USER MOD reduce.3.24.130724 H: found=0, std=0, add=515, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 518 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 102 HIS : no HE2:sc= -2.41 K(o=-2.4,f=-4.8!) USER MOD Set 1.2: A 105 ASN : amide:sc= -0.0298 K(o=-2.4,f=-6.2!) USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 84 HIS : no HE2:sc= -0.35 K(o=-0.35,f=-1) USER MOD Single : A 88 LYS NZ :NH3+ -164:sc= -0.0558 (180deg=-0.351) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0.118 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 HIS : no HE2:sc= 0.943 K(o=0.94,f=-5.8!) USER MOD Single : A 95 HIS : no HD1:sc= -1.05 K(o=-1,f=-2!) USER MOD Single : A 107 HIS : no HE2:sc= -1.86 K(o=-1.9,f=-3.4!) USER MOD Single : A 108 LYS NZ :NH3+ 143:sc= 1.25 (180deg=0.0669) USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 114 LYS NZ :NH3+ -164:sc= -0.0405 (180deg=-0.273) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 120 TYR OH : rot 30:sc= 0 USER MOD Single : A 122 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 MET CE :methyl 150:sc= -1.06 (180deg=-2.98!) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 130 THR OG1 : rot -25:sc= 0.704 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 SER OG : rot 77:sc= 1.01 USER MOD Single : A 138 ASN : amide:sc= -0.719 K(o=-0.72,f=-4.1!) USER MOD Single : A 143 ASN : amide:sc=-0.00154 X(o=-0.0015,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 75 14.043 4.715 -9.219 1.00 0.00 N ATOM 2 CA GLY A 75 14.405 3.666 -8.251 1.00 0.00 C ATOM 3 C GLY A 75 13.240 3.306 -7.364 1.00 0.00 C ATOM 4 O GLY A 75 12.248 4.035 -7.326 1.00 0.00 O ATOM 0 HA2 GLY A 75 14.745 2.779 -8.785 1.00 0.00 H new ATOM 0 HA3 GLY A 75 15.239 4.008 -7.638 1.00 0.00 H new ATOM 10 N PRO A 76 13.315 2.182 -6.640 1.00 0.00 N ATOM 11 CA PRO A 76 12.262 1.751 -5.743 1.00 0.00 C ATOM 12 C PRO A 76 12.435 2.330 -4.342 1.00 0.00 C ATOM 13 O PRO A 76 13.103 1.732 -3.489 1.00 0.00 O ATOM 14 CB PRO A 76 12.418 0.218 -5.713 1.00 0.00 C ATOM 15 CG PRO A 76 13.729 -0.082 -6.401 1.00 0.00 C ATOM 16 CD PRO A 76 14.422 1.234 -6.640 1.00 0.00 C ATOM 0 HA PRO A 76 11.279 2.083 -6.076 1.00 0.00 H new ATOM 0 HB2 PRO A 76 12.421 -0.154 -4.688 1.00 0.00 H new ATOM 0 HB3 PRO A 76 11.588 -0.269 -6.226 1.00 0.00 H new ATOM 0 HG2 PRO A 76 14.346 -0.735 -5.784 1.00 0.00 H new ATOM 0 HG3 PRO A 76 13.558 -0.603 -7.343 1.00 0.00 H new ATOM 0 HD2 PRO A 76 15.147 1.458 -5.858 1.00 0.00 H new ATOM 0 HD3 PRO A 76 14.962 1.242 -7.587 1.00 0.00 H new ATOM 24 N LEU A 77 11.858 3.502 -4.117 1.00 0.00 N ATOM 25 CA LEU A 77 11.955 4.175 -2.827 1.00 0.00 C ATOM 26 C LEU A 77 11.062 5.411 -2.796 1.00 0.00 C ATOM 27 O LEU A 77 10.987 6.163 -3.774 1.00 0.00 O ATOM 28 CB LEU A 77 13.415 4.574 -2.509 1.00 0.00 C ATOM 29 CG LEU A 77 13.983 5.809 -3.240 1.00 0.00 C ATOM 30 CD1 LEU A 77 15.365 6.144 -2.716 1.00 0.00 C ATOM 31 CD2 LEU A 77 14.030 5.592 -4.747 1.00 0.00 C ATOM 0 H LEU A 77 11.314 4.010 -4.815 1.00 0.00 H new ATOM 0 HA LEU A 77 11.617 3.473 -2.065 1.00 0.00 H new ATOM 0 HB2 LEU A 77 13.491 4.752 -1.436 1.00 0.00 H new ATOM 0 HB3 LEU A 77 14.056 3.722 -2.737 1.00 0.00 H new ATOM 0 HG LEU A 77 13.315 6.647 -3.043 1.00 0.00 H new ATOM 0 HD11 LEU A 77 15.752 7.017 -3.242 1.00 0.00 H new ATOM 0 HD12 LEU A 77 15.307 6.359 -1.649 1.00 0.00 H new ATOM 0 HD13 LEU A 77 16.031 5.297 -2.880 1.00 0.00 H new ATOM 0 HD21 LEU A 77 14.435 6.481 -5.230 1.00 0.00 H new ATOM 0 HD22 LEU A 77 14.666 4.736 -4.972 1.00 0.00 H new ATOM 0 HD23 LEU A 77 13.023 5.404 -5.119 1.00 0.00 H new ATOM 43 N GLY A 78 10.359 5.594 -1.694 1.00 0.00 N ATOM 44 CA GLY A 78 9.510 6.756 -1.539 1.00 0.00 C ATOM 45 C GLY A 78 8.183 6.574 -2.229 1.00 0.00 C ATOM 46 O GLY A 78 7.134 6.523 -1.587 1.00 0.00 O ATOM 0 H GLY A 78 10.360 4.956 -0.898 1.00 0.00 H new ATOM 0 HA2 GLY A 78 9.345 6.947 -0.479 1.00 0.00 H new ATOM 0 HA3 GLY A 78 10.015 7.632 -1.946 1.00 0.00 H new ATOM 50 N SER A 79 8.237 6.469 -3.534 1.00 0.00 N ATOM 51 CA SER A 79 7.062 6.272 -4.344 1.00 0.00 C ATOM 52 C SER A 79 6.505 4.861 -4.176 1.00 0.00 C ATOM 53 O SER A 79 5.293 4.650 -4.256 1.00 0.00 O ATOM 54 CB SER A 79 7.411 6.525 -5.806 1.00 0.00 C ATOM 55 OG SER A 79 7.843 7.862 -5.999 1.00 0.00 O ATOM 0 H SER A 79 9.105 6.518 -4.067 1.00 0.00 H new ATOM 0 HA SER A 79 6.294 6.974 -4.020 1.00 0.00 H new ATOM 0 HB2 SER A 79 8.195 5.836 -6.121 1.00 0.00 H new ATOM 0 HB3 SER A 79 6.541 6.326 -6.432 1.00 0.00 H new ATOM 0 HG SER A 79 8.063 8.001 -6.944 1.00 0.00 H new ATOM 61 N ASP A 80 7.381 3.908 -3.901 1.00 0.00 N ATOM 62 CA ASP A 80 6.976 2.530 -3.796 1.00 0.00 C ATOM 63 C ASP A 80 7.678 1.834 -2.655 1.00 0.00 C ATOM 64 O ASP A 80 8.885 1.984 -2.451 1.00 0.00 O ATOM 65 CB ASP A 80 7.197 1.768 -5.123 1.00 0.00 C ATOM 66 CG ASP A 80 8.653 1.624 -5.520 1.00 0.00 C ATOM 67 OD1 ASP A 80 9.343 2.654 -5.667 1.00 0.00 O ATOM 68 OD2 ASP A 80 9.103 0.469 -5.732 1.00 0.00 O ATOM 0 H ASP A 80 8.376 4.071 -3.748 1.00 0.00 H new ATOM 0 HA ASP A 80 5.907 2.526 -3.585 1.00 0.00 H new ATOM 0 HB2 ASP A 80 6.755 0.775 -5.037 1.00 0.00 H new ATOM 0 HB3 ASP A 80 6.664 2.286 -5.920 1.00 0.00 H new ATOM 73 N LEU A 81 6.901 1.129 -1.885 1.00 0.00 N ATOM 74 CA LEU A 81 7.407 0.350 -0.782 1.00 0.00 C ATOM 75 C LEU A 81 7.344 -1.119 -1.131 1.00 0.00 C ATOM 76 O LEU A 81 6.367 -1.576 -1.713 1.00 0.00 O ATOM 77 CB LEU A 81 6.594 0.627 0.474 1.00 0.00 C ATOM 78 CG LEU A 81 7.028 -0.154 1.727 1.00 0.00 C ATOM 79 CD1 LEU A 81 8.363 0.349 2.243 1.00 0.00 C ATOM 80 CD2 LEU A 81 5.964 -0.089 2.815 1.00 0.00 C ATOM 0 H LEU A 81 5.889 1.075 -2.002 1.00 0.00 H new ATOM 0 HA LEU A 81 8.443 0.629 -0.592 1.00 0.00 H new ATOM 0 HB2 LEU A 81 6.649 1.693 0.694 1.00 0.00 H new ATOM 0 HB3 LEU A 81 5.549 0.398 0.268 1.00 0.00 H new ATOM 0 HG LEU A 81 7.147 -1.199 1.442 1.00 0.00 H new ATOM 0 HD11 LEU A 81 8.648 -0.219 3.129 1.00 0.00 H new ATOM 0 HD12 LEU A 81 9.122 0.223 1.471 1.00 0.00 H new ATOM 0 HD13 LEU A 81 8.279 1.405 2.500 1.00 0.00 H new ATOM 0 HD21 LEU A 81 6.300 -0.650 3.687 1.00 0.00 H new ATOM 0 HD22 LEU A 81 5.794 0.950 3.096 1.00 0.00 H new ATOM 0 HD23 LEU A 81 5.035 -0.521 2.442 1.00 0.00 H new ATOM 92 N ILE A 82 8.376 -1.856 -0.797 1.00 0.00 N ATOM 93 CA ILE A 82 8.399 -3.261 -1.102 1.00 0.00 C ATOM 94 C ILE A 82 7.955 -4.068 0.108 1.00 0.00 C ATOM 95 O ILE A 82 8.271 -3.718 1.247 1.00 0.00 O ATOM 96 CB ILE A 82 9.799 -3.732 -1.540 1.00 0.00 C ATOM 97 CG1 ILE A 82 10.391 -2.767 -2.562 1.00 0.00 C ATOM 98 CG2 ILE A 82 9.712 -5.120 -2.135 1.00 0.00 C ATOM 99 CD1 ILE A 82 11.767 -3.161 -3.047 1.00 0.00 C ATOM 0 H ILE A 82 9.205 -1.506 -0.317 1.00 0.00 H new ATOM 0 HA ILE A 82 7.710 -3.422 -1.931 1.00 0.00 H new ATOM 0 HB ILE A 82 10.448 -3.755 -0.665 1.00 0.00 H new ATOM 0 HG12 ILE A 82 9.719 -2.702 -3.418 1.00 0.00 H new ATOM 0 HG13 ILE A 82 10.443 -1.772 -2.121 1.00 0.00 H new ATOM 0 HG21 ILE A 82 10.705 -5.447 -2.443 1.00 0.00 H new ATOM 0 HG22 ILE A 82 9.317 -5.811 -1.390 1.00 0.00 H new ATOM 0 HG23 ILE A 82 9.051 -5.104 -3.001 1.00 0.00 H new ATOM 0 HD11 ILE A 82 12.122 -2.427 -3.771 1.00 0.00 H new ATOM 0 HD12 ILE A 82 12.454 -3.198 -2.202 1.00 0.00 H new ATOM 0 HD13 ILE A 82 11.719 -4.142 -3.519 1.00 0.00 H new ATOM 111 N VAL A 83 7.231 -5.144 -0.143 1.00 0.00 N ATOM 112 CA VAL A 83 6.722 -6.002 0.910 1.00 0.00 C ATOM 113 C VAL A 83 6.877 -7.462 0.506 1.00 0.00 C ATOM 114 O VAL A 83 6.978 -7.779 -0.684 1.00 0.00 O ATOM 115 CB VAL A 83 5.225 -5.722 1.215 1.00 0.00 C ATOM 116 CG1 VAL A 83 5.037 -4.330 1.800 1.00 0.00 C ATOM 117 CG2 VAL A 83 4.380 -5.892 -0.039 1.00 0.00 C ATOM 0 H VAL A 83 6.980 -5.447 -1.084 1.00 0.00 H new ATOM 0 HA VAL A 83 7.300 -5.790 