 NH2 ARG A 121 1.940 13.730 10.770 1.00 0.00 N ATOM 0 H ARG A 121 0.656 8.082 6.719 1.00 0.00 H new ATOM 0 HA ARG A 121 3.475 8.412 5.869 1.00 0.00 H new ATOM 0 HB2 ARG A 121 2.347 8.070 8.677 1.00 0.00 H new ATOM 0 HB3 ARG A 121 4.052 8.056 8.273 1.00 0.00 H new ATOM 0 HG2 ARG A 121 4.092 10.353 7.766 1.00 0.00 H new ATOM 0 HG3 ARG A 121 2.361 10.432 7.503 1.00 0.00 H new ATOM 0 HD2 ARG A 121 2.085 9.872 9.995 1.00 0.00 H new ATOM 0 HD3 ARG A 121 3.810 10.133 10.157 1.00 0.00 H new ATOM 0 HE ARG A 121 3.016 12.450 8.928 1.00 0.00 H new ATOM 0 HH11 ARG A 121 1.823 10.658 11.726 1.00 0.00 H new ATOM 0 HH12 ARG A 121 1.238 12.107 12.549 1.00 0.00 H new ATOM 0 HH21 ARG A 121 2.263 14.307 9.994 1.00 0.00 H new ATOM 0 HH22 ARG A 121 1.485 14.164 11.573 1.00 0.00 H new ATOM 1923 N ASP A 122 4.030 5.942 6.550 1.00 0.00 N ATOM 1924 CA ASP A 122 4.234 4.499 6.492 1.00 0.00 C ATOM 1925 C ASP A 122 3.420 3.791 7.570 1.00 0.00 C ATOM 1926 O ASP A 122 3.405 4.211 8.727 1.00 0.00 O ATOM 1927 CB ASP A 122 5.717 4.165 6.654 1.00 0.00 C ATOM 1928 CG ASP A 122 6.186 4.291 8.090 1.00 0.00 C ATOM 1929 OD1 ASP A 122 5.877 5.320 8.726 1.00 0.00 O ATOM 1930 OD2 ASP A 122 6.862 3.361 8.578 1.00 0.00 O ATOM 0 H ASP A 122 4.888 6.486 6.635 1.00 0.00 H new ATOM 0 HA ASP A 122 3.895 4.148 5.517 1.00 0.00 H new ATOM 0 HB2 ASP A 122 5.898 3.149 6.304 1.00 0.00 H new ATOM 0 HB3 ASP A 122 6.307 4.829 6.023 1.00 0.00 H new ATOM 1935 N GLY A 123 2.741 2.715 7.183 1.00 0.00 N ATOM 1936 CA GLY A 123 1.933 1.967 8.128 1.00 0.00 C ATOM 1937 C GLY A 123 0.748 2.765 8.635 1.00 0.00 C ATOM 1938 O GLY A 123 0.491 2.808 9.838 1.00 0.00 O ATOM 0 H GLY A 123 2.736 2.348 6.231 1.00 0.00 H new ATOM 0 HA2 GLY A 123 1.576 1.053 7.653 1.00 0.00 H new ATOM 0 HA3 GLY A 123 2.553 1.666 8.973 1.00 0.00 H new ATOM 1942 N GLN A 124 0.025 3.398 7.716 1.00 0.00 N ATOM 1943 CA GLN A 124 -1.137 4.199 8.079 1.00 0.00 C ATOM 1944 C GLN A 124 -2.429 3.503 7.664 1.00 0.00 C ATOM 1945 O GLN A 124 -2.426 2.640 6.787 1.00 0.00 O ATOM 1946 CB GLN A 124 -1.056 5.579 7.424 1.00 0.00 C ATOM 1947 CG GLN A 124 -2.230 6.483 7.762 1.00 0.00 C ATOM 1948 CD GLN A 124 -2.314 6.804 9.241 1.00 0.00 C ATOM 1949 OE1 GLN A 124 -1.306 7.109 9.880 1.00 0.00 O ATOM 1950 NE2 GLN A 124 -3.519 6.737 9.795 1.00 0.00 N ATOM 0 H GLN A 124 0.224 3.371 6.716 1.00 0.00 H new ATOM 0 HA GLN A 124 -1.141 4.318 9.163 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -0.132 6.066 7.735 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -1.003 5.456 6.342 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -2.143 7.411 7.197 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -3.156 6.003 7.445 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -4.327 6.480 9.228 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -3.636 6.942 10.787 1.00 0.00 H new ATOM 1959 N GLU A 125 -3.532 3.883 8.302 1.00 0.00 N ATOM 