USER MOD reduce.3.24.130724 H: found=0, std=0, add=1081, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1077 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 7 SER OG : rot -117:sc= -0.0995 USER MOD Set 1.2: A 18 LYS NZ :NH3+ 155:sc= 0 (180deg=-0.229) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 THR OG1 : rot 180:sc= -0.962 USER MOD Single : A 9 THR OG1 : rot 138:sc= 0.789 USER MOD Single : A 10 GLN : amide:sc= 0.658 K(o=0.66,f=-4.5!) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 ASN : amide:sc= 0.00543 K(o=0.0054,f=-1.5) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= -0.463 K(o=-0.46,f=-4.8!) USER MOD Single : A 38 ASN : amide:sc= -2.35 K(o=-2.4,f=-5.7!) USER MOD Single : A 39 MET CE :methyl -111:sc= -3.06! (180deg=-6.41!) USER MOD Single : A 43 HIS : no HD1:sc= -0.189 X(o=-0.19,f=-0.083) USER MOD Single : A 45 SER OG : rot 180:sc= 0.886 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot -30:sc= -3.58! USER MOD Single : A 55 HIS :FLIP no HD1:sc= -0.659 F(o=-1.4,f=-0.66) USER MOD Single : A 63 SER OG : rot 130:sc= -0.656 USER MOD Single : A 64 THR OG1 : rot 180:sc= -0.279 USER MOD Single : A 66 GLN : amide:sc= -0.222 K(o=-0.22,f=-2.2!) USER MOD Single : A 67 TYR OH : rot 6:sc= 0.256 USER MOD Single : A 69 SER OG : rot 180:sc= 0.0323 USER MOD Single : A 70 LYS NZ :NH3+ 140:sc= 0.163 (180deg=0) USER MOD Single : A 73 CYS SG : rot 180:sc= -0.323 USER MOD Single : A 75 ASN : amide:sc= 0.953 K(o=0.95,f=-0.027) USER MOD Single : A 77 LYS NZ :NH3+ 137:sc= 1.26 (180deg=0.165) USER MOD Single : A 80 LYS NZ :NH3+ 179:sc= -1.19 (180deg=-1.22) USER MOD Single : A 82 ASN : amide:sc= -0.357 X(o=-0.36,f=-0.014) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 ASN :FLIP amide:sc= -0.127 F(o=-1.1,f=-0.13) USER MOD Single : A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ -162:sc= 0 (180deg=-0.0394) USER MOD Single : A 100 GLN : amide:sc= -0.116 X(o=-0.12,f=-0.046) USER MOD Single : A 110 THR OG1 : rot 50:sc= 0.494 USER MOD Single : A 112 ASN : amide:sc= -0.412 X(o=-0.41,f=-0.45) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 GLN : amide:sc= -0.0194 K(o=-0.019,f=-0.91) USER MOD Single : A 120 LYS NZ :NH3+ -138:sc= -0.127 (180deg=-0.756) USER MOD Single : A 124 GLN : amide:sc= -0.0138 K(o=-0.014,f=-1.2) USER MOD Single : A 128 THR OG1 : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 133 ASN : amide:sc= -0.142 X(o=-0.14,f=-0.15) USER MOD Single : A 134 ASN : amide:sc= -0.0357 K(o=-0.036,f=-1.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 1.598 0.187 0.262 1.00 0.00 N ATOM 2 CA GLY A 1 2.685 0.007 -0.682 1.00 0.00 C ATOM 3 C GLY A 1 3.149 -1.433 -0.764 1.00 0.00 C ATOM 4 O GLY A 1 3.557 -2.019 0.239 1.00 0.00 O ATOM 0 H1 GLY A 1 1.317 1.188 0.281 1.00 0.00 H new ATOM 0 H2 GLY A 1 0.786 -0.395 -0.028 1.00 0.00 H new ATOM 0 H3 GLY A 1 1.910 -0.103 1.211 1.00 0.00 H new ATOM 0 HA2 GLY A 1 2.363 0.339 -1.669 1.00 0.00 H new ATOM 0 HA3 GLY A 1 3.523 0.640 -0.391 1.00 0.00 H new ATOM 8 N ILE A 2 3.087 -2.006 -1.962 1.00 0.00 N ATOM 9 CA ILE A 2 3.504 -3.387 -2.170 1.00 0.00 C ATOM 10 C ILE A 2 4.740 -3.460 -3.060 1.00 0.00 C ATOM 11 O ILE A 2 5.573 -4.355 -2.913 1.00 0.00 O ATOM 12 CB ILE A 2 2.379 -4.225 -2.804 1.00 0.00 C ATOM 13 CG1 ILE A 2 1.156 -4.257 -1.884 1.00 0.00 C ATOM 14 CG2 ILE A 2 2.868 -5.637 -3.093 1.00 0.00 C ATOM 15 CD1 ILE A 2 -0.084 -4.817 -2.546 1.00 0.00 C ATOM 0 H ILE A 2 2.752 -1.535 -2.803 1.00 0.00 H new ATOM 0 HA ILE A 2 3.742 -3.796 -1.188 1.00 0.00 H new ATOM 0 HB ILE A 2 2.089 -3.762 -3.747 1.00 0.00 H new ATOM 0 HG12 ILE A 2 1.390 -4.855 -1.003 1.00 0.00 H new ATOM 0 HG13 ILE A 2 0.947 -3.246 -1.536 1.00 0.00 H new ATOM 0 HG21 ILE A 2 2.061 -6.217 -3.541 1.00 0.00 H new ATOM 0 HG22 ILE A 2 3.711 -5.596 -3.782 1.00 0.00 H new ATOM 0 HG23 ILE A 2 3.182 -6.111 -2.163 1.00 0.00 H new ATOM 0 HD11 ILE A 2 -0.911 -4.809 -1.836 1.00 0.00 H new ATOM 0 HD12 ILE A 2 -0.343 -4.205 -3.410 1.00 0.00 H new ATOM 0 HD13 ILE A 2 0.107 -5.840 -2.870 1.00 0.00 H new ATOM 27 N THR A 3 4.855 -2.510 -3.984 1.00 0.00 N ATOM 28 CA THR A 3 5.989 -2.466 -4.897 1.00 0.00 C ATOM 29 C THR A 3 7.309 -2.549 -4.139 1.00 0.00 C ATOM 30 O THR A 3 7.444 -2.050 -3.022 1.00 0.00 O ATOM 31 CB THR A 3 5.977 -1.180 -5.745 1.00 0.00 C ATOM 32 OG1 THR A 3 7.249 -0.998 -6.378 1.00 0.00 O ATOM 33 CG2 THR A 3 5.656 0.033 -4.885 1.00 0.00 C ATOM 0 H THR A 3 4.176 -1.761 -4.119 1.00 0.00 H new ATOM 0 HA THR A 3 5.898 -3.329 -5.557 1.00 0.00 H new ATOM 0 HB THR A 3 5.203 -1.281 -6.506 1.00 0.00 H new ATOM 0 HG1 THR A 3 7.232 -0.179 -6.916 1.00 0.00 H new ATOM 0 HG21 THR A 3 5.653 0.929 -5.506 1.00 0.00 H new ATOM 0 HG22 THR A 3 4.675 -0.095 -4.428 1.00 0.00 H new ATOM 0 HG23 THR A 3 6.410 0.135 -4.104 1.00 0.00 H new ATOM 41 N PRO A 4 8.308 -3.195 -4.759 1.00 0.00 N ATOM 42 CA PRO A 4 9.637 -3.357 -4.161 1.00 0.00 C ATOM 43 C PRO A 4 10.403 -2.041 -4.085 1.00 0.00 C ATOM 44 O PRO A 4 10.947 -1.689 -3.038 1.00 0.00 O ATOM 45 CB PRO A 4 10.338 -4.330 -5.113 1.00 0.00 C ATOM 46 CG PRO A 4 9.649 -4.143 -6.420 1.00 0.00 C ATOM 47 CD PRO A 4 8.218 -3.815 -6.092 1.00 0.00 C ATOM 0 HA PRO A 4 9.580 -3.712 -3.132 1.00 0.00 H new ATOM 0 HB2 PRO A 4 11.403 -4.109 -5.191 1.00 0.00 H new ATOM 0 HB3 PRO A 4 10.251 -5.359 -4.763 1.00 0.00 H new ATOM 0 HG2 PRO A 4 10.112 -3.340 -6.993 1.00 0.00 H new ATOM 0 HG3 PRO A 4 9.713 -5.046 -7.027 1.00 0.00 H new ATOM 0 HD2 PRO A 4 7.784 -3.134 -6.824 1.00 0.00 H new ATOM 0 HD3 PRO A 4 7.594 -4.708 -6.079 1.00 0.00 H new ATOM 55 N ARG A 5 10.442 -1.319 -5.199 1.00 0.00 N ATOM 56 CA ARG A 5 11.143 -0.042 -5.258 1.00 0.00 C ATOM 57 C ARG A 5 10.538 0.861 -6.329 1.00 0.00 C ATOM 58 O ARG A 5 9.983 0.383 -7.319 1.00 0.00 O ATOM 59 CB ARG A 5 12.629 -0.264 -5.544 1.00 0.00 C ATOM 60 CG ARG A 5 13.467 -0.459 -4.291 1.00 0.00 C ATOM 61 CD ARG A 5 13.799 -1.926 -4.066 1.00 0.00 C ATOM 62 NE ARG A 5 14.570 -2.131 -2.842 1.00 0.00 N ATOM 63 CZ ARG A 5 14.983 -3.323 -2.425 1.00 0.00 C ATOM 64 NH1 ARG A 5 14.701 -4.410 -3.129 1.00 0.00 N ATOM 65 NH2 ARG A 5 15.681 -3.428 -1.301 1.00 0.00 N ATOM 0 H ARG A 5 9.996 -1.596 -6.074 1.00 0.00 H new ATOM 0 HA ARG A 5 11.035 0.448 -4.290 1.00 0.00 H new ATOM 0 HB2 ARG A 5 12.740 -1.138 -6.185 1.00 0.00 H new ATOM 0 HB3 ARG A 5 13.015 0.590 -6.100 1.00 0.00 H new ATOM 0 HG2 ARG A 5 14.390 0.115 -4.376 1.00 0.00 H new ATOM 0 HG3 ARG A 5 12.928 -0.070 -3.427 1.00 0.00 H new ATOM 0 HD2 ARG A 5 12.876 -2.503 -4.014 1.00 0.00 H new ATOM 0 HD3 ARG A 5 14.364 -2.305 -4.918 1.00 0.00 H new ATOM 0 HE ARG A 5 14.804 -1.315 -2.277 1.00 0.00 H new ATOM 0 HH11 ARG A 5 14.165 -4.333 -3.994 1.00 0.00 H new ATOM 0 HH12 ARG A 5 15.020 -5.324 -2.806 1.00 0.00 H new ATOM 0 HH21 ARG A 5 15.900 -2.593 -0.757 1.00 0.00 H new ATOM 0 HH22 ARG A 5 15.998 -4.343 -0.981 1.00 0.00 H new ATOM 79 N PHE A 6 10.648 2.170 -6.123 1.00 0.00 N ATOM 80 CA PHE A 6 10.110 3.140 -7.070 1.00 0.00 C ATOM 81 C PHE A 6 10.642 4.540 -6.774 1.00 0.00 C ATOM 82 O PHE A 6 10.794 4.926 -5.616 1.00 0.00 O ATOM 83 CB PHE A 6 8.581 3.142 -7.018 1.00 0.00 C ATOM 84 CG PHE A 6 8.025 3.685 -5.732 1.00 0.00 C ATOM 85 CD1 PHE A 6 8.101 2.946 -4.563 1.00 0.00 C ATOM 86 CD2 PHE A 6 7.427 4.934 -5.694 1.00 0.00 C ATOM 87 CE1 PHE A 6 7.591 3.443 -3.378 1.00 0.00 C ATOM 88 CE2 PHE A 6 6.915 5.436 -4.512 1.00 0.00 C ATOM 89 CZ PHE A 6 6.997 4.689 -3.353 1.00 0.00 C ATOM 0 H PHE A 6 11.104 2.583 -5.310 1.00 0.00 H new ATOM 0 HA PHE A 6 10.432 2.851 -8.071 1.00 0.00 H new ATOM 0 HB2 PHE A 6 8.198 3.735 -7.849 1.00 0.00 H new ATOM 0 HB3 PHE A 6 8.219 2.124 -7.159 1.00 0.00 H new ATOM 0 HD1 PHE A 6 8.564 1.970 -4.577 1.00 0.00 H new ATOM 0 HD2 PHE A 6 7.360 5.522 -6.597 1.00 0.00 H new ATOM 0 HE1 PHE A 6 7.657 2.857 -2.473 1.00 0.00 H new ATOM 0 HE2 PHE A 6 6.451 6.411 -4.495 1.00 0.00 H new ATOM 0 HZ PHE A 6 6.597 5.079 -2.429 1.00 0.00 H new ATOM 99 N SER A 7 10.924 5.294 -7.832 1.00 0.00 N ATOM 100 CA SER A 7 11.443 6.649 -7.687 1.00 0.00 C ATOM 101 C SER A 7 10.568 7.649 -8.437 1.00 0.00 C ATOM 102 O SER A 7 10.097 7.373 -9.540 1.00 0.00 O ATOM 103 CB SER A 7 12.881 6.725 -8.204 1.00 0.00 C ATOM 104 OG SER A 7 13.157 5.664 -9.102 1.00 0.00 O ATOM 0 H SER A 7 10.802 4.990 -8.798 1.00 0.00 H new ATOM 0 HA SER A 7 11.431 6.905 -6.627 1.00 0.00 H new ATOM 0 HB2 SER A 7 13.041 7.680 -8.705 1.00 0.00 H new ATOM 0 HB3 SER A 7 13.575 6.685 -7.365 1.00 0.00 H new ATOM 0 HG SER A 7 13.869 5.100 -8.733 1.00 0.00 H new ATOM 110 N ILE A 8 10.355 8.811 -7.829 1.00 0.00 N ATOM 111 CA ILE A 8 9.538 9.853 -8.438 1.00 0.00 C ATOM 112 C ILE A 8 10.389 11.049 -8.850 1.00 0.00 C ATOM 113 O ILE A 8 11.328 11.428 -8.150 1.00 0.00 O ATOM 114 CB ILE A 8 8.429 10.331 -7.481 1.00 0.00 C ATOM 115 CG1 ILE A 8 7.895 9.157 -6.659 1.00 0.00 C ATOM 116 CG2 ILE A 8 7.304 10.993 -8.263 1.00 0.00 C ATOM 117 CD1 ILE A 8 6.771 9.539 -5.720 1.00 0.00 C ATOM 0 H ILE A 8 10.737 9.055 -6.915 1.00 0.00 H new ATOM 0 HA ILE A 8 9.078 9.415 -9.324 1.00 0.00 H new ATOM 0 HB ILE A 8 8.851 11.067 -6.797 1.00 0.00 H new ATOM 0 HG12 ILE A 8 7.543 8.379 -7.337 1.00 0.00 H new ATOM 0 HG13 ILE A 8 8.712 8.728 -6.079 1.00 0.00 H new ATOM 0 HG21 ILE A 8 6.528 11.325 -7.573 1.00 0.00 H new ATOM 0 HG22 ILE A 8 7.696 11.851 -8.809 1.00 0.00 H new ATOM 0 HG23 ILE A 8 6.881 10.277 -8.968 1.00 0.00 H new ATOM 0 HD11 ILE A 8 6.442 8.658 -5.169 1.00 0.00 H new ATOM 0 HD12 ILE A 8 7.124 10.294 -5.018 1.00 0.00 H new ATOM 0 HD13 ILE A 8 5.937 9.940 -6.295 1.00 0.00 H new ATOM 129 N THR A 9 10.053 11.643 -9.992 1.00 0.00 N ATOM 130 CA THR A 9 10.786 12.797 -10.497 1.00 0.00 C ATOM 131 C THR A 9 9.840 13.943 -10.836 1.00 0.00 C ATOM 132 O THR A 9 8.715 13.720 -11.281 1.00 0.00 O ATOM 133 CB THR A 9 11.606 12.437 -11.750 1.00 0.00 C ATOM 134 OG1 THR A 9 12.092 11.093 -11.648 1.00 0.00 O ATOM 135 CG2 THR A 9 12.777 13.393 -11.923 1.00 0.00 C ATOM 0 H THR A 9 9.278 11.343 -10.584 1.00 0.00 H new ATOM 0 HA THR A 9 11.465 13.111 -9.705 1.00 0.00 H new ATOM 0 HB THR A 9 10.955 12.523 -12.620 1.00 0.00 H new ATOM 0 HG1 THR A 9 11.988 10.641 -12.511 1.00 0.00 H new ATOM 0 HG21 THR A 9 13.342 13.119 -12.814 1.00 0.00 H new ATOM 0 HG22 THR A 9 12.403 14.411 -12.029 1.00 0.00 H new ATOM 0 HG23 THR A 9 13.427 13.334 -11.050 1.00 0.00 H new ATOM 143 N GLN A 10 10.304 15.170 -10.622 1.00 0.00 N ATOM 144 CA GLN A 10 9.498 16.352 -10.905 1.00 0.00 C ATOM 145 C GLN A 10 10.115 17.175 -12.031 1.00 0.00 C ATOM 146 O GLN A 10 11.337 17.274 -12.143 1.00 0.00 O ATOM 147 CB GLN A 10 9.356 17.211 -9.648 1.00 0.00 C ATOM 148 CG GLN A 10 10.658 17.857 -9.202 1.00 0.00 C ATOM 149 CD GLN A 10 10.773 17.957 -7.694 1.00 0.00 C ATOM 150 OE1 GLN A 10 10.650 19.040 -7.121 1.00 0.00 O ATOM 151 NE2 GLN A 10 11.011 16.825 -7.042 1.00 0.00 N ATOM 0 H GLN A 10 11.234 15.372 -10.254 1.00 0.00 H new ATOM 0 HA GLN A 10 8.510 16.019 -11.223 1.00 0.00 H new ATOM 0 HB2 GLN A 10 8.618 17.991 -9.833 1.00 0.00 H new ATOM 0 HB3 GLN A 10 8.970 16.593 -8.837 1.00 0.00 H new ATOM 0 HG2 GLN A 10 11.497 17.279 -9.589 1.00 0.00 H new ATOM 0 HG3 GLN A 10 10.731 18.855 -9.635 1.00 0.00 H new ATOM 0 HE21 GLN A 10 11.106 15.950 -7.557 1.00 0.00 H new ATOM 0 HE22 GLN A 10 11.099 16.831 -6.026 1.00 0.00 H new ATOM 160 N ASP A 11 9.262 17.762 -12.864 1.00 0.00 N ATOM 161 CA ASP A 11 9.723 18.577 -13.981 1.00 0.00 C ATOM 162 C ASP A 11 8.956 19.894 -14.046 1.00 0.00 C ATOM 163 O ASP A 11 7.984 20.093 -13.318 1.00 0.00 O ATOM 164 CB ASP A 11 9.563 17.814 -15.297 1.00 0.00 C ATOM 165 CG ASP A 11 9.846 16.332 -15.145 1.00 0.00 C ATOM 166 OD1 ASP A 11 10.844 15.983 -14.480 1.00 0.00 O ATOM 167 OD2 ASP A 11 9.068 15.521 -15.689 1.00 0.00 O ATOM 0 H ASP A 11 8.248 17.688 -12.786 1.00 0.00 H new ATOM 0 HA ASP A 11 10.779 18.799 -13.825 1.00 0.00 H new ATOM 0 HB2 ASP A 11 8.549 17.951 -15.672 1.00 0.00 H new ATOM 0 HB3 ASP A 11 10.238 18.235 -16.042 1.00 0.00 H new ATOM 172 N GLU A 12 9.399 20.789 -14.923 1.00 0.00 N ATOM 173 CA GLU A 12 8.755 22.087 -15.081 1.00 0.00 C ATOM 174 C GLU A 12 7.623 22.012 -16.102 1.00 0.00 C ATOM 175 O GLU A 12 7.064 23.034 -16.500 1.00 0.00 O ATOM 176 CB GLU A 12 9.778 23.140 -15.513 1.00 0.00 C ATOM 177 CG GLU A 12 10.421 22.848 -16.859 1.00 0.00 C ATOM 178 CD GLU A 12 11.711 22.062 -16.730 1.00 0.00 C ATOM 179 OE1 GLU A 12 12.755 22.679 -16.430 1.00 0.00 O ATOM 180 OE2 GLU A 12 11.678 20.830 -16.928 1.00 0.00 O ATOM 0 H GLU A 12 10.201 20.639 -15.535 1.00 0.00 H new ATOM 0 HA GLU A 12 8.334 22.375 -14.118 1.00 0.00 H new ATOM 0 HB2 GLU A 12 9.289 24.113 -15.557 1.00 0.00 H new ATOM 0 HB3 GLU A 12 10.558 23.209 -14.755 1.00 0.00 H new ATOM 0 HG2 GLU A 12 9.720 22.289 -17.479 1.00 0.00 H new ATOM 0 HG3 GLU A 12 10.622 23.788 -17.373 1.00 0.00 H new ATOM 187 N GLU A 13 7.292 20.795 -16.522 1.00 0.00 N ATOM 188 CA GLU A 13 6.229 20.587 -17.497 1.00 0.00 C ATOM 189 C GLU A 13 5.251 19.519 -17.017 1.00 0.00 C ATOM 190 O GLU A 13 4.041 19.634 -17.215 1.00 0.00 O ATOM 191 CB GLU A 13 6.819 20.183 -18.850 1.00 0.00 C ATOM 192 CG GLU A 13 8.109 19.387 -18.738 1.00 0.00 C ATOM 193 CD GLU A 13 8.513 18.743 -20.050 1.00 0.00 C ATOM 194 OE1 GLU A 13 7.721 18.811 -21.013 1.00 0.00 O ATOM 195 OE2 GLU A 13 9.621 18.171 -20.112 1.00 0.00 O ATOM 0 H GLU A 13 7.745 19.939 -16.202 1.00 0.00 H new ATOM 0 HA GLU A 13 5.687 21.526 -17.611 1.00 0.00 H new ATOM 0 HB2 GLU A 13 6.083 19.592 -19.396 1.00 0.00 H new ATOM 0 HB3 GLU A 13 7.006 21.081 -19.438 1.00 0.00 H new ATOM 0 HG2 GLU A 13 8.909 20.045 -18.399 1.00 0.00 H new ATOM 0 HG3 GLU A 13 7.989 18.613 -17.979 1.00 0.00 H new ATOM 202 N PHE A 14 5.784 18.479 -16.384 1.00 0.00 N ATOM 203 CA PHE A 14 4.960 17.388 -15.876 1.00 0.00 C ATOM 204 C PHE A 14 5.729 16.555 -14.856 1.00 0.00 C ATOM 205 O PHE A 14 6.868 16.872 -14.512 1.00 0.00 O ATOM 206 CB PHE A 14 4.488 16.498 -17.028 1.00 0.00 C ATOM 207 CG PHE A 14 5.604 15.755 -17.706 1.00 0.00 C ATOM 208 CD1 PHE A 14 6.490 16.418 -18.539 1.00 0.00 C ATOM 209 CD2 PHE A 14 5.766 14.393 -17.510 1.00 0.00 C ATOM 210 CE1 PHE A 14 7.516 15.737 -19.165 1.00 0.00 C ATOM 211 CE2 PHE A 14 6.791 13.706 -18.132 1.00 0.00 C ATOM 212 CZ PHE A 14 7.668 14.379 -18.960 1.00 0.00 C ATOM 0 H PHE A 14 6.783 18.369 -16.211 1.00 0.00 H new ATOM 0 HA PHE A 14 4.091 17.822 -15.382 1.00 0.00 H new ATOM 0 HB2 PHE A 14 3.762 15.779 -16.648 1.00 0.00 H new ATOM 0 HB3 PHE A 14 3.972 17.114 -17.765 1.00 0.00 H new ATOM 0 HD1 PHE A 14 6.377 17.480 -18.701 1.00 0.00 H new ATOM 0 HD2 PHE A 14 5.083 13.862 -16.863 1.00 0.00 H new ATOM 0 HE1 PHE A 14 8.199 16.265 -19.814 1.00 0.00 H new ATOM 0 HE2 PHE A 14 6.906 12.644 -17.971 1.00 0.00 H new ATOM 0 HZ PHE A 14 8.471 13.845 -19.446 1.00 0.00 H new ATOM 222 N ILE A 15 5.098 15.488 -14.376 1.00 0.00 N ATOM 223 CA ILE A 15 5.723 14.609 -13.396 1.00 0.00 C ATOM 224 C ILE A 15 6.157 13.294 -14.035 1.00 0.00 C ATOM 225 O ILE A 15 5.462 12.748 -14.891 1.00 0.00 O ATOM 226 CB ILE A 15 4.772 14.307 -12.223 1.00 0.00 C ATOM 227 CG1 ILE A 15 4.785 15.460 -11.217 1.00 0.00 C ATOM 228 CG2 ILE A 15 5.163 13.002 -11.546 1.00 0.00 C ATOM 229 CD1 ILE A 15 6.082 15.575 -10.447 1.00 0.00 C ATOM 0 H ILE A 15 4.155 15.212 -14.650 1.00 0.00 H new ATOM 0 HA ILE A 15 6.600 15.133 -13.016 1.00 0.00 H new ATOM 0 HB ILE A 15 3.760 14.202 -12.614 1.00 0.00 H new ATOM 0 HG12 ILE A 15 4.602 16.395 -11.746 1.00 0.00 H new ATOM 0 HG13 ILE A 15 3.964 15.326 -10.512 1.00 0.00 H new ATOM 0 HG21 ILE A 15 4.481 12.803 -10.719 1.00 0.00 H new ATOM 0 HG22 ILE A 15 5.107 12.187 -12.267 1.00 0.00 H new ATOM 0 HG23 ILE A 15 6.182 13.080 -11.166 1.00 0.00 H new ATOM 0 HD11 ILE A 15 6.020 16.413 -9.753 1.00 0.00 H new ATOM 0 HD12 ILE A 15 6.257 14.655 -9.890 1.00 0.00 H new ATOM 0 HD13 ILE A 15 6.905 15.740 -11.143 1.00 0.00 H new ATOM 241 N PHE A 16 7.312 12.790 -13.611 1.00 0.00 N ATOM 242 CA PHE A 16 7.839 11.538 -14.141 1.00 0.00 C ATOM 243 C PHE A 16 8.019 10.509 -13.029 1.00 0.00 C ATOM 244 O PHE A 16 8.996 10.552 -12.280 1.00 0.00 O ATOM 245 CB PHE A 16 9.175 11.781 -14.847 1.00 0.00 C ATOM 246 CG PHE A 16 9.987 10.532 -15.039 1.00 0.00 C ATOM 