1.809 1.00 0.00 H new ATOM 0 HB VAL A 83 4.893 -6.448 1.957 1.00 0.00 H new ATOM 0 HG11 VAL A 83 3.980 -4.161 2.004 1.00 0.00 H new ATOM 0 HG12 VAL A 83 5.603 -4.246 2.727 1.00 0.00 H new ATOM 0 HG13 VAL A 83 5.393 -3.585 1.088 1.00 0.00 H new ATOM 0 HG21 VAL A 83 3.335 -5.691 0.197 1.00 0.00 H new ATOM 0 HG22 VAL A 83 4.720 -5.194 -0.804 1.00 0.00 H new ATOM 0 HG23 VAL A 83 4.479 -6.913 -0.409 1.00 0.00 H new ATOM 127 N HIS A 84 6.902 -8.337 1.479 1.00 0.00 N ATOM 128 CA HIS A 84 7.034 -9.759 1.212 1.00 0.00 C ATOM 129 C HIS A 84 5.709 -10.469 1.385 1.00 0.00 C ATOM 130 O HIS A 84 5.260 -10.698 2.505 1.00 0.00 O ATOM 131 CB HIS A 84 8.100 -10.409 2.107 1.00 0.00 C ATOM 132 CG HIS A 84 9.506 -10.005 1.784 1.00 0.00 C ATOM 133 ND1 HIS A 84 10.387 -10.814 1.091 1.00 0.00 N ATOM 134 CD2 HIS A 84 10.190 -8.875 2.070 1.00 0.00 C ATOM 135 CE1 HIS A 84 11.543 -10.195 0.971 1.00 0.00 C ATOM 136 NE2 HIS A 84 11.450 -9.018 1.554 1.00 0.00 N ATOM 0 H HIS A 84 6.833 -8.096 2.468 1.00 0.00 H new ATOM 0 HA HIS A 84 7.355 -9.861 0.175 1.00 0.00 H new ATOM 0 HB2 HIS A 84 7.890 -10.153 3.146 1.00 0.00 H new ATOM 0 HB3 HIS A 84 8.017 -11.493 2.022 1.00 0.00 H new ATOM 0 HD1 HIS A 84 10.175 -11.744 0.730 1.00 0.00 H new ATOM 0 HD2 HIS A 84 9.812 -8.017 2.607 1.00 0.00 H new ATOM 0 HE1 HIS A 84 12.420 -10.587 0.477 1.00 0.00 H new ATOM 145 N GLU A 85 5.082 -10.812 0.281 1.00 0.00 N ATOM 146 CA GLU A 85 3.827 -11.546 0.320 1.00 0.00 C ATOM 147 C GLU A 85 4.108 -13.002 0.040 1.00 0.00 C ATOM 148 O GLU A 85 4.395 -13.377 -1.101 1.00 0.00 O ATOM 149 CB GLU A 85 2.824 -11.009 -0.706 1.00 0.00 C ATOM 150 CG GLU A 85 2.431 -9.555 -0.507 1.00 0.00 C ATOM 151 CD GLU A 85 1.917 -9.259 0.894 1.00 0.00 C ATOM 152 OE1 GLU A 85 1.408 -10.180 1.561 1.00 0.00 O ATOM 153 OE2 GLU A 85 1.991 -8.090 1.319 1.00 0.00 O ATOM 0 H GLU A 85 5.418 -10.596 -0.658 1.00 0.00 H new ATOM 0 HA GLU A 85 3.385 -11.423 1.309 1.00 0.00 H new ATOM 0 HB2 GLU A 85 3.248 -11.123 -1.703 1.00 0.00 H new ATOM 0 HB3 GLU A 85 1.924 -11.623 -0.670 1.00 0.00 H new ATOM 0 HG2 GLU A 85 3.294 -8.921 -0.712 1.00 0.00 H new ATOM 0 HG3 GLU A 85 1.662 -9.291 -1.233 1.00 0.00 H new ATOM 160 N GLY A 86 4.064 -13.817 1.075 1.00 0.00 N ATOM 161 CA GLY A 86 4.385 -15.216 0.914 1.00 0.00 C ATOM 162 C GLY A 86 5.842 -15.394 0.557 1.00 0.00 C ATOM 163 O GLY A 86 6.215 -16.326 -0.162 1.00 0.00 O ATOM 0 H GLY A 86 3.812 -13.538 2.023 1.00 0.00 H new ATOM 0 HA2 GLY A 86 4.164 -15.753 1.836 1.00 0.00 H new ATOM 0 HA3 GLY A 86 3.759 -15.650 0.134 1.00 0.00 H new ATOM 167 N GLY A 87 6.659 -14.474 1.047 1.00 0.00 N ATOM 168 CA GLY A 87 8.073 -14.494 0.766 1.00 0.00 C ATOM 169 C GLY A 87 8.432 -13.721 -0.488 1.00 0.00 C ATOM 170 O GLY A 87 9.560 -13.255 -0.630 1.00 0.00 O ATOM 0 H GLY A 87 6.358 -13.703 1.644 1.00 0.00 H new ATOM 0 HA2 GLY A 87 8.614 -14.074 1.614 1.00 0.00 H new ATOM 0 HA3 GLY A 87 8.403 -15.527 0.658 1.00 0.00 H new ATOM 174 N LYS A 88 7.458 -13.532 -1.372 1.00 0.00 N ATOM 175 CA LYS A 88 7.698 -12.879 -2.654 1.00 0.00 C ATOM 176 C LYS A 88 7.650 -11.367 -2.513 1.00 0.00 C ATOM 177 O LYS A 88 6.759 -10.823 -1.862 1.00 0.00 O ATOM 178 CB LYS A 88 6.672 -13.346 -3.682 1.00 0.00 C ATOM 179 CG LYS A 88 6.694 -14.846 -3.947 1.00 0.00 C ATOM 180 CD LYS A 88 7.990 -15.290 -4.621 1.00 0.00 C ATOM 181 CE LYS A 88 8.130 -14.701 -6.020 1.00 0.00 C ATOM 182 NZ LYS A 88 6.985 -15.063 -6.894 1.00 0.00 N ATOM 0 H LYS A 88 6.492 -13.823 -1.223 1.00 0.00 H new ATOM 0 HA LYS A 88 8.695 -13.156 -2.996 1.00 0.00 H new ATOM 0 HB2 LYS A 88 5.676 -13.063 -3.340 1.00 0.00 H new ATOM 0 HB3 LYS A 88 6.848 -12.820 -4.620 1.00 0.00 H new ATOM 0 HG2 LYS A 88 6.573 -15.382 -3.006 1.00 0.00 H new ATOM 0 HG3 LYS A 88 5.847 -15.115 -4.578 1.00 0.00 H new ATOM 0 HD2 LYS A 88 8.840 -14.985 -4.011 1.00 0.00 H new ATOM 0 HD3 LYS A 88 8.015 -16.378 -4.680 1.00 0.00 H new ATOM 0 HE2 LYS A 88 8.204 -13.616 -5.951 1.00 0.00 H new ATOM 0 HE3 LYS A 88 9.057 -15.055 -6.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 7.236 -14.884 -7.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 6.759 -16.071 -6.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 6.157 -14.488 -6.637 1.00 0.00 H new ATOM 196 N THR A 89 8.604 -10.699 -3.118 1.00 0.00 N ATOM 197 CA THR A 89 8.699 -9.263 -3.042 1.00 0.00 C ATOM 198 C THR A 89 7.770 -8.552 -4.022 1.00 0.00 C ATOM 199 O THR A 89 7.953 -8.621 -5.243 1.00 0.00 O ATOM 200 CB THR A 89 10.137 -8.811 -3.293 1.00 0.00 C ATOM 201 OG1 THR A 89 10.912 -9.918 -3.793 1.00 0.00 O ATOM 202 CG2 THR A 89 10.749 -8.286 -2.014 1.00 0.00 C ATOM 0 H THR A 89 9.336 -11.138 -3.677 1.00 0.00 H new ATOM 0 HA THR A 89 8.387 -8.988 -2.035 1.00 0.00 H new ATOM 0 HB THR A 89 10.135 -8.011 -4.033 1.00 0.00 H new ATOM 0 HG1 THR A 89 11.833 -9.626 -3.955 1.00 0.00 H new ATOM 0 HG21 THR A 89 11.774 -7.967 -2.205 1.00 0.00 H new ATOM 0 HG22 THR A 89 10.166 -7.438 -1.653 1.00 0.00 H new ATOM 0 HG23 THR A 89 10.749 -9.074 -1.261 1.00 0.00 H new ATOM 210 N TYR A 90 6.775 -7.874 -3.480 1.00 0.00 N ATOM 211 CA TYR A 90 5.853 -7.081 -4.270 1.00 0.00 C ATOM 212 C TYR A 90 6.054 -5.608 -3.963 1.00 0.00 C ATOM 213 O TYR A 90 6.392 -5.247 -2.838 1.00 0.00 O ATOM 214 CB TYR A 90 4.400 -7.470 -3.976 1.00 0.00 C ATOM 215 CG TYR A 90 3.956 -8.771 -4.605 1.00 0.00 C ATOM 216 CD1 TYR A 90 4.183 -9.989 -3.976 1.00 0.00 C ATOM 217 CD2 TYR A 90 3.293 -8.777 -5.825 1.00 0.00 C ATOM 218 CE1 TYR A 90 3.762 -11.174 -4.548 1.00 0.00 C ATOM 219 CE2 TYR A 90 2.872 -9.957 -6.404 1.00 0.00 C ATOM 220 CZ TYR A 90 3.108 -11.152 -5.762 1.00 0.00 C ATOM 221 OH TYR A 90 2.679 -12.330 -6.331 1.00 0.00 O ATOM 0 H TYR A 90 6.584 -7.858 -2.478 1.00 0.00 H new ATOM 0 HA TYR A 90 6.055 -7.272 -5.324 1.00 0.00 H new ATOM 0 HB2 TYR A 90 4.268 -7.540 -2.896 1.00 0.00 H new ATOM 0 HB3 TYR A 90 3.746 -6.671 -4.326 1.00 0.00 H new ATOM 0 HD1 TYR A 90 4.696 -10.010 -3.026 1.00 0.00 H new ATOM 0 HD2 TYR A 90 3.103 -7.841 -6.330 1.00 0.00 H new ATOM 0 HE1 TYR A 90 3.944 -12.113 -4.047 1.00 0.00 H new ATOM 0 HE2 TYR A 90 2.360 -9.943 -7.355 1.00 0.00 H new ATOM 0 HH TYR A 90 2.236 -12.139 -7.184 1.00 0.00 H new ATOM 231 N HIS A 91 5.861 -4.770 -4.954 1.00 0.00 N ATOM 232 CA HIS A 91 6.003 -3.331 -4.768 1.00 0.00 C ATOM 233 C HIS A 91 4.641 -2.682 -4.574 1.00 0.00 C ATOM 234 O HIS A 91 3.655 -3.085 -5.200 1.00 0.00 O ATOM 235 CB HIS A 91 6.724 -2.682 -5.961 1.00 0.00 C ATOM 236 CG HIS A 91 8.171 -3.061 -6.089 1.00 0.00 C ATOM 237 ND1 HIS A 91 9.199 -2.144 -6.044 1.00 0.00 N ATOM 238 CD2 HIS A 91 8.759 -4.267 -6.281 1.00 0.00 C ATOM 239 CE1 HIS A 91 10.347 -2.766 -6.206 1.00 0.00 C ATOM 240 NE2 HIS A 91 10.109 -4.055 -6.351 1.00 0.00 N ATOM 0 H HIS A 91 5.605 -5.052 -5.900 1.00 0.00 H new ATOM 0 HA HIS A 91 6.606 -3.172 -3.874 1.00 0.00 H new ATOM 0 HB2 HIS A 91 6.205 -2.959 -6.879 1.00 0.00 H new ATOM 0 HB3 HIS A 91 6.651 -1.598 -5.869 1.00 0.00 H new ATOM 0 HD1 HIS A 91 9.087 -1.140 -5.907 1.00 0.00 H new ATOM 0 HD2 HIS A 91 8.255 -5.219 -6.363 1.00 0.00 H new ATOM 0 HE1 HIS A 91 11.321 -2.299 -6.218 1.00 0.00 H new ATOM 249 N VAL A 92 4.588 -1.696 -3.707 1.00 0.00 N ATOM 250 CA VAL A 92 3.366 -0.968 -3.429 1.00 0.00 C ATOM 251 C VAL A 92 3.545 0.482 -3.812 1.00 0.00 C ATOM 252 O VAL A 92 4.417 1.168 -3.283 1.00 0.00 O ATOM 253 CB VAL A 92 2.993 -1.042 -1.937 1.00 0.00 C ATOM 254 CG1 VAL A 92 1.788 -0.163 -1.640 1.00 0.00 C ATOM 255 CG2 VAL A 92 2.735 -2.480 -1.510 1.00 0.00 C ATOM 0 H VAL A 92 5.394 -1.373 -3.171 1.00 0.00 H new ATOM 0 HA VAL A 92 2.565 -1.424 -4.012 1.00 0.00 H new ATOM 0 HB VAL A 92 3.837 -0.668 -1.358 1.00 0.00 H new ATOM 0 HG11 VAL A 92 1.541 -0.230 -0.580 1.00 0.00 H new ATOM 