1960 CA GLU A 125 -4.831 3.293 7.999 1.00 0.00 C ATOM 1961 C GLU A 125 -5.550 4.089 6.913 1.00 0.00 C ATOM 1962 O GLU A 125 -5.505 5.320 6.897 1.00 0.00 O ATOM 1963 CB GLU A 125 -5.695 3.233 9.260 1.00 0.00 C ATOM 1964 CG GLU A 125 -5.534 1.944 10.048 1.00 0.00 C ATOM 1965 CD GLU A 125 -5.815 2.125 11.527 1.00 0.00 C ATOM 1966 OE1 GLU A 125 -4.897 2.550 12.258 1.00 0.00 O ATOM 1967 OE2 GLU A 125 -6.954 1.841 11.952 1.00 0.00 O ATOM 0 H GLU A 125 -3.552 4.596 9.031 1.00 0.00 H new ATOM 0 HA GLU A 125 -4.665 2.280 7.633 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -5.443 4.076 9.903 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -6.742 3.349 8.979 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -6.208 1.189 9.644 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -4.519 1.568 9.918 1.00 0.00 H new ATOM 1974 N LEU A 126 -6.213 3.378 6.008 1.00 0.00 N ATOM 1975 CA LEU A 126 -6.942 4.016 4.918 1.00 0.00 C ATOM 1976 C LEU A 126 -8.360 3.463 4.813 1.00 0.00 C ATOM 1977 O LEU A 126 -8.560 2.250 4.767 1.00 0.00 O ATOM 1978 CB LEU A 126 -6.203 3.811 3.594 1.00 0.00 C ATOM 1979 CG LEU A 126 -6.581 4.764 2.460 1.00 0.00 C ATOM 1980 CD1 LEU A 126 -6.125 6.179 2.778 1.00 0.00 C ATOM 1981 CD2 LEU A 126 -5.980 4.291 1.144 1.00 0.00 C ATOM 0 H LEU A 126 -6.261 2.359 6.007 1.00 0.00 H new ATOM 0 HA LEU A 126 -7.003 5.083 5.131 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -5.133 3.906 3.780 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -6.379 2.789 3.257 1.00 0.00 H new ATOM 0 HG LEU A 126 -7.666 4.768 2.360 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -6.403 6.843 1.960 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -6.602 6.517 3.698 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -5.043 6.193 2.905 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -6.259 4.981 0.348 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -4.894 4.258 1.231 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -6.356 3.295 0.909 1.00 0.00 H new ATOM 1993 N GLU A 127 -9.339 4.361 4.774 1.00 0.00 N ATOM 1994 CA GLU A 127 -10.738 3.961 4.673 1.00 0.00 C ATOM 1995 C GLU A 127 -10.988 3.175 3.390 1.00 0.00 C ATOM 1996 O GLU A 127 -10.362 3.410 2.356 1.00 0.00 O ATOM 1997 CB GLU A 127 -11.647 5.191 4.717 1.00 0.00 C ATOM 1998 CG GLU A 127 -11.852 5.748 6.115 1.00 0.00 C ATOM 1999 CD GLU A 127 -10.746 6.698 6.532 1.00 0.00 C ATOM 2000 OE1 GLU A 127 -9.561 6.349 6.342 1.00 0.00 O ATOM 2001 OE2 GLU A 127 -11.063 7.789 7.048 1.00 0.00 O ATOM 0 H GLU A 127 -9.190 5.369 4.811 1.00 0.00 H new ATOM 0 HA GLU A 127 -10.968 3.318 5.522 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -11.221 5.970 4.084 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -12.617 4.931 4.293 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -12.809 6.269 6.158 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -11.905 4.924 