USER MOD reduce.3.24.130724 H: found=0, std=0, add=1094, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1089 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 103 HIS : no HD1:sc= -0.163 K(o=-0.56,f=-2.7) USER MOD Set 1.2: A 110 SER OG : rot 137:sc= -0.401 USER MOD Set 2.1: A 79 GLN :FLIP amide:sc= 0.601 F(o=0.63,f=2) USER MOD Set 2.2: A 84 THR OG1 : rot -42:sc= 1.38 USER MOD Set 3.1: A 54 THR OG1 : rot 180:sc= -0.674 USER MOD Set 3.2: A 57 MET CE :methyl 176:sc= -2.54! (180deg=-2.85!) USER MOD Single : A 1 GLY N :NH3+ -135:sc= 0.00642 (180deg=0) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot 25:sc= 0.229 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= -0.209 K(o=-0.21,f=-2.6!) USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 GLN : amide:sc= -0.6 K(o=-0.6,f=-1.5!) USER MOD Single : A 31 HIS : no HD1:sc= -0.328 X(o=-0.33,f=-0.65) USER MOD Single : A 33 ASN : amide:sc= -0.0588 X(o=-0.059,f=0) USER MOD Single : A 35 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 37 GLN : amide:sc= 0 K(o=0,f=-0.86) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 41 GLN : amide:sc= -0.0487 X(o=-0.049,f=0) USER MOD Single : A 42 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 46 HIS : no HD1:sc= 0 X(o=0,f=-0.037) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 SER OG : rot 180:sc= 0.00418 USER MOD Single : A 60 SER OG : rot -33:sc= 0.0941 USER MOD Single : A 64 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 66 GLN : amide:sc= -0.0247 K(o=-0.025,f=-0.56) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= 0 K(o=0,f=-0.79) USER MOD Single : A 69 MET CE :methyl 165:sc= -0.649 (180deg=-1.1) USER MOD Single : A 81 MET CE :methyl 175:sc= -0.627 (180deg=-0.685) USER MOD Single : A 82 HIS : no HD1:sc= -5.69! C(o=-5.7!,f=-10!) USER MOD Single : A 88 LYS NZ :NH3+ -135:sc= 0.055 (180deg=0) USER MOD Single : A 90 THR OG1 : rot -90:sc= -4.23! USER MOD Single : A 92 MET CE :methyl 170:sc= -2.02! (180deg=-2.17!) USER MOD Single : A 98 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 SER OG : rot 180:sc= 0.00226 USER MOD Single : A 104 MET CE :methyl 159:sc= -9.32! (180deg=-10.7!) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 GLN : amide:sc= -1.13 K(o=-1.1,f=-2) USER MOD Single : A 125 HIS : no HD1:sc= -1.09 X(o=-1.1,f=-0.94) USER MOD Single : A 126 GLN : amide:sc=-0.00281 K(o=-0.0028,f=-0.57) USER MOD Single : A 128 LYS NZ :NH3+ -175:sc=-0.00229 (180deg=-0.0366) USER MOD Single : A 132 GLN : amide:sc=-0.00812 K(o=-0.0081,f=-2.2) USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 ASN : amide:sc= -0.149 X(o=-0.15,f=-0.15) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 139 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0.0757 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -2.678 -19.523 1.399 1.00 0.00 N ATOM 2 CA GLY A 1 -1.632 -20.000 2.346 1.00 0.00 C ATOM 3 C GLY A 1 -2.016 -19.774 3.797 1.00 0.00 C ATOM 4 O GLY A 1 -3.182 -19.930 4.160 1.00 0.00 O ATOM 0 H1 GLY A 1 -2.831 -20.240 0.661 1.00 0.00 H new ATOM 0 H2 GLY A 1 -3.566 -19.362 1.915 1.00 0.00 H new ATOM 0 H3 GLY A 1 -2.368 -18.634 0.958 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -1.455 -21.063 2.182 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -0.695 -19.485 2.137 1.00 0.00 H new ATOM 10 N PRO A 2 -1.051 -19.401 4.659 1.00 0.00 N ATOM 11 CA PRO A 2 -1.312 -19.156 6.082 1.00 0.00 C ATOM 12 C PRO A 2 -2.362 -18.071 6.297 1.00 0.00 C ATOM 13 O PRO A 2 -2.983 -17.996 7.357 1.00 0.00 O ATOM 14 CB PRO A 2 0.045 -18.699 6.629 1.00 0.00 C ATOM 15 CG PRO A 2 1.047 -19.215 5.655 1.00 0.00 C ATOM 16 CD PRO A 2 0.368 -19.191 4.316 1.00 0.00 C ATOM 0 HA PRO A 2 -1.706 -20.043 6.579 1.00 0.00 H new ATOM 0 HB2 PRO A 2 0.094 -17.613 6.707 1.00 0.00 H new ATOM 0 HB3 PRO A 2 0.223 -19.099 7.627 1.00 0.00 H new ATOM 0 HG2 PRO A 2 1.943 -18.594 5.650 1.00 0.00 H new ATOM 0 HG3 PRO A 2 1.361 -20.226 5.916 1.00 0.00 H new ATOM 0 HD2 PRO A 2 0.523 -18.242 3.802 1.00 0.00 H new ATOM 0 HD3 PRO A 2 0.744 -19.975 3.659 1.00 0.00 H new ATOM 24 N LEU A 3 -2.555 -17.234 5.282 1.00 0.00 N ATOM 25 CA LEU A 3 -3.528 -16.152 5.356 1.00 0.00 C ATOM 26 C LEU A 3 -4.951 -16.699 5.346 1.00 0.00 C ATOM 27 O LEU A 3 -5.233 -17.716 4.714 1.00 0.00 O ATOM 28 CB LEU A 3 -3.335 -15.187 4.185 1.00 0.00 C ATOM 29 CG LEU A 3 -2.140 -14.241 4.316 1.00 0.00 C ATOM 30 CD1 LEU A 3 -1.018 -14.667 3.381 1.00 0.00 C ATOM 31 CD2 LEU A 3 -2.561 -12.807 4.031 1.00 0.00 C ATOM 0 H LEU A 3 -2.049 -17.285 4.398 1.00 0.00 H new ATOM 0 HA LEU A 3 -3.369 -15.617 6.292 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -3.220 -15.768 3.270 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -4.240 -14.591 4.072 1.00 0.00 H new ATOM 0 HG LEU A 3 -1.770 -14.292 5.340 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -0.176 -13.983 3.487 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -0.698 -15.678 3.633 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -1.375 -14.646 2.351 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -1.698 -12.148 4.129 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -2.957 -12.739 3.018 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -3.330 -12.505 4.742 1.00 0.00 H new ATOM 43 N GLY A 4 -5.846 -16.014 6.053 1.00 0.00 N ATOM 44 CA GLY A 4 -7.231 -16.442 6.111 1.00 0.00 C ATOM 45 C GLY A 4 -8.138 -15.581 5.254 1.00 0.00 C ATOM 46 O GLY A 4 -7.880 -14.392 5.068 1.00 0.00 O ATOM 0 H GLY A 4 -5.636 -15.170 6.586 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -7.302 -17.479 5.783 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -7.575 -16.411 7.145 1.00 0.00 H new ATOM 50 N SER A 5 -9.201 -16.182 4.730 1.00 0.00 N ATOM 51 CA SER A 5 -10.149 -15.462 3.889 1.00 0.00 C ATOM 52 C SER A 5 -11.434 -15.162 4.651 1.00 0.00 C ATOM 53 O SER A 5 -12.158 -14.222 4.321 1.00 0.00 O ATOM 54 CB SER A 5 -10.465 -16.274 2.632 1.00 0.00 C ATOM 55 OG SER A 5 -11.028 -15.454 1.622 1.00 0.00 O ATOM 0 H SER A 5 -9.427 -17.166 4.873 1.00 0.00 H new ATOM 0 HA SER A 5 -9.693 -14.516 3.597 1.00 0.00 H new ATOM 0 HB2 SER A 5 -9.554 -16.742 2.259 1.00 0.00 H new ATOM 0 HB3 SER A 5 -11.158 -17.078 2.880 1.00 0.00 H new ATOM 0 HG SER A 5 -11.219 -15.997 0.829 1.00 0.00 H new ATOM 61 N ALA A 6 -11.710 -15.966 5.674 1.00 0.00 N ATOM 62 CA ALA A 6 -12.908 -15.794 6.489 1.00 0.00 C ATOM 63 C ALA A 6 -14.166 -15.802 5.626 1.00 0.00 C ATOM 64 O ALA A 6 -14.720 -14.749 5.309 1.00 0.00 O ATOM 65 CB ALA A 6 -12.822 -14.506 7.294 1.00 0.00 C ATOM 0 H ALA A 6 -11.117 -16.746 5.959 1.00 0.00 H new ATOM 0 HA ALA A 6 -12.970 -16.634 7.180 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -13.723 -14.393 7.896 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -11.951 -14.543 7.948 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -12.730 -13.658 6.615 1.00 0.00 H new ATOM 71 N ALA A 7 -14.607 -16.997 5.247 1.00 0.00 N ATOM 72 CA ALA A 7 -15.797 -17.145 4.417 1.00 0.00 C ATOM 73 C ALA A 7 -16.588 -18.387 4.813 1.00 0.00 C ATOM 74 O ALA A 7 -16.092 -19.244 5.546 1.00 0.00 O ATOM 75 CB ALA A 7 -15.412 -17.205 2.947 1.00 0.00 C ATOM 0 H ALA A 7 -14.158 -17.877 5.501 1.00 0.00 H new ATOM 0 HA ALA A 7 -16.434 -16.275 4.576 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -16.310 -17.316 2.340 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -14.896 -16.286 2.668 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -14.753 -18.056 2.778 1.00 0.00 H new ATOM 81 N ALA A 8 -17.821 -18.478 4.324 1.00 0.00 N ATOM 82 CA ALA A 8 -18.683 -19.614 4.625 1.00 0.00 C ATOM 83 C ALA A 8 -19.333 -20.159 3.357 1.00 0.00 C ATOM 84 O ALA A 8 -20.132 -19.475 2.717 1.00 0.00 O ATOM 85 CB ALA A 8 -19.745 -19.216 5.638 1.00 0.00 C ATOM 0 H ALA A 8 -18.245 -17.777 3.717 1.00 0.00 H new ATOM 0 HA ALA A 8 -18.067 -20.404 5.054 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -20.382 -20.074 5.854 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -19.264 -18.881 6.557 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -20.352 -18.407 5.230 1.00 0.00 H new ATOM 91 N ALA A 9 -18.984 -21.393 3.004 1.00 0.00 N ATOM 92 CA ALA A 9 -19.532 -22.037 1.813 1.00 0.00 C ATOM 93 C ALA A 9 -19.275 -21.196 0.566 1.00 0.00 C ATOM 94 O ALA A 9 -20.162 -20.488 0.089 1.00 0.00 O ATOM 95 CB ALA A 9 -21.022 -22.292 1.987 1.00 0.00 C ATOM 0 H ALA A 9 -18.323 -21.968 3.526 1.00 0.00 H new ATOM 0 HA ALA A 9 -19.026 -22.994 1.682 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -21.416 -22.772 1.091 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -21.182 -22.942 2.847 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -21.537 -21.345 2.147 1.00 0.00 H new ATOM 101 N THR A 10 -18.055 -21.280 0.043 1.00 0.00 N ATOM 102 CA THR A 10 -17.681 -20.527 -1.148 1.00 0.00 C ATOM 103 C THR A 10 -16.978 -21.425 -2.163 1.00 0.00 C ATOM 104 O THR A 10 -16.009 -22.108 -1.830 1.00 0.00 O ATOM 105 CB THR A 10 -16.771 -19.356 -0.771 1.00 0.00 C ATOM 106 OG1 THR A 10 -15.586 -19.824 -0.151 1.00 0.00 O ATOM 107 CG2 THR A 10 -17.423 -18.367 0.170 1.00 0.00 C ATOM 0 H THR A 10 -17.310 -21.862 0.426 1.00 0.00 H new ATOM 0 HA THR A 10 -18.593 -20.140 -1.603 1.00 0.00 H new ATOM 0 HB THR A 10 -16.553 -18.846 -1.709 1.00 0.00 H new ATOM 0 HG1 THR A 10 -15.404 -20.741 -0.444 1.00 0.00 H new ATOM 0 HG21 THR A 10 -16.722 -17.563 0.396 1.00 0.00 H new ATOM 0 HG22 THR A 10 -18.314 -17.951 -0.300 1.00 0.00 H new ATOM 0 HG23 THR A 10 -17.703 -18.874 1.093 1.00 0.00 H new ATOM 115 N PRO A 11 -17.455 -21.437 -3.423 1.00 0.00 N ATOM 116 CA PRO A 11 -16.861 -22.258 -4.481 1.00 0.00 C ATOM 117 C PRO A 11 -15.538 -21.688 -4.983 1.00 0.00 C ATOM 118 O PRO A 11 -15.168 -20.564 -4.644 1.00 0.00 O ATOM 119 CB PRO A 11 -17.915 -22.217 -5.588 1.00 0.00 C ATOM 120 CG PRO A 11 -18.609 -20.914 -5.395 1.00 0.00 C ATOM 121 CD PRO A 11 -18.608 -20.654 -3.913 1.00 0.00 C ATOM 0 HA PRO A 11 -16.623 -23.264 -4.135 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -17.457 -22.280 -6.575 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -18.610 -23.053 -5.505 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -18.095 -20.116 -5.931 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -19.627 -20.954 -5.783 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -18.495 -19.593 -3.692 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -19.539 -20.978 -3.449 1.00 0.00 H new ATOM 129 N ALA A 12 -14.831 -22.472 -5.792 1.00 0.00 N ATOM 130 CA ALA A 12 -13.550 -22.045 -6.344 1.00 0.00 C ATOM 131 C ALA A 12 -13.712 -21.537 -7.772 1.00 0.00 C ATOM 132 O ALA A 12 -12.860 -20.810 -8.284 1.00 0.00 O ATOM 133 CB ALA A 12 -12.547 -23.187 -6.298 1.00 0.00 C ATOM 0 H ALA A 12 -15.124 -23.406 -6.079 1.00 0.00 H new ATOM 0 HA ALA A 12 -13.175 -21.224 -5.733 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -11.596 -22.853 -6.713 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -12.401 -23.502 -5.265 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -12.924 -24.026 -6.883 1.00 0.00 H new ATOM 139 N VAL A 13 -14.813 -21.923 -8.410 1.00 0.00 N ATOM 