0 HG12 VAL A 92 2.021 0.871 -1.894 1.00 0.00 H new ATOM 0 HG13 VAL A 92 0.937 -0.499 -2.233 1.00 0.00 H new ATOM 0 HG21 VAL A 92 2.474 -2.504 -0.452 1.00 0.00 H new ATOM 0 HG22 VAL A 92 1.914 -2.892 -2.096 1.00 0.00 H new ATOM 0 HG23 VAL A 92 3.633 -3.075 -1.675 1.00 0.00 H new ATOM 265 N VAL A 93 2.725 0.942 -4.716 1.00 0.00 N ATOM 266 CA VAL A 93 2.818 2.302 -5.201 1.00 0.00 C ATOM 267 C VAL A 93 1.430 2.924 -5.360 1.00 0.00 C ATOM 268 O VAL A 93 0.472 2.247 -5.743 1.00 0.00 O ATOM 269 CB VAL A 93 3.588 2.355 -6.552 1.00 0.00 C ATOM 270 CG1 VAL A 93 2.845 1.599 -7.645 1.00 0.00 C ATOM 271 CG2 VAL A 93 3.865 3.790 -6.976 1.00 0.00 C ATOM 0 H VAL A 93 1.976 0.393 -5.139 1.00 0.00 H new ATOM 0 HA VAL A 93 3.371 2.881 -4.462 1.00 0.00 H new ATOM 0 HB VAL A 93 4.547 1.861 -6.398 1.00 0.00 H new ATOM 0 HG11 VAL A 93 3.410 1.656 -8.575 1.00 0.00 H new ATOM 0 HG12 VAL A 93 2.731 0.555 -7.353 1.00 0.00 H new ATOM 0 HG13 VAL A 93 1.861 2.044 -7.791 1.00 0.00 H new ATOM 0 HG21 VAL A 93 4.404 3.792 -7.923 1.00 0.00 H new ATOM 0 HG22 VAL A 93 2.922 4.323 -7.094 1.00 0.00 H new ATOM 0 HG23 VAL A 93 4.468 4.284 -6.214 1.00 0.00 H new ATOM 281 N CYS A 94 1.323 4.197 -5.036 1.00 0.00 N ATOM 282 CA CYS A 94 0.076 4.923 -5.182 1.00 0.00 C ATOM 283 C CYS A 94 0.326 6.306 -5.739 1.00 0.00 C ATOM 284 O CYS A 94 1.165 7.047 -5.232 1.00 0.00 O ATOM 285 CB CYS A 94 -0.676 5.019 -3.845 1.00 0.00 C ATOM 286 SG CYS A 94 -1.569 3.504 -3.377 1.00 0.00 S ATOM 0 H CYS A 94 2.093 4.755 -4.666 1.00 0.00 H new ATOM 0 HA CYS A 94 -0.548 4.368 -5.883 1.00 0.00 H new ATOM 0 HB2 CYS A 94 0.037 5.264 -3.058 1.00 0.00 H new ATOM 0 HB3 CYS A 94 -1.387 5.843 -3.900 1.00 0.00 H new ATOM 291 N HIS A 95 -0.385 6.643 -6.798 1.00 0.00 N ATOM 292 CA HIS A 95 -0.273 7.965 -7.399 1.00 0.00 C ATOM 293 C HIS A 95 -1.448 8.818 -6.977 1.00 0.00 C ATOM 294 O HIS A 95 -1.569 9.975 -7.362 1.00 0.00 O ATOM 295 CB HIS A 95 -0.180 7.887 -8.932 1.00 0.00 C ATOM 296 CG HIS A 95 -1.416 7.386 -9.635 1.00 0.00 C ATOM 297 ND1 HIS A 95 -2.308 8.217 -10.270 1.00 0.00 N ATOM 298 CD2 HIS A 95 -1.884 6.132 -9.820 1.00 0.00 C ATOM 299 CE1 HIS A 95 -3.269 7.500 -10.814 1.00 0.00 C ATOM 300 NE2 HIS A 95 -3.037 6.230 -10.555 1.00 0.00 N ATOM 0 H HIS A 95 -1.047 6.022 -7.262 1.00 0.00 H new ATOM 0 HA HIS A 95 0.650 8.424 -7.044 1.00 0.00 H new ATOM 0 HB2 HIS A 95 0.057 8.880 -9.315 1.00 0.00 H new ATOM 0 HB3 HIS A 95 0.654 7.237 -9.195 1.00 0.00 H new ATOM 0 HD2 HIS A 95 -1.433 5.221 -9.456 1.00 0.00 H new ATOM 0 HE1 HIS A 95 -4.105 7.888 -11.377 1.00 0.00 H new ATOM 0 HE2 HIS A 95 -3.620 5.447 -10.852 1.00 0.00 H new ATOM 309 N GLU A 96 -2.307 8.218 -6.188 1.00 0.00 N ATOM 310 CA GLU A 96 -3.491 8.871 -5.651 1.00 0.00 C ATOM 311 C GLU A 96 -3.734 8.401 -4.232 1.00 0.00 C ATOM 312 O GLU A 96 -3.259 7.334 -3.838 1.00 0.00 O ATOM 313 CB GLU A 96 -4.722 8.549 -6.489 1.00 0.00 C ATOM 314 CG GLU A 96 -4.647 9.016 -7.920 1.00 0.00 C ATOM 315 CD GLU A 96 -5.877 8.648 -8.697 1.00 0.00 C ATOM 316 OE1 GLU A 96 -6.187 7.443 -8.783 1.00 0.00 O ATOM 317 OE2 GLU A 96 -6.536 9.553 -9.235 1.00 0.00 O ATOM 0 H GLU A 96 -2.207 7.247 -5.893 1.00 0.00 H new ATOM 0 HA GLU A 96 -3.320 9.947 -5.671 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -4.879 7.470 -6.480 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -5.594 9.002 -6.018 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -4.515 10.098 -7.942 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -3.771 8.578 -8.399 1.00 0.00 H new ATOM 324 N GLU A 97 -4.459 9.192 -3.466 1.00 0.00 N ATOM 325 CA GLU A 97 -4.787 8.829 -2.103 1.00 0.00 C ATOM 326 C GLU A 97 -6.031 7.957 -2.062 1.00 0.00 C ATOM 327 O GLU A 97 -6.883 8.023 -2.956 1.00 0.00 O ATOM 328 CB GLU A 97 -5.008 10.070 -1.246 1.00 0.00 C ATOM 329 CG GLU A 97 -3.784 10.946 -1.100 1.00 0.00 C ATOM 330 CD GLU A 97 -4.022 12.101 -0.158 1.00 0.00 C ATOM 331 OE1 GLU A 97 -3.784 11.939 1.056 1.00 0.00 O ATOM 332 OE2 GLU A 97 -4.457 13.174 -0.620 1.00 0.00 O ATOM 0 H GLU A 97 -4.833 10.092 -3.766 1.00 0.00 H new ATOM 0 HA GLU A 97 -3.944 8.267 -1.700 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -5.814 10.660 -1.682 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -5.340 9.760 -0.255 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -2.951 10.346 -0.734 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -3.495 11.330 -2.078 1.00 0.00 H new ATOM 339 N GLY A 98 -6.128 7.149 -1.033 1.00 0.00 N ATOM 340 CA GLY A 98 -7.277 6.300 -0.865 1.00 0.00 C ATOM 341 C GLY A 98 -6.890 4.855 -0.677 1.00 0.00 C ATOM 342 O GLY A 98 -5.758 4.471 -0.978 1.00 0.00 O ATOM 0 H GLY A 98 -5.423 7.064 -0.301 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -7.853 6.636 -0.003 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -7.925 6.391 -1.736 1.00 0.00 H new ATOM 346 N PRO A 99 -7.797 4.029 -0.149 1.00 0.00 N ATOM 347 CA PRO A 99 -7.545 2.616 0.033 1.00 0.00 C ATOM 348 C PRO A 99 -7.793 1.823 -1.252 1.00 0.00 C ATOM 349 O PRO A 99 -8.791 2.032 -1.946 1.00 0.00 O ATOM 350 CB PRO A 99 -8.545 2.218 1.114 1.00 0.00 C ATOM 351 CG PRO A 99 -9.694 3.158 0.942 1.00 0.00 C ATOM 352 CD PRO A 99 -9.137 4.422 0.329 1.00 0.00 C ATOM 0 HA PRO A 99 -6.509 2.410 0.301 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -8.862 1.182 0.997 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -8.108 2.307 2.108 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -10.458 2.721 0.299 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -10.167 3.370 1.901 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -9.763 4.778 -0.489 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -9.079 5.228 1.061 1.00 0.00 H new ATOM 360 N ILE A 100 -6.874 0.939 -1.568 1.00 0.00 N ATOM 361 CA ILE A 100 -6.979 0.081 -2.745 1.00 0.00 C ATOM 362 C ILE A 100 -6.453 -1.313 -2.415 1.00 0.00 C ATOM 363 O ILE A 100 -5.690 -1.462 -1.473 1.00 0.00 O ATOM 364 CB ILE A 100 -6.225 0.676 -3.984 1.00 0.00 C ATOM 365 CG1 ILE A 100 -4.940 1.429 -3.568 1.00 0.00 C ATOM 366 CG2 ILE A 100 -7.146 1.586 -4.795 1.00 0.00 C ATOM 367 CD1 ILE A 100 -3.809 0.538 -3.093 1.00 0.00 C ATOM 0 H ILE A 100 -6.027 0.788 -1.020 1.00 0.00 H new ATOM 0 HA ILE A 100 -8.033 0.018 -3.017 1.00 0.00 H new ATOM 0 HB ILE A 100 -5.924 -0.161 -4.613 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -4.589 2.017 -4.416 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -5.189 2.132 -2.773 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -6.601 1.987 -5.649 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -8.004 1.014 -5.148 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -7.491 2.407 -4.167 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -2.950 1.153 -2.823 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -4.135 -0.032 -2.223 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -3.527 -0.149 -3.891 1.00 0.00 H new ATOM 379 N PRO A 101 -6.865 -2.355 -3.165 1.00 0.00 N ATOM 380 CA PRO A 101 -6.429 -3.736 -2.902 1.00 0.00 C ATOM 381 C PRO A 101 -4.921 -3.911 -3.057 1.00 0.00 C ATOM 382 O PRO A 101 -4.238 -3.064 -3.642 1.00 0.00 O ATOM 383 CB PRO A 101 -7.170 -4.559 -3.963 1.00 0.00 C ATOM 384 CG PRO A 101 -7.510 -3.578 -5.027 1.00 0.00 C ATOM 385 CD PRO A 101 -7.775 -2.285 -4.317 1.00 0.00 C ATOM 0 HA PRO A 101 -6.649 -4.038 -1.878 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -6.544 -5.363 -4.350 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -8.066 -5.023 -3.551 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -6.691 -3.473 -5.739 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -8.384 -3.901 -5.592 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -7.561 -1.424 -4.950 