247 CD1 PHE A 16 9.409 9.387 -15.561 1.00 0.00 C ATOM 248 CD2 PHE A 16 11.330 10.504 -14.696 1.00 0.00 C ATOM 249 CE1 PHE A 16 10.154 8.236 -15.739 1.00 0.00 C ATOM 250 CE2 PHE A 16 12.080 9.357 -14.872 1.00 0.00 C ATOM 251 CZ PHE A 16 11.491 8.221 -15.393 1.00 0.00 C ATOM 0 H PHE A 16 7.900 13.229 -12.903 1.00 0.00 H new ATOM 0 HA PHE A 16 7.121 11.147 -14.861 1.00 0.00 H new ATOM 0 HB2 PHE A 16 8.986 12.235 -15.820 1.00 0.00 H new ATOM 0 HB3 PHE A 16 9.757 12.498 -14.269 1.00 0.00 H new ATOM 0 HD1 PHE A 16 8.364 9.393 -15.832 1.00 0.00 H new ATOM 0 HD2 PHE A 16 11.795 11.389 -14.287 1.00 0.00 H new ATOM 0 HE1 PHE A 16 9.691 7.350 -16.148 1.00 0.00 H new ATOM 0 HE2 PHE A 16 13.126 9.348 -14.603 1.00 0.00 H new ATOM 0 HZ PHE A 16 12.075 7.323 -15.529 1.00 0.00 H new ATOM 261 N LEU A 17 7.069 9.586 -12.926 1.00 0.00 N ATOM 262 CA LEU A 17 7.121 8.546 -11.905 1.00 0.00 C ATOM 263 C LEU A 17 7.726 7.262 -12.465 1.00 0.00 C ATOM 264 O LEU A 17 7.233 6.708 -13.447 1.00 0.00 O ATOM 265 CB LEU A 17 5.719 8.267 -11.361 1.00 0.00 C ATOM 266 CG LEU A 17 5.604 7.121 -10.355 1.00 0.00 C ATOM 267 CD1 LEU A 17 5.478 5.788 -11.077 1.00 0.00 C ATOM 268 CD2 LEU A 17 6.804 7.111 -9.419 1.00 0.00 C ATOM 0 H LEU A 17 6.254 9.537 -13.537 1.00 0.00 H new ATOM 0 HA LEU A 17 7.756 8.901 -11.093 1.00 0.00 H new ATOM 0 HB2 LEU A 17 5.347 9.176 -10.889 1.00 0.00 H new ATOM 0 HB3 LEU A 17 5.061 8.052 -12.203 1.00 0.00 H new ATOM 0 HG LEU A 17 4.704 7.275 -9.759 1.00 0.00 H new ATOM 0 HD11 LEU A 17 5.397 4.984 -10.345 1.00 0.00 H new ATOM 0 HD12 LEU A 17 4.588 5.797 -11.706 1.00 0.00 H new ATOM 0 HD13 LEU A 17 6.359 5.626 -11.698 1.00 0.00 H new ATOM 0 HD21 LEU A 17 6.705 6.289 -8.710 1.00 0.00 H new ATOM 0 HD22 LEU A 17 7.717 6.982 -10.000 1.00 0.00 H new ATOM 0 HD23 LEU A 17 6.850 8.055 -8.876 1.00 0.00 H new ATOM 280 N LYS A 18 8.797 6.794 -11.833 1.00 0.00 N ATOM 281 CA LYS A 18 9.468 5.574 -12.264 1.00 0.00 C ATOM 282 C LYS A 18 9.255 4.450 -11.256 1.00 0.00 C ATOM 283 O LYS A 18 9.247 4.682 -10.047 1.00 0.00 O ATOM 284 CB LYS A 18 10.965 5.830 -12.451 1.00 0.00 C ATOM 285 CG LYS A 18 11.841 4.671 -12.005 1.00 0.00 C ATOM 286 CD LYS A 18 13.263 4.816 -12.521 1.00 0.00 C ATOM 287 CE LYS A 18 13.871 6.148 -12.110 1.00 0.00 C ATOM 288 NZ LYS A 18 15.327 6.027 -11.822 1.00 0.00 N ATOM 0 H LYS A 18 9.219 7.242 -11.020 1.00 0.00 H new ATOM 0 HA LYS A 18 9.036 5.269 -13.217 1.00 0.00 H new ATOM 0 HB2 LYS A 18 11.161 6.039 -13.503 1.00 0.00 H new ATOM 0 HB3 LYS A 18 11.245 6.722 -11.891 1.00 0.00 H new ATOM 0 HG2 LYS A 18 11.852 4.620 -10.916 1.00 0.00 H new ATOM 0 HG3 LYS A 18 11.416 3.734 -12.364 1.00 0.00 H new ATOM 0 HD2 LYS A 18 13.876 4.001 -12.136 1.00 0.00 H new ATOM 0 HD3 LYS A 18 13.267 4.733 -13.608 1.00 0.00 H new ATOM 0 HE2 LYS A 18 13.717 6.878 -12.905 1.00 0.00 H new ATOM 0 HE3 LYS A 18 13.356 6.525 -11.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 15.786 6.950 -11.962 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 15.462 5.719 -10.838 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 15.751 5.328 -12.465 1.00 0.00 H new ATOM 302 N ILE A 19 9.086 3.232 -11.761 1.00 0.00 N ATOM 303 CA ILE A 19 8.876 2.073 -10.903 1.00 0.00 C ATOM 304 C ILE A 19 9.855 0.954 -11.242 1.00 0.00 C ATOM 305 O ILE A 19 10.041 0.609 -12.410 1.00 0.00 O ATOM 306 CB ILE A 19 7.438 1.535 -11.025 1.00 0.00 C ATOM 307 CG1 ILE A 19 6.436 2.691 -11.011 1.00 0.00 C ATOM 308 CG2 ILE A 19 7.141 0.556 -9.899 1.00 0.00 C ATOM 309 CD1 ILE A 19 5.787 2.945 -12.354 1.00 0.00 C ATOM 0 H ILE A 19 9.090 3.023 -12.759 1.00 0.00 H new ATOM 0 HA ILE A 19 9.046 2.404 -9.878 1.00 0.00 H new ATOM 0 HB ILE A 19 7.342 1.007 -11.974 1.00 0.00 H new ATOM 0 HG12 ILE A 19 5.660 2.479 -10.276 1.00 0.00 H new ATOM 0 HG13 ILE A 19 6.945 3.598 -10.685 1.00 0.00 H new ATOM 0 HG21 ILE A 19 6.121 0.185 -9.999 1.00 0.00 H new ATOM 0 HG22 ILE A 19 7.838 -0.280 -9.951 1.00 0.00 H new ATOM 0 HG23 ILE A 19 7.251 1.061 -8.939 1.00 0.00 H new ATOM 0 HD11 ILE A 19 5.089 3.778 -12.269 1.00 0.00 H new ATOM 0 HD12 ILE A 19 6.554 3.188 -13.089 1.00 0.00 H new ATOM 0 HD13 ILE A 19 5.249 2.052 -12.673 1.00 0.00 H new ATOM 321 N PHE A 20 10.478 0.388 -10.214 1.00 0.00 N ATOM 322 CA PHE A 20 11.438 -0.693 -10.402 1.00 0.00 C ATOM 323 C PHE A 20 10.761 -2.053 -10.257 1.00 0.00 C ATOM 324 O PHE A 20 10.309 -2.420 -9.172 1.00 0.00 O ATOM 325 CB PHE A 20 12.582 -0.570 -9.393 1.00 0.00 C ATOM 326 CG PHE A 20 13.351 0.715 -9.512 1.00 0.00 C ATOM 327 CD1 PHE A 20 14.223 0.920 -10.569 1.00 0.00 C ATOM 328 CD2 PHE A 20 13.201 1.717 -8.568 1.00 0.00 C ATOM 329 CE1 PHE A 20 14.932 2.101 -10.681 1.00 0.00 C ATOM 330 CE2 PHE A 20 13.908 2.901 -8.674 1.00 0.00 C ATOM 331 CZ PHE A 20 14.773 3.093 -9.733 1.00 0.00 C ATOM 0 H PHE A 20 10.335 0.660 -9.241 1.00 0.00 H new ATOM 0 HA PHE A 20 11.843 -0.614 -11.411 1.00 0.00 H new ATOM 0 HB2 PHE A 20 12.176 -0.649 -8.384 1.00 0.00 H new ATOM 0 HB3 PHE A 20 13.266 -1.408 -9.528 1.00 0.00 H new ATOM 0 HD1 PHE A 20 14.350 0.148 -11.314 1.00 0.00 H new ATOM 0 HD2 PHE A 20 12.524 1.572 -7.739 1.00 0.00 H new ATOM 0 HE1 PHE A 20 15.610 2.248 -11.509 1.00 0.00 H new ATOM 0 HE2 PHE A 20 13.784 3.674 -7.930 1.00 0.00 H new ATOM 0 HZ PHE A 20 15.324 4.017 -9.820 1.00 0.00 H new ATOM 341 N ILE A 21 10.695 -2.794 -11.357 1.00 0.00 N ATOM 342 CA ILE A 21 10.073 -4.113 -11.353 1.00 0.00 C ATOM 343 C ILE A 21 10.794 -5.063 -12.303 1.00 0.00 C ATOM 344 O ILE A 21 11.795 -4.699 -12.921 1.00 0.00 O ATOM 345 CB ILE A 21 8.588 -4.037 -11.751 1.00 0.00 C ATOM 346 CG1 ILE A 21 8.432 -3.310 -13.088 1.00 0.00 C ATOM 347 CG2 ILE A 21 7.784 -3.337 -10.665 1.00 0.00 C ATOM 348 CD1 ILE A 21 7.275 -3.818 -13.921 1.00 0.00 C ATOM 0 H ILE A 21 11.064 -2.504 -12.263 1.00 0.00 H new ATOM 0 HA ILE A 21 10.148 -4.494 -10.335 1.00 0.00 H new ATOM 0 HB ILE A 21 8.205 -5.051 -11.864 1.00 0.00 H new ATOM 0 HG12 ILE A 21 8.294 -2.245 -12.899 1.00 0.00 H new ATOM 0 HG13 ILE A 21 9.354 -3.415 -13.659 1.00 0.00 H new ATOM 0 HG21 ILE A 21 6.736 -3.291 -10.961 1.00 0.00 H new ATOM 0 HG22 ILE A 21 7.873 -3.892 -9.731 1.00 0.00 H new ATOM 0 HG23 ILE A 21 8.166 -2.326 -10.524 1.00 0.00 H new ATOM 0 HD11 ILE A 21 7.225 -3.257 -14.854 1.00 0.00 H new ATOM 0 HD12 ILE A 21 7.421 -4.876 -14.141 1.00 0.00 H new ATOM 0 HD13 ILE A 21 6.344 -3.688 -13.369 1.00 0.00 H new ATOM 360 N SER A 22 10.278 -6.283 -12.416 1.00 0.00 N ATOM 361 CA SER A 22 10.873 -7.287 -13.290 1.00 0.00 C ATOM 362 C SER A 22 9.799 -8.012 -14.095 1.00 0.00 C ATOM 363 O SER A 22 8.615 -7.694 -13.998 1.00 0.00 O ATOM 364 CB SER A 22 11.679 -8.295 -12.468 1.00 0.00 C ATOM 365 OG SER A 22 13.070 -8.139 -12.690 1.00 0.00 O ATOM 0 H SER A 22 9.449 -6.600 -11.913 1.00 0.00 H new ATOM 0 HA SER A 22 11.541 -6.779 -13.985 1.00 0.00 H new ATOM 0 HB2 SER A 22 11.460 -8.163 -11.408 1.00 0.00 H new ATOM 0 HB3 SER A 22 11.377 -9.308 -12.732 1.00 0.00 H new ATOM 0 HG SER A 22 13.563 -8.794 -12.152 1.00 0.00 H new ATOM 371 N ASN A 23 10.223 -8.989 -14.890 1.00 0.00 N ATOM 372 CA ASN A 23 9.299 -9.760 -15.713 1.00 0.00 C ATOM 373 C ASN A 23 8.886 -11.048 -15.007 1.00 0.00 C ATOM 374 O ASN A 23 8.584 -12.052 -15.653 1.00 0.00 O ATOM 375 CB ASN A 23 9.938 -10.088 -17.064 1.00 0.00 C ATOM 376 CG ASN A 23 11.357 -10.604 -16.923 1.00 0.00 C ATOM 377 OD1 ASN A 23 11.605 -11.587 -16.225 1.00 0.00 O ATOM 378 ND2 ASN A 23 12.296 -9.939 -17.585 1.00 0.00 N ATOM 0 H ASN A 23 11.201 -9.265 -14.982 1.00 0.00 H new ATOM 0 HA ASN A 23 8.407 -9.155 -15.878 1.00 0.00 H new ATOM 0 HB2 ASN A 23 9.332 -10.835 -17.577 1.00 0.00 H new ATOM 0 HB3 ASN A 23 9.940 -9.195 -17.688 1.00 0.00 H new ATOM 0 HD21 ASN A 23 13.270 -10.238 -17.527 1.00 0.00 H new ATOM 0 HD22 ASN A 23 12.044 -9.129 -18.152 1.00 0.00 H new ATOM 385 N ILE A 24 8.876 -11.011 -13.679 1.00 0.00 N ATOM 386 CA ILE A 24 8.499 -12.175 -12.886 1.00 0.00 C ATOM 387 C ILE A 24 7.093 -12.648 -13.238 1.00 0.00 C ATOM 388 O ILE A 24 6.745 -13.809 -13.023 1.00 0.00 O ATOM 389 CB ILE A 24 8.564 -11.873 -11.377 1.00 0.00 C ATOM 390 CG1 ILE A 24 7.680 -10.672 -11.036 1.00 0.00 C ATOM 391 CG2 ILE A 24 10.002 -11.616 -10.950 1.00 0.00 C ATOM 392 CD1 ILE A 24 8.459 -9.403 -10.768 1.00 0.00 C ATOM 0 H ILE A 24 9.124 -10.188 -13.130 1.00 0.00 H new ATOM 0 HA ILE A 24 9.214 -12.963 -13.122 1.00 0.00 H new ATOM 0 HB ILE A 24 8.192 -12.741 -10.832 1.00 0.00 H new ATOM 0 HG12 ILE A 24 6.987 -10.496 -11.859 1.00 0.00 H new ATOM 0 HG13 ILE A 24 7.079 -10.911 -10.159 1.00 0.00 H new ATOM 0 HG21 ILE A 24 10.032 -11.404 -9.881 1.00 0.00 H new ATOM 0 HG22 ILE A 24 10.608 -12.497 -11.162 1.00 0.00 H new ATOM 0 HG23 ILE A 24 10.398 -10.762 -11.500 1.00 0.00 H new ATOM 0 HD11 ILE A 24 7.767 -8.594 -10.533 1.00 0.00 H new ATOM 0 HD12 ILE A 24 9.132 -9.561 -9.926 1.00 0.00 H new ATOM 0 HD13 ILE A 24 9.039 -9.139 -11.652 1.00 0.00 H new ATOM 404 N ARG A 25 6.288 -11.740 -13.781 1.00 0.00 N ATOM 405 CA ARG A 25 4.919 -12.065 -14.164 1.00 0.00 C ATOM 406 C ARG A 25 4.263 -10.891 -14.885 1.00 0.00 C ATOM 407 O ARG A 25 3.094 -10.582 -14.655 1.00 0.00 O ATOM 408 CB ARG A 25 4.098 -12.442 -12.930 1.00 0.00 C ATOM 409 CG ARG A 25 3.867 -11.283 -11.974 1.00 0.00 C ATOM 410 CD ARG A 25 4.582 -11.502 -10.650 1.00 0.00 C ATOM 411 NE ARG A 25 3.725 -12.158 -9.667 1.00 0.00 N ATOM 412 CZ ARG A 25 4.188 -12.787 -8.592 1.00 0.00 C ATOM 413 NH1 ARG A 25 5.493 -12.844 -8.364 1.00 0.00 N ATOM 414 NH2 ARG A 25 3.344 -13.361 -7.743 1.00 0.00 N ATOM 0 H ARG A 25 6.560 -10.774 -13.965 1.00 0.00 H new ATOM 0 HA ARG A 25 4.951 -12.916 -14.845 1.00 0.00 H new ATOM 0 HB2 ARG A 25 3.133 -12.834 -13.252 1.00 0.00 H new ATOM 0 HB3 ARG A 25 4.607 -13.245 -12.397 1.00 0.00 H new ATOM 0 HG2 ARG A 25 4.219 -10.358 -12.430 1.00 0.00 H new ATOM 0 HG3 ARG A 25 2.798 -11.164 -11.796 1.00 0.00 H new ATOM 0 HD2 ARG A 25 5.473 -12.107 -10.815 1.00 0.00 H new ATOM 0 HD3 ARG A 25 4.917 -10.543 -10.256 1.00 0.00 H new ATOM 0 HE ARG A 25 2.716 -12.132 -9.813 1.00 0.00 H new ATOM 0 HH11 ARG A 25 6.144 -12.404 -9.015 1.00 0.00 H new ATOM 0 HH12 ARG A 25 5.846 -13.327 -7.538 1.00 0.00 H new ATOM 0 HH21 ARG A 25 2.340 -13.319 -7.916 1.00 0.00 H new ATOM 0 HH22 ARG A 25 3.700 -13.844 -6.918 1.00 0.00 H new ATOM 428 N PHE A 26 5.025 -10.239 -15.758 1.00 0.00 N ATOM 429 CA PHE A 26 4.519 -9.098 -16.512 1.00 0.00 C ATOM 430 C PHE A 26 3.678 -9.560 -17.698 1.00 0.00 C ATOM 431 O PHE A 26 4.200 -9.801 -18.787 1.00 0.00 O ATOM 432 CB PHE A 26 5.679 -8.229 -17.002 1.00 0.00 C ATOM 433 CG PHE A 26 5.312 -6.783 -17.177 1.00 0.00 C ATOM 434 CD1 PHE A 26 4.930 -6.015 -16.090 1.00 0.00 C ATOM 435 CD2 PHE A 26 5.349 -6.192 -18.430 1.00 0.00 C ATOM 436 CE1 PHE A 26 4.592 -4.684 -16.247 1.00 0.00 C ATOM 437 CE2 PHE A 26 5.012 -4.862 -18.594 1.00 0.00 C ATOM 438 CZ PHE A 26 4.632 -4.107 -17.501 1.00 0.00 C ATOM 0 H PHE A 26 5.995 -10.482 -15.960 1.00 0.00 H new ATOM 0 HA PHE A 26 3.887 -8.507 -15.849 1.00 0.00 H new ATOM 0 HB2 PHE A 26 6.503 -8.303 -16.292 1.00 0.00 H new ATOM 0 HB3 PHE A 26 6.040 -8.622 -17.952 1.00 0.00 H new ATOM 0 HD1 PHE A 26 4.896 -6.462 -15.107 1.00 0.00 H new ATOM 0 HD2 PHE A 26 5.645 -6.778 -19.288 1.00 0.00 H new ATOM 0 HE1 PHE A 26 4.297 -4.096 -15.390 1.00 0.00 H new ATOM 0 HE2 PHE A 26 5.046 -4.413 -19.576 1.00 0.00 H new ATOM 0 HZ PHE A 26 4.367 -3.068 -17.627 1.00 0.00 H new ATOM 448 N SER A 27 2.372 -9.681 -17.479 1.00 0.00 N ATOM 449 CA SER A 27 1.459 -10.118 -18.528 1.00 0.00 C ATOM 450 C SER A 27 1.045 -8.945 -19.412 1.00 0.00 C ATOM 451 O SER A 27 0.538 -9.135 -20.517 1.00 0.00 O ATOM 452 CB SER A 27 0.218 -10.771 -17.914 1.00 0.00 C ATOM 453 OG SER A 27 0.549 -11.988 -17.270 1.00 0.00 O ATOM 0 H SER A 27 1.923 -9.482 -16.585 1.00 0.00 H new ATOM 0 HA SER A 27 1.979 -10.850 -19.146 1.00 0.00 H new ATOM 0 HB2 SER A 27 -0.239 -10.089 -17.197 1.00 0.00 H new ATOM 0 HB3 SER A 27 -0.522 -10.957 -18.693 1.00 0.00 H new ATOM 0 HG SER A 27 -0.260 -12.385 -16.885 1.00 0.00 H new ATOM 459 N ALA A 28 1.267 -7.732 -18.916 1.00 0.00 N ATOM 460 CA ALA A 28 0.920 -6.528 -19.660 1.00 0.00 C ATOM 461 C ALA A 28 -0.569 -6.496 -19.990 1.00 0.00 C ATOM 462 O ALA A 28 -0.986 -5.866 -20.962 1.00 0.00 O ATOM 463 CB ALA A 28 1.746 -6.438 -20.935 1.00 0.00 C ATOM 0 H ALA A 28 1.685 -7.558 -18.002 1.00 0.00 H new ATOM 0 HA ALA A 28 1.146 -5.666 -19.032 1.00 0.00 H new ATOM 0 HB1 ALA A 28 1.476 -5.534 -21.480 1.00 0.00 H new ATOM 0 HB2 ALA A 28 2.805 -6.406 -20.681 1.00 0.00 H new ATOM 0 HB3 ALA A 28 1.549 -7.310 -21.558 1.00 0.00 H new ATOM 469 N VAL A 29 -1.365 -7.179 -19.174 1.00 0.00 N ATOM 470 CA VAL A 29 -2.808 -7.228 -19.378 1.00 0.00 C ATOM 471 C VAL A 29 -3.547 -6.507 -18.256 1.00 0.00 C ATOM 472 O VAL A 29 -4.674 -6.047 -18.436 1.00 0.00 O ATOM 473 CB VAL A 29 -3.314 -8.680 -19.461 1.00 0.00 C ATOM 474 CG1 VAL A 29 -3.107 -9.394 -18.134 1.00 0.00 C ATOM 475 CG2 VAL A 29 -4.779 -8.711 -19.870 1.00 0.00 C ATOM 0 H VAL A 29 -1.035 -7.706 -18.365 1.00 0.00 H new ATOM 0 HA VAL A 29 -3.011 -6.726 -20.324 1.00 0.00 H new ATOM 0 HB VAL A 29 -2.737 -9.205 -20.222 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -3.470 -10.419 -18.212 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -2.045 -9.403 -17.888 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -3.657 -8.872 -17.351 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -5.120 -9.745 -19.924 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -5.374 -8.171 -19.134 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -4.894 -8.240 -20.846 1.00 0.00 H new ATOM 485 N GLY A 30 -2.903 -6.412 -17.097 1.00 0.00 N ATOM 486 CA GLY A 30 -3.514 -5.745 -15.962 1.00 0.00 C ATOM 487 C GLY A 30 -2.980 -4.342 -15.757 1.00 0.00 C ATOM 488 O GLY A 30 -3.219 -3.723 -14.719 1.00 0.00 O ATOM 0 H GLY A 30 -1.970 -6.785 -16.924 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -4.593 -5.702 -16.108 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -3.338 -6.333 -15.061 1.00 0.00 H new ATOM 492 N LEU A 31 -2.252 -3.837 -16.747 1.00 0.00 N ATOM 493 CA LEU A 31 -1.680 -2.498 -16.671 1.00 0.00 C ATOM 494 C LEU A 31 -2.752 -1.434 -16.888 1.00 0.00 C ATOM 495 O LEU A 31 -3.465 -1.454 -17.891 1.00 0.00 O ATOM 496 CB LEU A 31 -0.569 -2.336 -17.710 1.00 0.00 C ATOM 497 CG LEU A 31 0.361 -3.537 -17.890 1.00 0.00 C ATOM 498 CD1 LEU A 31 1.582 -3.148 -18.708 1.00 0.00 C ATOM 499 CD2 LEU A 31 0.778 -4.096 -16.538 1.00 0.00 C ATOM 0 H LEU A 31 -2.044 -4.335 -17.612 1.00 0.00 H new ATOM 0 HA LEU A 31 -1.259 -2.367 -15.674 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -1.029 -2.110 -18.672 1.00 0.00 H new ATOM 0 HB3 LEU A 31 0.035 -1.472 -17.435 1.00 0.00 H new ATOM 0 HG LEU A 31 -0.180 -4.314 -18.430 1.00 0.00 H new ATOM 0 HD11 LEU A 31 2.232 -4.015 -18.826 1.00 0.00 H new ATOM 0 HD12 LEU A 31 1.265 -2.796 -19.690 1.00 0.00 H new ATOM 0 HD13 LEU A 31 2.125 -2.354 -18.196 1.00 0.00 H new ATOM 0 HD21 LEU A 31 1.439 -4.950 -16.686 1.00 0.00 H new ATOM 0 HD22 LEU A 31 1.301 -3.326 -15.971 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -0.107 -4.414 -15.987 1.00 0.00 H new ATOM 511 N GLU A 32 -2.859 -0.507 -15.941 1.00 0.00 N ATOM 512 CA GLU A 32 -3.843 0.565 -16.030 1.00 0.00 C ATOM 513 C GLU A 32 -3.693 1.540 -14.866 1.00 0.00 C ATOM 514 O GLU A 32 -4.337 1.386 -13.827 1.00 0.00 O ATOM 515 CB GLU A 32 -5.260 -0.014 -16.046 1.00 0.00 C ATOM 516 CG GLU A 32 -6.265 0.858 -16.781 1.00 0.00 C ATOM 517 CD GLU A 32 -5.954 0.987 -18.259 1.00 0.00 C ATOM 518 OE1 GLU A 32 -5.413 0.021 -18.838 1.00 0.00 O ATOM 519 OE2 GLU A 32 -6.250 2.054 -18.837 1.00 0.00 O ATOM 0 H GLU A 32 -2.277 -0.477 -15.104 1.00 0.00 H new ATOM 0 HA GLU A 32 -3.669 1.107 -16.959 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -5.236 -0.999 -16.513 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -5.597 -0.156 -15.019 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -7.263 0.437 -16.659 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -6.279 1.850 -16.329 1.00 0.00 H new ATOM 526 N ILE A 33 -2.839 2.541 -15.047 1.00 0.00 N ATOM 527 CA ILE A 33 -2.605 3.541 -14.012 1.00 0.00 