140 CA VAL A 13 -15.091 -21.505 -9.780 1.00 0.00 C ATOM 141 C VAL A 13 -16.099 -20.361 -9.808 1.00 0.00 C ATOM 142 O VAL A 13 -16.948 -20.247 -8.925 1.00 0.00 O ATOM 143 CB VAL A 13 -15.632 -22.669 -10.634 1.00 0.00 C ATOM 144 CG1 VAL A 13 -15.042 -22.621 -12.035 1.00 0.00 C ATOM 145 CG2 VAL A 13 -15.343 -24.009 -9.972 1.00 0.00 C ATOM 0 H VAL A 13 -15.527 -22.525 -8.000 1.00 0.00 H new ATOM 0 HA VAL A 13 -14.144 -21.169 -10.203 1.00 0.00 H new ATOM 0 HB VAL A 13 -16.714 -22.560 -10.713 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -15.435 -23.450 -12.624 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -15.311 -21.678 -12.511 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -13.957 -22.701 -11.976 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -15.735 -24.814 -10.594 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -14.266 -24.132 -9.854 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -15.821 -24.042 -8.993 1.00 0.00 H new ATOM 155 N ARG A 14 -15.999 -19.516 -10.830 1.00 0.00 N ATOM 156 CA ARG A 14 -16.900 -18.379 -10.974 1.00 0.00 C ATOM 157 C ARG A 14 -18.073 -18.723 -11.886 1.00 0.00 C ATOM 158 O ARG A 14 -18.673 -17.842 -12.502 1.00 0.00 O ATOM 159 CB ARG A 14 -16.143 -17.171 -11.527 1.00 0.00 C ATOM 160 CG ARG A 14 -14.871 -16.848 -10.760 1.00 0.00 C ATOM 161 CD ARG A 14 -13.631 -17.268 -11.532 1.00 0.00 C ATOM 162 NE ARG A 14 -12.682 -17.992 -10.690 1.00 0.00 N ATOM 163 CZ ARG A 14 -11.616 -17.430 -10.127 1.00 0.00 C ATOM 164 NH1 ARG A 14 -11.365 -16.142 -10.316 1.00 0.00 N ATOM 165 NH2 ARG A 14 -10.802 -18.157 -9.374 1.00 0.00 N ATOM 0 H ARG A 14 -15.302 -19.598 -11.571 1.00 0.00 H new ATOM 0 HA ARG A 14 -17.294 -18.132 -9.988 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -15.891 -17.357 -12.571 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -16.800 -16.301 -11.508 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -14.829 -15.778 -10.558 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -14.889 -17.355 -9.795 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -13.923 -17.897 -12.373 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -13.146 -16.385 -11.948 1.00 0.00 H new ATOM 0 HE ARG A 14 -12.846 -18.985 -10.524 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -11.990 -15.580 -10.894 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -10.547 -15.713 -9.883 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -10.993 -19.148 -9.226 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -9.985 -17.725 -8.943 1.00 0.00 H new ATOM 179 N THR A 15 -18.396 -20.010 -11.966 1.00 0.00 N ATOM 180 CA THR A 15 -19.499 -20.473 -12.801 1.00 0.00 C ATOM 181 C THR A 15 -20.801 -20.517 -12.008 1.00 0.00 C ATOM 182 O THR A 15 -20.788 -20.595 -10.779 1.00 0.00 O ATOM 183 CB THR A 15 -19.187 -21.860 -13.368 1.00 0.00 C ATOM 184 OG1 THR A 15 -17.812 -21.968 -13.695 1.00 0.00 O ATOM 185 CG2 THR A 15 -19.982 -22.193 -14.611 1.00 0.00 C ATOM 0 H THR A 15 -17.909 -20.751 -11.462 1.00 0.00 H new ATOM 0 HA THR A 15 -19.620 -19.769 -13.624 1.00 0.00 H new ATOM 0 HB THR A 15 -19.464 -22.563 -12.582 1.00 0.00 H new ATOM 0 HG1 THR A 15 -17.630 -22.861 -14.054 1.00 0.00 H new ATOM 0 HG21 THR A 15 -19.712 -23.190 -14.960 1.00 0.00 H new ATOM 0 HG22 THR A 15 -21.047 -22.166 -14.380 1.00 0.00 H new ATOM 0 HG23 THR A 15 -19.761 -21.464 -15.390 1.00 0.00 H new ATOM 193 N VAL A 16 -21.923 -20.468 -12.719 1.00 0.00 N ATOM 194 CA VAL A 16 -23.235 -20.503 -12.082 1.00 0.00 C ATOM 195 C VAL A 16 -23.816 -21.919 -12.102 1.00 0.00 C ATOM 196 O VAL A 16 -24.236 -22.413 -13.149 1.00 0.00 O ATOM 197 CB VAL A 16 -24.220 -19.529 -12.765 1.00 0.00 C ATOM 198 CG1 VAL A 16 -24.172 -19.686 -14.279 1.00 0.00 C ATOM 199 CG2 VAL A 16 -25.635 -19.732 -12.245 1.00 0.00 C ATOM 0 H VAL A 16 -21.950 -20.404 -13.737 1.00 0.00 H new ATOM 0 HA VAL A 16 -23.098 -20.189 -11.047 1.00 0.00 H new ATOM 0 HB VAL A 16 -23.914 -18.512 -12.519 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -24.874 -18.990 -14.739 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -23.164 -19.473 -14.635 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -24.444 -20.707 -14.548 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -26.309 -19.034 -12.742 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -25.955 -20.754 -12.450 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -25.657 -19.554 -11.170 1.00 0.00 H new ATOM 209 N PRO A 17 -23.845 -22.597 -10.939 1.00 0.00 N ATOM 210 CA PRO A 17 -24.361 -23.963 -10.829 1.00 0.00 C ATOM 211 C PRO A 17 -25.883 -24.020 -10.930 1.00 0.00 C ATOM 212 O PRO A 17 -26.432 -24.374 -11.973 1.00 0.00 O ATOM 213 CB PRO A 17 -23.902 -24.423 -9.434 1.00 0.00 C ATOM 214 CG PRO A 17 -22.967 -23.366 -8.941 1.00 0.00 C ATOM 215 CD PRO A 17 -23.358 -22.100 -9.647 1.00 0.00 C ATOM 0 HA PRO A 17 -23.994 -24.594 -11.639 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -24.752 -24.537 -8.761 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -23.404 -25.391 -9.486 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -23.046 -23.249 -7.860 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -21.932 -23.629 -9.158 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -24.130 -21.554 -9.105 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -22.512 -21.423 -9.765 1.00 0.00 H new ATOM 223 N GLN A 18 -26.558 -23.676 -9.836 1.00 0.00 N ATOM 224 CA GLN A 18 -28.016 -23.699 -9.797 1.00 0.00 C ATOM 225 C GLN A 18 -28.602 -22.409 -10.361 1.00 0.00 C ATOM 226 O GLN A 18 -27.868 -21.498 -10.746 1.00 0.00 O ATOM 227 CB GLN A 18 -28.502 -23.906 -8.361 1.00 0.00 C ATOM 228 CG GLN A 18 -27.903 -22.924 -7.368 1.00 0.00 C ATOM 229 CD GLN A 18 -27.655 -23.547 -6.008 1.00 0.00 C ATOM 230 OE1 GLN A 18 -27.724 -24.764 -5.847 1.00 0.00 O ATOM 231 NE2 GLN A 18 -27.360 -22.710 -5.019 1.00 0.00 N ATOM 0 H GLN A 18 -26.118 -23.378 -8.965 1.00 0.00 H new ATOM 0 HA GLN A 18 -28.356 -24.529 -10.416 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -29.588 -23.816 -8.338 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -28.259 -24.921 -8.047 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -26.963 -22.540 -7.764 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -28.573 -22.072 -7.256 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -27.313 -21.707 -5.197 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -27.180 -23.071 -4.082 1.00 0.00 H new ATOM 240 N TYR A 19 -29.929 -22.339 -10.405 1.00 0.00 N ATOM 241 CA TYR A 19 -30.620 -21.162 -10.919 1.00 0.00 C ATOM 242 C TYR A 19 -30.535 -20.004 -9.930 1.00 0.00 C ATOM 243 O TYR A 19 -30.887 -20.148 -8.759 1.00 0.00 O ATOM 244 CB TYR A 19 -32.086 -21.495 -11.206 1.00 0.00 C ATOM 245 CG TYR A 19 -32.725 -20.591 -12.235 1.00 0.00 C ATOM 246 CD1 TYR A 19 -32.413 -20.709 -13.585 1.00 0.00 C ATOM 247 CD2 TYR A 19 -33.646 -19.621 -11.858 1.00 0.00 C ATOM 248 CE1 TYR A 19 -32.996 -19.884 -14.528 1.00 0.00 C ATOM 249 CE2 TYR A 19 -34.234 -18.793 -12.795 1.00 0.00 C ATOM 250 CZ TYR A 19 -33.906 -18.929 -14.128 1.00 0.00 C ATOM 251 OH TYR A 19 -34.490 -18.106 -15.063 1.00 0.00 O ATOM 0 H TYR A 19 -30.548 -23.086 -10.090 1.00 0.00 H new ATOM 0 HA TYR A 19 -30.132 -20.860 -11.846 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -32.154 -22.527 -11.550 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -32.652 -21.430 -10.277 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -31.703 -21.458 -13.902 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -33.906 -19.513 -10.816 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -32.740 -19.987 -15.572 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -34.947 -18.043 -12.485 1.00 0.00 H new ATOM 0 HH TYR A 19 -35.108 -17.490 -14.616 1.00 0.00 H new ATOM 261 N LYS A 20 -30.067 -18.856 -10.409 1.00 0.00 N ATOM 262 CA LYS A 20 -29.933 -17.671 -9.568 1.00 0.00 C ATOM 263 C LYS A 20 -31.284 -16.996 -9.355 1.00 0.00 C ATOM 264 O LYS A 20 -32.285 -17.388 -9.953 1.00 0.00 O ATOM 265 CB LYS A 20 -28.950 -16.682 -10.196 1.00 0.00 C ATOM 266 CG LYS A 20 -27.672 -17.331 -10.702 1.00 0.00 C ATOM 267 CD LYS A 20 -26.598 -16.297 -10.997 1.00 0.00 C ATOM 268 CE LYS A 20 -26.701 -15.777 -12.421 1.00 0.00 C ATOM 269 NZ LYS A 20 -26.356 -14.331 -12.511 1.00 0.00 N ATOM 0 H LYS A 20 -29.774 -18.721 -11.377 1.00 0.00 H new ATOM 0 HA LYS A 20 -29.550 -17.988 -8.598 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -29.441 -16.172 -11.025 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -28.694 -15.920 -9.460 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -27.303 -18.038 -9.959 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -27.886 -17.902 -11.606 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -26.690 -15.466 -10.298 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -25.614 -16.738 -10.840 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -26.035 -16.350 -13.066 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -27.714 -15.932 -12.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -26.439 -14.015 -13.498 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -27.008 -13.781 -11.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -25.380 -14.186 -12.182 1.00 0.00 H new ATOM 283 N TYR A 21 -31.301 -15.978 -8.500 1.00 0.00 N ATOM 284 CA TYR A 21 -32.528 -15.245 -8.206 1.00 0.00 C ATOM 285 C TYR A 21 -32.663 -14.021 -9.105 1.00 0.00 C ATOM 286 O TYR A 21 -31.709 -13.619 -9.772 1.00 0.00 O ATOM 287 CB TYR A 21 -32.551 -14.817 -6.737 1.00 0.00 C ATOM 288 CG TYR A 21 -33.308 -15.769 -5.839 1.00 0.00 C ATOM 289 CD1 TYR A 21 -32.804 -17.031 -5.550 1.00 0.00 C ATOM 290 CD2 TYR A 21 -34.526 -15.405 -5.278 1.00 0.00 C ATOM 291 CE1 TYR A 21 -33.494 -17.904 -4.730 1.00 0.00 C ATOM 292 CE2 TYR A 21 -35.221 -16.272 -4.457 1.00 0.00 C ATOM 293 CZ TYR A 21 -34.700 -17.520 -4.185 1.00 0.00 C ATOM 294 OH TYR A 21 -35.389 -18.385 -3.368 1.00 0.00 O ATOM 0 H TYR A 21 -30.479 -15.642 -7.998 1.00 0.00 H new ATOM 0 HA TYR A 21 -33.371 -15.908 -8.399 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -31.526 -14.729 -6.377 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -33.000 -13.827 -6.663 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -31.858 -17.335 -5.973 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -34.936 -14.428 -5.487 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -33.090 -18.883 -4.517 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -36.167 -15.974 -4.030 1.00 0.00 H new ATOM 0 HH TYR A 21 -36.219 -17.960 -3.067 1.00 0.00 H new ATOM 304 N ALA A 22 -33.855 -13.433 -9.118 1.00 0.00 N ATOM 305 CA ALA A 22 -34.122 -12.255 -9.937 1.00 0.00 C ATOM 306 C ALA A 22 -33.688 -10.979 -9.225 1.00 0.00 C ATOM 307 O ALA A 22 -33.066 -10.102 -9.825 1.00 0.00 O ATOM 308 CB ALA A 22 -35.599 -12.187 -10.293 1.00 0.00 C ATOM 0 H ALA A 22 -34.653 -13.754 -8.570 1.00 0.00 H new ATOM 0 HA ALA A 22 -33.540 -12.341 -10.855 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -35.786 -11.304 -10.904 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -35.880 -13.080 -10.851 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -36.191 -12.128 -9.380 1.00 0.00 H new ATOM 314 N ALA A 23 -34.022 -10.880 -7.941 1.00 0.00 N ATOM 315 CA ALA A 23 -33.673 -9.706 -7.148 1.00 0.00 C ATOM 316 C ALA A 23 -32.163 -9.600 -6.954 1.00 0.00 C ATOM 317 O ALA A 23 -31.648 -8.542 -6.591 1.00 0.00 O ATOM 318 CB ALA A 23 -34.377 -9.752 -5.801 1.00 0.00 C ATOM 0 H ALA A 23 -34.533 -11.598 -7.428 1.00 0.00 H new ATOM 0 HA ALA A 23 -34.005 -8.821 -7.691 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -34.108 -8.870 -5.219 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -35.456 -9.770 -5.955 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -34.073 -10.649 -5.262 1.00 0.00 H new ATOM 324 N GLY A 24 -31.460 -10.702 -7.198 1.00 0.00 N ATOM 325 CA GLY A 24 -30.017 -10.710 -7.044 1.00 0.00 C ATOM 326 C GLY A 24 -29.306 -10.048 -8.208 1.00 0.00 C ATOM 327 O GLY A 24 -28.786 -10.725 -9.094 1.00 0.00 O ATOM 0 H GLY A 24 -31.864 -11.589 -7.499 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -29.750 -10.197 -6.120 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -29.671 -11.739 -6.948 1.00 0.00 H new ATOM 331 N VAL A 25 -29.285 -8.718 -8.206 1.00 0.00 N ATOM 332 CA VAL A 25 -28.635 -7.962 -9.270 1.00 0.00 C ATOM 333 C VAL A 25 -27.202 -7.604 -8.888 1.00 0.00 C ATOM 334 O VAL A 25 -26.346 -7.420 -9.753 1.00 0.00 O ATOM 335 CB VAL A 25 -29.403 -6.666 -9.601 1.00 0.00 C ATOM 336 CG1 VAL A 25 -29.290 -6.346 -11.084 1.00 0.00 C ATOM 337 CG2 VAL A 25 -30.861 -6.780 -9.182 1.00 0.00 C ATOM 0 H VAL A 25 -29.711 -8.143 -7.479 1.00 0.00 H new ATOM 0 HA VAL A 25 -28.630 -8.603 -10.152 1.00 0.00 H new ATOM 0 HB VAL A 25 -28.955 -5.847 -9.038 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -29.837 -5.429 -11.301 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -28.241 -6.214 -11.349 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -29.711 -7.166 -11.666 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -31.383 -5.854 -9.425 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -31.328 -7.610 -9.712 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -30.918 -6.957 -8.108 1.00 0.00 H new ATOM 347 N ARG A 26 -26.951 -7.507 -7.585 1.00 0.00 N ATOM 348 CA ARG A 26 -25.624 -7.168 -7.085 1.00 0.00 C ATOM 349 C ARG A 26 -24.782 -8.422 -6.869 1.00 0.00 C ATOM 350 O ARG A 26 -23.838 -8.421 -6.079 1.00 0.00 O ATOM 351 CB ARG A 26 -25.738 -6.388 -5.773 1.00 0.00 C ATOM 352 CG ARG A 26 -25.888 -4.888 -5.968 1.00 0.00 C ATOM 353 CD ARG A 26 -26.608 -4.242 -4.794 1.00 0.00 C ATOM 354 NE ARG A 26 -25.785 -4.229 -3.587 1.00 0.00 N ATOM 355 CZ ARG A 26 -26.255 -3.943 -2.377 1.00 0.00 C ATOM 356 NH1 ARG A 26 -27.537 -3.648 -2.211 1.00 0.00 N ATOM 357 NH2 ARG A 26 -25.442 -3.952 -1.330 1.00 0.00 N ATOM 0 H ARG A 26 -27.650 -7.659 -6.857 1.00 0.00 H new ATOM 0 HA ARG A 26 -25.131 -6.547 -7.833 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -26.595 -6.761 -5.212 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -24.852 -6.580 -5.167 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -24.904 -4.435 -6.086 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -26.441 -4.693 -6.887 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -26.884 -3.220 -5.056 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -27.534 -4.781 -4.595 1.00 0.00 H new ATOM 0 HE ARG A 26 -24.794 -4.452 -3.678 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -28.167 -3.640 -3.014 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -27.894 -3.429 -1.281 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -24.455 -4.178 -1.453 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -25.803 -3.732 -0.402 1.00 0.00 H new ATOM 371 N ASN A 27 -25.130 -9.492 -7.578 1.00 0.00 N ATOM 372 CA ASN A 27 -24.408 -10.755 -7.461 1.00 0.00 C ATOM 373 C ASN A 27 -23.031 -10.678 -8.130 1.00 0.00 C ATOM 374 O ASN A 27 -22.023 -11.025 -7.512 1.00 0.00 O ATOM 375 CB ASN A 27 -25.228 -11.898 -8.066 1.00 0.00 C ATOM 376 CG ASN A 27 -25.791 -12.827 -7.009 1.00 0.00 C ATOM 377 OD1 ASN A 27 -25.456 -14.011 -6.963 1.00 0.00 O ATOM 378 ND2 ASN A 27 -26.654 -12.294 -6.150 1.00 0.00 N ATOM 0 H ASN A 27 -25.907 -9.510 -8.239 1.00 0.00 H new ATOM 0 HA ASN A 27 -24.255 -10.952 -6.400 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -26.046 -11.483 -8.654 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -24.601 -12.469 -8.751 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -27.066 -12.871 -5.417 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -26.904 -11.308 -6.224 1.00 0.00 H new ATOM 385 N PRO A 28 -22.955 -10.227 -9.403 1.00 0.00 N ATOM 386 CA PRO A 28 -21.678 -10.123 -10.118 1.00 0.00 C ATOM 387 C PRO A 28 -20.814 -8.980 -9.597 1.00 0.00 C ATOM 388 O PRO A 28 -20.964 -7.832 -10.018 1.00 0.00 O ATOM 389 CB PRO A 28 -22.101 -9.859 -11.564 1.00 0.00 C ATOM 390 CG PRO A 28 -23.428 -9.194 -11.453 1.00 0.00 C ATOM 391 CD PRO A 28 -24.091 -9.787 -10.240 1.00 0.00 C ATOM 0 HA PRO A 28 -21.068 -11.018 -9.996 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -21.381 -9.222 -12.078 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -22.169 -10.786 -12.133 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -23.316 -8.115 -11.347 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -24.026 -9.366 -12.348 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -24.710 -9.054 -9.723 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -24.740 -10.621 -10.506 1.00 0.00 H new ATOM 399 N GLN A 29 -19.909 -9.301 -8.677 1.00 0.00 N ATOM 400 CA GLN A 29 -19.019 -8.300 -8.098 1.00 0.00 C ATOM 401 C GLN A 29 -17.803 -8.073 -8.990 1.00 0.00 C ATOM 402 O GLN A 29 -16.802 -8.783 -8.883 1.00 0.00 O ATOM 403 CB GLN A 29 -18.568 -8.734 -6.701 1.00 0.00 C ATOM 404 CG GLN A 29 -19.029 -7.799 -5.596 1.00 0.00 C ATOM 405 CD GLN A 29 -19.574 -8.543 -4.393 1.00 0.00 C ATOM 406 OE1 GLN A 29 -20.668 -9.105 -4.438 1.00 0.00 O ATOM 407 NE2 GLN A 29 -18.810 -8.551 -3.307 1.00 0.00 N ATOM 0 H GLN A 29 -19.773 -10.245 -8.317 1.00 0.00 H new ATOM 0 HA GLN A 29 -19.570 -7.363 -8.019 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -18.948 -9.736 -6.500 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -17.480 -8.796 -6.682 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -18.194 -7.172 -5.283 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -19.799 -7.133 -5.986 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -17.910 -8.072 -3.313 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -19.124 -9.036 -2.466 1.00 0.00 H new ATOM 416 N GLN A 30 -17.897 -7.082 -9.869 1.00 0.00 N ATOM 417 CA GLN A 30 -16.805 -6.761 -10.780 1.00 0.00 C ATOM 418 C GLN A 30 -15.660 -6.080 -10.036 1.00 0.00 C ATOM 419 O GLN A 30 -14.652 -6.713 -9.718 1.00 0.00 O ATOM 420 CB GLN A 30 -17.300 -5.859 -11.913 1.00 0.00 C ATOM 421 CG GLN A 30 -18.675 -6.239 -12.438 1.00 0.00 C ATOM 422 CD GLN A 30 -18.614 -7.276 -13.543 1.00 0.00 C ATOM 423 OE1 GLN A 30 -19.357 -8.257 -13.532 1.00 0.00 O ATOM 424 NE2 GLN A 30 -17.724 -7.064 -14.506 1.00 0.00 N ATOM 0 H GLN A 30 -18.719 -6.487 -9.970 1.00 0.00 H new ATOM 0 HA GLN A 30 -16.436 -7.694 -11.206 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -17.328 -4.828 -11.560 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -16.584 -5.895 -12.734 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -19.279 -6.624 -11.617 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -19.177 -5.346 -12.811 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -17.127 -6.237 -14.476 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -17.637 -7.728 -15.275 1.00 0.00 H new ATOM 433 N HIS A 31 -15.826 -4.788 -9.761 1.00 0.00 N ATOM 434 CA HIS A 31 -14.810 -4.016 -9.053 1.00 0.00 C ATOM 435 C HIS A 31 -13.465 -4.095 -9.770 1.00 0.00 C ATOM 436 O HIS A 31 -12.410 -3.957 -9.149 1.00 0.00 O ATOM 437 CB HIS A 31 -14.666 -4.520 -7.615 1.00 0.00 C ATOM 438 CG HIS A 31 -15.094 -3.522 -6.585 1.00 0.00 C ATOM 439 ND1 HIS A 31 -15.993 -2.524 -6.881 1.00 0.00 N ATOM 440 CD2 HIS A 31 -14.723 -3.410 -5.285 1.00 0.00 C ATOM 441 CE1 HIS A 31 -16.147 -1.832 -5.766 1.00 0.00 C ATOM 442 NE2 HIS A 31 -15.398 -2.333 -4.774 1.00 0.00 N ATOM 0 H HIS A 31 -16.656 -4.254 -10.019 1.00 0.00 H new ATOM 0 HA HIS A 31 -15.130 -2.974 -9.035 1.00 0.00 H new ATOM 0 HB2 HIS A 31 -15.257 -5.428 -7.496 1.00 0.00 H new ATOM 0 HB3 HIS A 31 -13.625 -4.791 -7.436 1.00 0.00 H new ATOM 0 HD2 HIS A 31 -14.030 -4.047 -4.755 1.00 0.00 H new ATOM 0 HE1 HIS A 31 -16.794 -0.973 -5.667 1.00 0.00 H new ATOM 0 HE2 HIS A 31 -15.341 -1.979 -3.819 1.00 0.00 H new ATOM 450 N LEU A 32 -13.512 -4.315 -11.079 1.00 0.00 N ATOM 451 CA LEU A 32 -12.299 -4.407 -11.884 1.00 0.00 C ATOM 452 C LEU A 32 -11.771 -3.021 -12.230 1.00 0.00 C ATOM 453 O LEU A 32 -10.696 -2.625 -11.779 1.00 0.00 O ATOM 454 CB LEU A 32 -12.573 -5.195 -13.167 1.00 0.00 C ATOM 455 CG LEU A 32 -12.801 -6.695 -12.970 1.00 0.00 C ATOM 456 CD1 LEU A 32 -14.033 -7.151 -13.737 1.00 0.00 C ATOM 457 CD2 LEU A 32 -11.575 -7.482 -13.408 1.00 0.00 C ATOM 0 H LEU A 32 -14.377 -4.433 -11.606 1.00 0.00 H new ATOM 0 HA LEU A 32 -11.542 -4.929 -11.299 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -13.450 -4.771 -13.655 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -11.732 -5.057 -13.847 1.00 0.00 H new ATOM 0 HG LEU A 32 -12.968 -6.883 -11.909 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -14.181 -8.220 -13.586 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -14.907 -6.609 -13.376 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -13.895 -6.950 -14.799 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -11.755 -8.547 -13.261 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -11.377 -7.290 -14.462 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -10.714 -7.174 -12.815 1.00 0.00 H new ATOM 469 N ASN A 33 -12.536 -2.287 -13.032 1.00 0.00 N ATOM 470 CA ASN A 33 -12.148 -0.941 -13.439 1.00 0.00 C ATOM 471 C ASN A 33 -12.711 0.100 -12.480 1.00 0.00 C ATOM 472 O ASN A 33 -13.512 -0.220 -11.601 1.00 0.00 O ATOM 473 CB ASN A 33 -12.637 -0.657 -14.861 1.00 0.00 C ATOM 474 CG ASN A 33 -11.901 -1.481 -15.900 1.00 0.00 C ATOM 475 OD1 ASN A 33 -12.514 -2.226 -16.665 1.00 0.00 O ATOM 476 ND2 ASN A 33 -10.581 -1.351 -15.932 1.00 0.00 N ATOM 0 H ASN A 33 -13.428 -2.602 -13.413 1.00 0.00 H new ATOM 0 HA ASN A 33 -11.060 -0.880 -13.415 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -13.705 -0.867 -14.924 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -12.507 0.402 -15.082 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -10.033 -1.880 -16.610 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -10.115 -0.722 -15.279 1.00 0.00 H new ATOM 483 N ALA A 34 -12.287 1.348 -12.653 1.00 0.00 N ATOM 484 CA ALA A 34 -12.750 2.438 -11.804 1.00 0.00 C ATOM 485 C ALA A 34 -14.181 2.834 -12.155 1.00 0.00 C ATOM 486 O ALA A 34 -14.501 3.073 -13.320 1.00 0.00 O ATOM 487 CB ALA A 34 -11.823 3.638 -11.929 1.00 0.00 C ATOM 0 H ALA A 34 -11.623 1.629 -13.374 1.00 0.00 H new