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -8.816 -2.200 -4.006 1.00 0.00 H new ATOM 393 N HIS A 102 -4.411 -5.010 -2.545 1.00 0.00 N ATOM 394 CA HIS A 102 -2.997 -5.296 -2.612 1.00 0.00 C ATOM 395 C HIS A 102 -2.702 -6.118 -3.869 1.00 0.00 C ATOM 396 O HIS A 102 -3.243 -7.205 -4.034 1.00 0.00 O ATOM 397 CB HIS A 102 -2.559 -6.063 -1.358 1.00 0.00 C ATOM 398 CG HIS A 102 -1.089 -6.023 -1.107 1.00 0.00 C ATOM 399 ND1 HIS A 102 -0.223 -6.999 -1.532 1.00 0.00 N ATOM 400 CD2 HIS A 102 -0.332 -5.103 -0.481 1.00 0.00 C ATOM 401 CE1 HIS A 102 1.005 -6.671 -1.186 1.00 0.00 C ATOM 402 NE2 HIS A 102 0.968 -5.525 -0.545 1.00 0.00 N ATOM 0 H HIS A 102 -4.963 -5.726 -2.073 1.00 0.00 H new ATOM 0 HA HIS A 102 -2.439 -4.361 -2.660 1.00 0.00 H new ATOM 0 HB2 HIS A 102 -3.077 -5.650 -0.492 1.00 0.00 H new ATOM 0 HB3 HIS A 102 -2.873 -7.102 -1.452 1.00 0.00 H new ATOM 0 HD1 HIS A 102 -0.488 -7.845 -2.036 1.00 0.00 H new ATOM 0 HD2 HIS A 102 -0.686 -4.196 -0.013 1.00 0.00 H new ATOM 0 HE1 HIS A 102 1.894 -7.248 -1.395 1.00 0.00 H new ATOM 411 N PRO A 103 -1.819 -5.614 -4.758 1.00 0.00 N ATOM 412 CA PRO A 103 -1.501 -6.275 -6.050 1.00 0.00 C ATOM 413 C PRO A 103 -0.946 -7.695 -5.891 1.00 0.00 C ATOM 414 O PRO A 103 -0.959 -8.484 -6.830 1.00 0.00 O ATOM 415 CB PRO A 103 -0.434 -5.356 -6.671 1.00 0.00 C ATOM 416 CG PRO A 103 0.091 -4.548 -5.532 1.00 0.00 C ATOM 417 CD PRO A 103 -1.061 -4.363 -4.593 1.00 0.00 C ATOM 0 HA PRO A 103 -2.398 -6.398 -6.657 1.00 0.00 H new ATOM 0 HB2 PRO A 103 0.360 -5.935 -7.143 1.00 0.00 H new ATOM 0 HB3 PRO A 103 -0.864 -4.717 -7.443 1.00 0.00 H new ATOM 0 HG2 PRO A 103 0.918 -5.059 -5.039 1.00 0.00 H new ATOM 0 HG3 PRO A 103 0.471 -3.587 -5.878 1.00 0.00 H new ATOM 0 HD2 PRO A 103 -0.727 -4.225 -3.565 1.00 0.00 H new ATOM 0 HD3 PRO A 103 -1.659 -3.490 -4.854 1.00 0.00 H new ATOM 425 N GLY A 104 -0.454 -8.006 -4.705 1.00 0.00 N ATOM 426 CA GLY A 104 0.097 -9.326 -4.460 1.00 0.00 C ATOM 427 C GLY A 104 -0.919 -10.288 -3.881 1.00 0.00 C ATOM 428 O GLY A 104 -0.739 -11.501 -3.950 1.00 0.00 O ATOM 0 H GLY A 104 -0.425 -7.372 -3.906 1.00 0.00 H new ATOM 0 HA2 GLY A 104 0.484 -9.732 -5.395 1.00 0.00 H new ATOM 0 HA3 GLY A 104 0.941 -9.241 -3.776 1.00 0.00 H new ATOM 432 N ASN A 105 -1.990 -9.746 -3.318 1.00 0.00 N ATOM 433 CA ASN A 105 -3.034 -10.550 -2.677 1.00 0.00 C ATOM 434 C ASN A 105 -4.279 -9.708 -2.397 1.00 0.00 C ATOM 435 O ASN A 105 -4.299 -8.908 -1.464 1.00 0.00 O ATOM 436 CB ASN A 105 -2.536 -11.264 -1.393 1.00 0.00 C ATOM 437 CG ASN A 105 -1.565 -10.447 -0.549 1.00 0.00 C ATOM 438 OD1 ASN A 105 -1.600 -9.215 -0.531 1.00 0.00 O ATOM 439 ND2 ASN A 105 -0.689 -11.139 0.153 1.00 0.00 N ATOM 0 H ASN A 105 -2.164 -8.741 -3.290 1.00 0.00 H new ATOM 0 HA ASN A 105 -3.304 -11.336 -3.382 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -3.399 -11.525 -0.780 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -2.052 -12.199 -1.677 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -0.008 -10.655 0.738 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -0.693 -12.158 0.111 1.00 0.00 H new ATOM 446 N VAL A 106 -5.302 -9.864 -3.241 1.00 0.00 N ATOM 447 CA VAL A 106 -6.578 -9.128 -3.098 1.00 0.00 C ATOM 448 C VAL A 106 -7.239 -9.298 -1.716 1.00 0.00 C ATOM 449 O VAL A 106 -8.150 -8.546 -1.368 1.00 0.00 O ATOM 450 CB VAL A 106 -7.589 -9.512 -4.203 1.00 0.00 C ATOM 451 CG1 VAL A 106 -7.085 -9.060 -5.565 1.00 0.00 C ATOM 452 CG2 VAL A 106 -7.857 -11.013 -4.200 1.00 0.00 C ATOM 0 H VAL A 106 -5.278 -10.497 -4.040 1.00 0.00 H new ATOM 0 HA VAL A 106 -6.307 -8.077 -3.203 1.00 0.00 H new ATOM 0 HB VAL A 106 -8.530 -9.002 -3.995 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -7.808 -9.338 -6.331 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -6.955 -7.978 -5.564 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -6.129 -9.540 -5.777 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -8.571 -11.257 -4.986 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -6.925 -11.549 -4.377 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -8.267 -11.308 -3.234 1.00 0.00 H new ATOM 462 N HIS A 107 -6.781 -10.277 -0.942 1.00 0.00 N ATOM 463 CA HIS A 107 -7.288 -10.493 0.419 1.00 0.00 C ATOM 464 C HIS A 107 -6.760 -9.400 1.370 1.00 0.00 C ATOM 465 O HIS A 107 -7.092 -9.361 2.560 1.00 0.00 O ATOM 466 CB HIS A 107 -6.891 -11.899 0.923 1.00 0.00 C ATOM 467 CG HIS A 107 -7.292 -12.182 2.344 1.00 0.00 C ATOM 468 ND1 HIS A 107 -6.401 -12.588 3.310 1.00 0.00 N ATOM 469 CD2 HIS A 107 -8.491 -12.088 2.961 1.00 0.00 C ATOM 470 CE1 HIS A 107 -7.028 -12.727 4.458 1.00 0.00 C ATOM 471 NE2 HIS A 107 -8.302 -12.427 4.280 1.00 0.00 N ATOM 0 H HIS A 107 -6.059 -10.937 -1.230 1.00 0.00 H new ATOM 0 HA HIS A 107 -8.376 -10.431 0.401 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -7.346 -12.647 0.273 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -5.811 -12.013 0.833 1.00 0.00 H new ATOM 0 HD1 HIS A 107 -5.406 -12.756 3.159 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -9.425 -11.800 2.502 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -6.577 -13.035 5.390 1.00 0.00 H new ATOM 480 N LYS A 108 -5.970 -8.503 0.830 1.00 0.00 N ATOM 481 CA LYS A 108 -5.401 -7.421 1.589 1.00 0.00 C ATOM 482 C LYS A 108 -5.493 -6.147 0.793 1.00 0.00 C ATOM 483 O LYS A 108 -5.670 -6.182 -0.426 1.00 0.00 O ATOM 484 CB LYS A 108 -3.941 -7.706 1.967 1.00 0.00 C ATOM 485 CG LYS A 108 -3.775 -8.898 2.895 1.00 0.00 C ATOM 486 CD LYS A 108 -2.479 -8.828 3.677 1.00 0.00 C ATOM 487 CE LYS A 108 -1.268 -8.926 2.774 1.00 0.00 C ATOM 488 NZ LYS A 108 -0.006 -9.023 3.546 1.00 0.00 N ATOM 0 H LYS A 108 -5.704 -8.505 -0.155 1.00 0.00 H new ATOM 0 HA LYS A 108 -5.966 -7.317 2.515 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -3.366 -7.881 1.057 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -3.519 -6.822 2.445 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -4.615 -8.939 3.588 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -3.798 -9.818 2.312 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -2.441 -7.892 4.234 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -2.452 -9.636 4.409 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -1.366 -9.799 2.129 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -1.229 -8.052 2.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 0.650 -9.668 3.060 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 0.428 -8.081 3.622 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -0.209 -9.388 4.498 1.00 0.00 H new ATOM 502 N TYR A 109 -5.384 -5.036 1.467 1.00 0.00 N ATOM 503 CA TYR A 109 -5.458 -3.759 0.816 1.00 0.00 C ATOM 504 C TYR A 109 -4.486 -2.788 1.442 1.00 0.00 C ATOM 505 O TYR A 109 -3.846 -3.095 2.440 1.00 0.00 O ATOM 506 CB TYR A 109 -6.881 -3.208 0.828 1.00 0.00 C ATOM 507 CG TYR A 109 -7.332 -2.606 2.136 1.00 0.00 C ATOM 508 CD1 TYR A 109 -7.624 -3.398 3.235 1.00 0.00 C ATOM 509 CD2 TYR A 109 -7.486 -1.234 2.255 1.00 0.00 C ATOM 510 CE1 TYR A 109 -8.054 -2.838 4.419 1.00 0.00 C ATOM 511 CE2 TYR A 109 -7.913 -0.664 3.430 1.00 0.00 C ATOM 512 CZ TYR A 109 -8.197 -1.471 4.512 1.00 0.00 C ATOM 513 OH TYR A 109 -8.629 -0.906 5.689 1.00 0.00 O ATOM 0 H TYR A 109 -5.242 -4.990 2.476 1.00 0.00 H new ATOM 0 HA TYR A 109 -5.175 -3.895 -0.228 1.00 0.00 H new ATOM 0 HB2 TYR A 109 -6.965 -2.449 0.050 1.00 0.00 H new ATOM 0 HB3 TYR A 109 -7.566 -4.013 0.563 1.00 0.00 H new ATOM 0 HD1 TYR A 109 -7.513 -4.470 3.163 1.00 0.00 H new ATOM 0 HD2 TYR A 109 -7.266 -0.601 1.408 1.00 0.00 H new ATOM 0 HE1 TYR A 109 -8.277 -3.467 5.268 1.00 0.00 H new ATOM 0 HE2 TYR A 109 -8.025 0.407 3.506 1.00 0.00 H new ATOM 0 