C ATOM 528 C ILE A 33 -3.474 4.774 -14.233 1.00 0.00 C ATOM 529 O ILE A 33 -3.538 5.311 -15.339 1.00 0.00 O ATOM 530 CB ILE A 33 -1.127 3.970 -13.969 1.00 0.00 C ATOM 531 CG1 ILE A 33 -0.223 2.748 -13.795 1.00 0.00 C ATOM 532 CG2 ILE A 33 -0.898 4.969 -12.844 1.00 0.00 C ATOM 533 CD1 ILE A 33 1.253 3.075 -13.844 1.00 0.00 C ATOM 0 H ILE A 33 -2.298 2.682 -15.900 1.00 0.00 H new ATOM 0 HA ILE A 33 -2.869 3.079 -13.061 1.00 0.00 H new ATOM 0 HB ILE A 33 -0.877 4.452 -14.914 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -0.450 2.272 -12.841 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -0.452 2.023 -14.576 1.00 0.00 H new ATOM 0 HG21 ILE A 33 0.151 5.263 -12.826 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -1.519 5.850 -13.008 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -1.163 4.511 -11.891 1.00 0.00 H new ATOM 0 HD11 ILE A 33 1.833 2.161 -13.714 1.00 0.00 H new ATOM 0 HD12 ILE A 33 1.494 3.524 -14.808 1.00 0.00 H new ATOM 0 HD13 ILE A 33 1.497 3.776 -13.046 1.00 0.00 H new ATOM 545 N ILE A 34 -4.140 5.219 -13.172 1.00 0.00 N ATOM 546 CA ILE A 34 -5.003 6.391 -13.250 1.00 0.00 C ATOM 547 C ILE A 34 -4.635 7.417 -12.183 1.00 0.00 C ATOM 548 O ILE A 34 -4.059 7.073 -11.150 1.00 0.00 O ATOM 549 CB ILE A 34 -6.487 6.010 -13.088 1.00 0.00 C ATOM 550 CG1 ILE A 34 -6.757 5.517 -11.665 1.00 0.00 C ATOM 551 CG2 ILE A 34 -6.874 4.946 -14.105 1.00 0.00 C ATOM 552 CD1 ILE A 34 -7.521 6.510 -10.817 1.00 0.00 C ATOM 0 H ILE A 34 -4.098 4.786 -12.249 1.00 0.00 H new ATOM 0 HA ILE A 34 -4.854 6.827 -14.238 1.00 0.00 H new ATOM 0 HB ILE A 34 -7.096 6.896 -13.267 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -7.319 4.584 -11.713 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -5.807 5.293 -11.180 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -7.925 4.687 -13.978 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -6.714 5.330 -15.112 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -6.261 4.058 -13.954 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -7.677 6.094 -9.821 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -6.951 7.436 -10.739 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -8.486 6.716 -11.279 1.00 0.00 H new ATOM 564 N ILE A 35 -4.972 8.676 -12.439 1.00 0.00 N ATOM 565 CA ILE A 35 -4.679 9.751 -11.499 1.00 0.00 C ATOM 566 C ILE A 35 -5.957 10.289 -10.863 1.00 0.00 C ATOM 567 O ILE A 35 -6.921 10.606 -11.559 1.00 0.00 O ATOM 568 CB ILE A 35 -3.933 10.910 -12.184 1.00 0.00 C ATOM 569 CG1 ILE A 35 -2.627 10.409 -12.804 1.00 0.00 C ATOM 570 CG2 ILE A 35 -3.658 12.026 -11.187 1.00 0.00 C ATOM 571 CD1 ILE A 35 -2.654 10.364 -14.316 1.00 0.00 C ATOM 0 H ILE A 35 -5.448 8.977 -13.289 1.00 0.00 H new ATOM 0 HA ILE A 35 -4.041 9.327 -10.724 1.00 0.00 H new ATOM 0 HB ILE A 35 -4.563 11.307 -12.980 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -1.810 11.055 -12.482 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -2.413 9.411 -12.423 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -3.130 12.838 -11.687 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -4.602 12.398 -10.788 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -3.045 11.642 -10.371 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -1.696 10.000 -14.686 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -3.449 9.695 -14.646 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -2.837 11.365 -14.707 1.00 0.00 H new ATOM 583 N GLN A 36 -5.955 10.390 -9.538 1.00 0.00 N ATOM 584 CA GLN A 36 -7.114 10.891 -8.809 1.00 0.00 C ATOM 585 C GLN A 36 -7.212 12.409 -8.919 1.00 0.00 C ATOM 586 O GLN A 36 -6.504 13.030 -9.712 1.00 0.00 O ATOM 587 CB GLN A 36 -7.036 10.478 -7.339 1.00 0.00 C ATOM 588 CG GLN A 36 -8.215 9.635 -6.880 1.00 0.00 C ATOM 589 CD GLN A 36 -9.546 10.189 -7.349 1.00 0.00 C ATOM 590 OE1 GLN A 36 -10.031 11.194 -6.830 1.00 0.00 O ATOM 591 NE2 GLN A 36 -10.144 9.534 -8.337 1.00 0.00 N ATOM 0 H GLN A 36 -5.164 10.132 -8.948 1.00 0.00 H new ATOM 0 HA GLN A 36 -8.008 10.455 -9.254 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -6.115 9.919 -7.176 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -6.978 11.374 -6.721 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -8.097 8.618 -7.254 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -8.213 9.577 -5.792 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -9.706 8.705 -8.738 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -11.042 9.860 -8.695 1.00 0.00 H new ATOM 600 N GLU A 37 -8.093 13.000 -8.118 1.00 0.00 N ATOM 601 CA GLU A 37 -8.283 14.446 -8.127 1.00 0.00 C ATOM 602 C GLU A 37 -6.952 15.171 -7.954 1.00 0.00 C ATOM 603 O GLU A 37 -6.725 16.225 -8.547 1.00 0.00 O ATOM 604 CB GLU A 37 -9.251 14.862 -7.018 1.00 0.00 C ATOM 605 CG GLU A 37 -8.989 14.172 -5.690 1.00 0.00 C ATOM 606 CD GLU A 37 -9.333 15.047 -4.500 1.00 0.00 C ATOM 607 OE1 GLU A 37 -9.903 16.137 -4.710 1.00 0.00 O ATOM 608 OE2 GLU A 37 -9.032 14.639 -3.359 1.00 0.00 O ATOM 0 H GLU A 37 -8.686 12.500 -7.455 1.00 0.00 H new ATOM 0 HA GLU A 37 -8.706 14.725 -9.092 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -9.186 15.941 -6.876 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -10.270 14.643 -7.336 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -9.573 13.253 -5.641 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -7.939 13.886 -5.634 1.00 0.00 H new ATOM 615 N ASN A 38 -6.075 14.597 -7.136 1.00 0.00 N ATOM 616 CA ASN A 38 -4.766 15.189 -6.883 1.00 0.00 C ATOM 617 C ASN A 38 -3.686 14.113 -6.821 1.00 0.00 C ATOM 618 O ASN A 38 -2.642 14.229 -7.463 1.00 0.00 O ATOM 619 CB ASN A 38 -4.786 15.983 -5.576 1.00 0.00 C ATOM 620 CG ASN A 38 -5.283 15.157 -4.405 1.00 0.00 C ATOM 621 OD1 ASN A 38 -6.488 14.991 -4.215 1.00 0.00 O ATOM 622 ND2 ASN A 38 -4.353 14.635 -3.613 1.00 0.00 N ATOM 0 H ASN A 38 -6.247 13.724 -6.638 1.00 0.00 H new ATOM 0 HA ASN A 38 -4.535 15.864 -7.707 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -3.782 16.347 -5.360 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -5.424 16.859 -5.696 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -4.626 14.070 -2.809 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -3.366 14.799 -3.809 1.00 0.00 H new ATOM 629 N MET A 39 -3.945 13.067 -6.043 1.00 0.00 N ATOM 630 CA MET A 39 -2.995 11.969 -5.898 1.00 0.00 C ATOM 631 C MET A 39 -3.023 11.062 -7.124 1.00 0.00 C ATOM 632 O MET A 39 -3.830 11.255 -8.033 1.00 0.00 O ATOM 633 CB MET A 39 -3.310 11.157 -4.641 1.00 0.00 C ATOM 634 CG MET A 39 -4.200 9.953 -4.902 1.00 0.00 C ATOM 635 SD MET A 39 -5.212 9.515 -3.475 1.00 0.00 S ATOM 636 CE MET A 39 -3.966 8.873 -2.360 1.00 0.00 C ATOM 0 H MET A 39 -4.804 12.956 -5.504 1.00 0.00 H new ATOM 0 HA MET A 39 -1.996 12.395 -5.805 1.00 0.00 H new ATOM 0 HB2 MET A 39 -2.376 10.818 -4.194 1.00 0.00 H new ATOM 0 HB3 MET A 39 -3.795 11.806 -3.912 1.00 0.00 H new ATOM 0 HG2 MET A 39 -4.849 10.163 -5.752 1.00 0.00 H new ATOM 0 HG3 MET A 39 -3.580 9.100 -5.178 1.00 0.00 H new ATOM 0 HE1 MET A 39 -4.102 7.798 -2.243 1.00 0.00 H new ATOM 0 HE2 MET A 39 -2.975 9.071 -2.769 1.00 0.00 H new ATOM 0 HE3 MET A 39 -4.062 9.359 -1.389 1.00 0.00 H new ATOM 646 N ILE A 40 -2.136 10.072 -7.141 1.00 0.00 N ATOM 647 CA ILE A 40 -2.060 9.135 -8.255 1.00 0.00 C ATOM 648 C ILE A 40 -2.210 7.695 -7.774 1.00 0.00 C ATOM 649 O ILE A 40 -1.652 7.314 -6.744 1.00 0.00 O ATOM 650 CB ILE A 40 -0.730 9.273 -9.018 1.00 0.00 C ATOM 651 CG1 ILE A 40 -0.586 10.688 -9.584 1.00 0.00 C ATOM 652 CG2 ILE A 40 -0.648 8.241 -10.133 1.00 0.00 C ATOM 653 CD1 ILE A 40 0.719 10.917 -10.314 1.00 0.00 C ATOM 0 H ILE A 40 -1.461 9.898 -6.397 1.00 0.00 H new ATOM 0 HA ILE A 40 -2.882 9.379 -8.928 1.00 0.00 H new ATOM 0 HB ILE A 40 0.090 9.094 -8.323 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -1.414 10.884 -10.266 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -0.668 11.407 -8.769 1.00 0.00 H new ATOM 0 HG21 ILE A 40 0.298 8.352 -10.663 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -0.710 7.240 -9.707 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -1.473 8.391 -10.829 1.00 0.00 H new ATOM 0 HD11 ILE A 40 0.752 11.940 -10.688 1.00 0.00 H new ATOM 0 HD12 ILE A 40 1.552 10.753 -9.630 1.00 0.00 H new ATOM 0 HD13 ILE A 40 0.795 10.222 -11.151 1.00 0.00 H new ATOM 665 N ILE A 41 -2.964 6.901 -8.526 1.00 0.00 N ATOM 666 CA ILE A 41 -3.184 5.503 -8.177 1.00 0.00 C ATOM 667 C ILE A 41 -2.436 4.575 -9.128 1.00 0.00 C ATOM 668 O ILE A 41 -2.662 4.595 -10.338 1.00 0.00 O ATOM 669 CB ILE A 41 -4.682 5.145 -8.202 1.00 0.00 C ATOM 670 CG1 ILE A 41 -5.455 6.024 -7.216 1.00 0.00 C ATOM 671 CG2 ILE A 41 -4.880 3.673 -7.875 1.00 0.00 C ATOM 672 CD1 ILE A 41 -4.951 5.923 -5.793 1.00 0.00 C ATOM 0 H ILE A 41 -3.433 7.202 -9.381 1.00 0.00 H new ATOM 0 HA ILE A 41 -2.803 5.367 -7.165 1.00 0.00 H new ATOM 0 HB ILE A 41 -5.068 5.330 -9.204 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -5.393 7.062 -7.542 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -6.508 5.744 -7.241 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -5.944 3.435 -7.897 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -4.357 3.063 -8.612 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -4.482 3.464 -6.882 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -5.545 6.572 -5.150 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -5.038 4.893 -5.448 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -3.906 6.231 -5.754 1.00 0.00 H new ATOM 684 N PHE A 42 -1.545 3.761 -8.572 1.00 0.00 N ATOM 685 CA PHE A 42 -0.763 2.824 -9.370 1.00 0.00 C ATOM 686 C PHE A 42 -1.370 1.425 -9.316 1.00 0.00 C ATOM 687 O PHE A 42 -1.254 0.725 -8.309 1.00 0.00 O ATOM 688 CB PHE A 42 0.685 2.784 -8.876 1.00 0.00 C ATOM 689 CG PHE A 42 1.512 1.713 -9.529 1.00 0.00 C ATOM 690 CD1 PHE A 42 2.125 1.941 -10.750 1.00 0.00 C ATOM 691 CD2 PHE A 42 1.675 0.479 -8.922 1.00 0.00 C ATOM 692 CE1 PHE A 42 2.887 0.958 -11.353 1.00 0.00 C ATOM 693 CE2 PHE A 42 2.436 -0.508 -9.520 1.00 0.00 C ATOM 694 CZ PHE A 42 3.042 -0.268 -10.737 1.00 0.00 C ATOM 0 H PHE A 42 -1.346 3.731 -7.572 1.00 0.00 H new ATOM 0 HA PHE A 42 -0.777 3.167 -10.404 1.00 0.00 H new ATOM 0 HB2 PHE A 42 1.150 3.753 -9.059 1.00 0.00 H new ATOM 0 HB3 PHE A 42 0.688 2.627 -7.797 1.00 0.00 H new ATOM 0 HD1 PHE A 42 2.006 2.898 -11.236 1.00 0.00 H new ATOM 0 HD2 PHE A 42 1.202 0.286 -7.970 1.00 0.00 H new ATOM 0 HE1 PHE A 42 3.361 1.149 -12.305 1.00 0.00 H new ATOM 0 HE2 PHE A 42 2.556 -1.466 -9.036 1.00 0.00 H new ATOM 0 HZ PHE A 42 3.636 -1.038 -11.206 1.00 0.00 H new ATOM 704 N HIS A 43 -2.017 1.024 -10.406 1.00 0.00 N ATOM 705 CA HIS A 43 -2.642 -0.292 -10.483 1.00 0.00 C ATOM 706 C HIS A 43 -1.785 -1.253 -11.301 1.00 0.00 C ATOM 707 O HIS A 43 -1.950 -2.471 -11.219 1.00 0.00 O ATOM 708 CB HIS A 43 -4.037 -0.181 -11.100 1.00 0.00 C ATOM 709 CG HIS A 43 -5.035 -1.120 -10.495 1.00 0.00 C ATOM 710 ND1 HIS A 43 -6.385 -1.062 -10.771 1.00 0.00 N ATOM 711 CD2 HIS A 43 -4.873 -2.144 -9.626 1.00 0.00 C ATOM 712 CE1 HIS A 43 -7.011 -2.010 -10.096 1.00 0.00 C ATOM 713 NE2 HIS A 43 -6.116 -2.681 -9.393 1.00 0.00 N ATOM 0 H HIS A 43 -2.122 1.591 -11.247 1.00 0.00 H new ATOM 0 HA HIS A 43 -2.731 -0.686 -9.470 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -4.396 0.842 -10.985 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -3.969 -0.376 -12.170 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -3.940 -2.477 -9.196 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -8.073 -2.203 -10.116 1.00 0.00 H new ATOM 0 HE2 HIS A 43 -6.315 -3.469 -8.777 1.00 0.00 H new ATOM 721 N LEU A 44 -0.872 -0.699 -12.091 1.00 0.00 N ATOM 722 CA LEU A 44 0.010 -1.507 -12.925 1.00 0.00 C ATOM 723 C LEU A 44 0.684 -2.602 -12.104 1.00 0.00 C ATOM 724 O LEU A 44 0.825 -2.481 -10.887 1.00 0.00 O ATOM 725 CB LEU A 44 1.070 -0.624 -13.586 1.00 0.00 C ATOM 726 CG LEU A 44 1.326 -0.881 -15.071 1.00 0.00 C ATOM 727 CD1 LEU A 44 1.501 0.433 -15.818 1.00 0.00 C ATOM 728 CD2 LEU A 44 2.549 -1.767 -15.256 1.00 0.00 C ATOM 0 H LEU A 44 -0.723 0.307 -12.171 1.00 0.00 H new ATOM 0 HA LEU A 44 -0.595 -1.979 -13.699 1.00 0.00 H new ATOM 0 HB2 LEU A 44 0.774 0.418 -13.464 1.00 0.00 H new ATOM 0 HB3 LEU A 44 2.009 -0.754 -13.048 1.00 0.00 H new ATOM 0 HG LEU A 44 0.460 -1.399 -15.484 1.00 0.00 H new ATOM 0 HD11 LEU A 44 1.682 0.230 -16.873 1.00 0.00 H new ATOM 0 HD12 LEU A 44 0.598 1.034 -15.714 1.00 0.00 H new ATOM 0 HD13 LEU A 44 2.349 0.978 -15.402 1.00 0.00 H new ATOM 0 HD21 LEU A 44 2.716 -1.939 -16.319 1.00 0.00 H new ATOM 0 HD22 LEU A 44 3.422 -1.276 -14.826 1.00 0.00 H new ATOM 0 HD23 LEU A 44 2.386 -2.721 -14.755 1.00 0.00 H new ATOM 740 N SER A 45 1.101 -3.668 -12.778 1.00 0.00 N ATOM 741 CA SER A 45 1.759 -4.786 -12.111 1.00 0.00 C ATOM 742 C SER A 45 0.838 -5.417 -11.072 1.00 0.00 C ATOM 743 O SER A 45 -0.198 -4.862 -10.704 1.00 0.00 O ATOM 744 CB SER A 45 3.054 -4.317 -11.443 1.00 0.00 C ATOM 745 OG SER A 45 2.962 -4.408 -10.032 1.00 0.00 O ATOM 0 H SER A 45 0.995 -3.782 -13.786 1.00 0.00 H new ATOM 0 HA SER A 45 1.997 -5.537 -12.864 1.00 0.00 H new ATOM 0 HB2 SER A 45 3.889 -4.922 -11.796 1.00 0.00 H new ATOM 0 HB3 SER A 45 3.263 -3.287 -11.731 1.00 0.00 H new ATOM 0 HG SER A 45 3.802 -4.104 -9.629 1.00 0.00 H new ATOM 751 N PRO A 46 1.222 -6.607 -10.587 1.00 0.00 N ATOM 752 CA PRO A 46 0.445 -7.341 -9.583 1.00 0.00 C ATOM 753 C PRO A 46 0.476 -6.664 -8.217 1.00 0.00 C ATOM 754 O PRO A 46 -0.208 -7.091 -7.286 1.00 0.00 O ATOM 755 CB PRO A 46 1.142 -8.702 -9.521 1.00 0.00 C ATOM 756 CG PRO A 46 2.539 -8.433 -9.965 1.00 0.00 C ATOM 757 CD PRO A 46 2.445 -7.327 -10.980 1.00 0.00 C ATOM 0 HA PRO A 46 -0.611 -7.399 -9.847 1.00 0.00 H new ATOM 0 HB2 PRO A 46 1.120 -9.113 -8.512 1.00 0.00 H new ATOM 0 HB3 PRO A 46 0.653 -9.427 -10.171 1.00 0.00 H new ATOM 0 HG2 PRO A 46 3.166 -8.138 -9.124 1.00 0.00 H new ATOM 0 HG3 PRO A 46 2.989 -9.325 -10.401 1.00 0.00 H new ATOM 0 HD2 PRO A 46 3.320 -6.678 -10.950 1.00 0.00 H new ATOM 0 HD3 PRO A 46 2.373 -7.718 -11.995 1.00 0.00 H new ATOM 765 N TYR A 47 1.272 -5.607 -8.104 1.00 0.00 N ATOM 766 CA TYR A 47 1.393 -4.872 -6.851 1.00 0.00 C ATOM 767 C TYR A 47 0.731 -3.501 -6.957 1.00 0.00 C ATOM 768 O TYR A 47 0.995 -2.742 -7.890 1.00 0.00 O ATOM 769 CB TYR A 47 2.866 -4.711 -6.469 1.00 0.00 C ATOM 770 CG TYR A 47 3.653 -6.000 -6.538 1.00 0.00 C ATOM 771 CD1 TYR A 47 3.122 -7.188 -6.051 1.00 0.00 C ATOM 772 CD2 TYR A 47 4.927 -6.030 -7.091 1.00 0.00 C ATOM 773 CE1 TYR A 47 3.839 -8.368 -6.111 1.00 0.00 C ATOM 774 CE2 TYR A 47 5.650 -7.205 -7.157 1.00 0.00 C ATOM 775 CZ TYR A 47 5.102 -8.371 -6.665 1.00 0.00 C ATOM 776 OH TYR A 47 5.818 -9.545 -6.728 1.00 0.00 O ATOM 0 H TYR A 47 1.843 -5.240 -8.865 1.00 0.00 H new ATOM 0 HA TYR A 47 0.883 -5.443 -6.075 1.00 0.00 H new ATOM 0 HB2 TYR A 47 3.327 -3.978 -7.131 1.00 0.00 H new ATOM 0 HB3 TYR A 47 2.929 -4.310 -5.457 1.00 0.00 H new ATOM 0 HD1 TYR A 47 2.132 -7.189 -5.618 1.00 0.00 H new ATOM 0 HD2 TYR A 47 5.360 -5.119 -7.476 1.00 0.00 H new ATOM 0 HE1 TYR A 47 3.413 -9.283 -5.726 1.00 0.00 H new ATOM 0 HE2 TYR A 47 6.639 -7.211 -7.591 1.00 0.00 H new ATOM 0 HH TYR A 47 6.687 -9.376 -7.147 1.00 0.00 H new ATOM 786 N TYR A 48 -0.129 -3.191 -5.993 1.00 0.00 N ATOM 787 CA TYR A 48 -0.831 -1.913 -5.978 1.00 0.00 C ATOM 788 C TYR A 48 -0.085 -0.893 -5.123 1.00 0.00 C ATOM 789 O TYR A 48 0.280 -1.170 -3.980 1.00 0.00 O ATOM 790 CB TYR A 48 -2.254 -2.096 -5.448 1.00 0.00 C ATOM 791 CG TYR A 48 -3.041 -0.807 -5.369 1.00 0.00 C ATOM 792 CD1 TYR A 48 -2.913 0.042 -4.276 1.00 0.00 C ATOM 793 CD2 TYR A 48 -3.913 -0.439 -6.386 1.00 0.00 C ATOM 794 CE1 TYR A 48 -3.630 1.220 -4.199 1.00 0.00 C ATOM 795 CE2 TYR A 48 -4.633 0.738 -6.318 1.00 0.00 C ATOM 796 CZ TYR A 48 -4.488 1.564 -5.223 1.00 0.00 C ATOM 797 OH TYR A 48 -5.205 2.737 -5.151 1.00 0.00 O ATOM 0 H TYR A 48 -0.357 -3.807 -5.212 1.00 0.00 H new ATOM 0 HA TYR A 48 -0.877 -1.539 -7.001 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -2.785 -2.797 -6.092 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -2.208 -2.545 -4.456 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -2.241 -0.224 -3.473 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -4.030 -1.084 -7.244 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -3.520 1.868 -3.342 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -5.306 1.010 -7.118 1.00 0.00 H new ATOM 0 HH TYR A 48 -5.385 2.953 -4.212 1.00 0.00 H new ATOM 807 N LEU A 49 0.137 0.290 -5.686 1.00 0.00 N ATOM 808 CA LEU A 49 0.839 1.355 -4.977 1.00 0.00 C ATOM 809 C LEU A 49 0.046 2.657 -5.028 1.00 0.00 C ATOM 810 O LEU A 49 -0.664 2.925 -5.997 1.00 0.00 O ATOM 811 CB LEU A 49 2.229 1.566 -5.580 1.00 0.00 C ATOM 812 CG LEU A 49 3.130 2.567 -4.856 1.00 0.00 C ATOM 813 CD1 LEU A 49 3.503 2.047 -3.476 1.00 0.00 C ATOM 814 CD2 LEU A 49 4.379 2.851 -5.677 1.00 0.00 C ATOM 0 H LEU A 49 -0.159 0.536 -6.631 1.00 0.00 H new ATOM 0 HA LEU A 49 0.944 1.056 -3.934 1.00 0.00 H new ATOM 0 HB2 LEU A 49 2.740 0.604 -5.610 1.00 0.00 H new ATOM 0 HB3 LEU A 49 2.109 1.896 -6.612 1.00 0.00 H new ATOM 0 HG LEU A 49 2.580 3.500 -4.734 1.00 0.00 H new ATOM 0 HD11 LEU A 49 4.144 2.772 -2.975 1.00 0.00 H new ATOM 0 HD12 LEU A 49 2.598 1.895 -2.887 1.00 0.00 H new ATOM 0 HD13 LEU A 49 4.034 1.100 -3.575 1.00 0.00 H new ATOM 0 HD21 LEU A 49 5.009 3.565 -5.146 1.00 0.00 H new ATOM 0 HD22 LEU A 49 4.932 1.924 -5.831 1.00 0.00 H new ATOM 0 HD23 LEU A 49 4.093 3.267 -6.643 1.00 0.00 H new ATOM 826 N ARG A 50 0.176 3.464 -3.980 1.00 0.00 N ATOM 827 CA ARG A 50 -0.528 4.739 -3.906 1.00 0.00 C ATOM 828 C ARG A 50 0.452 5.888 -3.687 1.00 0.00 C ATOM 829 O ARG A 50 1.310 5.827 -2.804 1.00 0.00 O ATOM 830 CB ARG A 50 -1.559 4.711 -2.777 1.00 0.00 C ATOM 831 CG ARG A 50 -2.714 5.678 -2.984 1.00 0.00 C ATOM 832 CD ARG A 50 -4.005 5.139 -2.388 1.00 0.00 C ATOM 833 NE ARG A 50 -3.993 5.180 -0.928 1.00 0.00 N ATOM 834 CZ ARG A 50 -5.092 5.145 -0.183 1.00 0.00 C ATOM 835 NH1 ARG A 50 -6.285 5.068 -0.758 1.00 0.00 N ATOM 836 NH2 ARG A 50 -5.000 5.185 1.140 1.00 0.00 N ATOM 0 H ARG A 50 0.762 3.258 -3.171 1.00 0.00 H new ATOM 0 HA ARG A 50 -1.042 4.898 -4.854 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -1.955 3.700 -2.683 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -1.062 4.948 -1.836 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -2.473 6.637 -2.526 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -2.852 5.859 -4.050 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -4.847 5.722 -2.760 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -4.157 4.112 -2.721 1.00 0.00 H new ATOM 0 HE ARG A 50 -3.091 5.239 -0.455 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -6.360 5.035 -1.775 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -7.127 5.041 -0.183 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -4.085 5.243 1.586 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -5.845 5.158 1.711 1.00 0.00 H new ATOM 850 N LEU A 51 0.319 6.934 -4.494 1.00 0.00 N ATOM 851 CA LEU A 51 1.192 8.098 -4.389 1.00 0.00 C ATOM 852 C LEU A 51 0.395 9.346 -4.024 1.00 0.00 C ATOM 853 O LEU A 51 -0.453 9.800 -4.792 1.00 0.00 O ATOM 854 CB LEU A 51 1.937 8.322 -5.707 1.00 0.00 C ATOM 855 CG LEU A 51 2.867 7.194 -6.152 1.00 0.00 C ATOM 856 CD1 LEU A 51 3.525 7.537 -7.480 1.00 0.00 C ATOM 857 CD2 LEU A 51 3.920 6.919 -5.089 1.00 0.00 C ATOM 0 H LEU A 51 -0.385 7.000 -5.229 1.00 0.00 H new ATOM 0 HA LEU A 51 1.916 7.908 -3.597 1.00 0.00 H new ATOM 0 HB2 LEU A 51 1.201 8.490 -6.493 1.00 0.00 H new ATOM 0 HB3 LEU A 51 2.524 9.236 -5.619 1.00 0.00 H new ATOM 0 HG LEU A 51 2.272 6.291 -6.287 1.00 0.00 H new ATOM 0 HD11 LEU A 51 4.184 6.722 -7.781 1.00 0.00 H new ATOM 0 HD12 LEU A 51 2.757 7.682 -8.240 1.00 0.00 H new ATOM 0 HD13 LEU A 51 4.107 8.453 -7.372 1.00 0.00 H new ATOM 0 HD21 LEU A 51 4.573 6.113 -5.424 1.00 0.00 H new ATOM 0 HD22 LEU A 51 4.511 7.819 -4.921 1.00 0.00 H new ATOM 0 HD23 LEU A 51 3.431 6.628 -4.159 1.00 0.00 H new ATOM 869 N ARG A 52 0.675 9.897 -2.847 1.00 0.00 N ATOM 870 CA ARG A 52 -0.015 11.093 -2.380 1.00 0.00 C ATOM 871 C ARG A 52 0.930 12.290 -2.353 1.00 0.00 C ATOM 872 O ARG A 52 1.783 12.401 -1.471 1.00 0.00 O ATOM 873 CB ARG A 52 -0.600 10.859 -0.986 1.00 0.00 C ATOM 874 CG ARG A 52 -2.000 11.424 -0.809 1.00 0.00 C ATOM 875 CD ARG A 52 -2.129 12.195 0.495 1.00 0.00 C ATOM 876 NE ARG A 52 -2.801 11.412 1.529 1.00 0.00 N ATOM 877 CZ ARG A 52 -2.961 11.830 2.780 1.00 0.00 C ATOM 878 NH1 ARG A 52 -2.501 13.018 3.149 1.00 0.00 N ATOM 879 NH2 ARG A 52 -3.583 11.061 3.663 1.00 0.00 N ATOM 0 H ARG A 52 1.375 9.534 -2.200 1.00 0.00 H new ATOM 0 HA ARG A 52 -0.827 11.309 -3.075 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -0.622 9.788 -0.786 1.00 0.00 H new ATOM 0 HB3 ARG A 52 0.060 11.308 -0.244 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -2.237 12.081 -1.646 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -2.726 10.611 -0.826 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -1.138 12.483 0.845 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -2.685 13.116 0.318 1.00 0.00 H new ATOM 0 HE ARG A 52 -3.167 10.494 1.277 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -2.023 13.613 2.472 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -2.625 13.337 4.110 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -3.939 10.147 3.382 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -3.705 11.383 4.623 1.00 0.00 H new ATOM 893 N PHE A 53 0.773 13.184 -3.324 1.00 0.00 N ATOM 894 CA PHE A 53 1.613 14.372 -3.412 1.00 0.00 C ATOM 895 C PHE A 53 0.924 15.574 -2.773 1.00 0.00 C ATOM 896 O PHE A 53 -0.302 15.639 -2.674 1.00 0.00 O ATOM 897 CB PHE A 53 1.948 14.679 -4.873 1.00 0.00 C ATOM 898 CG PHE A 53 2.613 13.538 -5.588 1.00 0.00 C ATOM 899 CD1 PHE A 53 3.473 12.686 -4.912 1.00 0.00 C ATOM 900 CD2 PHE A 53 2.379 13.316 -6.936 1.00 0.00 C ATOM 901 CE1 PHE A 53 4.087 11.636 -5.568 1.00 0.00 C ATOM 902 CE2 PHE A 53 2.990 12.267 -7.597 1.00 0.00 C ATOM 903 CZ PHE A 53 3.844 11.425 -6.911 1.00 0.00 C ATOM 0 H PHE A 53 0.072 13.108 -4.061 1.00 0.00 H new ATOM 0 HA PHE A 53 2.537 14.174 -2.869 1.00 0.00 H new ATOM 0 HB2 PHE A 53 1.031 14.943 -5.400 1.00 0.00 H new ATOM 0 HB3 PHE A 53 2.600 15.551 -4.912 1.00 0.00 H new ATOM 0 HD1 PHE A 53 3.665 12.845 -3.861 1.00 0.00 H new ATOM 0 HD2 PHE A 53 1.711 13.971 -7.476 1.00 0.00 H new ATOM 0 HE1 PHE A 53 4.757 10.981 -5.031 1.00 0.00 H new ATOM 0 HE2 PHE A 53 2.800 12.106 -8.648 1.00 0.00 H new ATOM 0 HZ PHE A 53 4.321 10.603 -7.424 1.00 0.00 H new ATOM 913 N PRO A 54 1.729 16.551 -2.329 1.00 0.00 N ATOM 914 CA PRO A 54 1.220 17.769 -1.692 1.00 0.00 C ATOM 915 C PRO A 54 0.497 18.680 -2.678 1.00 0.00 C ATOM 916 O PRO A 54 -0.122 19.669 -2.286 1.00 0.00 O ATOM 917 CB PRO A 54 2.486 18.449 -1.165 1.00 0.00 C ATOM 918 CG PRO A 54 3.580 17.947 -2.043 1.00 0.00 C ATOM 919 CD PRO A 54 3.199 16.541 -2.415 1.00 0.00 C ATOM 0 HA PRO A 54 0.485 17.548 -0.918 1.00 0.00 H new ATOM 0 HB2 PRO A 54 2.403 19.535 -1.217 1.00 0.00 H new ATOM 0 HB3 PRO A 54 2.667 18.193 -0.121 1.00 0.00 H new ATOM 0 HG2 PRO A 54 3.685 18.571 -2.931 1.00 0.00 H new ATOM 0 HG3 PRO A 54 4.538 17.967 -1.523 1.00 0.00 H new ATOM 0 HD2 PRO A 54 3.541 16.284 -3.418 1.00 0.00 H new ATOM 0 HD3 PRO A 54 3.636 15.812 -1.732 1.00 0.00 H new ATOM 927 N HIS A 55 0.579 18.340 -3.961 1.00 0.00 N ATOM 928 CA HIS A 55 -0.069 19.127 -5.003 1.00 0.00 C ATOM 929 C HIS A 55 -1.237 18.361 -5.616 1.00 0.00 C ATOM 930 O HIS A 55 -1.616 17.296 -5.130 1.00 0.00 O ATOM 931 CB HIS A 55 0.939 19.500 -6.091 1.00 0.00 C ATOM 932 CG HIS A 55 2.032 20.405 -5.611 1.00 0.00 C ATOM 933 ND1 HIS A 55 3.229 20.124 -5.046 1.00 0.00 N flip ATOM 934 CD2 HIS A 55 1.958 21.779 -5.686 1.00 0.00 C flip ATOM 935 CE1 HIS A 55 3.851 21.322 -4.793 1.00 0.00 C flip ATOM 936 NE2 HIS A 55 3.063 22.305 -5.189 1.00 0.00 N flip ATOM 0 H HIS A 55 1.088 17.525 -4.303 1.00 0.00 H new ATOM 0 HA HIS A 55 -0.455 20.039 -4.548 1.00 0.00 H new ATOM 0 HB2 HIS A 55 1.383 18.588 -6.491 1.00 0.00 H new ATOM 0 HB3 HIS A 55 0.412 19.985 -6.912 1.00 0.00 H new ATOM 0 HD2 HIS A 55 1.126 22.338 -6.088 1.00 0.00 H new ATOM 0 HE1 HIS A 55 4.826 21.441 -4.343 1.00 0.00 H new ATOM 0 HE2 HIS A 55 3.272 23.301 -5.122 1.00 0.00 H new ATOM 944 N GLU A 56 -1.803 18.911 -6.686 1.00 0.00 N ATOM 945 CA GLU A 56 -2.929 18.279 -7.364 1.00 0.00 C ATOM 946 C GLU A 56 -2.654 18.136 -8.858 1.00 0.00 C ATOM 947 O GLU A 56 -2.466 19.127 -9.564 1.00 0.00 O ATOM 948 CB GLU A 56 -4.207 19.092 -7.144 1.00 0.00 C ATOM 949 CG GLU A 56 -3.998 20.593 -7.248 1.00 0.00 C ATOM 950 CD GLU A 56 -5.303 21.365 -7.245 1.00 0.00 C ATOM 951 OE1 GLU A 56 -6.348 20.764 -6.919 1.00 0.00 O ATOM 952 OE2 GLU A 56 -5.279 22.571 -7.568 1.00 0.00 O ATOM 0 H GLU A 56 -1.501 19.792 -7.102 1.00 0.00 H new ATOM 0 HA GLU A 56 -3.063 17.284 -6.940 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -4.953 18.786 -7.877 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -4.612 18.857 -6.160 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -3.380 20.929 -6.415 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -3.450 20.817 -8.163 1.00 0.00 H new ATOM 959 N LEU A 57 -2.632 16.895 -9.333 1.00 0.00 N ATOM 960 CA LEU A 57 -2.380 16.621 -10.743 1.00 0.00 C ATOM 961 C LEU A 57 -3.688 16.413 -11.500 1.00 0.00 C ATOM 962 O LEU A 57 -4.768 16.428 -10.909 1.00 0.00 O ATOM 963 CB LEU A 57 -1.490 15.385 -10.892 1.00 0.00 C ATOM 964 CG LEU A 57 -0.252 15.339 -9.996 1.00 0.00 C ATOM 965 CD1 LEU A 57 -0.019 13.928 -9.479 1.00 0.00 C ATOM 966 CD2 LEU A 57 0.971 15.840 -10.750 1.00 0.00 C ATOM 0 H LEU A 57 -2.786 16.064 -8.763 1.00 0.00 H new ATOM 0 HA LEU A 57 -1.868 17.484 -11.169 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -2.094 14.500 -10.690 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.165 15.318 -11.930 1.00 0.00 H new ATOM 0 HG LEU A 57 -0.422 15.994 -9.141 1.00 0.00 H new ATOM 0 HD11 LEU A 57 0.866 13.915 -8.843 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -0.885 13.604 -8.902 1.00 0.00 H new ATOM 0 HD13 LEU A 57 0.129 13.252 -10.321 1.00 0.00 H new ATOM 0 HD21 LEU A 57 1.843 15.800 -10.097 1.00 0.00 H new ATOM 0 HD22 LEU A 57 1.143 15.211 -11.623 1.00 0.00 H new ATOM 0 HD23 LEU A 57 0.805 16.868 -11.071 1.00 0.00 H new ATOM 978 N ILE A 58 -3.583 16.217 -12.810 1.00 0.00 N ATOM 979 CA ILE A 58 -4.757 16.003 -13.647 1.00 0.00 C ATOM 980 C ILE A 58 -4.508 14.902 -14.672 1.00 0.00 C ATOM 981 O ILE A 58 -3.409 14.781 -15.214 1.00 0.00 O ATOM 982 CB ILE A 58 -5.166 17.292 -14.384 1.00 0.00 C ATOM 983 CG1 ILE A 58 -6.373 17.029 -15.286 1.00 0.00 C ATOM 984 CG2 ILE A 58 -3.998 17.832 -15.196 1.00 0.00 C ATOM 985 CD1 ILE A 58 -6.934 18.279 -15.926 1.00 0.00 C ATOM 0 H ILE A 58 -2.697 16.202 -13.315 1.00 0.00 H new ATOM 0 HA ILE A 58 -5.567 15.702 -12.983 1.00 0.00 H new ATOM 0 HB ILE A 58 -5.446 18.042 -13.644 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -6.085 16.328 -16.069 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -7.156 16.548 -14.700 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -4.303 18.743 -15.711 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -3.164 18.053 -14.530 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -3.689 17.087 -15.929 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -7.787 18.016 -16.551 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -7.254 18.973 -15.149 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -6.166 18.750 -16.540 1.00 0.00 H new ATOM 997 N ASP A 59 -5.536 14.103 -14.935 1.00 0.00 N ATOM 998 CA ASP A 59 -5.431 13.013 -15.898 1.00 0.00 C ATOM 999 C ASP A 59 -6.029 13.416 -17.242 1.00 0.00 C ATOM 1000 O ASP A 59 -7.249 13.483 -17.394 1.00 0.00 O ATOM 1001 CB ASP A 59 -6.135 11.764 -15.366 1.00 0.00 C ATOM 1002 CG ASP A 59 -6.596 10.842 -16.477 1.00 0.00 C ATOM 1003 OD1 ASP A 59 -5.751 10.440 -17.303 1.00 0.00 O ATOM 1004 OD2 ASP A 59 -7.803 10.522 -16.521 1.00 0.00 O ATOM 0 H ASP A 59 -6.452 14.190 -14.495 1.00 0.00 H new ATOM 0 HA ASP A 59 -4.374 12.790 -16.043 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -5.458 11.222 -14.706 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -6.994 12.063 -14.766 1.00 0.00 H new ATOM 1009 N ASP A 60 -5.163 13.683 -18.213 1.00 0.00 N ATOM 1010 CA ASP A 60 -5.606 14.079 -19.545 1.00 0.00 C ATOM 1011 C ASP A 60 -5.140 13.075 -20.594 1.00 0.00 C ATOM 1012 O ASP A 60 -4.718 11.967 -20.262 1.00 0.00 O ATOM 1013 CB ASP A 60 -5.080 15.474 -19.887 1.00 0.00 C ATOM 1014 CG ASP A 60 -6.146 16.361 -20.499 1.00 0.00 C ATOM 1015 OD1 ASP A 60 -7.322 16.242 -20.095 1.00 0.00 O ATOM 1016 OD2 ASP A 60 -5.804 17.176 -21.382 1.00 0.00 O ATOM 0 H ASP A 60 -4.150 13.633 -18.103 1.00 0.00 H new ATOM 0 HA ASP A 60 -6.696 14.099 -19.547 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -4.694 15.945 -18.983 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -4.244 15.384 -20.581 1.00 0.00 H new ATOM 1021 N GLU A 61 -5.220 13.469 -21.861 1.00 0.00 N ATOM 1022 CA GLU A 61 -4.808 12.602 -22.958 1.00 0.00 C ATOM 1023 C GLU A 61 -3.298 12.382 -22.940 1.00 0.00 C ATOM 1024 O GLU A 61 -2.812 11.308 -23.296 1.00 0.00 O ATOM 1025 CB GLU A 61 -5.230 13.204 -24.300 1.00 0.00 C ATOM 1026 CG GLU A 61 -6.608 13.845 -24.273 1.00 0.00 C ATOM 1027 CD GLU A 61 -7.673 12.916 -23.723 1.00 0.00 C ATOM 1028 OE1 GLU A 61 -7.687 11.730 -24.116 1.00 0.00 O ATOM 1029 OE2 GLU A 61 -8.491 13.374 -22.899 1.00 0.00 O ATOM 0 H GLU A 61 -5.566 14.383 -22.153 1.00 0.00 H new ATOM 0 HA GLU A 61 -5.300 11.638 -22.829 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -4.496 13.952 -24.600 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -5.217 12.422 -25.060 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -6.572 14.750 -23.666 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -6.883 14.149 -25.283 1.00 0.00 H new ATOM 1036 N ARG A 62 -2.561 13.406 -22.523 1.00 0.00 N ATOM 1037 CA ARG A 62 -1.107 13.326 -22.459 1.00 0.00 C ATOM 1038 C ARG A 62 -0.664 12.274 -21.447 1.00 0.00 C ATOM 1039 O ARG A 62 0.329 11.578 -21.655 1.00 0.00 O ATOM 1040 CB ARG A 62 -0.516 14.687 -22.088 1.00 0.00 C ATOM 1041 CG ARG A 62 -1.218 15.358 -20.919 1.00 0.00 C ATOM 1042 CD ARG A 62 -1.974 16.601 -21.361 1.00 0.00 C ATOM 1043 NE ARG A 62 -1.132 17.794 -21.327 1.00 0.00 N ATOM 1044 CZ ARG A 62 -0.551 18.314 -22.403 1.00 0.00 C ATOM 1045 NH1 ARG A 62 -0.720 17.749 -23.590 1.00 0.00 N ATOM 1046 NH2 ARG A 62 0.201 19.402 -22.292 1.00 0.00 N ATOM 0 H ARG A 62 -2.947 14.301 -22.224 1.00 0.00 H new ATOM 0 HA ARG A 62 -0.741 13.035 -23.443 1.00 0.00 H new ATOM 0 HB2 ARG A 62 0.539 14.561 -21.844 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -0.566 15.344 -22.956 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -1.911 14.655 -20.457 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -0.484 15.628 -20.159 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -2.354 16.454 -22.372 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -2.839 16.749 -20.714 1.00 0.00 H new ATOM 0 HE ARG A 62 -0.982 18.253 -20.429 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -1.297 16.913 -23.679 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -0.273 18.150 -24.414 1.00 0.00 H new ATOM 0 HH21 ARG A 62 0.333 19.840 -21.380 1.00 0.00 H new ATOM 0 HH22 ARG A 62 0.647 19.800 -23.118 1.00 0.00 H new ATOM 1060 N SER A 63 -1.408 12.165 -20.351 1.00 0.00 N ATOM 1061 CA SER A 63 -1.090 11.201 -19.304 1.00 0.00 C ATOM 1062 C SER A 63 -1.021 9.786 -19.871 1.00 0.00 C ATOM 1063 O SER A 63 -1.896 9.365 -20.628 1.00 0.00 O ATOM 1064 CB SER A 63 -2.134 11.265 -18.187 1.00 0.00 C ATOM 1065 OG SER A 63 -1.671 12.049 -17.101 1.00 0.00 O ATOM 0 H SER A 63 -2.235 12.732 -20.165 1.00 0.00 H new ATOM 0 HA SER A 63 -0.113 11.457 -18.893 1.00 0.00 H new ATOM 0 HB2 SER A 63 -3.061 11.687 -18.575 1.00 0.00 H new ATOM 0 HB3 SER A 63 -2.363 10.257 -17.841 1.00 0.00 H new ATOM 0 HG SER A 63 -2.354 12.708 -16.859 1.00 0.00 H new ATOM 1071 N THR A 64 0.025 9.056 -19.498 1.00 0.00 N ATOM 1072 CA THR A 64 0.210 7.689 -19.969 1.00 