ATOM 0 HA ALA A 34 -12.737 2.091 -10.771 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -12.182 4.444 -11.289 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -10.816 3.353 -11.623 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -11.805 3.978 -12.965 1.00 0.00 H new ATOM 493 N GLN A 35 -15.037 2.900 -11.140 1.00 0.00 N ATOM 494 CA GLN A 35 -16.435 3.267 -11.339 1.00 0.00 C ATOM 495 C GLN A 35 -16.626 4.787 -11.286 1.00 0.00 C ATOM 496 O GLN A 35 -17.231 5.367 -12.187 1.00 0.00 O ATOM 497 CB GLN A 35 -17.323 2.583 -10.298 1.00 0.00 C ATOM 498 CG GLN A 35 -17.272 1.065 -10.359 1.00 0.00 C ATOM 499 CD GLN A 35 -18.370 0.410 -9.544 1.00 0.00 C ATOM 500 OE1 GLN A 35 -18.165 0.043 -8.386 1.00 0.00 O ATOM 501 NE2 GLN A 35 -19.544 0.260 -10.144 1.00 0.00 N ATOM 0 H GLN A 35 -14.787 2.704 -10.171 1.00 0.00 H new ATOM 0 HA GLN A 35 -16.730 2.926 -12.331 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -17.020 2.909 -9.303 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -18.353 2.910 -10.440 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -17.355 0.744 -11.397 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -16.303 0.723 -9.996 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -19.670 0.579 -11.105 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -20.320 -0.174 -9.644 1.00 0.00 H new ATOM 510 N PRO A 36 -16.114 5.464 -10.233 1.00 0.00 N ATOM 511 CA PRO A 36 -16.248 6.919 -10.100 1.00 0.00 C ATOM 512 C PRO A 36 -15.372 7.674 -11.094 1.00 0.00 C ATOM 513 O PRO A 36 -14.768 7.075 -11.984 1.00 0.00 O ATOM 514 CB PRO A 36 -15.785 7.190 -8.668 1.00 0.00 C ATOM 515 CG PRO A 36 -14.844 6.077 -8.362 1.00 0.00 C ATOM 516 CD PRO A 36 -15.372 4.876 -9.097 1.00 0.00 C ATOM 0 HA PRO A 36 -17.265 7.254 -10.304 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -15.293 8.159 -8.587 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -16.626 7.201 -7.975 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -13.833 6.320 -8.687 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -14.797 5.889 -7.289 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -14.565 4.227 -9.438 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -16.021 4.271 -8.464 1.00 0.00 H new ATOM 524 N GLN A 37 -15.306 8.992 -10.934 1.00 0.00 N ATOM 525 CA GLN A 37 -14.501 9.830 -11.815 1.00 0.00 C ATOM 526 C GLN A 37 -13.119 10.077 -11.217 1.00 0.00 C ATOM 527 O GLN A 37 -12.996 10.582 -10.102 1.00 0.00 O ATOM 528 CB GLN A 37 -15.204 11.166 -12.067 1.00 0.00 C ATOM 529 CG GLN A 37 -16.562 11.021 -12.733 1.00 0.00 C ATOM 530 CD GLN A 37 -16.597 11.620 -14.126 1.00 0.00 C ATOM 531 OE1 GLN A 37 -16.214 12.772 -14.329 1.00 0.00 O ATOM 532 NE2 GLN A 37 -17.063 10.839 -15.093 1.00 0.00 N ATOM 0 H GLN A 37 -15.800 9.503 -10.202 1.00 0.00 H new ATOM 0 HA GLN A 37 -14.381 9.305 -12.763 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -15.328 11.687 -11.118 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -14.566 11.791 -12.693 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -16.824 9.964 -12.790 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -17.319 11.504 -12.115 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -17.370 9.890 -14.879 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -17.114 11.188 -16.050 1.00 0.00 H new ATOM 541 N VAL A 38 -12.082 9.716 -11.967 1.00 0.00 N ATOM 542 CA VAL A 38 -10.708 9.891 -11.510 1.00 0.00 C ATOM 543 C VAL A 38 -10.140 11.228 -11.976 1.00 0.00 C ATOM 544 O VAL A 38 -9.290 11.818 -11.308 1.00 0.00 O ATOM 545 CB VAL A 38 -9.799 8.753 -12.015 1.00 0.00 C ATOM 546 CG1 VAL A 38 -8.461 8.778 -11.295 1.00 0.00 C ATOM 547 CG2 VAL A 38 -10.483 7.406 -11.840 1.00 0.00 C ATOM 0 H VAL A 38 -12.168 9.300 -12.894 1.00 0.00 H new ATOM 0 HA VAL A 38 -10.731 9.870 -10.420 1.00 0.00 H new ATOM 0 HB VAL A 38 -9.615 8.905 -13.078 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -7.833 7.967 -11.665 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -7.967 9.732 -11.478 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -8.622 8.653 -10.224 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -9.826 6.615 -12.202 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -10.700 7.243 -10.784 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -11.413 7.394 -12.408 1.00 0.00 H new ATOM 557 N THR A 39 -10.613 11.699 -13.125 1.00 0.00 N ATOM 558 CA THR A 39 -10.151 12.964 -13.684 1.00 0.00 C ATOM 559 C THR A 39 -10.851 14.143 -13.016 1.00 0.00 C ATOM 560 O THR A 39 -10.401 15.285 -13.122 1.00 0.00 O ATOM 561 CB THR A 39 -10.401 12.999 -15.193 1.00 0.00 C ATOM 562 OG1 THR A 39 -10.113 11.739 -15.775 1.00 0.00 O ATOM 563 CG2 THR A 39 -9.573 14.040 -15.915 1.00 0.00 C ATOM 0 H THR A 39 -11.317 11.223 -13.688 1.00 0.00 H new ATOM 0 HA THR A 39 -9.080 13.046 -13.496 1.00 0.00 H new ATOM 0 HB THR A 39 -11.454 13.257 -15.307 1.00 0.00 H new ATOM 0 HG1 THR A 39 -10.280 11.779 -16.740 1.00 0.00 H new ATOM 0 HG21 THR A 39 -9.800 14.010 -16.981 1.00 0.00 H new ATOM 0 HG22 THR A 39 -9.808 15.029 -15.521 1.00 0.00 H new ATOM 0 HG23 THR A 39 -8.514 13.832 -15.764 1.00 0.00 H new ATOM 571 N MET A 40 -11.952 13.860 -12.329 1.00 0.00 N ATOM 572 CA MET A 40 -12.716 14.898 -11.644 1.00 0.00 C ATOM 573 C MET A 40 -12.322 14.985 -10.173 1.00 0.00 C ATOM 574 O MET A 40 -13.175 15.153 -9.300 1.00 0.00 O ATOM 575 CB MET A 40 -14.216 14.619 -11.770 1.00 0.00 C ATOM 576 CG MET A 40 -15.075 15.868 -11.668 1.00 0.00 C ATOM 577 SD MET A 40 -16.829 15.526 -11.910 1.00 0.00 S ATOM 578 CE MET