HH TYR A 109 -8.675 0.068 5.587 1.00 0.00 H new ATOM 523 N ILE A 110 -4.367 -1.631 0.856 1.00 0.00 N ATOM 524 CA ILE A 110 -3.453 -0.632 1.337 1.00 0.00 C ATOM 525 C ILE A 110 -4.155 0.705 1.435 1.00 0.00 C ATOM 526 O ILE A 110 -4.991 1.038 0.596 1.00 0.00 O ATOM 527 CB ILE A 110 -2.254 -0.486 0.376 1.00 0.00 C ATOM 528 CG1 ILE A 110 -1.742 -1.858 -0.047 1.00 0.00 C ATOM 529 CG2 ILE A 110 -1.138 0.310 1.042 1.00 0.00 C ATOM 530 CD1 ILE A 110 -1.255 -1.904 -1.471 1.00 0.00 C ATOM 0 H ILE A 110 -4.900 -1.353 0.032 1.00 0.00 H new ATOM 0 HA ILE A 110 -3.097 -0.943 2.319 1.00 0.00 H new ATOM 0 HB ILE A 110 -2.585 0.051 -0.513 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -0.929 -2.154 0.616 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -2.540 -2.590 0.080 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -0.298 0.406 0.353 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -1.506 1.302 1.306 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -0.810 -0.207 1.944 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -0.905 -2.910 -1.704 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -2.071 -1.639 -2.143 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -0.436 -1.197 -1.598 1.00 0.00 H new ATOM 542 N ILE A 111 -3.830 1.455 2.459 1.00 0.00 N ATOM 543 CA ILE A 111 -4.359 2.784 2.617 1.00 0.00 C ATOM 544 C ILE A 111 -3.288 3.760 2.194 1.00 0.00 C ATOM 545 O ILE A 111 -2.243 3.860 2.844 1.00 0.00 O ATOM 546 CB ILE A 111 -4.790 3.103 4.081 1.00 0.00 C ATOM 547 CG1 ILE A 111 -5.843 2.110 4.585 1.00 0.00 C ATOM 548 CG2 ILE A 111 -5.329 4.525 4.176 1.00 0.00 C ATOM 549 CD1 ILE A 111 -5.268 0.806 5.092 1.00 0.00 C ATOM 0 H ILE A 111 -3.195 1.162 3.202 1.00 0.00 H new ATOM 0 HA ILE A 111 -5.255 2.865 2.002 1.00 0.00 H new ATOM 0 HB ILE A 111 -3.907 3.010 4.714 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -6.415 2.578 5.386 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -6.542 1.897 3.777 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -5.626 4.734 5.204 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -4.554 5.229 3.872 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -6.193 4.631 3.520 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -6.077 0.159 5.430 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -4.721 0.313 4.289 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -4.591 1.005 5.923 1.00 0.00 H new ATOM 561 N CYS A 112 -3.517 4.452 1.111 1.00 0.00 N ATOM 562 CA CYS A 112 -2.524 5.361 0.593 1.00 0.00 C ATOM 563 C CYS A 112 -2.866 6.798 0.934 1.00 0.00 C ATOM 564 O CYS A 112 -3.948 7.286 0.619 1.00 0.00 O ATOM 565 CB CYS A 112 -2.356 5.165 -0.915 1.00 0.00 C ATOM 566 SG CYS A 112 -1.608 3.548 -1.347 1.00 0.00 S ATOM 0 H CYS A 112 -4.380 4.406 0.569 1.00 0.00 H new ATOM 0 HA CYS A 112 -1.570 5.136 1.070 1.00 0.00 H new ATOM 0 HB2 CYS A 112 -3.330 5.249 -1.398 1.00 0.00 H new ATOM 0 HB3 CYS A 112 -1.732 5.966 -1.313 1.00 0.00 H new ATOM 571 N SER A 113 -1.943 7.461 1.595 1.00 0.00 N ATOM 572 CA SER A 113 -2.134 8.830 2.006 1.00 0.00 C ATOM 573 C SER A 113 -0.957 9.690 1.563 1.00 0.00 C ATOM 574 O SER A 113 0.193 9.237 1.553 1.00 0.00 O ATOM 575 CB SER A 113 -2.294 8.897 3.526 1.00 0.00 C ATOM 576 OG SER A 113 -3.322 8.020 3.968 1.00 0.00 O ATOM 0 H SER A 113 -1.041 7.065 1.861 1.00 0.00 H new ATOM 0 HA SER A 113 -3.038 9.215 1.534 1.00 0.00 H new ATOM 0 HB2 SER A 113 -1.352 8.631 4.007 1.00 0.00 H new ATOM 0 HB3 SER A 113 -2.528 9.918 3.826 1.00 0.00 H new ATOM 0 HG SER A 113 -3.405 8.078 4.943 1.00 0.00 H new ATOM 582 N LYS A 114 -1.244 10.920 1.203 1.00 0.00 N ATOM 583 CA LYS A 114 -0.221 11.843 0.778 1.00 0.00 C ATOM 584 C LYS A 114 -0.104 12.957 1.795 1.00 0.00 C ATOM 585 O LYS A 114 -0.948 13.848 1.857 1.00 0.00 O ATOM 586 CB LYS A 114 -0.555 12.416 -0.610 1.00 0.00 C ATOM 587 CG LYS A 114 0.490 13.367 -1.174 1.00 0.00 C ATOM 588 CD LYS A 114 1.814 12.669 -1.375 1.00 0.00 C ATOM 589 CE LYS A 114 2.820 13.566 -2.064 1.00 0.00 C ATOM 590 NZ LYS A 114 2.397 13.950 -3.437 1.00 0.00 N ATOM 0 H LYS A 114 -2.188 11.306 1.197 1.00 0.00 H new ATOM 0 HA LYS A 114 0.731 11.318 0.705 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -0.687 11.589 -1.307 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -1.509 12.940 -0.552 1.00 0.00 H new ATOM 0 HG2 LYS A 114 0.142 13.772 -2.124 1.00 0.00 H new ATOM 0 HG3 LYS A 114 0.620 14.211 -0.497 1.00 0.00 H new ATOM 0 HD2 LYS A 114 2.209 12.353 -0.410 1.00 0.00 H new ATOM 0 HD3 LYS A 114 1.664 11.767 -1.969 1.00 0.00 H new ATOM 0 HE2 LYS A 114 2.967 14.467 -1.468 1.00 0.00 H new ATOM 0 HE3 LYS A 114 3.782 13.056 -2.113 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 3.214 14.326 -3.960 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 2.024 13.115 -3.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 1.657 14.679 -3.381 1.00 0.00 H new ATOM 604 N SER A 115 0.923 12.899 2.600 1.00 0.00 N ATOM 605 CA SER A 115 1.145 13.898 3.606 1.00 0.00 C ATOM 606 C SER A 115 2.019 14.997 3.043 1.00 0.00 C ATOM 607 O SER A 115 3.235 15.016 3.241 1.00 0.00 O ATOM 608 CB SER A 115 1.781 13.266 4.837 1.00 0.00 C ATOM 609 OG SER A 115 0.925 12.278 5.390 1.00 0.00 O ATOM 0 H SER A 115 1.626 12.160 2.576 1.00 0.00 H new ATOM 0 HA SER A 115 0.192 14.334 3.906 1.00 0.00 H new ATOM 0 HB2 SER A 115 2.738 12.817 4.569 1.00 0.00 H new ATOM 0 HB3 SER A 115 1.987 14.035 5.582 1.00 0.00 H new ATOM 0 HG SER A 115 1.350 11.881 6.179 1.00 0.00 H new ATOM 615 N GLY A 116 1.397 15.865 2.276 1.00 0.00 N ATOM 616 CA GLY A 116 2.118 16.941 1.662 1.00 0.00 C ATOM 617 C GLY A 116 2.930 16.438 0.497 1.00 0.00 C ATOM 618 O GLY A 116 2.399 16.219 -0.588 1.00 0.00 O ATOM 0 H GLY A 116 0.399 15.842 2.068 1.00 0.00 H new ATOM 0 HA2 GLY A 116 1.420 17.706 1.322 1.00 0.00 H new ATOM 0 HA3 GLY A 116 2.775 17.411 2.394 1.00 0.00 H new ATOM 622 N SER A 117 4.211 16.218 0.728 1.00 0.00 N ATOM 623 CA SER A 117 5.097 15.740 -0.308 1.00 0.00 C ATOM 624 C SER A 117 5.580 14.327 0.025 1.00 0.00 C ATOM 625 O SER A 117 6.346 13.720 -0.723 1.00 0.00 O ATOM 626 CB SER A 117 6.286 16.685 -0.449 1.00 0.00 C ATOM 627 OG SER A 117 5.848 18.021 -0.666 1.00 0.00 O ATOM 0 H SER A 117 4.660 16.365 1.632 1.00 0.00 H new ATOM 0 HA SER A 117 4.556 15.710 -1.254 1.00 0.00 H new ATOM 0 HB2 SER A 117 6.900 16.641 0.451 1.00 0.00 H new ATOM 0 HB3 SER A 117 6.914 16.364 -1.280 1.00 0.00 H new ATOM 0 HG SER A 117 6.626 18.610 -0.752 1.00 0.00 H new ATOM 633 N LEU A 118 5.104 13.808 1.147 1.00 0.00 N ATOM 634 CA LEU A 118 5.519 12.523 1.632 1.00 0.00 C ATOM 635 C LEU A 118 4.381 11.502 1.564 1.00 0.00 C ATOM 636 O LEU A 118 3.308 11.723 2.124 1.00 0.00 O ATOM 637 CB LEU A 118 5.985 12.678 3.068 1.00 0.00 C ATOM 638 CG LEU A 118 7.280 13.469 3.277 1.00 0.00 C ATOM 639 CD1 LEU A 118 7.576 13.616 4.758 1.00 0.00 C ATOM 640 CD2 LEU A 118 8.446 12.797 2.566 1.00 0.00 C ATOM 0 H LEU A 118 4.418 14.276 1.740 1.00 0.00 H new ATOM 0 HA LEU A 118 6.329 12.154 1.003 1.00 0.00 H new ATOM 0 HB2 LEU A 118 5.191 13.164 3.635 1.00 0.00 H new ATOM 0 HB3 LEU A 118 6.118 11.684 3.494 1.00 0.00 H new ATOM 0 HG LEU A 118 7.147 14.462 2.848 1.00 0.00 H new ATOM 0 HD11 LEU A 118 8.499 14.180 4.890 1.00 0.00 H new ATOM 0 HD12 LEU A 118 6.755 14.145 5.242 1.00 0.00 H new ATOM 0 HD13 LEU A 118 7.687 12.629 5.207 1.00 0.00 H new ATOM 0 HD21 LEU A 118 9.354 13.377 2.729 1.00 0.00 H new ATOM 0 HD22 LEU A 118 8.582 11.791 2.962 1.00 0.00 H new ATOM 0 HD23 LEU A 118 8.238 12.742 1.498 1.00 0.00 H new ATOM 652 N TRP A 119 4.610 10.401 0.867 1.00 0.00 N ATOM 653 CA TRP A 119 3.614 9.338 0.785 1.00 0.00 C ATOM 654 C TRP A 119 3.726 8.390 1.969 1.00 0.00 C ATOM 