0.00 C ATOM 1073 C THR A 64 1.461 7.063 -19.363 1.00 0.00 C ATOM 1074 O THR A 64 2.258 7.745 -18.719 1.00 0.00 O ATOM 1075 CB THR A 64 0.314 7.633 -21.505 1.00 0.00 C ATOM 1076 OG1 THR A 64 0.467 6.277 -21.936 1.00 0.00 O ATOM 1077 CG2 THR A 64 1.490 8.463 -21.998 1.00 0.00 C ATOM 0 H THR A 64 0.757 9.389 -18.871 1.00 0.00 H new ATOM 0 HA THR A 64 -0.666 7.124 -19.651 1.00 0.00 H new ATOM 0 HB THR A 64 -0.603 8.046 -21.925 1.00 0.00 H new ATOM 0 HG1 THR A 64 0.531 6.250 -22.914 1.00 0.00 H new ATOM 0 HG21 THR A 64 1.543 8.408 -23.085 1.00 0.00 H new ATOM 0 HG22 THR A 64 1.356 9.501 -21.693 1.00 0.00 H new ATOM 0 HG23 THR A 64 2.414 8.075 -21.569 1.00 0.00 H new ATOM 1085 N ALA A 65 1.628 5.762 -19.574 1.00 0.00 N ATOM 1086 CA ALA A 65 2.784 5.045 -19.050 1.00 0.00 C ATOM 1087 C ALA A 65 3.433 4.187 -20.131 1.00 0.00 C ATOM 1088 O ALA A 65 2.745 3.604 -20.969 1.00 0.00 O ATOM 1089 CB ALA A 65 2.378 4.184 -17.863 1.00 0.00 C ATOM 0 H ALA A 65 0.977 5.183 -20.104 1.00 0.00 H new ATOM 0 HA ALA A 65 3.517 5.780 -18.717 1.00 0.00 H new ATOM 0 HB1 ALA A 65 3.251 3.654 -17.482 1.00 0.00 H new ATOM 0 HB2 ALA A 65 1.967 4.818 -17.077 1.00 0.00 H new ATOM 0 HB3 ALA A 65 1.625 3.462 -18.178 1.00 0.00 H new ATOM 1095 N GLN A 66 4.760 4.114 -20.105 1.00 0.00 N ATOM 1096 CA GLN A 66 5.501 3.327 -21.084 1.00 0.00 C ATOM 1097 C GLN A 66 6.359 2.271 -20.396 1.00 0.00 C ATOM 1098 O GLN A 66 7.066 2.563 -19.432 1.00 0.00 O ATOM 1099 CB GLN A 66 6.381 4.239 -21.940 1.00 0.00 C ATOM 1100 CG GLN A 66 5.606 5.325 -22.668 1.00 0.00 C ATOM 1101 CD GLN A 66 5.228 4.926 -24.080 1.00 0.00 C ATOM 1102 OE1 GLN A 66 5.850 4.046 -24.677 1.00 0.00 O ATOM 1103 NE2 GLN A 66 4.202 5.571 -24.624 1.00 0.00 N ATOM 0 H GLN A 66 5.344 4.590 -19.417 1.00 0.00 H new ATOM 0 HA GLN A 66 4.781 2.820 -21.727 1.00 0.00 H new ATOM 0 HB2 GLN A 66 7.133 4.706 -21.304 1.00 0.00 H new ATOM 0 HB3 GLN A 66 6.914 3.632 -22.672 1.00 0.00 H new ATOM 0 HG2 GLN A 66 4.702 5.559 -22.106 1.00 0.00 H new ATOM 0 HG3 GLN A 66 6.206 6.235 -22.700 1.00 0.00 H new ATOM 0 HE21 GLN A 66 3.715 6.293 -24.094 1.00 0.00 H new ATOM 0 HE22 GLN A 66 3.901 5.344 -25.572 1.00 0.00 H new ATOM 1112 N TYR A 67 6.292 1.043 -20.898 1.00 0.00 N ATOM 1113 CA TYR A 67 7.061 -0.058 -20.330 1.00 0.00 C ATOM 1114 C TYR A 67 8.455 -0.122 -20.945 1.00 0.00 C ATOM 1115 O TYR A 67 8.610 -0.092 -22.166 1.00 0.00 O ATOM 1116 CB TYR A 67 6.332 -1.384 -20.551 1.00 0.00 C ATOM 1117 CG TYR A 67 7.196 -2.599 -20.302 1.00 0.00 C ATOM 1118 CD1 TYR A 67 7.991 -2.690 -19.166 1.00 0.00 C ATOM 1119 CD2 TYR A 67 7.217 -3.658 -21.202 1.00 0.00 C ATOM 1120 CE1 TYR A 67 8.783 -3.798 -18.934 1.00 0.00 C ATOM 1121 CE2 TYR A 67 8.005 -4.771 -20.978 1.00 0.00 C ATOM 1122 CZ TYR A 67 8.787 -4.835 -19.843 1.00 0.00 C ATOM 1123 OH TYR A 67 9.573 -5.941 -19.615 1.00 0.00 O ATOM 0 H TYR A 67 5.713 0.785 -21.697 1.00 0.00 H new ATOM 0 HA TYR A 67 7.164 0.118 -19.259 1.00 0.00 H new ATOM 0 HB2 TYR A 67 5.464 -1.425 -19.894 1.00 0.00 H new ATOM 0 HB3 TYR A 67 5.959 -1.418 -21.575 1.00 0.00 H new ATOM 0 HD1 TYR A 67 7.990 -1.880 -18.452 1.00 0.00 H new ATOM 0 HD2 TYR A 67 6.607 -3.610 -22.092 1.00 0.00 H new ATOM 0 HE1 TYR A 67 9.395 -3.852 -18.046 1.00 0.00 H new ATOM 0 HE2 TYR A 67 8.009 -5.586 -21.687 1.00 0.00 H new ATOM 0 HH TYR A 67 9.985 -5.872 -18.729 1.00 0.00 H new ATOM 1133 N ASP A 68 9.468 -0.213 -20.089 1.00 0.00 N ATOM 1134 CA ASP A 68 10.851 -0.283 -20.547 1.00 0.00 C ATOM 1135 C ASP A 68 11.423 -1.682 -20.334 1.00 0.00 C ATOM 1136 O ASP A 68 11.431 -2.196 -19.216 1.00 0.00 O ATOM 1137 CB ASP A 68 11.707 0.748 -19.811 1.00 0.00 C ATOM 1138 CG ASP A 68 11.915 2.012 -20.621 1.00 0.00 C ATOM 1139 OD1 ASP A 68 11.972 1.916 -21.865 1.00 0.00 O ATOM 1140 OD2 ASP A 68 12.022 3.097 -20.012 1.00 0.00 O ATOM 0 H ASP A 68 9.357 -0.240 -19.075 1.00 0.00 H new ATOM 0 HA ASP A 68 10.866 -0.061 -21.614 1.00 0.00 H new ATOM 0 HB2 ASP A 68 11.231 1.001 -18.864 1.00 0.00 H new ATOM 0 HB3 ASP A 68 12.676 0.309 -19.574 1.00 0.00 H new ATOM 1145 N SER A 69 11.898 -2.292 -21.415 1.00 0.00 N ATOM 1146 CA SER A 69 12.468 -3.632 -21.348 1.00 0.00 C ATOM 1147 C SER A 69 13.966 -3.573 -21.067 1.00 0.00 C ATOM 1148 O SER A 69 14.522 -4.456 -20.413 1.00 0.00 O ATOM 1149 CB SER A 69 12.213 -4.383 -22.657 1.00 0.00 C ATOM 1150 OG SER A 69 12.323 -3.517 -23.772 1.00 0.00 O ATOM 0 H SER A 69 11.899 -1.879 -22.348 1.00 0.00 H new ATOM 0 HA SER A 69 11.984 -4.165 -20.530 1.00 0.00 H new ATOM 0 HB2 SER A 69 12.927 -5.200 -22.756 1.00 0.00 H new ATOM 0 HB3 SER A 69 11.219 -4.829 -22.636 1.00 0.00 H new ATOM 0 HG SER A 69 12.157 -4.022 -24.596 1.00 0.00 H new ATOM 1156 N LYS A 70 14.614 -2.525 -21.564 1.00 0.00 N ATOM 1157 CA LYS A 70 16.048 -2.348 -21.366 1.00 0.00 C ATOM 1158 C LYS A 70 16.403 -2.402 -19.884 1.00 0.00 C ATOM 1159 O LYS A 70 17.520 -2.769 -19.517 1.00 0.00 O ATOM 1160 CB LYS A 70 16.504 -1.014 -21.963 1.00 0.00 C ATOM 1161 CG LYS A 70 15.742 0.185 -21.426 1.00 0.00 C ATOM 1162 CD LYS A 70 16.461 0.820 -20.248 1.00 0.00 C ATOM 1163 CE LYS A 70 15.521 1.683 -19.420 1.00 0.00 C ATOM 1164 NZ LYS A 70 15.193 2.963 -20.108 1.00 0.00 N ATOM 0 H LYS A 70 14.169 -1.785 -22.107 1.00 0.00 H new ATOM 0 HA LYS A 70 16.564 -3.162 -21.875 1.00 0.00 H new ATOM 0 HB2 LYS A 70 17.566 -0.879 -21.760 1.00 0.00 H new ATOM 0 HB3 LYS A 70 16.388 -1.052 -23.046 1.00 0.00 H new ATOM 0 HG2 LYS A 70 15.618 0.923 -22.218 1.00 0.00 H new ATOM 0 HG3 LYS A 70 14.743 -0.125 -21.120 1.00 0.00 H new ATOM 0 HD2 LYS A 70 16.890 0.040 -19.619 1.00 0.00 H new ATOM 0 HD3 LYS A 70 17.290 1.428 -20.611 1.00 0.00 H new ATOM 0 HE2 LYS A 70 14.602 1.132 -19.221 1.00 0.00 H new ATOM 0 HE3 LYS A 70 15.980 1.897 -18.455 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 14.187 3.186 -19.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 15.777 3.728 -19.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 15.385 2.869 -21.126 1.00 0.00 H new ATOM 1178 N ASP A 71 15.447 -2.036 -19.037 1.00 0.00 N ATOM 1179 CA ASP A 71 15.659 -2.045 -17.595 1.00 0.00 C ATOM 1180 C ASP A 71 14.489 -2.712 -16.878 1.00 0.00 C ATOM 1181 O ASP A 71 14.431 -2.729 -15.649 1.00 0.00 O ATOM 1182 CB ASP A 71 15.845 -0.618 -17.076 1.00 0.00 C ATOM 1183 CG ASP A 71 16.214 -0.581 -15.606 1.00 0.00 C ATOM 1184 OD1 ASP A 71 17.365 -0.934 -15.273 1.00 0.00 O ATOM 1185 OD2 ASP A 71 15.352 -0.197 -14.788 1.00 0.00 O ATOM 0 H ASP A 71 14.518 -1.729 -19.325 1.00 0.00 H new ATOM 0 HA ASP A 71 16.563 -2.619 -17.389 1.00 0.00 H new ATOM 0 HB2 ASP A 71 16.623 -0.122 -17.656 1.00 0.00 H new ATOM 0 HB3 ASP A 71 14.925 -0.055 -17.231 1.00 0.00 H new ATOM 1190 N GLU A 72 13.559 -3.258 -17.655 1.00 0.00 N ATOM 1191 CA GLU A 72 12.390 -3.924 -17.094 1.00 0.00 C ATOM 1192 C GLU A 72 11.685 -3.024 -16.082 1.00 0.00 C ATOM 1193 O GLU A 72 11.102 -3.504 -15.109 1.00 0.00 O ATOM 1194 CB GLU A 72 12.796 -5.239 -16.426 1.00 0.00 C ATOM 1195 CG GLU A 72 13.419 -6.241 -17.384 1.00 0.00 C ATOM 1196 CD GLU A 72 12.439 -6.733 -18.432 1.00 0.00 C ATOM 1197 OE1 GLU A 72 11.393 -7.297 -18.047 1.00 0.00 O ATOM 1198 OE2 GLU A 72 12.718 -6.554 -19.636 1.00 0.00 O ATOM 0 H GLU A 72 13.593 -3.252 -18.674 1.00 0.00 H new ATOM 0 HA GLU A 72 11.699 -4.137 -17.910 1.00 0.00 H new ATOM 0 HB2 GLU A 72 13.504 -5.026 -15.625 1.00 0.00 H new ATOM 0 HB3 GLU A 72 11.917 -5.689 -15.964 1.00 0.00 H new ATOM 0 HG2 GLU A 72 14.274 -5.781 -17.879 1.00 0.00 H new ATOM 0 HG3 GLU A 72 13.798 -7.092 -16.818 1.00 0.00 H new ATOM 1205 N CYS A 73 11.743 -1.719 -16.319 1.00 0.00 N ATOM 1206 CA CYS A 73 11.112 -0.751 -15.429 1.00 0.00 C ATOM 1207 C CYS A 73 9.890 -0.121 -16.090 1.00 0.00 C ATOM 1208 O CYS A 73 9.728 -0.187 -17.309 1.00 0.00 O ATOM 1209 CB CYS A 73 12.111 0.338 -15.034 1.00 0.00 C ATOM 1210 SG CYS A 73 12.630 1.396 -16.405 1.00 0.00 S ATOM 0 H CYS A 73 12.221 -1.306 -17.120 1.00 0.00 H new ATOM 0 HA CYS A 73 10.787 -1.278 -14.532 1.00 0.00 H new ATOM 0 HB2 CYS A 73 11.666 0.960 -14.257 1.00 0.00 H new ATOM 0 HB3 CYS A 73 12.992 -0.133 -14.599 1.00 0.00 H new ATOM 0 HG CYS A 73 13.472 2.286 -15.971 1.00 0.00 H new ATOM 1216 N ILE A 74 9.033 0.488 -15.278 1.00 0.00 N ATOM 1217 CA ILE A 74 7.825 1.129 -15.784 1.00 0.00 C ATOM 1218 C ILE A 74 7.890 2.642 -15.606 1.00 0.00 C ATOM 1219 O ILE A 74 8.224 3.136 -14.530 1.00 0.00 O ATOM 1220 CB ILE A 74 6.566 0.594 -15.077 1.00 0.00 C ATOM 1221 CG1 ILE A 74 6.503 -0.931 -15.185 1.00 0.00 C ATOM 1222 CG2 ILE A 74 5.316 1.224 -15.673 1.00 0.00 C ATOM 1223 CD1 ILE A 74 6.253 -1.428 -16.592 1.00 0.00 C ATOM 0 H ILE A 74 9.152 0.551 -14.267 1.00 0.00 H new ATOM 0 HA ILE A 74 7.763 0.893 -16.846 1.00 0.00 H new ATOM 0 HB ILE A 74 6.618 0.863 -14.022 1.00 0.00 H new ATOM 0 HG12 ILE A 74 7.440 -1.352 -14.821 1.00 0.00 H new ATOM 0 HG13 ILE A 74 5.713 -1.301 -14.532 1.00 0.00 H new ATOM 0 HG21 ILE A 74 4.434 0.836 -15.163 1.00 0.00 H new ATOM 0 HG22 ILE A 74 5.360 2.306 -15.550 1.00 0.00 H new ATOM 0 HG23 ILE A 74 5.257 0.982 -16.734 1.00 0.00 H new ATOM 0 HD11 ILE A 74 6.221 -2.518 -16.593 1.00 0.00 H new ATOM 0 HD12 ILE A 74 5.302 -1.037 -16.952 1.00 0.00 H new ATOM 0 HD13 ILE A 74 7.056 -1.088 -17.246 1.00 0.00 H new ATOM 1235 N ASN A 75 7.567 3.371 -16.668 1.00 0.00 N ATOM 1236 CA ASN A 75 7.587 4.829 -16.629 1.00 0.00 C ATOM 1237 C ASN A 75 6.173 5.395 -16.710 1.00 0.00 C ATOM 1238 O ASN A 75 5.436 5.122 -17.657 1.00 0.00 O ATOM 1239 CB ASN A 75 8.434 5.379 -17.779 1.00 0.00 C ATOM 1240 CG ASN A 75 9.726 4.606 -17.966 1.00 0.00 C ATOM 1241 OD1 ASN A 75 10.780 5.010 -17.475 1.00 0.00 O ATOM 1242 ND2 ASN A 75 9.648 3.489 -18.679 1.00 0.00 N ATOM 0 H ASN A 75 7.288 2.977 -17.566 1.00 0.00 H new ATOM 0 HA ASN A 75 8.029 5.136 -15.681 1.00 0.00 H new ATOM 0 HB2 ASN A 75 7.856 5.343 -18.702 1.00 0.00 H new ATOM 0 HB3 ASN A 75 8.665 6.427 -17.588 1.00 0.00 H new ATOM 0 HD21 ASN A 75 10.484 2.927 -18.839 1.00 0.00 H new ATOM 0 HD22 ASN A 75 8.752 3.193 -19.067 1.00 0.00 H new ATOM 1249 N VAL A 76 5.800 6.186 -15.708 1.00 0.00 N ATOM 1250 CA VAL A 76 4.475 6.793 -15.666 1.00 0.00 C ATOM 1251 C VAL A 76 4.565 8.314 -15.714 1.00 0.00 C ATOM 1252 O VAL A 76 5.224 8.935 -14.880 1.00 0.00 O ATOM 1253 CB VAL A 76 3.706 6.375 -14.398 1.00 0.00 C ATOM 1254 CG1 VAL A 76 2.245 6.783 -14.500 1.00 0.00 C ATOM 1255 CG2 VAL A 76 3.835 4.877 -14.167 1.00 0.00 C ATOM 0 H VAL A 76 6.397 6.421 -14.915 1.00 0.00 H new ATOM 0 HA VAL A 76 3.936 6.436 -16.543 1.00 0.00 H new ATOM 0 HB VAL A 76 4.143 6.891 -13.543 1.00 0.00 H new ATOM 0 HG11 VAL A 76 1.718 6.479 -13.595 1.00 0.00 H new ATOM 0 HG12 VAL A 76 2.176 7.865 -14.614 1.00 0.00 H new ATOM 0 HG13 VAL A 76 1.791 6.298 -15.364 1.00 0.00 H new ATOM 0 HG21 VAL A 76 3.286 4.599 -13.267 1.00 0.00 H new ATOM 0 HG22 VAL A 76 3.425 4.340 -15.023 1.00 0.00 H new ATOM 0 HG23 VAL A 76 4.886 4.617 -14.045 1.00 0.00 H new ATOM 1265 N LYS A 77 3.897 8.910 -16.696 1.00 0.00 N ATOM 1266 CA LYS A 77 3.899 10.359 -16.854 1.00 0.00 C ATOM 1267 C LYS A 77 2.510 10.936 -16.599 1.00 0.00 C ATOM 1268 O LYS A 77 1.503 10.359 -17.009 1.00 0.00 O ATOM 1269 CB LYS A 77 4.371 10.739 -18.259 1.00 0.00 C ATOM 1270 CG LYS A 77 3.265 10.718 -19.299 1.00 0.00 C ATOM 1271 CD LYS A 77 2.611 12.082 -19.446 1.00 0.00 C ATOM 1272 CE LYS A 77 3.353 12.951 -20.449 1.00 0.00 C ATOM 1273 NZ LYS A 77 2.865 12.735 -21.839 1.00 0.00 N ATOM 0 H LYS A 77 3.347 8.411 -17.395 1.00 0.00 H new ATOM 0 HA LYS A 77 4.588 10.778 -16.121 1.00 0.00 H new ATOM 0 HB2 LYS A 77 4.810 11.736 -18.228 1.00 0.00 H new ATOM 0 HB3 LYS A 77 5.160 10.052 -18.566 1.00 0.00 H new ATOM 0 HG2 LYS A 77 3.674 10.404 -20.260 1.00 0.00 H new ATOM 0 HG3 LYS A 77 2.513 9.981 -19.017 1.00 0.00 H new ATOM 0 HD2 LYS A 77 1.576 11.958 -19.766 1.00 0.00 H new ATOM 0 HD3 LYS A 77 2.587 12.582 -18.478 1.00 0.00 H new ATOM 0 HE2 LYS A 77 3.231 14.000 -20.180 1.00 0.00 H new ATOM 0 HE3 LYS A 77 4.420 12.731 -20.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 2.769 13.652 -22.320 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 3.544 12.142 -22.357 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 1.940 12.260 -21.812 1.00 0.00 H new ATOM 1287 N VAL A 78 2.464 12.079 -15.922 1.00 0.00 N ATOM 1288 CA VAL A 78 1.199 12.736 -15.616 1.00 0.00 C ATOM 1289 C VAL A 78 1.327 14.251 -15.718 1.00 0.00 C ATOM 1290 O VAL A 78 2.299 14.836 -15.241 1.00 0.00 O ATOM 1291 CB VAL A 78 0.703 12.368 -14.205 1.00 0.00 C ATOM 1292 CG1 VAL A 78 1.778 12.656 -13.168 1.00 0.00 C ATOM 1293 CG2 VAL A 78 -0.579 13.120 -13.878 1.00 0.00 C ATOM 0 H VAL A 78 3.288 12.569 -15.575 1.00 0.00 H new ATOM 0 HA VAL A 78 0.475 12.386 -16.351 1.00 0.00 H new ATOM 0 HB VAL A 78 0.487 11.300 -14.182 1.00 0.00 H new ATOM 0 HG11 VAL A 78 1.409 12.390 -12.178 1.00 0.00 H new ATOM 0 HG12 VAL A 78 2.668 12.069 -13.394 1.00 0.00 H new ATOM 0 HG13 VAL A 78 2.029 13.717 -13.189 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -0.915 12.848 -12.877 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -0.392 14.193 -13.919 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -1.349 12.858 -14.603 1.00 0.00 H new ATOM 1303 N ALA A 79 0.338 14.882 -16.344 1.00 0.00 N ATOM 1304 CA ALA A 79 0.339 16.331 -16.507 1.00 0.00 C ATOM 1305 C ALA A 79 -0.011 17.031 -15.198 1.00 0.00 C ATOM 1306 O ALA A 79 -0.827 16.539 -14.418 1.00 0.00 O ATOM 1307 CB ALA A 79 -0.634 16.739 -17.603 1.00 0.00 C ATOM 0 H ALA A 79 -0.473 14.413 -16.746 1.00 0.00 H new ATOM 0 HA ALA A 79 1.344 16.639 -16.795 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -0.623 17.823 -17.714 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -0.338 16.275 -18.544 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -1.639 16.412 -17.338 1.00 0.00 H new ATOM 1313 N LYS A 80 0.610 18.181 -14.964 1.00 0.00 N ATOM 1314 CA LYS A 80 0.363 18.951 -13.750 1.00 0.00 C ATOM 1315 C LYS A 80 -0.581 20.116 -14.026 1.00 0.00 C ATOM 1316 O LYS A 80 -0.564 20.698 -15.111 1.00 0.00 O ATOM 1317 CB LYS A 80 1.682 19.475 -13.177 1.00 0.00 C ATOM 1318 CG LYS A 80 1.539 20.116 -11.807 1.00 0.00 C ATOM 1319 CD LYS A 80 1.157 19.093 -10.750 1.00 0.00 C ATOM 1320 CE LYS A 80 1.192 19.696 -9.354 1.00 0.00 C ATOM 1321 NZ LYS A 80 0.335 20.909 -9.251 1.00 0.00 N ATOM 0 H LYS A 80 1.289 18.601 -15.599 1.00 0.00 H new ATOM 0 HA LYS A 80 -0.107 18.291 -13.021 1.00 0.00 H new ATOM 0 HB2 LYS A 80 2.392 18.651 -13.111 1.00 0.00 H new ATOM 0 HB3 LYS A 80 2.104 20.205 -13.868 1.00 0.00 H new ATOM 0 HG2 LYS A 80 2.478 20.595 -11.529 1.00 0.00 H new ATOM 0 HG3 LYS A 80 0.782 20.899 -11.848 1.00 0.00 H new ATOM 0 HD2 LYS A 80 0.158 18.710 -10.957 1.00 0.00 H new ATOM 0 HD3 LYS A 80 1.840 18.245 -10.799 1.00 0.00 H new ATOM 0 HE2 LYS A 80 0.858 18.953 -8.629 1.00 0.00 H new ATOM 0 HE3 LYS A 80 2.219 19.954 -9.096 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 0.373 21.280 -8.280 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 0.679 21.634 -9.912 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -0.647 20.662 -9.489 1.00 0.00 H new ATOM 1335 N LEU A 81 -1.404 20.452 -13.038 1.00 0.00 N ATOM 1336 CA LEU A 81 -2.355 21.549 -13.174 1.00 0.00 C ATOM 1337 C LEU A 81 -1.640 22.849 -13.531 1.00 0.00 C ATOM 1338 O LEU A 81 -2.083 23.593 -14.404 1.00 0.00 O ATOM 1339 CB LEU A 81 -3.146 21.728 -11.877 1.00 0.00 C ATOM 1340 CG LEU A 81 -4.171 20.638 -11.560 1.00 0.00 C ATOM 1341 CD1 LEU A 81 -4.943 20.983 -10.296 1.00 0.00 C ATOM 1342 CD2 LEU A 81 -5.122 20.444 -12.732 1.00 0.00 C ATOM 0 H LEU A 81 -1.431 19.980 -12.134 1.00 0.00 H new ATOM 0 HA LEU A 81 -3.044 21.302 -13.981 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -2.439 21.786 -11.049 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -3.665 22.685 -11.921 1.00 0.00 H new ATOM 0 HG LEU A 81 -3.638 19.702 -11.391 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -5.668 20.196 -10.086 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -4.250 21.071 -9.459 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -5.465 21.929 -10.436 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -5.845 19.665 -12.489 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -5.648 21.377 -12.932 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -4.555 20.151 -13.616 1.00 0.00 H new ATOM 1354 N ASN A 82 -0.530 23.113 -12.849 1.00 0.00 N ATOM 1355 CA ASN A 82 0.248 24.322 -13.095 1.00 0.00 C ATOM 1356 C ASN A 82 1.664 23.976 -13.545 1.00 0.00 C ATOM 1357 O ASN A 82 2.373 23.224 -12.876 1.00 0.00 O ATOM 1358 CB ASN A 82 0.298 25.187 -11.834 1.00 0.00 C ATOM 1359 CG ASN A 82 -1.022 25.197 -11.087 1.00 0.00 C ATOM 1360 OD1 ASN A 82 -1.821 26.123 -11.227 1.00 0.00 O ATOM 1361 ND2 ASN A 82 -1.256 24.163 -10.287 1.00 0.00 N ATOM 0 H ASN A 82 -0.149 22.507 -12.122 1.00 0.00 H new ATOM 0 HA ASN A 82 -0.240 24.882 -13.892 1.00 0.00 H new ATOM 0 HB2 ASN A 82 1.083 24.818 -11.174 1.00 0.00 H new ATOM 0 HB3 ASN A 82 0.565 26.208 -12.107 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -2.127 24.114 -9.758 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -0.565 23.418 -10.202 1.00 0.00 H new ATOM 1368 N LYS A 83 2.070 24.531 -14.682 1.00 0.00 N ATOM 1369 CA LYS A 83 3.402 24.283 -15.221 1.00 0.00 C ATOM 1370 C LYS A 83 4.475 24.885 -14.319 1.00 0.00 C ATOM 1371 O LYS A 83 4.188 25.742 -13.485 1.00 0.00 O ATOM 1372 CB LYS A 83 3.520 24.867 -16.631 1.00 0.00 C ATOM 1373 CG LYS A 83 4.629 24.241 -17.458 1.00 0.00 C ATOM 1374 CD LYS A 83 4.346 24.351 -18.947 1.00 0.00 C ATOM 1375 CE LYS A 83 5.078 23.276 -19.734 1.00 0.00 C ATOM 1376 NZ LYS A 83 5.434 23.737 -21.104 1.00 0.00 N ATOM 0 H LYS A 83 1.496 25.156 -15.248 1.00 0.00 H new ATOM 0 HA LYS A 83 3.554 23.205 -15.266 1.00 0.00 H new ATOM 0 HB2 LYS A 83 2.571 24.734 -17.151 1.00 0.00 H new ATOM 0 HB3 LYS A 83 3.695 25.940 -16.557 1.00 0.00 H new ATOM 0 HG2 LYS A 83 5.575 24.731 -17.230 1.00 0.00 H new ATOM 0 HG3 LYS A 83 4.740 23.192 -17.185 1.00 0.00 H new ATOM 0 HD2 LYS A 83 3.274 24.265 -19.122 1.00 0.00 H new ATOM 0 HD3 LYS A 83 4.649 25.335 -19.304 1.00 0.00 H new ATOM 0 HE2 LYS A 83 5.984 22.989 -19.201 1.00 0.00 H new ATOM 0 HE3 LYS A 83 4.452 22.386 -19.