6.826 1.00 0.00 H new ATOM 2008 N PRO A 128 -11.924 2.217 3.456 1.00 0.00 N ATOM 2009 CA PRO A 128 -12.279 1.376 2.309 1.00 0.00 C ATOM 2010 C PRO A 128 -13.013 2.156 1.223 1.00 0.00 C ATOM 2011 O PRO A 128 -13.079 1.723 0.073 1.00 0.00 O ATOM 2012 CB PRO A 128 -13.197 0.314 2.918 1.00 0.00 C ATOM 2013 CG PRO A 128 -13.776 0.962 4.128 1.00 0.00 C ATOM 2014 CD PRO A 128 -12.709 1.881 4.655 1.00 0.00 C ATOM 0 HA PRO A 128 -11.398 0.965 1.817 1.00 0.00 H new ATOM 0 HB2 PRO A 128 -13.977 0.016 2.217 1.00 0.00 H new ATOM 0 HB3 PRO A 128 -12.642 -0.587 3.179 1.00 0.00 H new ATOM 0 HG2 PRO A 128 -14.681 1.517 3.879 1.00 0.00 H new ATOM 0 HG3 PRO A 128 -14.054 0.218 4.874 1.00 0.00 H new ATOM 0 HD2 PRO A 128 -13.137 2.771 5.117 1.00 0.00 H new ATOM 0 HD3 PRO A 128 -12.096 1.392 5.412 1.00 0.00 H new ATOM 2022 N GLN A 129 -13.563 3.307 1.597 1.00 0.00 N ATOM 2023 CA GLN A 129 -14.293 4.146 0.654 1.00 0.00 C ATOM 2024 C GLN A 129 -13.334 5.001 -0.168 1.00 0.00 C ATOM 2025 O GLN A 129 -13.459 5.092 -1.390 1.00 0.00 O ATOM 2026 CB GLN A 129 -15.284 5.042 1.398 1.00 0.00 C ATOM 2027 CG GLN A 129 -16.503 5.418 0.572 1.00 0.00 C ATOM 2028 CD GLN A 129 -16.254 6.613 -0.326 1.00 0.00 C ATOM 2029 OE1 GLN A 129 -15.525 6.520 -1.314 1.00 0.00 O ATOM 2030 NE2 GLN A 129 -16.860 7.745 0.012 1.00 0.00 N ATOM 0 H GLN A 129 -13.517 3.679 2.545 1.00 0.00 H new ATOM 0 HA GLN A 129 -14.843 3.494 -0.025 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -15.612 4.532 2.304 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -14.773 5.952 1.712 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -16.800 4.565 -0.039 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -17.336 5.638 1.240 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -17.456 7.777 0.839 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -16.730 8.582 -0.556 1.00 0.00 H new ATOM 2039 N VAL A 130 -12.377 5.627 0.509 1.00 0.00 N ATOM 2040 CA VAL A 130 -11.397 6.474 -0.159 1.00 0.00 C ATOM 2041 C VAL A 130 -10.234 5.649 -0.698 1.00 0.00 C ATOM 2042 O VAL A 130 -9.544 6.063 -1.629 1.00 0.00 O ATOM 2043 CB VAL A 130 -10.848 7.555 0.792 1.00 0.00 C ATOM 2044 CG1 VAL A 130 -11.988 8.325 1.440 1.00 0.00 C ATOM 2045 CG2 VAL A 130 -9.949 6.928 1.847 1.00 0.00 C ATOM 0 H VAL A 130 -12.260 5.563 1.520 1.00 0.00 H new ATOM 0 HA VAL A 130 -11.911 6.958 -0.989 1.00 0.00 H new ATOM 0 HB VAL A 130 -10.252 8.258 0.210 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -11.581 9.084 2.108 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -12.588 8.806 0.667 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -12.614 7.638 2.010 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -9.570 7.705 2.510 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -10.520 6.203 2.427 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -9.113 6.426 1.361 1.00 0.00 H new ATOM 2055 N GLY A 131 -10.022 4.477 -0.107 1.00 0.00 N ATOM 2056 CA GLY A 131 -8.942 3.611 -0.541 1.00 0.00 C ATOM 2057 C GLY A 131 -9.306 2.803 -1.771 1.00 0.00 C ATOM 2058 O GLY A 131 -8.428 2.318 -2.484 1.00 0.00 O ATOM 0 H GLY A 131 -10.580 4.112 0.665 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -8.060 4.215 -0.754 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -8.676 2.933 0.270 1.00 0.00 H new ATOM 2062 N GLU A 132 -10.604 2.656 -2.018 1.00 0.00 N ATOM 2063 CA GLU A 132 -11.080 1.898 -3.169 1.00 0.00 C ATOM 2064 C GLU A 132 -11.219 2.798 -4.394 1.00 0.00 C ATOM 2065 O GLU A 132 -10.866 2.407 -5.506 1.00 0.00 O ATOM 2066 CB GLU A 132 -12.424 1.239 -2.852 1.00 0.00 C ATOM 2067 CG GLU A 132 -13.587 2.216 -2.813 1.00 0.00 C ATOM 2068 CD GLU A 132 -14.929 1.521 -2.689 1.00 0.00 C ATOM 2069 OE1 GLU A 132 -15.090 0.431 -3.277 1.00 0.00 O ATOM 2070 OE2 GLU A 132 -15.819 2.068 -2.004 1.00 0.00 O ATOM 0 H GLU A 132 -11.344 3.051 -1.437 1.00 0.00 H new ATOM 0 HA GLU A 132 -10.346 1.123 -3.391 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -12.629 0.473 -3.600 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -12.353 0.733 -1.889 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -13.456 2.898 -1.972 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -13.578 2.822 -3.719 1.00 0.00 H new ATOM 2077 N GLN A 133 -11.736 4.004 -4.179 1.00 0.00 N ATOM 2078 CA GLN A 133 -11.922 4.958 -5.266 1.00 0.00 C ATOM 2079 C GLN A 133 -10.595 5.595 -5.664 1.00 0.00 C ATOM 2080 O GLN A 133 -10.509 6.297 -6.673 1.00 0.00 O ATOM 2081 CB GLN A 133 -12.919 6.043 -4.854 1.00 0.00 C ATOM 2082 CG GLN A 133 -12.505 6.808 -3.608 1.00 0.00 C ATOM 2083 CD GLN A 133 -13.637 7.630 -3.024 1.00 0.00 C ATOM 2084 OE1 GLN A 133 -14.797 7.468 -3.405 1.00 0.00 O ATOM 2085 NE2 GLN A 133 -13.307 8.518 -2.094 1.00 0.00 N ATOM 0 H GLN A 133 -12.033 4.343 -3.264 1.00 0.00 H new ATOM 0 HA GLN A 133 -12.317 4.418 -6.127 1.00 0.00 H new ATOM 0 HB2 GLN A 133 -13.040 6.746 -5.678 1.00 0.00 H new ATOM 0 HB3 GLN A 133 -13.892 5.584 -4.682 1.00 0.00 H new ATOM 0 HG2 GLN A 133 -12.147 6.104 -2.857 1.00 0.00 H new ATOM 0 HG3 GLN A 133 -11.671 7.466 -3.851 1.00 0.00 H new ATOM 0 HE21 GLN A 133 -12.333 8.619 -1.808 1.00 0.00 H new ATOM 0 HE22 GLN A 133 -14.027 9.099 -1.665 1.00 0.00 H new ATOM 2094 N LEU A 134 -9.562 5.348 -4.866 1.00 0.00 N ATOM 2095 CA LEU A 134 -8.238 5.898 -5.135 1.00 0.00 C ATOM 2096 C LEU A 134 -7.507 5.068 -6.185 1.00 0.00 C ATOM 2097 O LEU A 134 -6.761 5.603 -7.007 1.00 0.00 O ATOM 2098 CB LEU A 134 -7.415 5.951 -3.847 1.00 0.00 C ATOM 2099 CG LEU A 134 -5.903 6.103 -4.022 1.00 0.00 C ATOM 2100 CD1 LEU A 134 -5.553 7.527 -4.424 1.00 0.00 C ATOM 2101 CD2 LEU A 134 -5.177 5.714 -2.743 1.00 0.00 C ATOM 0 H LEU A 134 -9.616 4.770 -4.027 1.00 0.00 H new ATOM 0 HA LEU A 134 -8.363 6.910 -5.521 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -7.776 6.783 -3.243 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -7.605 5.040 -3.280 1.00 0.00 H new ATOM 0 HG LEU A 134 -5.579 5.433 -4.818 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -4.473 7.616 -4.544 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -6.044 7.770 -5.366 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -5.890 8.217 -3.650 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -4.102 5.828 -2.885 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -5.505 6.359 -1.928 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -5.402 4.676 -2.498 1.00 0.00 H new ATOM 2113 N LEU A 135 -7.727 3.758 -6.155 1.00 0.00 N ATOM 2114 CA LEU A 135 -7.090 2.853 -7.106 1.00 0.00 C ATOM 2115 C LEU A 135 -7.712 2.995 -8.492 1.00 0.00 C ATOM 2116 O LEU A 135 -7.006 3.176 -9.483 1.00 0.00 O ATOM 2117 CB LEU A 135 -7.214 1.406 -6.624 1.00 0.00 C ATOM 2118 CG LEU A 135 -6.744 1.132 -5.195 1.00 0.00 C ATOM 2119 CD1 LEU A 135 -6.828 -0.353 -4.882 1.00 0.00 C ATOM 2120 CD2 LEU A 135 -5.325 1.643 -4.993 1.00 0.00 C ATOM 0 H LEU A 135 -8.341 3.299 -5.483 1.00 0.00 H new ATOM 0 HA LEU A 135 -6.035 3.118 -7.173 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -8.258 1.105 -6.706 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -6.645 0.769 -7.301 1.00 0.00 H new ATOM 0 HG LEU A 135 -7.401 1.665 -4.508 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -6.490 -0.529 -3.861 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -7.860 -0.689 -4.985 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -6.195 -0.907 -5.575 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -5.007 1.439 -3.970 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -4.654 1.139 -5.689 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -5.296 2.717 -5.175 1.00 0.00 H new ATOM 2132 N GLN A 136 -9.037 2.912 -8.551 1.00 0.00 N ATOM 2133 CA GLN A 136 -9.753 3.033 -9.816 1.00 0.00 C ATOM 2134 C GLN A 136 -9.184 4.170 -10.657 1.00 0.00 C ATOM 2135 O GLN A 136 -9.238 4.133 -11.887 1.00 0.00 O ATOM 2136 CB GLN A 136 -11.244 3.267 -9.562 1.00 0.00 C ATOM 2137 CG GLN A 136 -11.526 4.437 -8.633 1.00 0.00 C ATOM 2138 CD GLN A 136 -13.010 4.678 -8.434 1.00 0.00 C ATOM 2139 OE1 GLN A 136 -13.701 3.879 -7.802 1.00 0.00 O ATOM 2140 NE2 GLN A 136 -13.507 5.785 -8.973 1.00 0.00 N ATOM 0 H GLN A 136 -9.636 2.762 -7.739 1.00 0.00 H new ATOM 0 HA GLN A 136 -9.627 2.101 -10.366 1.00 0.00 H new ATOM 0 HB2 GLN A 136 -11.743 3.442 -10.515 1.00 0.00 H new ATOM 0 HB3 GLN A 136 -11.678 2.362 -9.136 1.00 0.00 H new ATOM 0 HG2 GLN A 136 -11.059 4.249 -7.666 1.00 0.00 H new ATOM 0 HG3 GLN A 136 -11.066 5.338 -9.039 1.00 0.00 H new ATOM 0 HE21 GLN A 136 -12.897 6.419 -9.489 1.00 0.00 H new ATOM 0 HE22 GLN A 136 -14.499 6.001 -8.871 1.00 0.00 H new ATOM 2149 N LEU A 137 -8.640 5.180 -9.987 1.00 0.00 N ATOM 2150 CA LEU A 137 -8.061 6.330 -10.674 1.00 0.00 C ATOM 2151 