655 O TRP A 119 4.818 7.934 2.317 1.00 0.00 O ATOM 656 CB TRP A 119 3.769 8.528 -0.512 1.00 0.00 C ATOM 657 CG TRP A 119 3.216 9.192 -1.732 1.00 0.00 C ATOM 658 CD1 TRP A 119 3.908 9.912 -2.660 1.00 0.00 C ATOM 659 CD2 TRP A 119 1.849 9.186 -2.169 1.00 0.00 C ATOM 660 NE1 TRP A 119 3.058 10.358 -3.640 1.00 0.00 N ATOM 661 CE2 TRP A 119 1.788 9.927 -3.363 1.00 0.00 C ATOM 662 CE3 TRP A 119 0.669 8.626 -1.662 1.00 0.00 C ATOM 663 CZ2 TRP A 119 0.601 10.125 -4.058 1.00 0.00 C ATOM 664 CZ3 TRP A 119 -0.508 8.825 -2.356 1.00 0.00 C ATOM 665 CH2 TRP A 119 -0.533 9.567 -3.540 1.00 0.00 C ATOM 0 H TRP A 119 5.471 10.218 0.351 1.00 0.00 H new ATOM 0 HA TRP A 119 2.636 9.819 0.795 1.00 0.00 H new ATOM 0 HB2 TRP A 119 4.828 8.325 -0.673 1.00 0.00 H new ATOM 0 HB3 TRP A 119 3.276 7.564 -0.384 1.00 0.00 H new ATOM 0 HD1 TRP A 119 4.970 10.103 -2.628 1.00 0.00 H new ATOM 0 HE1 TRP A 119 3.329 10.921 -4.446 1.00 0.00 H new ATOM 0 HE3 TRP A 119 0.680 8.051 -0.748 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 0.576 10.698 -4.973 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -1.426 8.400 -1.977 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -1.471 9.702 -4.058 1.00 0.00 H new ATOM 676 N TYR A 120 2.601 8.112 2.590 1.00 0.00 N ATOM 677 CA TYR A 120 2.533 7.136 3.661 1.00 0.00 C ATOM 678 C TYR A 120 1.479 6.100 3.345 1.00 0.00 C ATOM 679 O TYR A 120 0.320 6.435 3.088 1.00 0.00 O ATOM 680 CB TYR A 120 2.232 7.802 5.002 1.00 0.00 C ATOM 681 CG TYR A 120 3.354 8.677 5.513 1.00 0.00 C ATOM 682 CD1 TYR A 120 4.397 8.133 6.246 1.00 0.00 C ATOM 683 CD2 TYR A 120 3.377 10.039 5.256 1.00 0.00 C ATOM 684 CE1 TYR A 120 5.429 8.920 6.711 1.00 0.00 C ATOM 685 CE2 TYR A 120 4.407 10.835 5.715 1.00 0.00 C ATOM 686 CZ TYR A 120 5.430 10.271 6.444 1.00 0.00 C ATOM 687 OH TYR A 120 6.466 11.059 6.895 1.00 0.00 O ATOM 0 H TYR A 120 1.708 8.554 2.369 1.00 0.00 H new ATOM 0 HA TYR A 120 3.506 6.650 3.741 1.00 0.00 H new ATOM 0 HB2 TYR A 120 1.329 8.405 4.903 1.00 0.00 H new ATOM 0 HB3 TYR A 120 2.020 7.030 5.741 1.00 0.00 H new ATOM 0 HD1 TYR A 120 4.401 7.074 6.457 1.00 0.00 H new ATOM 0 HD2 TYR A 120 2.575 10.485 4.687 1.00 0.00 H new ATOM 0 HE1 TYR A 120 6.233 8.479 7.282 1.00 0.00 H new ATOM 0 HE2 TYR A 120 4.411 11.894 5.504 1.00 0.00 H new ATOM 0 HH TYR A 120 7.287 10.526 6.940 1.00 0.00 H new ATOM 697 N ILE A 121 1.881 4.849 3.337 1.00 0.00 N ATOM 698 CA ILE A 121 0.971 3.766 3.016 1.00 0.00 C ATOM 699 C ILE A 121 0.972 2.698 4.107 1.00 0.00 C ATOM 700 O ILE A 121 1.991 2.460 4.760 1.00 0.00 O ATOM 701 CB ILE A 121 1.300 3.128 1.620 1.00 0.00 C ATOM 702 CG1 ILE A 121 2.683 2.452 1.605 1.00 0.00 C ATOM 703 CG2 ILE A 121 1.223 4.175 0.519 1.00 0.00 C ATOM 704 CD1 ILE A 121 2.656 0.983 1.976 1.00 0.00 C ATOM 0 H ILE A 121 2.834 4.553 3.549 1.00 0.00 H new ATOM 0 HA ILE A 121 -0.029 4.195 2.960 1.00 0.00 H new ATOM 0 HB ILE A 121 0.550 2.358 1.437 1.00 0.00 H new ATOM 0 HG12 ILE A 121 3.116 2.557 0.610 1.00 0.00 H new ATOM 0 HG13 ILE A 121 3.341 2.979 2.296 1.00 0.00 H new ATOM 0 HG21 ILE A 121 1.454 3.712 -0.440 1.00 0.00 H new ATOM 0 HG22 ILE A 121 0.218 4.595 0.486 1.00 0.00 H new ATOM 0 HG23 ILE A 121 1.942 4.969 0.721 1.00 0.00 H new ATOM 0 HD11 ILE A 121 3.668 0.580 1.942 1.00 0.00 H new ATOM 0 HD12 ILE A 121 2.254 0.869 2.983 1.00 0.00 H new ATOM 0 HD13 ILE A 121 2.026 0.441 1.271 1.00 0.00 H new ATOM 716 N THR A 122 -0.171 2.081 4.311 1.00 0.00 N ATOM 717 CA THR A 122 -0.313 1.016 5.289 1.00 0.00 C ATOM 718 C THR A 122 -1.085 -0.146 4.674 1.00 0.00 C ATOM 719 O THR A 122 -2.187 0.041 4.167 1.00 0.00 O ATOM 720 CB THR A 122 -1.058 1.511 6.551 1.00 0.00 C ATOM 721 OG1 THR A 122 -0.410 2.681 7.072 1.00 0.00 O ATOM 722 CG2 THR A 122 -1.082 0.432 7.624 1.00 0.00 C ATOM 0 H THR A 122 -1.030 2.300 3.806 1.00 0.00 H new ATOM 0 HA THR A 122 0.685 0.690 5.581 1.00 0.00 H new ATOM 0 HB THR A 122 -2.083 1.750 6.269 1.00 0.00 H new ATOM 0 HG1 THR A 122 -0.887 2.991 7.870 1.00 0.00 H new ATOM 0 HG21 THR A 122 -1.611 0.803 8.502 1.00 0.00 H new ATOM 0 HG22 THR A 122 -1.592 -0.452 7.240 1.00 0.00 H new ATOM 0 HG23 THR A 122 -0.060 0.170 7.900 1.00 0.00 H new ATOM 730 N VAL A 123 -0.508 -1.338 4.706 1.00 0.00 N ATOM 731 CA VAL A 123 -1.155 -2.502 4.128 1.00 0.00 C ATOM 732 C VAL A 123 -1.921 -3.299 5.193 1.00 0.00 C ATOM 733 O VAL A 123 -1.331 -3.912 6.083 1.00 0.00 O ATOM 734 CB VAL A 123 -0.143 -3.417 3.374 1.00 0.00 C ATOM 735 CG1 VAL A 123 1.072 -3.734 4.237 1.00 0.00 C ATOM 736 CG2 VAL A 123 -0.819 -4.696 2.895 1.00 0.00 C ATOM 0 H VAL A 123 0.404 -1.522 5.125 1.00 0.00 H new ATOM 0 HA VAL A 123 -1.873 -2.135 3.395 1.00 0.00 H new ATOM 0 HB VAL A 123 0.208 -2.870 2.499 1.00 0.00 H new ATOM 0 HG11 VAL A 123 1.757 -4.374 3.680 1.00 0.00 H new ATOM 0 HG12 VAL A 123 1.579 -2.807 4.506 1.00 0.00 H new ATOM 0 HG13 VAL A 123 0.751 -4.248 5.143 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -0.092 -5.318 2.372 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -1.214 -5.242 3.752 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -1.635 -4.444 2.218 1.00 0.00 H new ATOM 746 N MET A 124 -3.235 -3.270 5.090 1.00 0.00 N ATOM 747 CA MET A 124 -4.106 -3.952 6.038 1.00 0.00 C ATOM 748 C MET A 124 -4.838 -5.096 5.346 1.00 0.00 C ATOM 749 O MET A 124 -5.159 -5.006 4.172 1.00 0.00 O ATOM 750 CB MET A 124 -5.125 -2.967 6.623 1.00 0.00 C ATOM 751 CG MET A 124 -4.518 -1.777 7.366 1.00 0.00 C ATOM 752 SD MET A 124 -4.065 -2.140 9.086 1.00 0.00 S ATOM 753 CE MET A 124 -2.516 -3.018 8.886 1.00 0.00 C ATOM 0 H MET A 124 -3.732 -2.775 4.350 1.00 0.00 H new ATOM 0 HA MET A 124 -3.495 -4.354 6.846 1.00 0.00 H new ATOM 0 HB2 MET A 124 -5.750 -2.590 5.813 1.00 0.00 H new ATOM 0 HB3 MET A 124 -5.780 -3.508 7.306 1.00 0.00 H new ATOM 0 HG2 MET A 124 -3.631 -1.440 6.830 1.00 0.00 H new ATOM 0 HG3 MET A 124 -5.230 -0.952 7.354 1.00 0.00 H new ATOM 0 HE1 MET A 124 -1.882 -2.841 9.755 1.00 0.00 H new ATOM 0 HE2 MET A 124 -2.713 -4.086 8.792 1.00 0.00 H new ATOM 0 HE3 MET A 124 -2.009 -2.662 7.989 1.00 0.00 H new ATOM 763 N PRO A 125 -5.093 -6.194 6.056 1.00 0.00 N ATOM 764 CA PRO A 125 -5.792 -7.338 5.495 1.00 0.00 C ATOM 765 C PRO A 125 -7.312 -7.251 5.657 1.00 0.00 C ATOM 766 O PRO A 125 -7.815 -6.631 6.594 1.00 0.00 O ATOM 767 CB PRO A 125 -5.242 -8.488 6.323 1.00 0.00 C ATOM 768 CG PRO A 125 -4.999 -7.894 7.676 1.00 0.00 C ATOM 769 CD PRO A 125 -4.698 -6.426 7.459 1.00 0.00 C ATOM 0 HA PRO A 125 -5.636 -7.429 4.420 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -5.951 -9.315 6.374 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -4.322 -8.883 5.892 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -5.872 -8.019 8.316 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -4.166 -8.391 8.173 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -5.264 -5.795 8.144 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -3.643 -6.205 7.620 1.00 0.00 H new ATOM 777 N CYS A 126 -8.032 -7.863 4.731 1.00 0.00 N ATOM 778 CA CYS A 126 -9.486 -7.933 4.810 1.00 0.00 C ATOM 779 C CYS A 126 -9.910 -9.190 5.550 1.00 0.00 C ATOM 780 O CYS A 126 -9.074 -10.061 5.845 1.00 0.00 O ATOM 781 CB CYS A 126 -10.119 -7.935 3.411 1.00 0.00 C ATOM 782 SG CYS A 126 -10.195 -6.307 2.589 1.00 0.00 S ATOM 0 H CYS A 126 -7.633 -8.321 3.912 1.00 0.00 H new ATOM 0 HA CYS A 126 -9.832 -7.051 5.350 1.00 0.00 H new ATOM 0 HB2 CYS A 126 -9.556 -8.619 2.776 1.00 0.00 H new ATOM 0 HB3 CYS A 126 -11.131 -8.333 3.488 1.00 0.00 H new ATOM 787 N SER A 127 -11.200 -9.284 5.851 1.00 0.00 N ATOM 788 CA SER A 127 -11.761 -10.452 6.505 1.00 0.00 C ATOM 789 C SER A 127 -11.405 -11.708 5.704 1.00 0.00 C ATOM 790 O SER A 127 -11.250 -11.656 4.478 1.00 0.00 O ATOM 791 CB SER A 127 -13.285 -10.301 6.621 1.00 0.00 C ATOM 792 OG SER A 127 -13.856 -11.343 7.392 1.00 0.00 O ATOM 0 H SER A 127 -11.882 -8.553 5.648 1.00 0.00 H new ATOM 0 HA SER A 127 -11.344 -10.545 7.508 1.00 0.00 H new ATOM 0 HB2 SER A 127 -13.522 -9.339 7.076 1.00 0.00 H new ATOM 0 HB3 SER A 127 -13.728 -10.300 5.625 1.00 0.00 H new ATOM 0 HG SER A 127 -14.826 -11.215 7.447 1.00 0.00 H new ATOM 798 N ILE A 128 -11.243 -12.815 6.384 1.00 0.00 N ATOM 799 CA ILE A 128 -10.885 -14.053 5.726 1.00 0.00 C ATOM 800 C ILE A 128 -11.994 -14.483 4.772 1.00 0.00 C ATOM 801 O ILE A 128 -13.166 -14.530 5.145 1.00 0.00 O ATOM 802 CB ILE A 128 -10.560 -15.184 6.750 1.00 0.00 C ATOM 803 CG1 ILE A 128 -9.220 -14.903 7.472 1.00 0.00 C ATOM 804 CG2 ILE A 128 -10.510 -16.546 6.063 1.00 0.00 C ATOM 805 CD1 ILE A 128 -9.214 -13.661 8.349 1.00 0.00 C ATOM 0 H ILE A 128 -11.353 -12.888 7.395 1.00 0.00 H new ATOM 0 HA ILE A 128 -9.977 -13.873 5.151 1.00 0.00 H new ATOM 0 HB ILE A 128 -11.359 -15.200 7.491 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -8.968 -15.766 8.088 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -8.434 -14.805 6.723 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -10.282 -17.317 6.799 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -11.476 -16.758 5.604 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -9.737 -16.538 5.295 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -8.234 -13.547 8.812 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -9.431 -12.784 7.739 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -9.973 -13.760 9.125 1.00 0.00 H new ATOM 817 N GLY A 129 -11.617 -14.774 3.539 1.00 0.00 N ATOM 818 CA GLY A 129 -12.592 -15.144 2.540 1.00 0.00 C ATOM 819 C GLY A 129 -13.141 -13.948 1.783 1.00 0.00 C ATOM 820 O GLY A 129 -14.068 -14.084 0.989 1.00 0.00 O ATOM 0 H GLY A 129 -10.651 -14.760 3.212 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -12.136 -15.838 1.833 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -13.415 -15.673 3.020 1.00 0.00 H new ATOM 824 N THR A 130 -12.587 -12.767 2.033 1.00 0.00 N ATOM 825 CA THR A 130 -13.026 -11.578 1.325 1.00 0.00 C ATOM 826 C THR A 130 -11.865 -10.937 0.574 1.00 0.00 C ATOM 827 O THR A 130 -10.696 -11.168 0.897 1.00 0.00 O ATOM 828 CB THR A 130 -13.682 -10.526 2.267 1.00 0.00 C ATOM 829 OG1 THR A 130 -12.720 -9.995 3.177 1.00 0.00 O ATOM 830 CG2 THR A 130 -14.837 -11.138 3.051 1.00 0.00 C ATOM 0 H THR A 130 -11.842 -12.611 2.713 1.00 0.00 H new ATOM 0 HA THR A 130 -13.786 -11.906 0.616 1.00 0.00 H new ATOM 0 HB THR A 130 -14.068 -9.721 1.642 1.00 0.00 H new ATOM 0 HG1 THR A 130 -11.992 -10.640 3.297 1.00 0.00 H new ATOM 0 HG21 THR A 130 -15.277 -10.381 3.701 1.00 0.00 H new ATOM 0 HG22 THR A 130 -15.594 -11.505 2.357 1.00 0.00 H new ATOM 0 HG23 THR A 130 -14.468 -11.966 3.656 1.00 0.00 H new ATOM 838 N LYS A 131 -12.198 -10.142 -0.419 1.00 0.00 N ATOM 839 CA LYS A 131 -11.229 -9.448 -1.233 1.00 0.00 C ATOM 840 C LYS A 131 -11.585 -7.968 -1.269 1.00 0.00 C ATOM 841 O LYS A 131 -12.763 -7.611 -1.256 1.00 0.00 O ATOM 842 CB LYS A 131 -11.242 -10.027 -2.654 1.00 0.00 C ATOM 843 CG LYS A 131 -12.618 -9.995 -3.307 1.00 0.00 C ATOM 844 CD LYS A 131 -12.609 -10.615 -4.690 1.00 0.00 C ATOM 845 CE LYS A 131 -13.984 -10.543 -5.328 1.00 0.00 C ATOM 846 NZ LYS A 131 -13.980 -11.072 -6.709 1.00 0.00 N ATOM 0 H LYS A 131 -13.165 -9.958 -0.686 1.00 0.00 H new ATOM 0 HA LYS A 131 -10.231 -9.572 -0.812 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -10.541 -9.467 -3.273 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -10.887 -11.057 -2.622 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -13.330 -10.527 -2.676 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -12.962 -8.963 -3.375 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -11.885 -10.098 -5.319 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -12.289 -11.655 -4.624 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -14.694 -11.109 -4.725 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -14.326 -9.508 -5.337 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -14.938 -11.005 -7.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -13.322 -10.516 -7.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -13.678 -12.067 -6.699 1.00 0.00 H new ATOM 860 N PHE A 132 -10.590 -7.115 -1.289 1.00 0.00 N ATOM 861 CA PHE A 132 -10.835 -5.684 -1.316 1.00 0.00 C ATOM 862 C PHE A 132 -11.067 -5.202 -2.746 1.00 0.00 C ATOM 863 O PHE A 132 -10.369 -5.621 -3.674 1.00 0.00 O ATOM 864 CB PHE A 132 -9.664 -4.939 -0.685 1.00 0.00 C ATOM 865 CG PHE A 132 -9.970 -3.511 -0.319 1.00 0.00 C ATOM 866 CD1 PHE A 132 -10.565 -3.210 0.892 1.00 0.00 C ATOM 867 CD2 PHE A 132 -9.649 -2.477 -1.177 1.00 0.00 C ATOM 868 CE1 PHE A 132 -10.836 -1.905 1.240 1.00 0.00 C ATOM 869 CE2 PHE A 132 -9.919 -1.167 -0.836 1.00 0.00 C ATOM 870 CZ PHE A 132 -10.512 -0.882 0.375 1.00 0.00 C ATOM 0 H PHE A 132 -9.605 -7.380 -1.287 1.00 0.00 H new ATOM 0 HA PHE A 132 -11.735 -5.476 -0.738 1.00 0.00 H new ATOM 0 HB2 PHE A 132 -9.348 -5.473 0.211 1.00 0.00 H new ATOM 0 HB3 PHE A 132 -8.823 -4.953 -1.378 1.00 0.00 H new ATOM 0 HD1 PHE A 132 -10.821 -4.008 1.574 1.00 0.00 H new ATOM 0 HD2 PHE A 132 -9.181 -2.696 -2.126 1.00 0.00 H new ATOM 0 HE1 PHE A 132 -11.302 -1.684 2.189 1.00 0.00 H new ATOM 0 HE2 PHE A 132 -9.666 -0.367 -1.516 1.00 0.00 H new ATOM 0 HZ PHE A 132 -10.723 0.142 0.646 1.00 0.00 H new ATOM 880 N ASP A 133 -12.055 -4.336 -2.919 1.00 0.00 N ATOM 881 CA ASP A 133 -12.374 -3.784 -4.235 1.00 0.00 C ATOM 882 C ASP A 133 -11.782 -2.386 -4.381 1.00 0.00 C ATOM 883 O ASP A 133 -11.906 -1.563 -3.481 1.00 0.00 O ATOM 884 CB ASP A 133 -13.892 -3.743 -4.451 1.00 0.00 C ATOM 885 CG ASP A 133 -14.269 -3.309 -5.855 1.00 0.00 C ATOM 886 OD1 ASP A 133 -14.283 -4.168 -6.761 1.00 0.00 O ATOM 887 OD2 ASP A 133 -14.557 -2.106 -6.066 1.00 0.00 O ATOM 0 H ASP A 133 -12.653 -3.998 -2.165 1.00 0.00 H new ATOM 0 HA ASP A 133 -11.935 -4.432 -4.994 1.00 0.00 H new ATOM 0 HB2 ASP A 133 -14.310 -4.730 -4.255 1.00 0.00 H new ATOM 0 HB3 ASP A 133 -14.340 -3.059 -3.730 1.00 0.00 H new ATOM 892 N PRO A 134 -11.127 -2.102 -5.522 1.00 0.00 N ATOM 893 CA PRO A 134 -10.466 -0.810 -5.763 1.00 0.00 C ATOM 894 C PRO A 134 -11.432 0.365 -5.897 1.00 0.00 C ATOM 895 O PRO A 134 -11.177 1.446 -5.374 1.00 0.00 O ATOM 896 CB PRO A 134 -9.718 -1.031 -7.083 1.00 0.00 C ATOM 897 CG PRO A 134 -10.459 -2.131 -7.760 1.00 0.00 C ATOM 898 CD PRO A 134 -10.967 -3.023 -6.666 1.00 0.00 C ATOM 0 HA PRO A 134 -9.829 -0.539 -4.921 1.00 0.00 H new ATOM 0 HB2 PRO A 134 -9.712 -0.126 -7.690 1.00 0.00 H new ATOM 0 HB3 PRO A 134 -8.678 -1.304 -6.907 1.00 0.00 H new ATOM 0 HG2 PRO A 134 -11.282 -1.737 -8.356 1.00 0.00 H new ATOM 0 HG3 PRO A 134 -9.807 -2.680 -8.440 1.00 0.00 H new ATOM 0 HD2 PRO A 134 -11.911 -3.495 -6.938 1.00 0.00 H new ATOM 0 HD3 PRO A 134 -10.263 -3.825 -6.441 1.00 0.00 H new ATOM 906 N ILE A 135 -12.530 0.156 -6.602 1.00 0.00 N ATOM 907 CA ILE A 135 -13.477 1.231 -6.854 1.00 0.00 C ATOM 908 C ILE A 135 -14.429 1.438 -5.682 1.00 0.00 C ATOM 909 O ILE A 135 -14.623 2.568 -5.223 1.00 0.00 O ATOM 910 CB ILE A 135 -14.280 0.981 -8.153 1.00 0.00 C ATOM 911 CG1 ILE A 135 -13.324 0.736 -9.334 1.00 0.00 C ATOM 912 CG2 ILE A 135 -15.211 2.156 -8.452 1.00 0.00 C ATOM 913 CD1 ILE A 135 -12.270 1.817 -9.517 1.00 0.00 C ATOM 0 H ILE A 135 -12.788 -0.743 -7.009 1.00 0.00 H new ATOM 0 HA ILE A 135 -12.891 2.142 -6.976 1.00 0.00 H new ATOM 0 HB ILE A 135 -14.893 0.091 -8.010 1.00 0.00 H new ATOM 0 HG12 ILE A 135 -12.825 -0.222 -9.190 1.00 0.00 H new ATOM 0 HG13 