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 5.932 22.976 -21.608 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 4.568 23.987 -21.622 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 6.052 24.571 -21.040 1.00 0.00 H new ATOM 1390 N ASN A 84 5.711 24.430 -14.494 1.00 0.00 N ATOM 1391 CA ASN A 84 6.827 24.924 -13.696 1.00 0.00 C ATOM 1392 C ASN A 84 6.607 24.633 -12.214 1.00 0.00 C ATOM 1393 O ASN A 84 7.239 25.243 -11.352 1.00 0.00 O ATOM 1394 CB ASN A 84 7.008 26.428 -13.910 1.00 0.00 C ATOM 1395 CG ASN A 84 8.008 26.740 -15.006 1.00 0.00 C ATOM 1396 OD1 ASN A 84 7.887 26.046 -16.132 1.00 0.00 O flip ATOM 1397 ND2 ASN A 84 8.879 27.594 -14.842 1.00 0.00 N flip ATOM 0 H ASN A 84 5.965 23.720 -15.181 1.00 0.00 H new ATOM 0 HA ASN A 84 7.730 24.406 -14.020 1.00 0.00 H new ATOM 0 HB2 ASN A 84 6.046 26.875 -14.162 1.00 0.00 H new ATOM 0 HB3 ASN A 84 7.339 26.887 -12.979 1.00 0.00 H new ATOM 0 HD21 ASN A 84 8.934 28.103 -13.960 1.00 0.00 H new ATOM 0 HD22 ASN A 84 9.545 27.793 -15.588 1.00 0.00 H new ATOM 1404 N GLU A 85 5.708 23.697 -11.927 1.00 0.00 N ATOM 1405 CA GLU A 85 5.406 23.325 -10.550 1.00 0.00 C ATOM 1406 C GLU A 85 6.343 22.223 -10.065 1.00 0.00 C ATOM 1407 O GLU A 85 6.547 21.221 -10.751 1.00 0.00 O ATOM 1408 CB GLU A 85 3.952 22.864 -10.431 1.00 0.00 C ATOM 1409 CG GLU A 85 3.563 22.435 -9.026 1.00 0.00 C ATOM 1410 CD GLU A 85 3.429 23.607 -8.074 1.00 0.00 C ATOM 1411 OE1 GLU A 85 4.465 24.212 -7.729 1.00 0.00 O ATOM 1412 OE2 GLU A 85 2.288 23.921 -7.675 1.00 0.00 O ATOM 0 H GLU A 85 5.176 23.183 -12.629 1.00 0.00 H new ATOM 0 HA GLU A 85 5.554 24.204 -9.922 1.00 0.00 H new ATOM 0 HB2 GLU A 85 3.296 23.674 -10.749 1.00 0.00 H new ATOM 0 HB3 GLU A 85 3.786 22.032 -11.115 1.00 0.00 H new ATOM 0 HG2 GLU A 85 2.618 21.893 -9.064 1.00 0.00 H new ATOM 0 HG3 GLU A 85 4.312 21.743 -8.641 1.00 0.00 H new ATOM 1419 N TYR A 86 6.909 22.415 -8.879 1.00 0.00 N ATOM 1420 CA TYR A 86 7.826 21.439 -8.303 1.00 0.00 C ATOM 1421 C TYR A 86 7.193 20.736 -7.106 1.00 0.00 C ATOM 1422 O TYR A 86 6.069 21.049 -6.711 1.00 0.00 O ATOM 1423 CB TYR A 86 9.128 22.120 -7.878 1.00 0.00 C ATOM 1424 CG TYR A 86 9.023 22.861 -6.564 1.00 0.00 C ATOM 1425 CD1 TYR A 86 8.622 24.191 -6.524 1.00 0.00 C ATOM 1426 CD2 TYR A 86 9.324 22.231 -5.363 1.00 0.00 C ATOM 1427 CE1 TYR A 86 8.525 24.872 -5.326 1.00 0.00 C ATOM 1428 CE2 TYR A 86 9.228 22.904 -4.160 1.00 0.00 C ATOM 1429 CZ TYR A 86 8.829 24.224 -4.147 1.00 0.00 C ATOM 1430 OH TYR A 86 8.733 24.898 -2.951 1.00 0.00 O ATOM 0 H TYR A 86 6.749 23.238 -8.298 1.00 0.00 H new ATOM 0 HA TYR A 86 8.046 20.692 -9.065 1.00 0.00 H new ATOM 0 HB2 TYR A 86 9.913 21.368 -7.800 1.00 0.00 H new ATOM 0 HB3 TYR A 86 9.433 22.819 -8.656 1.00 0.00 H new ATOM 0 HD1 TYR A 86 8.382 24.701 -7.445 1.00 0.00 H new ATOM 0 HD2 TYR A 86 9.638 21.198 -5.370 1.00 0.00 H new ATOM 0 HE1 TYR A 86 8.213 25.906 -5.313 1.00 0.00 H new ATOM 0 HE2 TYR A 86 9.464 22.399 -3.235 1.00 0.00 H new ATOM 0 HH TYR A 86 8.981 24.298 -2.217 1.00 0.00 H new ATOM 1440 N PHE A 87 7.922 19.785 -6.533 1.00 0.00 N ATOM 1441 CA PHE A 87 7.433 19.036 -5.381 1.00 0.00 C ATOM 1442 C PHE A 87 8.509 18.931 -4.304 1.00 0.00 C ATOM 1443 O PHE A 87 9.699 18.846 -4.608 1.00 0.00 O ATOM 1444 CB PHE A 87 6.985 17.637 -5.808 1.00 0.00 C ATOM 1445 CG PHE A 87 5.809 17.644 -6.742 1.00 0.00 C ATOM 1446 CD1 PHE A 87 5.952 18.064 -8.055 1.00 0.00 C ATOM 1447 CD2 PHE A 87 4.560 17.231 -6.307 1.00 0.00 C ATOM 1448 CE1 PHE A 87 4.872 18.071 -8.917 1.00 0.00 C ATOM 1449 CE2 PHE A 87 3.476 17.236 -7.165 1.00 0.00 C ATOM 1450 CZ PHE A 87 3.632 17.657 -8.471 1.00 0.00 C ATOM 0 H PHE A 87 8.854 19.514 -6.847 1.00 0.00 H new ATOM 0 HA PHE A 87 6.580 19.572 -4.966 1.00 0.00 H new ATOM 0 HB2 PHE A 87 7.819 17.128 -6.291 1.00 0.00 H new ATOM 0 HB3 PHE A 87 6.730 17.059 -4.920 1.00 0.00 H new ATOM 0 HD1 PHE A 87 6.919 18.390 -8.409 1.00 0.00 H new ATOM 0 HD2 PHE A 87 4.432 16.902 -5.286 1.00 0.00 H new ATOM 0 HE1 PHE A 87 4.997 18.400 -9.938 1.00 0.00 H new ATOM 0 HE2 PHE A 87 2.508 16.911 -6.814 1.00 0.00 H new ATOM 0 HZ PHE A 87 2.786 17.663 -9.142 1.00 0.00 H new ATOM 1460 N GLU A 88 8.082 18.938 -3.046 1.00 0.00 N ATOM 1461 CA GLU A 88 9.008 18.845 -1.924 1.00 0.00 C ATOM 1462 C GLU A 88 8.742 17.588 -1.101 1.00 0.00 C ATOM 1463 O GLU A 88 9.235 17.450 0.019 1.00 0.00 O ATOM 1464 CB GLU A 88 8.893 20.084 -1.033 1.00 0.00 C ATOM 1465 CG GLU A 88 10.161 20.396 -0.257 1.00 0.00 C ATOM 1466 CD GLU A 88 9.977 21.535 0.727 1.00 0.00 C ATOM 1467 OE1 GLU A 88 8.898 21.609 1.352 1.00 0.00 O ATOM 1468 OE2 GLU A 88 10.911 22.352 0.872 1.00 0.00 O ATOM 0 H GLU A 88 7.100 19.007 -2.778 1.00 0.00 H new ATOM 0 HA GLU A 88 10.019 18.788 -2.326 1.00 0.00 H new ATOM 0 HB2 GLU A 88 8.635 20.943 -1.652 1.00 0.00 H new ATOM 0 HB3 GLU A 88 8.073 19.940 -0.330 1.00 0.00 H new ATOM 0 HG2 GLU A 88 10.482 19.504 0.281 1.00 0.00 H new ATOM 0 HG3 GLU A 88 10.957 20.650 -0.956 1.00 0.00 H new ATOM 1475 N ASP A 89 7.960 16.674 -1.665 1.00 0.00 N ATOM 1476 CA ASP A 89 7.628 15.427 -0.985 1.00 0.00 C ATOM 1477 C ASP A 89 8.157 14.226 -1.763 1.00 0.00 C ATOM 1478 O ASP A 89 8.293 13.130 -1.218 1.00 0.00 O ATOM 1479 CB ASP A 89 6.114 15.307 -0.805 1.00 0.00 C ATOM 1480 CG ASP A 89 5.561 16.343 0.154 1.00 0.00 C ATOM 1481 OD1 ASP A 89 6.277 17.324 0.445 1.00 0.00 O ATOM 1482 OD2 ASP A 89 4.412 16.173 0.611 1.00 0.00 O ATOM 0 H ASP A 89 7.544 16.773 -2.591 1.00 0.00 H new ATOM 0 HA ASP A 89 8.103 15.439 -0.004 1.00 0.00 H new ATOM 0 HB2 ASP A 89 5.626 15.416 -1.774 1.00 0.00 H new ATOM 0 HB3 ASP A 89 5.873 14.310 -0.437 1.00 0.00 H new ATOM 1487 N LEU A 90 8.454 14.440 -3.041 1.00 0.00 N ATOM 1488 CA LEU A 90 8.967 13.375 -3.895 1.00 0.00 C ATOM 1489 C LEU A 90 10.335 12.902 -3.414 1.00 0.00 C ATOM 1490 O LEU A 90 10.777 11.803 -3.750 1.00 0.00 O ATOM 1491 CB LEU A 90 9.062 13.857 -5.344 1.00 0.00 C ATOM 1492 CG LEU A 90 7.813 13.655 -6.202 1.00 0.00 C ATOM 1493 CD1 LEU A 90 6.617 14.358 -5.578 1.00 0.00 C ATOM 1494 CD2 LEU A 90 8.051 14.159 -7.618 1.00 0.00 C ATOM 0 H LEU A 90 8.348 15.341 -3.508 1.00 0.00 H new ATOM 0 HA LEU A 90 8.274 12.536 -3.842 1.00 0.00 H new ATOM 0 HB2 LEU A 90 9.306 14.919 -5.337 1.00 0.00 H new ATOM 0 HB3 LEU A 90 9.895 13.342 -5.823 1.00 0.00 H new ATOM 0 HG LEU A 90 7.597 12.588 -6.249 1.00 0.00 H new ATOM 0 HD11 LEU A 90 5.737 14.203 -6.203 1.00 0.00 H new ATOM 0 HD12 LEU A 90 6.433 13.950 -4.584 1.00 0.00 H new ATOM 0 HD13 LEU A 90 6.823 15.426 -5.499 1.00 0.00 H new ATOM 0 HD21 LEU A 90 7.151 14.007 -8.214 1.00 0.00 H new ATOM 0 HD22 LEU A 90 8.293 15.221 -7.590 1.00 0.00 H new ATOM 0 HD23 LEU A 90 8.880 13.610 -8.065 1.00 0.00 H new ATOM 1506 N ASP A 91 10.999 13.738 -2.623 1.00 0.00 N ATOM 1507 CA ASP A 91 12.316 13.405 -2.092 1.00 0.00 C ATOM 1508 C ASP A 91 12.217 12.292 -1.054 1.00 0.00 C ATOM 1509 O ASP A 91 13.209 11.635 -0.736 1.00 0.00 O ATOM 1510 CB ASP A 91 12.968 14.642 -1.472 1.00 0.00 C ATOM 1511 CG ASP A 91 14.479 14.618 -1.586 1.00 0.00 C ATOM 1512 OD1 ASP A 91 14.986 14.344 -2.694 1.00 0.00 O ATOM 1513 OD2 ASP A 91 15.155 14.873 -0.567 1.00 0.00 O ATOM 0 H ASP A 91 10.647 14.651 -2.335 1.00 0.00 H new ATOM 0 HA ASP A 91 12.935 13.054 -2.917 1.00 0.00 H new ATOM 0 HB2 ASP A 91 12.584 15.536 -1.963 1.00 0.00 H new ATOM 0 HB3 ASP A 91 12.687 14.709 -0.421 1.00 0.00 H new ATOM 1518 N LEU A 92 11.015 12.086 -0.528 1.00 0.00 N ATOM 1519 CA LEU A 92 10.786 11.053 0.476 1.00 0.00 C ATOM 1520 C LEU A 92 9.816 9.996 -0.041 1.00 0.00 C ATOM 1521 O LEU A 92 8.625 10.248 -0.227 1.00 0.00 O ATOM 1522 CB LEU A 92 10.240 11.676 1.763 1.00 0.00 C ATOM 1523 CG LEU A 92 11.007 12.885 2.300 1.00 0.00 C ATOM 1524 CD1 LEU A 92 12.505 12.684 2.134 1.00 0.00 C ATOM 1525 CD2 LEU A 92 10.556 14.157 1.598 1.00 0.00 C ATOM 0 H LEU A 92 10.184 12.621 -0.780 1.00 0.00 H new ATOM 0 HA LEU A 92 11.740 10.571 0.689 1.00 0.00 H new ATOM 0 HB2 LEU A 92 9.206 11.975 1.589 1.00 0.00 H new ATOM 0 HB3 LEU A 92 10.224 10.908 2.536 1.00 0.00 H new ATOM 0 HG LEU A 92 10.791 12.985 3.364 1.00 0.00 H new ATOM 0 HD11 LEU A 92 13.034 13.555 2.522 1.00 0.00 H new ATOM 0 HD12 LEU A 92 12.816 11.796 2.684 1.00 0.00 H new ATOM 0 HD13 LEU A 92 12.740 12.557 1.077 1.00 0.00 H new ATOM 0 HD21 LEU A 92 11.112 15.007 1.993 1.00 0.00 H new ATOM 0 HD22 LEU A 92 10.742 14.067 0.528 1.00 0.00 H new ATOM 0 HD23 LEU A 92 9.490 14.309 1.770 1.00 0.00 H new ATOM 1537 N PRO A 93 10.334 8.781 -0.278 1.00 0.00 N ATOM 1538 CA PRO A 93 9.530 7.661 -0.775 1.00 0.00 C ATOM 1539 C PRO A 93 8.547 7.145 0.270 1.00 0.00 C ATOM 1540 O PRO A 93 7.689 6.312 -0.026 1.00 0.00 O ATOM 1541 CB PRO A 93 10.575 6.591 -1.099 1.00 0.00 C ATOM 1542 CG PRO A 93 11.733 6.912 -0.217 1.00 0.00 C ATOM 1543 CD PRO A 93 11.745 8.409 -0.079 1.00 0.00 C ATOM 0 HA PRO A 93 8.915 7.948 -1.628 1.00 0.00 H new ATOM 0 HB2 PRO A 93 10.192 5.590 -0.900 1.00 0.00 H new ATOM 0 HB3 PRO A 93 10.859 6.620 -2.151 1.00 0.00 H new ATOM 0 HG2 PRO A 93 11.628 6.431 0.756 1.00 0.00 H new ATOM 0 HG3 PRO A 93 12.666 6.553 -0.651 1.00 0.00 H new ATOM 0 HD2 PRO A 93 12.108 8.719 0.901 1.00 0.00 H new ATOM 0 HD3 PRO A 93 12.392 8.876 -0.821 1.00 0.00 H new ATOM 1551 N THR A 94 8.675 7.645 1.496 1.00 0.00 N ATOM 1552 CA THR A 94 7.799 7.234 2.585 1.00 0.00 C ATOM 1553 C THR A 94 6.619 8.188 2.730 1.00 0.00 C ATOM 1554 O THR A 94 5.581 7.829 3.287 1.00 0.00 O ATOM 1555 CB THR A 94 8.559 7.168 3.923 1.00 0.00 C ATOM 1556 OG1 THR A 94 8.979 8.480 4.313 1.00 0.00 O ATOM 1557 CG2 THR A 94 9.770 6.254 3.813 1.00 0.00 C ATOM 0 H THR A 94 9.378 8.336 1.759 1.00 0.00 H new ATOM 0 HA THR A 94 7.430 6.239 2.336 1.00 0.00 H new ATOM 0 HB THR A 94 7.886 6.763 4.678 1.00 0.00 H new ATOM 0 HG1 THR A 94 9.460 8.430 5.165 1.00 0.00 H new ATOM 0 HG21 THR A 94 10.291 6.223 4.770 1.00 0.00 H new ATOM 0 HG22 THR A 94 9.444 5.249 3.545 1.00 0.00 H new ATOM 0 HG23 THR A 94 10.444 6.634 3.045 1.00 0.00 H new ATOM 1565 N LYS A 95 6.783 9.406 2.225 1.00 0.00 N ATOM 1566 CA LYS A 95 5.730 10.413 2.297 1.00 0.00 C ATOM 1567 C LYS A 95 4.535 10.012 1.438 1.00 0.00 C ATOM 1568 O LYS A 95 3.400 10.402 1.715 1.00 0.00 O ATOM 1569 CB LYS A 95 6.265 11.773 1.842 1.00 0.00 C ATOM 1570 CG LYS A 95 7.013 12.526 2.929 1.00 0.00 C ATOM 1571 CD LYS A 95 7.286 13.964 2.523 1.00 0.00 C ATOM 1572 CE LYS A 95 7.944 14.746 3.650 1.00 0.00 C ATOM 1573 NZ LYS A 95 8.204 16.161 3.265 1.00 0.00 N ATOM 0 H LYS A 95 7.635 9.720 1.761 1.00 0.00 H new ATOM 0 HA LYS A 95 5.402 10.487 3.334 1.00 0.00 H new ATOM 0 HB2 LYS A 95 6.929 11.626 0.990 1.00 0.00 H new ATOM 0 HB3 LYS A 95 5.432 12.384 1.495 1.00 0.00 H new ATOM 0 HG2 LYS A 95 6.430 12.511 3.850 1.00 0.00 H new ATOM 0 HG3 LYS A 95 7.956 12.021 3.140 1.00 0.00 H new ATOM 0 HD2 LYS A 95 7.930 13.979 1.644 1.00 0.00 H new ATOM 0 HD3 LYS A 95 6.351 14.447 2.241 1.00 0.00 H new ATOM 0 HE2 LYS A 95 7.303 14.721 4.531 1.00 0.00 H new ATOM 0 HE3 LYS A 95 8.883 14.266 3.925 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 8.907 16.573 3.911 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 8.567 16.195 2.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 7.319 16.705 3.323 1.00 0.00 H new ATOM 1587 N LEU A 96 4.796 9.230 0.396 1.00 0.00 N ATOM 1588 CA LEU A 96 3.741 8.775 -0.503 1.00 0.00 C ATOM 1589 C LEU A 96 2.971 7.609 0.109 1.00 0.00 C ATOM 1590 O LEU A 96 1.739 7.600 0.113 1.00 0.00 O ATOM 1591 CB LEU A 96 4.336 8.358 -1.849 1.00 0.00 C ATOM 1592 CG LEU A 96 5.150 9.425 -2.582 1.00 0.00 C ATOM 1593 CD1 LEU A 96 4.533 10.800 -2.381 1.00 0.00 C ATOM 1594 CD2 LEU A 96 6.596 9.412 -2.107 1.00 0.00 C ATOM 0 H LEU A 96 5.729 8.898 0.153 1.00 0.00 H new ATOM 0 HA LEU A 96 3.048 9.602 -0.660 1.00 0.00 H new ATOM 0 HB2 LEU A 96 4.974 7.489 -1.688 1.00 0.00 H new ATOM 0 HB3 LEU A 96 3.522 8.039 -2.500 1.00 0.00 H new ATOM 0 HG LEU A 96 5.136 9.196 -3.648 1.00 0.00 H new ATOM 0 HD11 LEU A 96 5.126 11.546 -2.910 1.00 0.00 H new ATOM 0 HD12 LEU A 96 3.515 10.803 -2.771 1.00 0.00 H new ATOM 0 HD13 LEU A 96 4.515 11.039 -1.318 1.00 0.00 H new ATOM 0 HD21 LEU A 96 7.161 10.178 -2.639 1.00 0.00 H new ATOM 0 HD22 LEU A 96 6.629 9.615 -1.037 1.00 0.00 H new ATOM 0 HD23 LEU A 96 7.035 8.434 -2.305 1.00 0.00 H new ATOM 1606 N LEU A 97 3.703 6.629 0.626 1.00 0.00 N ATOM 1607 CA LEU A 97 3.088 5.459 1.243 1.00 0.00 C ATOM 1608 C LEU A 97 2.317 5.848 2.500 1.00 0.00 C ATOM 1609 O LEU A 97 1.194 5.392 2.718 1.00 0.00 O ATOM 1610 CB LEU A 97 4.156 4.420 1.588 1.00 0.00 C ATOM 1611 CG LEU A 97 5.165 4.102 0.484 1.00 0.00 C ATOM 1612 CD1 LEU A 97 6.116 3.002 0.930 1.00 0.00 C ATOM 1613 CD2 LEU A 97 4.446 3.701 -0.796 1.00 0.00 C ATOM 0 H LEU A 97 4.723 6.621 0.630 1.00 0.00 H new ATOM 0 HA LEU A 97 2.387 5.028 0.528 1.00 0.00 H new ATOM 0 HB2 LEU A 97 4.704 4.768 2.464 1.00 0.00 H new ATOM 0 HB3 LEU A 97 3.655 3.495 1.873 1.00 0.00 H new ATOM 0 HG LEU A 97 5.750 5.000 0.283 1.00 0.00 H new ATOM 0 HD11 LEU A 97 6.827 2.789 0.131 1.00 0.00 H new ATOM 0 HD12 LEU A 97 6.656 3.327 1.819 1.00 0.00 H new ATOM 0 HD13 LEU A 97 5.548 2.101 1.159 1.00 0.00 H new ATOM 0 HD21 LEU A 97 5.180 3.478 -1.571 1.00 0.00 H new ATOM 0 HD22 LEU A 97 3.836 2.817 -0.609 1.00 0.00 H new ATOM 0 HD23 LEU A 97 3.807 4.520 -1.126 1.00 0.00 H new ATOM 1625 N ALA A 98 2.925 6.695 3.324 1.00 0.00 N ATOM 1626 CA ALA A 98 2.294 7.149 4.557 1.00 0.00 C ATOM 1627 C ALA A 98 1.957 5.973 5.466 1.00 0.00 C ATOM 1628 O ALA A 98 0.830 5.849 5.946 1.00 0.00 O ATOM 1629 CB ALA A 98 1.040 7.952 4.243 1.00 0.00 C ATOM 0 H ALA A 98 3.855 7.081 3.160 1.00 0.00 H new ATOM 0 HA ALA A 98 3.001 7.790 5.083 1.00 0.00 H new ATOM 0 HB1 ALA A 98 0.579 8.285 5.173 1.00 0.00 H new ATOM 0 HB2 ALA A 98 1.305 8.819 3.639 1.00 0.00 H new ATOM 0 HB3 ALA A 98 0.337 7.328 3.692 1.00 0.00 H new ATOM 1635 N ARG A 99 2.941 5.110 5.699 1.00 0.00 N ATOM 1636 CA ARG A 99 2.748 3.942 6.550 1.00 0.00 C ATOM 1637 C ARG A 99 3.150 4.246 7.990 1.00 0.00 C ATOM 1638 O ARG A 99 3.954 5.143 8.243 1.00 0.00 O ATOM 1639 CB ARG A 99 3.562 2.759 6.021 1.00 0.00 C ATOM 1640 