C LEU A 137 -7.071 5.883 -11.745 1.00 0.00 C ATOM 2152 O LEU A 137 -7.093 6.380 -12.871 1.00 0.00 O ATOM 2153 CB LEU A 137 -7.363 7.249 -9.670 1.00 0.00 C ATOM 2154 CG LEU A 137 -8.279 8.059 -8.752 1.00 0.00 C ATOM 2155 CD1 LEU A 137 -7.486 8.661 -7.602 1.00 0.00 C ATOM 2156 CD2 LEU A 137 -8.994 9.149 -9.537 1.00 0.00 C ATOM 0 H LEU A 137 -8.588 5.226 -8.969 1.00 0.00 H new ATOM 0 HA LEU A 137 -8.869 6.878 -11.159 1.00 0.00 H new ATOM 0 HB2 LEU A 137 -6.704 6.642 -9.049 1.00 0.00 H new ATOM 0 HB3 LEU A 137 -6.730 7.943 -10.222 1.00 0.00 H new ATOM 0 HG LEU A 137 -9.030 7.387 -8.336 1.00 0.00 H new ATOM 0 HD11 LEU A 137 -8.155 9.234 -6.959 1.00 0.00 H new ATOM 0 HD12 LEU A 137 -7.022 7.863 -7.023 1.00 0.00 H new ATOM 0 HD13 LEU A 137 -6.712 9.319 -7.998 1.00 0.00 H new ATOM 0 HD21 LEU A 137 -9.641 9.715 -8.867 1.00 0.00 H new ATOM 0 HD22 LEU A 137 -8.258 9.819 -9.982 1.00 0.00 H new ATOM 0 HD23 LEU A 137 -9.595 8.695 -10.325 1.00 0.00 H new ATOM 2168 N TRP A 138 -6.206 4.941 -11.387 1.00 0.00 N ATOM 2169 CA TRP A 138 -5.210 4.425 -12.318 1.00 0.00 C ATOM 2170 C TRP A 138 -5.847 4.071 -13.658 1.00 0.00 C ATOM 2171 O TRP A 138 -5.258 4.297 -14.714 1.00 0.00 O ATOM 2172 CB TRP A 138 -4.519 3.194 -11.728 1.00 0.00 C ATOM 2173 CG TRP A 138 -3.257 3.520 -10.987 1.00 0.00 C ATOM 2174 CD1 TRP A 138 -1.982 3.448 -11.470 1.00 0.00 C ATOM 2175 CD2 TRP A 138 -3.151 3.965 -9.631 1.00 0.00 C ATOM 2176 NE1 TRP A 138 -1.089 3.823 -10.495 1.00 0.00 N ATOM 2177 CE2 TRP A 138 -1.781 4.146 -9.358 1.00 0.00 C ATOM 2178 CE3 TRP A 138 -4.079 4.232 -8.621 1.00 0.00 C ATOM 2179 CZ2 TRP A 138 -1.320 4.579 -8.117 1.00 0.00 C ATOM 2180 CZ3 TRP A 138 -3.620 4.661 -7.390 1.00 0.00 C ATOM 2181 CH2 TRP A 138 -2.251 4.832 -7.147 1.00 0.00 C ATOM 0 H TRP A 138 -6.174 4.519 -10.459 1.00 0.00 H new ATOM 0 HA TRP A 138 -4.468 5.206 -12.485 1.00 0.00 H new ATOM 0 HB2 TRP A 138 -5.208 2.688 -11.052 1.00 0.00 H new ATOM 0 HB3 TRP A 138 -4.290 2.495 -12.532 1.00 0.00 H new ATOM 0 HD1 TRP A 138 -1.715 3.142 -12.471 1.00 0.00 H new ATOM 0 HE1 TRP A 138 -0.075 3.856 -10.601 1.00 0.00 H new ATOM 0 HE3 TRP A 138 -5.137 4.105 -8.799 1.00 0.00 H new ATOM 0 HZ2 TRP A 138 -0.265 4.710 -7.927 1.00 0.00 H new ATOM 0 HZ3 TRP A 138 -4.329 4.868 -6.602 1.00 0.00 H new ATOM 0 HH2 TRP A 138 -1.924 5.170 -6.175 1.00 0.00 H new ATOM 2192 N GLU A 139 -7.055 3.517 -13.605 1.00 0.00 N ATOM 2193 CA GLU A 139 -7.771 3.133 -14.816 1.00 0.00 C ATOM 2194 C GLU A 139 -8.136 4.361 -15.645 1.00 0.00 C ATOM 2195 O GLU A 139 -8.266 4.282 -16.867 1.00 0.00 O ATOM 2196 CB GLU A 139 -9.036 2.350 -14.460 1.00 0.00 C ATOM 2197 CG GLU A 139 -8.787 1.188 -13.513 1.00 0.00 C ATOM 2198 CD GLU A 139 -9.801 0.073 -13.678 1.00 0.00 C ATOM 2199 OE1 GLU A 139 -10.965 0.374 -14.017 1.00 0.00 O ATOM 2200 OE2 GLU A 139 -9.431 -1.101 -13.468 1.00 0.00 O ATOM 0 H GLU A 139 -7.557 3.325 -12.738 1.00 0.00 H new