ILE A 135 -13.909 0.656 -10.250 1.00 0.00 H new ATOM 0 HG21 ILE A 135 -15.765 1.957 -9.370 1.00 0.00 H new ATOM 0 HG22 ILE A 135 -15.911 2.285 -7.626 1.00 0.00 H new ATOM 0 HG23 ILE A 135 -14.622 3.065 -8.573 1.00 0.00 H new ATOM 0 HD11 ILE A 135 -11.638 1.568 -10.370 1.00 0.00 H new ATOM 0 HD12 ILE A 135 -12.758 2.775 -9.695 1.00 0.00 H new ATOM 0 HD13 ILE A 135 -11.657 1.883 -8.618 1.00 0.00 H new ATOM 925 N SER A 136 -15.023 0.361 -5.203 1.00 0.00 N ATOM 926 CA SER A 136 -15.942 0.437 -4.081 1.00 0.00 C ATOM 927 C SER A 136 -15.184 0.784 -2.806 1.00 0.00 C ATOM 928 O SER A 136 -15.678 1.534 -1.961 1.00 0.00 O ATOM 929 CB SER A 136 -16.666 -0.895 -3.919 1.00 0.00 C ATOM 930 OG SER A 136 -17.033 -1.424 -5.185 1.00 0.00 O ATOM 0 H SER A 136 -14.886 -0.579 -5.574 1.00 0.00 H new ATOM 0 HA SER A 136 -16.677 1.219 -4.272 1.00 0.00 H new ATOM 0 HB2 SER A 136 -16.023 -1.603 -3.396 1.00 0.00 H new ATOM 0 HB3 SER A 136 -17.556 -0.759 -3.304 1.00 0.00 H new ATOM 0 HG SER A 136 -16.245 -1.814 -5.617 1.00 0.00 H new ATOM 936 N ARG A 137 -13.977 0.227 -2.687 1.00 0.00 N ATOM 937 CA ARG A 137 -13.101 0.470 -1.547 1.00 0.00 C ATOM 938 C ARG A 137 -13.656 -0.142 -0.278 1.00 0.00 C ATOM 939 O ARG A 137 -13.842 0.531 0.734 1.00 0.00 O ATOM 940 CB ARG A 137 -12.795 1.958 -1.376 1.00 0.00 C ATOM 941 CG ARG A 137 -11.870 2.480 -2.451 1.00 0.00 C ATOM 942 CD ARG A 137 -11.610 3.962 -2.314 1.00 0.00 C ATOM 943 NE ARG A 137 -10.425 4.355 -3.078 1.00 0.00 N ATOM 944 CZ ARG A 137 -10.275 5.520 -3.710 1.00 0.00 C ATOM 945 NH1 ARG A 137 -11.235 6.433 -3.670 1.00 0.00 N ATOM 946 NH2 ARG A 137 -9.158 5.768 -4.379 1.00 0.00 N ATOM 0 H ARG A 137 -13.582 -0.406 -3.382 1.00 0.00 H new ATOM 0 HA ARG A 137 -12.153 -0.027 -1.755 1.00 0.00 H new ATOM 0 HB2 ARG A 137 -13.727 2.523 -1.396 1.00 0.00 H new ATOM 0 HB3 ARG A 137 -12.342 2.124 -0.398 1.00 0.00 H new ATOM 0 HG2 ARG A 137 -10.923 1.942 -2.405 1.00 0.00 H new ATOM 0 HG3 ARG A 137 -12.304 2.279 -3.430 1.00 0.00 H new ATOM 0 HD2 ARG A 137 -12.477 4.522 -2.665 1.00 0.00 H new ATOM 0 HD3 ARG A 137 -11.471 4.216 -1.263 1.00 0.00 H new ATOM 0 HE ARG A 137 -9.656 3.687 -3.131 1.00 0.00 H new ATOM 0 HH11 ARG A 137 -12.095 6.247 -3.154 1.00 0.00 H new ATOM 0 HH12 ARG A 137 -11.114 7.322 -4.155 1.00 0.00 H new ATOM 0 HH21 ARG A 137 -8.416 5.069 -4.410 1.00 0.00 H new ATOM 0 HH22 ARG A 137 -9.040 6.658 -4.863 1.00 0.00 H new ATOM 960 N ASN A 138 -13.914 -1.429 -0.352 1.00 0.00 N ATOM 961 CA ASN A 138 -14.414 -2.203 0.766 1.00 0.00 C ATOM 962 C ASN A 138 -14.011 -3.652 0.563 1.00 0.00 C ATOM 963 O ASN A 138 -13.478 -4.002 -0.493 1.00 0.00 O ATOM 964 CB ASN A 138 -15.949 -2.098 0.868 1.00 0.00 C ATOM 965 CG ASN A 138 -16.678 -2.755 -0.303 1.00 0.00 C ATOM 966 OD1 ASN A 138 -16.185 -2.782 -1.427 1.00 0.00 O ATOM 967 ND2 ASN A 138 -17.857 -3.286 -0.040 1.00 0.00 N ATOM 0 H ASN A 138 -13.781 -1.977 -1.202 1.00 0.00 H new ATOM 0 HA ASN A 138 -13.990 -1.814 1.692 1.00 0.00 H new ATOM 0 HB2 ASN A 138 -16.277 -2.562 1.798 1.00 0.00 H new ATOM 0 HB3 ASN A 138 -16.232 -1.047 0.919 1.00 0.00 H new ATOM 0 HD21 ASN A 138 -18.390 -3.738 -0.783 1.00 0.00 H new ATOM 0 HD22 ASN A 138 -18.235 -3.245 0.906 1.00 0.00 H new ATOM 974 N CYS A 139 -14.252 -4.490 1.548 1.00 0.00 N ATOM 975 CA CYS A 139 -13.934 -5.898 1.404 1.00 0.00 C ATOM 976 C CYS A 139 -15.210 -6.668 1.090 1.00 0.00 C ATOM 977 O CYS A 139 -16.202 -6.580 1.825 1.00 0.00 O ATOM 978 CB CYS A 139 -13.276 -6.446 2.685 1.00 0.00 C ATOM 979 SG CYS A 139 -11.886 -5.433 3.328 1.00 0.00 S ATOM 0 H CYS A 139 -14.661 -4.229 2.445 1.00 0.00 H new ATOM 0 HA CYS A 139 -13.223 -6.021 0.587 1.00 0.00 H new ATOM 0 HB2 CYS A 139 -14.037 -6.528 3.461 1.00 0.00 H new ATOM 0 HB3 CYS A 139 -12.912 -7.454 2.487 1.00 0.00 H new ATOM 984 N VAL A 140 -15.187 -7.405 -0.003 1.00 0.00 N ATOM 985 CA VAL A 140 -16.342 -8.167 -0.451 1.00 0.00 C ATOM 986 C VAL A 140 -16.024 -9.654 -0.454 1.00 0.00 C ATOM 987 O VAL A 140 -14.866 -10.038 -0.521 1.00 0.00 O ATOM 988 CB VAL A 140 -16.794 -7.730 -1.868 1.00 0.00 C ATOM 989 CG1 VAL A 140 -17.227 -6.272 -1.864 1.00 0.00 C ATOM 990 CG2 VAL A 140 -15.685 -7.950 -2.889 1.00 0.00 C ATOM 0 H VAL A 140 -14.370 -7.494 -0.607 1.00 0.00 H new ATOM 0 HA VAL A 140 -17.157 -7.970 0.245 1.00 0.00 H new ATOM 0 HB VAL A 140 -17.646 -8.347 -2.154 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -17.541 -5.983 -2.867 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -18.059 -6.141 -1.172 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -16.392 -5.645 -1.550 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -16.030 -7.635 -3.874 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -14.809 -7.365 -2.607 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -15.422 -9.007 -2.918 1.00 0.00 H new ATOM 1000 N LEU A 141 -17.047 -10.481 -0.379 1.00 0.00 N ATOM 1001 CA LEU A 141 -16.856 -11.926 -0.338 1.00 0.00 C ATOM 1002 C LEU A 141 -16.241 -12.459 -1.618 1.00 0.00 C ATOM 1003 O LEU A 141 -16.806 -12.304 -2.702 1.00 0.00 O ATOM 1004 CB LEU A 141 -18.173 -12.667 -0.077 1.00 0.00 C ATOM 1005 CG LEU A 141 -18.722 -12.614 1.347 1.00 0.00 C ATOM 1006 CD1 LEU A 141 -19.374 -11.274 1.637 1.00 0.00 C ATOM 1007 CD2 LEU A 141 -19.700 -13.752 1.572 1.00 0.00 C ATOM 0 H LEU A 141 -18.022 -10.182 -0.345 1.00 0.00 H new ATOM 0 HA LEU A 141 -16.169 -12.110 0.488 1.00 0.00 H new ATOM 0 HB2 LEU A 141 -18.930 -12.261 -0.748 1.00 0.00 H new ATOM 0 HB3 LEU A 141 -18.034 -13.713 -0.349 1.00 0.00 H new ATOM 0 HG LEU A 141 -17.888 -12.728 2.039 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -19.755 -11.268 2.658 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -18.638 -10.478 1.519 1.00 0.00 H new ATOM 0 HD13 LEU A 141 -20.198 -11.112 0.942 1.00 0.00 H new ATOM 0 HD21 LEU A 141 -20.085 -13.705 2.591 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -20.527 -13.666 0.867 1.00 0.00 H new ATOM 0 HD23 LEU A 141 -19.191 -14.704 1.420 1.00 0.00 H new ATOM 1019 N ASP A 142 -15.080 -13.072 -1.490 1.00 0.00 N ATOM 1020 CA ASP A 142 -14.461 -13.732 -2.618 1.00 0.00 C ATOM 1021 C ASP A 142 -15.065 -15.111 -2.736 1.00 0.00 C ATOM 1022 O ASP A 142 -14.606 -16.069 -2.115 1.00 0.00 O ATOM 1023 CB ASP A 142 -12.941 -13.818 -2.460 1.00 0.00 C ATOM 1024 CG ASP A 142 -12.274 -14.453 -3.666 1.00 0.00 C ATOM 1025 OD1 ASP A 142 -12.398 -13.901 -4.780 1.00 0.00 O ATOM 1026 OD2 ASP A 142 -11.606 -15.498 -3.508 1.00 0.00 O ATOM 0 H ASP A 142 -14.550 -13.126 -0.620 1.00 0.00 H new ATOM 0 HA ASP A 142 -14.647 -13.155 -3.524 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -12.536 -12.817 -2.308 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -12.702 -14.397 -1.568 1.00 0.00 H new ATOM 1031 N ASN A 143 -16.117 -15.191 -3.506 1.00 0.00 N ATOM 1032 CA ASN A 143 -16.882 -16.415 -3.632 1.00 0.00 C ATOM 1033 C ASN A 143 -17.617 -16.446 -4.958 1.00 0.00 C ATOM 1034 O ASN A 143 -18.737 -15.911 -5.036 1.00 0.00 O ATOM 1035 CB ASN A 143 -17.864 -16.519 -2.451 1.00 0.00 C ATOM 1036 CG ASN A 143 -18.716 -17.771 -2.476 1.00 0.00 C ATOM 1037 OD1 ASN A 143 -18.304 -18.825 -1.998 1.00 0.00 O ATOM 1038 ND2 ASN A 143 -19.918 -17.650 -2.992 1.00 0.00 N ATOM 1039 OXT ASN A 143 -17.056 -16.981 -5.933 1.00 0.00 O ATOM 0 H ASN A 143 -16.472 -14.415 -4.065 1.00 0.00 H new ATOM 0 HA ASN A 143 -16.209 -17.272 -3.609 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -17.301 -16.492 -1.518 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -18.517 -15.646 -2.455 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -20.550 -18.451 -3.006 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -20.219 -16.755 -3.378 1.00 0.00 H new TER 1046 ASN A 143