CG ARG A 99 2.778 1.849 5.089 1.00 0.00 C ATOM 1641 CD ARG A 99 2.208 2.619 3.908 1.00 0.00 C ATOM 1642 NE ARG A 99 0.845 3.078 4.161 1.00 0.00 N ATOM 1643 CZ ARG A 99 -0.212 2.273 4.169 1.00 0.00 C ATOM 1644 NH1 ARG A 99 -0.063 0.975 3.941 1.00 0.00 N ATOM 1645 NH2 ARG A 99 -1.421 2.766 4.407 1.00 0.00 N ATOM 0 H ARG A 99 3.880 5.198 5.310 1.00 0.00 H new ATOM 0 HA ARG A 99 1.689 3.683 6.533 1.00 0.00 H new ATOM 0 HB2 ARG A 99 4.437 3.138 5.494 1.00 0.00 H new ATOM 0 HB3 ARG A 99 3.927 2.173 6.865 1.00 0.00 H new ATOM 0 HG2 ARG A 99 3.427 1.052 4.726 1.00 0.00 H new ATOM 0 HG3 ARG A 99 1.967 1.373 5.640 1.00 0.00 H new ATOM 0 HD2 ARG A 99 2.845 3.477 3.693 1.00 0.00 H new ATOM 0 HD3 ARG A 99 2.218 1.984 3.022 1.00 0.00 H new ATOM 0 HE ARG A 99 0.696 4.071 4.341 1.00 0.00 H new ATOM 0 HH11 ARG A 99 0.865 0.592 3.759 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -0.876 0.359 3.948 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -1.539 3.764 4.584 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -2.232 2.147 4.413 1.00 0.00 H new ATOM 1659 N GLN A 100 2.585 3.493 8.928 1.00 0.00 N ATOM 1660 CA GLN A 100 2.884 3.684 10.343 1.00 0.00 C ATOM 1661 C GLN A 100 4.389 3.672 10.587 1.00 0.00 C ATOM 1662 O GLN A 100 5.035 2.629 10.496 1.00 0.00 O ATOM 1663 CB GLN A 100 2.211 2.595 11.179 1.00 0.00 C ATOM 1664 CG GLN A 100 0.766 2.906 11.534 1.00 0.00 C ATOM 1665 CD GLN A 100 0.644 3.992 12.585 1.00 0.00 C ATOM 1666 OE1 GLN A 100 0.767 3.730 13.782 1.00 0.00 O ATOM 1667 NE2 GLN A 100 0.401 5.220 12.142 1.00 0.00 N ATOM 0 H GLN A 100 1.918 2.746 8.734 1.00 0.00 H new ATOM 0 HA GLN A 100 2.493 4.656 10.644 1.00 0.00 H new ATOM 0 HB2 GLN A 100 2.247 1.654 10.631 1.00 0.00 H new ATOM 0 HB3 GLN A 100 2.779 2.451 12.098 1.00 0.00 H new ATOM 0 HG2 GLN A 100 0.233 3.215 10.635 1.00 0.00 H new ATOM 0 HG3 GLN A 100 0.282 1.999 11.896 1.00 0.00 H new ATOM 0 HE21 GLN A 100 0.306 5.392 11.141 1.00 0.00 H new ATOM 0 HE22 GLN A 100 0.309 5.992 12.803 1.00 0.00 H new ATOM 1676 N GLY A 101 4.943 4.840 10.898 1.00 0.00 N ATOM 1677 CA GLY A 101 6.368 4.942 11.151 1.00 0.00 C ATOM 1678 C GLY A 101 6.705 6.042 12.138 1.00 0.00 C ATOM 1679 O GLY A 101 7.824 6.555 12.147 1.00 0.00 O ATOM 0 H GLY A 101 4.430 5.718 10.979 1.00 0.00 H new ATOM 0 HA2 GLY A 101 6.735 3.990 11.534 1.00 0.00 H new ATOM 0 HA3 GLY A 101 6.888 5.129 10.212 1.00 0.00 H new ATOM 1683 N ASP A 102 5.735 6.406 12.969 1.00 0.00 N ATOM 1684 CA ASP A 102 5.934 7.453 13.964 1.00 0.00 C ATOM 1685 C ASP A 102 5.624 6.937 15.366 1.00 0.00 C ATOM 1686 O ASP A 102 4.467 6.682 15.703 1.00 0.00 O ATOM 1687 CB ASP A 102 5.054 8.663 13.647 1.00 0.00 C ATOM 1688 CG ASP A 102 5.521 9.411 12.413 1.00 0.00 C ATOM 1689 OD1 ASP A 102 6.012 8.754 11.471 1.00 0.00 O ATOM 1690 OD2 ASP A 102 5.394 10.653 12.390 1.00 0.00 O ATOM 0 H ASP A 102 4.803 5.992 12.973 1.00 0.00 H new ATOM 0 HA ASP A 102 6.980 7.756 13.931 1.00 0.00 H new ATOM 0 HB2 ASP A 102 4.026 8.332 13.501 1.00 0.00 H new ATOM 0 HB3 ASP A 102 5.052 9.341 14.500 1.00 0.00 H new ATOM 1695 N LEU A 103 6.664 6.784 16.178 1.00 0.00 N ATOM 1696 CA LEU A 103 6.503 6.296 17.544 1.00 0.00 C ATOM 1697 C LEU A 103 5.679 7.272 18.376 1.00 0.00 C ATOM 1698 O LEU A 103 4.961 6.871 19.292 1.00 0.00 O ATOM 1699 CB LEU A 103 7.871 6.082 18.194 1.00 0.00 C ATOM 1700 CG LEU A 103 7.879 5.264 19.486 1.00 0.00 C ATOM 1701 CD1 LEU A 103 9.205 4.537 19.649 1.00 0.00 C ATOM 1702 CD2 LEU A 103 7.609 6.160 20.686 1.00 0.00 C ATOM 0 H LEU A 103 7.628 6.991 15.915 1.00 0.00 H new ATOM 0 HA LEU A 103 5.974 5.344 17.504 1.00 0.00 H new ATOM 0 HB2 LEU A 103 8.521 5.589 17.471 1.00 0.00 H new ATOM 0 HB3 LEU A 103 8.309 7.058 18.403 1.00 0.00 H new ATOM 0 HG LEU A 103 7.085 4.520 19.427 1.00 0.00 H new ATOM 0 HD11 LEU A 103 9.192 3.960 20.574 1.00 0.00 H new ATOM 0 HD12 LEU A 103 9.358 3.865 18.804 1.00 0.00 H new ATOM 0 HD13 LEU A 103 10.016 5.264 19.686 1.00 0.00 H new ATOM 0 HD21 LEU A 103 7.618 5.561 21.597 1.00 0.00 H new ATOM 0 HD22 LEU A 103 8.381 6.927 20.748 1.00 0.00 H new ATOM 0 HD23 LEU A 103 6.634 6.634 20.574 1.00 0.00 H new ATOM 1714 N ALA A 104 5.785 8.557 18.051 1.00 0.00 N ATOM 1715 CA ALA A 104 5.046 9.590 18.766 1.00 0.00 C ATOM 1716 C ALA A 104 3.659 9.788 18.165 1.00 0.00 C ATOM 1717 O ALA A 104 2.749 10.285 18.828 1.00 0.00 O ATOM 1718 CB ALA A 104 5.821 10.899 18.752 1.00 0.00 C ATOM 0 H ALA A 104 6.376 8.907 17.297 1.00 0.00 H new ATOM 0 HA ALA A 104 4.923 9.265 19.799 1.00 0.00 H new ATOM 0 HB1 ALA A 104 5.257 11.661 19.290 1.00 0.00 H new ATOM 0 HB2 ALA A 104 6.788 10.755 19.235 1.00 0.00 H new ATOM 0 HB3 ALA A 104 5.974 11.220 17.722 1.00 0.00 H new ATOM 1724 N GLY A 105 3.503 9.396 16.904 1.00 0.00 N ATOM 1725 CA GLY A 105 2.224 9.540 16.234 1.00 0.00 C ATOM 1726 C GLY A 105 1.274 8.401 16.549 1.00 0.00 C ATOM 1727 O GLY A 105 1.102 7.487 15.743 1.00 0.00 O ATOM 0 H GLY A 105 4.240 8.981 16.334 1.00 0.00 H new ATOM 0 HA2 GLY A 105 1.766 10.484 16.530 1.00 0.00 H new ATOM 0 HA3 GLY A 105 2.385 9.588 15.157 1.00 0.00 H new ATOM 1731 N ALA A 106 0.656 8.455 17.724 1.00 0.00 N ATOM 1732 CA ALA A 106 -0.281 7.421 18.143 1.00 0.00 C ATOM 1733 C ALA A 106 -1.721 7.917 18.055 1.00 0.00 C ATOM 1734 O ALA A 106 -2.665 7.142 18.211 1.00 0.00 O ATOM 1735 CB ALA A 106 0.036 6.962 19.558 1.00 0.00 C ATOM 0 H ALA A 106 0.788 9.205 18.403 1.00 0.00 H new ATOM 0 HA ALA A 106 -0.174 6.573 17.466 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -0.672 6.189 19.857 1.00 0.00 H new ATOM 0 HB2 ALA A 106 1.048 6.559 19.592 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -0.040 7.808 20.241 1.00 0.00 H new ATOM 1741 N ASP A 107 -1.881 9.211 17.806 1.00 0.00 N ATOM 1742 CA ASP A 107 -3.207 9.811 17.698 1.00 0.00 C ATOM 1743 C ASP A 107 -3.316 10.663 16.437 1.00 0.00 C ATOM 1744 O ASP A 107 -2.608 11.658 16.286 1.00 0.00 O ATOM 1745 CB ASP A 107 -3.507 10.662 18.932 1.00 0.00 C ATOM 1746 CG ASP A 107 -2.362 11.589 19.289 1.00 0.00 C ATOM 1747 OD1 ASP A 107 -1.476 11.167 20.061 1.00 0.00 O ATOM 1748 OD2 ASP A 107 -2.352 12.737 18.796 1.00 0.00 O ATOM 0 H ASP A 107 -1.110 9.866 17.675 1.00 0.00 H new ATOM 0 HA ASP A 107 -3.940 9.006 17.635 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -4.406 11.252 18.753 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -3.718 10.008 19.778 1.00 0.00 H new ATOM 1753 N ALA A 108 -4.207 10.265 15.535 1.00 0.00 N ATOM 1754 CA ALA A 108 -4.410 10.993 14.289 1.00 0.00 C ATOM 1755 C ALA A 108 -5.703 10.562 13.606 1.00 0.00 C ATOM 1756 O ALA A 108 -6.188 9.450 13.817 1.00 0.00 O ATOM 1757 CB ALA A 108 -3.225 10.785 13.358 1.00 0.00 C ATOM 0 H ALA A 108 -4.800 9.442 15.644 1.00 0.00 H new ATOM 0 HA ALA A 108 -4.491 12.054 14.526 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -3.390 11.334 12.431 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -2.317 11.148 13.839 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -3.118 9.723 13.136 1.00 0.00 H new ATOM 1763 N LEU A 109 -6.258 11.449 12.787 1.00 0.00 N ATOM 1764 CA LEU A 109 -7.497 11.161 12.073 1.00 0.00 C ATOM 1765 C LEU A 109 -7.381 11.548 10.602 1.00 0.00 C ATOM 1766 O LEU A 109 -6.881 12.623 10.269 1.00 0.00 O ATOM 1767 CB LEU A 109 -8.666 11.908 12.718 1.00 0.00 C ATOM 1768 CG LEU A 109 -8.950 11.574 14.183 1.00 0.00 C ATOM 1769 CD1 LEU A 109 -9.634 12.744 14.874 1.00 0.00 C ATOM 1770 CD2 LEU A 109 -9.802 10.318 14.288 1.00 0.00 C ATOM 0 H LEU A 109 -5.869 12.374 12.601 1.00 0.00 H new ATOM 0 HA LEU A 109 -7.681 10.088 12.134 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -8.474 12.978 12.641 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -9.566 11.703 12.138 1.00 0.00 H new ATOM 0 HG LEU A 109 -8.000 11.387 14.684 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -9.828 12.488 15.916 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -8.988 13.621 14.830 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -10.577 12.962 14.372 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -9.994 10.095 15.338 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -10.749 10.476 13.771 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -9.274 9.481 13.830 1.00 0.00 H new ATOM 1782 N THR A 110 -7.847 10.665 9.725 1.00 0.00 N ATOM 1783 CA THR A 110 -7.797 10.914 8.290 1.00 0.00 C ATOM 1784 C THR A 110 -8.934 10.200 7.567 1.00 0.00 C ATOM 1785 O THR A 110 -8.907 8.981 7.402 1.00 0.00 O ATOM 1786 CB THR A 110 -6.455 10.458 7.687 1.00 0.00 C ATOM 1787 OG1 THR A 110 -6.197 9.094 8.041 1.00 0.00 O ATOM 1788 CG2 THR A 110 -5.315 11.338 8.176 1.00 0.00 C ATOM 0 H THR A 110 -8.264 9.771 9.984 1.00 0.00 H new ATOM 0 HA THR A 110 -7.902 11.990 8.153 1.00 0.00 H new ATOM 0 HB THR A 110 -6.521 10.545 6.603 1.00 0.00 H new ATOM 0 HG1 THR A 110 -6.989 8.550 7.847 1.00 0.00 H new ATOM 0 HG21 THR A 110 -4.378 10.997 7.737 1.00 0.00 H new ATOM 0 HG22 THR A 110 -5.500 12.371 7.880 1.00 0.00 H new ATOM 0 HG23 THR A 110 -5.250 11.278 9.262 1.00 0.00 H new ATOM 1796 N GLU A 111 -9.931 10.968 7.139 1.00 0.00 N ATOM 1797 CA GLU A 111 -11.077 10.407 6.434 1.00 0.00 C ATOM 1798 C GLU A 111 -10.792 10.289 4.939 1.00 0.00 C ATOM 1799 O GLU A 111 -10.600 11.290 4.252 1.00 0.00 O ATOM 1800 CB GLU A 111 -12.318 11.275 6.660 1.00 0.00 C ATOM 1801 CG GLU A 111 -13.608 10.628 6.184 1.00 0.00 C ATOM 1802 CD GLU A 111 -14.837 11.433 6.560 1.00 0.00 C ATOM 1803 OE1 GLU A 111 -14.937 11.851 7.732 1.00 0.00 O ATOM 1804 OE2 GLU A 111 -15.699 11.644 5.681 1.00 0.00 O ATOM 0 H GLU A 111 -9.968 11.979 7.268 1.00 0.00 H new ATOM 0 HA GLU A 111 -11.262 9.409 6.831 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -12.405 11.500 7.723 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -12.186 12.225 6.143 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -13.573 10.510 5.101 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -13.688 9.628 6.611 1.00 0.00 H new ATOM 1811 N ASN A 112 -10.766 9.055 4.444 1.00 0.00 N ATOM 1812 CA ASN A 112 -10.504 8.804 3.032 1.00 0.00 C ATOM 1813 C ASN A 112 -11.095 7.467 2.598 1.00 0.00 C ATOM 1814 O ASN A 112 -10.972 6.463 3.301 1.00 0.00 O ATOM 1815 CB ASN A 112 -8.998 8.821 2.761 1.00 0.00 C ATOM 1816 CG ASN A 112 -8.459 10.226 2.576 1.00 0.00 C ATOM 1817 OD1 ASN A 112 -8.865 10.944 1.662 1.00 0.00 O ATOM 1818 ND2 ASN A 112 -7.539 10.626 3.446 1.00 0.00 N ATOM 0 H ASN A 112 -10.923 8.214 5.000 1.00 0.00 H new ATOM 0 HA ASN A 112 -10.980 9.596 2.453 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -8.477 8.341 3.590 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -8.786 8.233 1.868 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -7.140 11.562 3.372 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -7.232 9.998 4.188 1.00 0.00 H new ATOM 1825 N THR A 113 -11.737 7.459 1.434 1.00 0.00 N ATOM 1826 CA THR A 113 -12.348 6.246 0.906 1.00 0.00 C ATOM 1827 C THR A 113 -12.405 6.277 -0.617 1.00 0.00 C ATOM 1828 O THR A 113 -12.714 7.307 -1.216 1.00 0.00 O ATOM 1829 CB THR A 113 -13.773 6.049 1.457 1.00 0.00 C ATOM 1830 OG1 THR A 113 -14.371 4.889 0.867 1.00 0.00 O ATOM 1831 CG2 THR A 113 -14.636 7.270 1.175 1.00 0.00 C ATOM 0 H THR A 113 -11.847 8.280 0.839 1.00 0.00 H new ATOM 0 HA THR A 113 -11.723 5.412 1.227 1.00 0.00 H new ATOM 0 HB THR A 113 -13.706 5.913 2.536 1.00 0.00 H new ATOM 0 HG1 THR A 113 -15.276 4.770 1.224 1.00 0.00 H new ATOM 0 HG21 THR A 113 -15.638 7.108 1.573 1.00 0.00 H new ATOM 0 HG22 THR A 113 -14.194 8.146 1.650 1.00 0.00 H new ATOM 0 HG23 THR A 113 -14.696 7.433 0.099 1.00 0.00 H new ATOM 1839 N ASP A 114 -12.104 5.142 -1.239 1.00 0.00 N ATOM 1840 CA ASP A 114 -12.122 5.039 -2.693 1.00 0.00 C ATOM 1841 C ASP A 114 -12.820 3.757 -3.138 1.00 0.00 C ATOM 1842 O ASP A 114 -12.848 2.768 -2.407 1.00 0.00 O ATOM 1843 CB ASP A 114 -10.697 5.077 -3.246 1.00 0.00 C ATOM 1844 CG ASP A 114 -9.821 6.079 -2.521 1.00 0.00 C ATOM 1845 OD1 ASP A 114 -9.822 7.263 -2.918 1.00 0.00 O ATOM 1846 OD2 ASP A 114 -9.134 5.680 -1.558 1.00 0.00 O ATOM 0 H ASP A 114 -11.845 4.280 -0.758 1.00 0.00 H new ATOM 0 HA ASP A 114 -12.678 5.890 -3.086 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -10.253 4.085 -3.165 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -10.729 5.327 -4.307 1.00 0.00 H new ATOM 1851 N ALA A 115 -13.383 3.783 -4.342 1.00 0.00 N ATOM 1852 CA ALA A 115 -14.079 2.623 -4.885 1.00 0.00 C ATOM 1853 C ALA A 115 -13.132 1.741 -5.691 1.00 0.00 C ATOM 1854 O ALA A 115 -12.444 2.215 -6.595 1.00 0.00 O ATOM 1855 CB ALA A 115 -15.252 3.068 -5.747 1.00 0.00 C ATOM 0 H ALA A 115 -13.371 4.595 -4.960 1.00 0.00 H new ATOM 0 HA ALA A 115 -14.458 2.034 -4.050 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -15.763 2.192 -6.146 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -15.948 3.650 -5.142 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -14.886 3.681 -6.570 1.00 0.00 H new ATOM 1861 N LYS A 116 -13.101 0.456 -5.357 1.00 0.00 N ATOM 1862 CA LYS A 116 -12.238 -0.494 -6.050 1.00 0.00 C ATOM 1863 C LYS A 116 -12.842 -0.900 -7.390 1.00 0.00 C ATOM 1864 O LYS A 116 -13.809 -1.660 -7.443 1.00 0.00 O ATOM 1865 CB LYS A 116 -12.012 -1.735 -5.183 1.00 0.00 C ATOM 1866 CG LYS A 116 -11.413 -1.426 -3.822 1.00 0.00 C ATOM 1867 CD LYS A 116 -10.558 -2.575 -3.315 1.00 0.00 C ATOM 1868 CE LYS A 116 -10.015 -2.294 -1.923 1.00 0.00 C ATOM 1869 NZ LYS A 116 -9.257 -3.454 -1.378 1.00 0.00 N ATOM 0 H LYS A 116 -13.664 0.048 -4.610 1.00 0.00 H new ATOM 0 HA LYS A 116 -11.280 -0.009 -6.236 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -12.963 -2.249 -5.044 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -11.353 -2.423 -5.713 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -10.808 -0.522 -3.887 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -12.212 -1.224 -3.109 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -11.150 -3.490 -3.298 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -9.729 -2.744 -4.003 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -9.365 -1.419 -1.956 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -10.840 -2.053 -1.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -8.904 -3.222 -0.428 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -9.883 -4.282 -1.322 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -8.454 -3.669 -2.003 1.00 0.00 H new ATOM 1883 N LYS A 117 -12.265 -0.390 -8.473 1.00 0.00 N ATOM 1884 CA LYS A 117 -12.743 -0.701 -9.815 1.00 0.00 C ATOM 1885 C LYS A 117 -11.913 -1.815 -10.444 1.00 0.00 C ATOM 1886 O LYS A 117 -10.717 -1.649 -10.690 1.00 0.00 O ATOM 1887 CB LYS A 117 -12.695 0.547 -10.698 1.00 0.00 C ATOM 1888 CG LYS A 117 -13.629 1.654 -10.239 1.00 0.00 C ATOM 1889 CD LYS A 117 -13.204 3.006 -10.786 1.00 0.00 C ATOM 1890 CE LYS A 117 -13.477 3.114 -12.279 1.00 0.00 C ATOM 1891 NZ LYS A 117 -13.670 4.527 -12.706 1.00 0.00 N ATOM 0 H LYS A 117 -11.464 0.242 -8.447 1.00 0.00 H new ATOM 0 HA LYS A 117 -13.775 -1.042 -9.736 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -11.674 0.929 -10.717 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -12.950 0.268 -11.720 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -14.645 1.432 -10.565 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -13.644 1.690 -9.150 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -13.738 3.797 -10.259 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -12.141 3.158 -10.597 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -12.646 2.677 -12.833 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -14.366 2.534 -12.529 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -13.854 4.558 -13.