ATOM 0 HA GLU A 139 -7.114 2.498 -15.410 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -9.758 3.029 -14.006 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -9.488 1.970 -15.376 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -7.786 0.792 -13.685 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -8.814 1.550 -12.485 1.00 0.00 H new ATOM 2207 N ARG A 140 -8.300 5.495 -14.972 1.00 0.00 N ATOM 2208 CA ARG A 140 -8.652 6.739 -15.645 1.00 0.00 C ATOM 2209 C ARG A 140 -7.489 7.246 -16.493 1.00 0.00 C ATOM 2210 O ARG A 140 -7.693 7.851 -17.547 1.00 0.00 O ATOM 2211 CB ARG A 140 -9.052 7.803 -14.621 1.00 0.00 C ATOM 2212 CG ARG A 140 -10.159 7.357 -13.680 1.00 0.00 C ATOM 2213 CD ARG A 140 -11.532 7.541 -14.308 1.00 0.00 C ATOM 2214 NE ARG A 140 -12.519 6.624 -13.744 1.00 0.00 N ATOM 2215 CZ ARG A 140 -13.626 6.255 -14.379 1.00 0.00 C ATOM 2216 NH1 ARG A 140 -13.885 6.721 -15.592 1.00 0.00 N ATOM 2217 NH2 ARG A 140 -14.476 5.417 -13.799 1.00 0.00 N ATOM 0 H ARG A 140 -8.195 5.578 -13.961 1.00 0.00 H new ATOM 0 HA ARG A 140 -9.499 6.540 -16.302 1.00 0.00 H new ATOM 0 HB2 ARG A 140 -8.176 8.077 -14.033 1.00 0.00 H new ATOM 0 HB3 ARG A 140 -9.375 8.700 -15.149 1.00 0.00 H new ATOM 0 HG2 ARG A 140 -10.015 6.309 -13.418 1.00 0.00 H new ATOM 0 HG3 ARG A 140 -10.102 7.928 -12.753 1.00 0.00 H new ATOM 0 HD2 ARG A 140 -11.864 8.568 -14.158 1.00 0.00 H new ATOM 0 HD3 ARG A 140 -11.463 7.382 -15.384 1.00 0.00 H new ATOM 0 HE ARG A 140 -12.349 6.246 -12.812 1.00 0.00 H new ATOM 0 HH11 ARG A 140 -13.234 7.365 -16.041 1.00 0.00 H new ATOM 0 HH12 ARG A 140 -14.736 6.436 -16.077 1.00 0.00 H new ATOM 0 HH21 ARG A 140 -14.279 5.056 -12.865 1.00 0.00 H new ATOM 0 HH22 ARG A 140 -15.326 5.134 -14.287 1.00 0.00 H new ATOM 2231 N LEU A 141 -6.271 6.995 -16.027 1.00 0.00 N ATOM 2232 CA LEU A 141 -5.075 7.426 -16.743 1.00 0.00 C ATOM 2233 C LEU A 141 -5.143 7.021 -18.211 1.00 0.00 C ATOM 2234 O LEU A 141 -4.992 7.855 -19.104 1.00 0.00 O ATOM 2235 CB LEU A 141 -3.825 6.828 -16.094 1.00 0.00 C ATOM 2236 CG LEU A 141 -3.707 7.002 -14.579 1.00 0.00 C ATOM 2237 CD1 LEU A 141 -2.519 6.218 -14.043 1.00 0.00 C ATOM 2238 CD2 LEU A 141 -3.583 8.475 -14.219 1.00 0.00 C ATOM 0 H LEU A 141 -6.085 6.496 -15.157 1.00 0.00 H new ATOM 0 HA LEU A 141 -5.021 8.513 -16.688 1.00 0.00 H new ATOM 0 HB2 LEU A 141 -3.797 5.762 -16.321 1.00 0.00 H new ATOM 0 HB3 LEU A 141 -2.948 7.276 -16.561 1.00 0.00 H new ATOM 0 HG LEU A 141 -4.613 6.611 -14.116 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -2.451 6.354 -12.964 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -2.650 5.160 -14.268 1.00 0.00 H new ATOM 0 HD13 LEU A 141 -1.604 6.578 -14.513 1.00 0.00 H new ATOM 0 HD21 LEU A 141 -3.500 8.579 -13.137 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -2.694 8.892 -14.693 1.00 0.00 H new ATOM 0 HD23 LEU A 141 -4.466 9.011 -14.569 1.00 0.00 H new