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -14.479 4.936 -12.196 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -12.812 5.075 -12.491 1.00 0.00 H new ATOM 1905 N THR A 118 -12.553 -2.950 -10.706 1.00 0.00 N ATOM 1906 CA THR A 118 -11.874 -4.090 -11.307 1.00 0.00 C ATOM 1907 C THR A 118 -12.562 -4.522 -12.597 1.00 0.00 C ATOM 1908 O THR A 118 -13.729 -4.913 -12.587 1.00 0.00 O ATOM 1909 CB THR A 118 -11.823 -5.288 -10.340 1.00 0.00 C ATOM 1910 OG1 THR A 118 -11.426 -4.848 -9.036 1.00 0.00 O ATOM 1911 CG2 THR A 118 -10.852 -6.347 -10.841 1.00 0.00 C ATOM 0 H THR A 118 -13.542 -3.104 -10.511 1.00 0.00 H new ATOM 0 HA THR A 118 -10.856 -3.770 -11.530 1.00 0.00 H new ATOM 0 HB THR A 118 -12.819 -5.727 -10.287 1.00 0.00 H new ATOM 0 HG1 THR A 118 -11.398 -5.615 -8.427 1.00 0.00 H new ATOM 0 HG21 THR A 118 -10.833 -7.183 -10.142 1.00 0.00 H new ATOM 0 HG22 THR A 118 -11.173 -6.701 -11.821 1.00 0.00 H new ATOM 0 HG23 THR A 118 -9.853 -5.917 -10.920 1.00 0.00 H new ATOM 1919 N GLN A 119 -11.831 -4.451 -13.705 1.00 0.00 N ATOM 1920 CA GLN A 119 -12.372 -4.835 -15.003 1.00 0.00 C ATOM 1921 C GLN A 119 -11.412 -5.765 -15.739 1.00 0.00 C ATOM 1922 O GLN A 119 -10.400 -5.324 -16.284 1.00 0.00 O ATOM 1923 CB GLN A 119 -12.649 -3.593 -15.851 1.00 0.00 C ATOM 1924 CG GLN A 119 -11.524 -2.572 -15.822 1.00 0.00 C ATOM 1925 CD GLN A 119 -11.499 -1.694 -17.057 1.00 0.00 C ATOM 1926 OE1 GLN A 119 -12.481 -1.614 -17.796 1.00 0.00 O ATOM 1927 NE2 GLN A 119 -10.373 -1.030 -17.289 1.00 0.00 N ATOM 0 H GLN A 119 -10.863 -4.131 -13.729 1.00 0.00 H new ATOM 0 HA GLN A 119 -13.308 -5.368 -14.836 1.00 0.00 H new ATOM 0 HB2 GLN A 119 -12.824 -3.899 -16.882 1.00 0.00 H new ATOM 0 HB3 GLN A 119 -13.566 -3.121 -15.499 1.00 0.00 H new ATOM 0 HG2 GLN A 119 -11.631 -1.944 -14.937 1.00 0.00 H new ATOM 0 HG3 GLN A 119 -10.570 -3.091 -15.731 1.00 0.00 H new ATOM 0 HE21 GLN A 119 -9.584 -1.126 -16.650 1.00 0.00 H new ATOM 0 HE22 GLN A 119 -10.297 -0.424 -18.106 1.00 0.00 H new ATOM 1936 N LYS A 120 -11.737 -7.053 -15.751 1.00 0.00 N ATOM 1937 CA LYS A 120 -10.906 -8.046 -16.420 1.00 0.00 C ATOM 1938 C LYS A 120 -11.759 -9.171 -16.997 1.00 0.00 C ATOM 1939 O LYS A 120 -11.725 -10.310 -16.530 1.00 0.00 O ATOM 1940 CB LYS A 120 -9.876 -8.621 -15.445 1.00 0.00 C ATOM 1941 CG LYS A 120 -8.882 -7.592 -14.934 1.00 0.00 C ATOM 1942 CD LYS A 120 -7.591 -8.246 -14.471 1.00 0.00 C ATOM 1943 CE LYS A 120 -7.783 -8.989 -13.157 1.00 0.00 C ATOM 1944 NZ LYS A 120 -8.262 -8.085 -12.075 1.00 0.00 N ATOM 0 H LYS A 120 -12.571 -7.434 -15.304 1.00 0.00 H new ATOM 0 HA LYS A 120 -10.385 -7.552 -17.240 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -10.398 -9.062 -14.596 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -9.332 -9.426 -15.938 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -8.664 -6.872 -15.723 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -9.325 -7.035 -14.108 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -7.239 -8.940 -15.235 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -6.819 -7.486 -14.351 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -8.500 -9.798 -13.298 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -6.840 -9.447 -12.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -7.758 -8.303 -11.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -8.080 -7.097 -12.343 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -9.283 -8.223 -11.934 1.00 0.00 H new ATOM 1958 N PRO A 121 -12.543 -8.848 -18.036 1.00 0.00 N ATOM 1959 CA PRO A 121 -13.418 -9.819 -18.699 1.00 0.00 C ATOM 1960 C PRO A 121 -12.635 -10.862 -19.489 1.00 0.00 C ATOM 1961 O PRO A 121 -12.005 -10.546 -20.499 1.00 0.00 O ATOM 1962 CB PRO A 121 -14.257 -8.953 -19.643 1.00 0.00 C ATOM 1963 CG PRO A 121 -13.414 -7.754 -19.906 1.00 0.00 C ATOM 1964 CD PRO A 121 -12.634 -7.510 -18.644 1.00 0.00 C ATOM 0 HA PRO A 121 -14.009 -10.390 -17.983 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -14.489 -9.484 -20.566 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -15.208 -8.676 -19.187 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -12.746 -7.924 -20.750 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -14.031 -6.891 -20.156 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -11.648 -7.096 -18.855 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -13.142 -6.804 -17.987 1.00 0.00 H new ATOM 1972 N LEU A 122 -12.677 -12.105 -19.022 1.00 0.00 N ATOM 1973 CA LEU A 122 -11.971 -13.195 -19.685 1.00 0.00 C ATOM 1974 C LEU A 122 -12.755 -14.499 -19.575 1.00 0.00 C ATOM 1975 O LEU A 122 -12.837 -15.096 -18.501 1.00 0.00 O ATOM 1976 CB LEU A 122 -10.578 -13.372 -19.077 1.00 0.00 C ATOM 1977 CG LEU A 122 -9.530 -12.338 -19.490 1.00 0.00 C ATOM 1978 CD1 LEU A 122 -8.331 -12.391 -18.556 1.00 0.00 C ATOM 1979 CD2 LEU A 122 -9.097 -12.564 -20.931 1.00 0.00 C ATOM 0 H LEU A 122 -13.193 -12.383 -18.187 1.00 0.00 H new ATOM 0 HA LEU A 122 -11.871 -12.940 -20.740 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -10.672 -13.351 -17.991 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -10.209 -14.362 -19.346 1.00 0.00 H new ATOM 0 HG LEU A 122 -9.977 -11.347 -19.418 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -7.596 -11.648 -18.865 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -8.654 -12.179 -17.537 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -7.883 -13.384 -18.595 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -8.351 -11.819 -21.208 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -8.668 -13.561 -21.030 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -9.961 -12.474 -21.589 1.00 0.00 H new ATOM 1991 N ILE A 123 -13.328 -14.935 -20.691 1.00 0.00 N ATOM 1992 CA ILE A 123 -14.103 -16.170 -20.720 1.00 0.00 C ATOM 1993 C ILE A 123 -13.343 -17.279 -21.439 1.00 0.00 C ATOM 1994 O ILE A 123 -12.841 -17.083 -22.546 1.00 0.00 O ATOM 1995 CB ILE A 123 -15.464 -15.964 -21.411 1.00 0.00 C ATOM 1996 CG1 ILE A 123 -16.235 -14.827 -20.738 1.00 0.00 C ATOM 1997 CG2 ILE A 123 -16.274 -17.252 -21.378 1.00 0.00 C ATOM 1998 CD1 ILE A 123 -17.562 -14.522 -21.399 1.00 0.00 C ATOM 0 H ILE A 123 -13.271 -14.452 -21.587 1.00 0.00 H new ATOM 0 HA ILE A 123 -14.271 -16.462 -19.683 1.00 0.00 H new ATOM 0 HB ILE A 123 -15.289 -15.693 -22.452 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -16.409 -15.086 -19.694 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -15.619 -13.927 -20.745 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -17.233 -17.091 -21.870 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -15.727 -18.039 -21.897 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -16.442 -17.550 -20.343 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -18.053 -13.706 -20.869 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -17.394 -14.232 -22.436 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -18.196 -15.408 -21.368 1.00 0.00 H new ATOM 2010 N GLN A 124 -13.265 -18.443 -20.803 1.00 0.00 N ATOM 2011 CA GLN A 124 -12.567 -19.585 -21.384 1.00 0.00 C ATOM 2012 C GLN A 124 -13.046 -20.891 -20.759 1.00 0.00 C ATOM 2013 O GLN A 124 -13.545 -20.905 -19.635 1.00 0.00 O ATOM 2014 CB GLN A 124 -11.056 -19.437 -21.191 1.00 0.00 C ATOM 2015 CG GLN A 124 -10.624 -19.459 -19.733 1.00 0.00 C ATOM 2016 CD GLN A 124 -9.204 -18.966 -19.538 1.00 0.00 C ATOM 2017 OE1 GLN A 124 -8.547 -18.537 -20.487 1.00 0.00 O ATOM 2018 NE2 GLN A 124 -8.721 -19.025 -18.302 1.00 0.00 N ATOM 0 H GLN A 124 -13.676 -18.621 -19.886 1.00 0.00 H new ATOM 0 HA GLN A 124 -12.789 -19.611 -22.451 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -10.549 -20.242 -21.724 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -10.730 -18.501 -21.644 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -11.303 -18.840 -19.147 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -10.708 -20.475 -19.348 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -9.300 -19.388 -17.545 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -7.771 -18.707 -18.110 1.00 0.00 H new ATOM 2027 N GLU A 125 -12.891 -21.986 -21.497 1.00 0.00 N ATOM 2028 CA GLU A 125 -13.309 -23.297 -21.015 1.00 0.00 C ATOM 2029 C GLU A 125 -12.245 -24.350 -21.309 1.00 0.00 C ATOM 2030 O GLU A 125 -11.572 -24.298 -22.338 1.00 0.00 O ATOM 2031 CB GLU A 125 -14.636 -23.703 -21.661 1.00 0.00 C ATOM 2032 CG GLU A 125 -15.160 -25.046 -21.182 1.00 0.00 C ATOM 2033 CD GLU A 125 -16.595 -25.295 -21.603 1.00 0.00 C ATOM 2034 OE1 GLU A 125 -17.245 -24.347 -22.090 1.00 0.00 O ATOM 2035 OE2 GLU A 125 -17.068 -26.441 -21.445 1.00 0.00 O ATOM 0 H GLU A 125 -12.479 -21.991 -22.430 1.00 0.00 H new ATOM 0 HA GLU A 125 -13.443 -23.233 -19.935 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -15.382 -22.936 -21.452 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -14.508 -23.737 -22.743 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -14.526 -25.841 -21.576 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -15.091 -25.092 -20.095 1.00 0.00 H new ATOM 2042 N VAL A 126 -12.098 -25.305 -20.396 1.00 0.00 N ATOM 2043 CA VAL A 126 -11.116 -26.371 -20.556 1.00 0.00 C ATOM 2044 C VAL A 126 -11.791 -27.689 -20.918 1.00 0.00 C ATOM 2045 O VAL A 126 -12.547 -28.248 -20.124 1.00 0.00 O ATOM 2046 CB VAL A 126 -10.286 -26.566 -19.273 1.00 0.00 C ATOM 2047 CG1 VAL A 126 -9.173 -27.577 -19.506 1.00 0.00 C ATOM 2048 CG2 VAL A 126 -9.719 -25.237 -18.798 1.00 0.00 C ATOM 0 H VAL A 126 -12.646 -25.362 -19.538 1.00 0.00 H new ATOM 0 HA VAL A 126 -10.452 -26.072 -21.367 1.00 0.00 H new ATOM 0 HB VAL A 126 -10.941 -26.955 -18.493 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -8.597 -27.702 -18.589 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -9.606 -28.534 -19.796 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -8.517 -27.220 -20.300 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -9.136 -25.394 -17.891 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -9.078 -24.817 -19.573 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -10.536 -24.547 -18.589 1.00 0.00 H new ATOM 2058 N GLU A 127 -11.510 -28.180 -22.121 1.00 0.00 N ATOM 2059 CA GLU A 127 -12.091 -29.434 -22.587 1.00 0.00 C ATOM 2060 C GLU A 127 -11.083 -30.575 -22.478 1.00 0.00 C ATOM 2061 O GLU A 127 -10.160 -30.683 -23.286 1.00 0.00 O ATOM 2062 CB GLU A 127 -12.565 -29.294 -24.035 1.00 0.00 C ATOM 2063 CG GLU A 127 -13.222 -30.550 -24.585 1.00 0.00 C ATOM 2064 CD GLU A 127 -14.524 -30.881 -23.882 1.00 0.00 C ATOM 2065 OE1 GLU A 127 -15.384 -29.983 -23.773 1.00 0.00 O ATOM 2066 OE2 GLU A 127 -14.683 -32.039 -23.441 1.00 0.00 O ATOM 0 H GLU A 127 -10.885 -27.730 -22.789 1.00 0.00 H new ATOM 0 HA GLU A 127 -12.946 -29.667 -21.953 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -13.272 -28.467 -24.099 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -11.713 -29.035 -24.664 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -13.411 -30.420 -25.651 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -12.535 -31.390 -24.483 1.00 0.00 H new ATOM 2073 N THR A 128 -11.266 -31.424 -21.472 1.00 0.00 N ATOM 2074 CA THR A 128 -10.374 -32.555 -21.254 1.00 0.00 C ATOM 2075 C THR A 128 -11.128 -33.748 -20.678 1.00 0.00 C ATOM 2076 O THR A 128 -12.277 -33.623 -20.255 1.00 0.00 O ATOM 2077 CB THR A 128 -9.219 -32.185 -20.304 1.00 0.00 C ATOM 2078 OG1 THR A 128 -9.735 -31.541 -19.133 1.00 0.00 O ATOM 2079 CG2 THR A 128 -8.222 -31.268 -20.995 1.00 0.00 C ATOM 0 H THR A 128 -12.025 -31.349 -20.795 1.00 0.00 H new ATOM 0 HA THR A 128 -9.963 -32.824 -22.227 1.00 0.00 H new ATOM 0 HB THR A 128 -8.706 -33.103 -20.017 1.00 0.00 H new ATOM 0 HG1 THR A 128 -8.995 -31.311 -18.533 1.00 0.00 H new ATOM 0 HG21 THR A 128 -7.416 -31.021 -20.304 1.00 0.00 H new ATOM 0 HG22 THR A 128 -7.809 -31.772 -21.869 1.00 0.00 H new ATOM 0 HG23 THR A 128 -8.725 -30.353 -21.308 1.00 0.00 H new ATOM 2087 N ASP A 129 -10.474 -34.905 -20.665 1.00 0.00 N ATOM 2088 CA ASP A 129 -11.083 -36.121 -20.139 1.00 0.00 C ATOM 2089 C ASP A 129 -10.015 -37.114 -19.691 1.00 0.00 C ATOM 2090 O ASP A 129 -8.851 -37.004 -20.074 1.00 0.00 O ATOM 2091 CB ASP A 129 -11.984 -36.763 -21.195 1.00 0.00 C ATOM 2092 CG ASP A 129 -13.141 -37.528 -20.582 1.00 0.00 C ATOM 2093 OD1 ASP A 129 -13.612 -37.122 -19.499 1.00 0.00 O ATOM 2094 OD2 ASP A 129 -13.574 -38.532 -21.184 1.00 0.00 O ATOM 0 H ASP A 129 -9.523 -35.026 -21.013 1.00 0.00 H new ATOM 0 HA ASP A 129 -11.687 -35.850 -19.273 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -12.374 -35.988 -21.855 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -11.391 -37.439 -21.812 1.00 0.00 H new ATOM 2099 N GLY A 130 -10.420 -38.083 -18.876 1.00 0.00 N ATOM 2100 CA GLY A 130 -9.485 -39.081 -18.389 1.00 0.00 C ATOM 2101 C GLY A 130 -10.181 -40.253 -17.726 1.00 0.00 C ATOM 2102 O GLY A 130 -11.106 -40.068 -16.935 1.00 0.00 O ATOM 0 H GLY A 130 -11.378 -38.195 -18.544 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -8.881 -39.444 -19.220 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -8.802 -38.618 -17.677 1.00 0.00 H new ATOM 2106 N VAL A 131 -9.738 -41.463 -18.051 1.00 0.00 N ATOM 2107 CA VAL A 131 -10.325 -42.671 -17.482 1.00 0.00 C ATOM 2108 C VAL A 131 -9.320 -43.817 -17.469 1.00 0.00 C ATOM 2109 O VAL A 131 -8.551 -43.992 -18.414 1.00 0.00 O ATOM 2110 CB VAL A 131 -11.577 -43.109 -18.265 1.00 0.00 C ATOM 2111 CG1 VAL A 131 -11.197 -43.567 -19.665 1.00 0.00 C ATOM 2112 CG2 VAL A 131 -12.315 -44.209 -17.517 1.00 0.00 C ATOM 0 H VAL A 131 -8.974 -41.633 -18.705 1.00 0.00 H new ATOM 0 HA VAL A 131 -10.611 -42.432 -16.458 1.00 0.00 H new ATOM 0 HB VAL A 131 -12.245 -42.253 -18.357 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -12.094 -43.873 -20.204 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -10.715 -42.747 -20.198 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -10.509 -44.410 -19.598 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -13.197 -44.506 -18.084 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -11.657 -45.069 -17.392 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -12.621 -43.841 -16.538 1.00 0.00 H new ATOM 2122 N SER A 132 -9.333 -44.595 -16.391 1.00 0.00 N ATOM 2123 CA SER A 132 -8.420 -45.724 -16.253 1.00 0.00 C ATOM 2124 C SER A 132 -9.186 -47.010 -15.959 1.00 0.00 C ATOM 2125 O SER A 132 -10.385 -46.981 -15.683 1.00 0.00 O ATOM 2126 CB SER A 132 -7.407 -45.454 -15.139 1.00 0.00 C ATOM 2127 OG SER A 132 -6.205 -46.174 -15.357 1.00 0.00 O ATOM 0 H SER A 132 -9.965 -44.464 -15.601 1.00 0.00 H new ATOM 0 HA SER A 132 -7.888 -45.847 -17.196 1.00 0.00 H new ATOM 0 HB2 SER A 132 -7.191 -44.387 -15.090 1.00 0.00 H new ATOM 0 HB3 SER A 132 -7.835 -45.737 -14.177 1.00 0.00 H new ATOM 0 HG SER A 132 -5.573 -45.983 -14.632 1.00 0.00 H new ATOM 2133 N ASN A 133 -8.484 -48.137 -16.021 1.00 0.00 N ATOM 2134 CA ASN A 133 -9.098 -49.434 -15.762 1.00 0.00 C ATOM 2135 C ASN A 133 -8.237 -50.263 -14.813 1.00 0.00 C ATOM 2136 O ASN A 133 -7.106 -49.894 -14.502 1.00 0.00 O ATOM 2137 CB ASN A 133 -9.307 -50.194 -17.073 1.00 0.00 C ATOM 2138 CG ASN A 133 -10.499 -51.130 -17.016 1.00 0.00 C ATOM 2139 OD1 ASN A 133 -10.342 -52.349 -16.951 1.00 0.00 O ATOM 2140 ND2 ASN A 133 -11.699 -50.562 -17.039 1.00 0.00 N ATOM 0 H ASN A 133 -7.490 -48.178 -16.248 1.00 0.00 H new ATOM 0 HA ASN A 133 -10.066 -49.262 -15.291 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -9.448 -49.480 -17.885 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -8.409 -50.767 -17.304 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -12.538 -51.141 -17.002 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -11.782 -49.547 -17.093 1.00 0.00 H new ATOM 2147 N ASN A 134 -8.783 -51.386 -14.356 1.00 0.00 N ATOM 2148 CA ASN A 134 -8.066 -52.267 -13.442 1.00 0.00 C ATOM 2149 C ASN A 134 -7.589 -53.525 -14.162 1.00 0.00 C ATOM 2150 O ASN A 134 -8.282 -54.056 -15.029 1.00 0.00 O ATOM 2151 CB ASN A 134 -8.961 -52.651 -12.262 1.00 0.00 C ATOM 2152 CG ASN A 134 -8.171 -53.212 -11.096 1.00 0.00 C ATOM 2153 OD1 ASN A 134 -6.955 -53.038 -11.014 1.00 0.00 O ATOM 2154 ND2 ASN A 134 -8.861 -53.891 -10.186 1.00 0.00 N ATOM 0 H ASN A 134 -9.719 -51.707 -14.604 1.00 0.00 H new ATOM 0 HA ASN A 134 -7.194 -51.730 -13.068 1.00 0.00 H new ATOM 0 HB2 ASN A 134 -9.518 -51.774 -11.932 1.00 0.00 H new ATOM 0 HB3 ASN A 134 -9.693 -53.389 -12.590 1.00 0.00 H new ATOM 0 HD21 ASN A 134 -8.384 -54.293 -9.379 1.00 0.00 H new ATOM 0 HD22 ASN A 134 -9.868 -54.011 -10.294 1.00 0.00 H new TER 2161 ASN A 134