A 40 -17.561 16.986 -11.175 1.00 0.00 C ATOM 0 H MET A 40 -12.336 12.920 -12.231 1.00 0.00 H new ATOM 0 HA MET A 40 -12.490 15.854 -12.116 1.00 0.00 H new ATOM 0 HB2 MET A 40 -14.408 14.133 -12.726 1.00 0.00 H new ATOM 0 HB3 MET A 40 -14.514 13.918 -10.990 1.00 0.00 H new ATOM 0 HG2 MET A 40 -14.930 16.325 -10.689 1.00 0.00 H new ATOM 0 HG3 MET A 40 -14.744 16.593 -12.411 1.00 0.00 H new ATOM 0 HE1 MET A 40 -18.647 16.924 -11.247 1.00 0.00 H new ATOM 0 HE2 MET A 40 -17.270 17.051 -10.127 1.00 0.00 H new ATOM 0 HE3 MET A 40 -17.213 17.873 -11.704 1.00 0.00 H new ATOM 588 N GLN A 41 -11.024 14.874 -9.905 1.00 0.00 N ATOM 589 CA GLN A 41 -10.516 14.943 -8.539 1.00 0.00 C ATOM 590 C GLN A 41 -9.003 15.136 -8.530 1.00 0.00 C ATOM 591 O GLN A 41 -8.245 14.167 -8.480 1.00 0.00 O ATOM 592 CB GLN A 41 -10.884 13.672 -7.771 1.00 0.00 C ATOM 593 CG GLN A 41 -11.131 13.905 -6.290 1.00 0.00 C ATOM 594 CD GLN A 41 -12.412 13.257 -5.801 1.00 0.00 C ATOM 595 OE1 GLN A 41 -13.215 13.885 -5.113 1.00 0.00 O ATOM 596 NE2 GLN A 41 -12.607 11.992 -6.155 1.00 0.00 N ATOM 0 H GLN A 41 -10.305 14.736 -10.616 1.00 0.00 H new ATOM 0 HA GLN A 41 -10.977 15.801 -8.050 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -11.778 13.235 -8.215 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -10.082 12.943 -7.887 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -10.289 13.512 -5.719 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -11.174 14.977 -6.097 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -11.914 11.510 -6.727 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -13.450 11.503 -5.855 1.00 0.00 H new ATOM 605 N GLN A 42 -8.573 16.395 -8.575 1.00 0.00 N ATOM 606 CA GLN A 42 -7.151 16.727 -8.571 1.00 0.00 C ATOM 607 C GLN A 42 -6.421 16.036 -9.725 1.00 0.00 C ATOM 608 O GLN A 42 -5.943 14.910 -9.580 1.00 0.00 O ATOM 609 CB GLN A 42 -6.514 16.328 -7.237 1.00 0.00 C ATOM 610 CG GLN A 42 -6.611 17.407 -6.171 1.00 0.00 C ATOM 611 CD GLN A 42 -7.331 16.932 -4.924 1.00 0.00 C ATOM 612 OE1 GLN A 42 -8.499 16.549 -4.977 1.00 0.00 O ATOM 613 NE2 GLN A 42 -6.634 16.953 -3.793 1.00 0.00 N ATOM 0 H GLN A 42 -9.192 17.205 -8.615 1.00 0.00 H new ATOM 0 HA GLN A 42 -7.058 17.805 -8.702 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -6.996 15.422 -6.870 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -5.464 16.086 -7.403 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -5.608 17.739 -5.903 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -7.134 18.271 -6.581 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -5.667 17.279 -3.796 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -7.066 16.643 -2.922 1.00 0.00 H new ATOM 622 N PRO A 43 -6.322 16.708 -10.888 1.00 0.00 N ATOM 623 CA PRO A 43 -5.645 16.152 -12.066 1.00 0.00 C ATOM 624 C PRO A 43 -4.240 15.652 -11.747 1.00 0.00 C ATOM 625 O PRO A 43 -3.538 16.233 -10.919 1.00 0.00 O ATOM 626 CB PRO A 43 -5.586 17.334 -13.035 1.00 0.00 C ATOM 627 CG PRO A 43 -6.727 18.206 -12.638 1.00 0.00 C ATOM 628 CD PRO A 43 -6.863 18.056 -11.148 1.00 0.00 C ATOM 0 HA PRO A 43 -6.170 15.284 -12.464 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -4.637 17.864 -12.956 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -5.681 17.003 -14.069 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -6.538 19.244 -12.910 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -7.643 17.905 -13.146 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -6.302 18.824 -10.614 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -7.902 18.140 -10.829 1.00 0.00 H new ATOM 636 N ALA A 44 -3.839 14.570 -12.405 1.00 0.00 N ATOM 637 CA ALA A 44 -2.521 13.985 -12.186 1.00 0.00 C ATOM 638 C ALA A 44 -1.465 14.670 -13.048 1.00 0.00 C ATOM 639 O ALA A 44 -1.175 14.228 -14.160 1.00 0.00 O ATOM 640 CB ALA A 44 -2.553 12.491 -12.472 1.00 0.00 C ATOM 0 H ALA A 44 -4.408 14.080 -13.095 1.00 0.00 H new ATOM 0 HA ALA A 44 -2.252 14.138 -11.141 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -1.563 12.067 -12.305 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -3.271 12.009 -11.809 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -2.848 12.325 -13.508 1.00 0.00 H new ATOM 646 N VAL A 45 -0.892 15.748 -12.525 1.00 0.00 N ATOM 647 CA VAL A 45 0.137 16.491 -13.239 1.00 0.00 C ATOM 648 C VAL A 45 1.517 16.210 -12.650 1.00 0.00 C ATOM 649 O VAL A 45 1.700 15.244 -11.910 1.00 0.00 O ATOM 650 CB VAL A 45 -0.132 18.007 -13.194 1.00 0.00 C ATOM 651 CG1 VAL A 45 -1.203 18.390 -14.205 1.00 0.00 C ATOM 652 CG2 VAL A 45 -0.533 18.438 -11.791 1.00 0.00 C ATOM 0 H VAL A 45 -1.124 16.127 -11.607 1.00 0.00 H new ATOM 0 HA VAL A 45 0.111 16.159 -14.277 1.00 0.00 H new ATOM 0 HB VAL A 45 0.788 18.528 -13.459 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -1.379 19.465 -14.159 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -0.870 18.120 -15.207 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -2.127 17.860 -13.974 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -0.719 19.512 -11.779 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -1.439 17.910 -11.493 1.00 0.00 H new ATOM 0 HG23 VAL A 45 0.271 18.201 -11.094 1.00 0.00 H new ATOM 662 N HIS A 46 2.483 17.062 -12.979 1.00 0.00 N ATOM 663 CA HIS A 46 3.843 16.906 -12.475 1.00 0.00 C ATOM 664 C HIS A 46 3.957 17.441 -11.050 1.00 0.00 C ATOM 665 O HIS A 46 4.539 18.500 -10.818 1.00 0.00 O ATOM 666 CB HIS A 46 4.834 17.633 -13.387 1.00 0.00 C ATOM 667 CG HIS A 46 5.457 16.751 -14.423 1.00 0.00 C ATOM 668 ND1 HIS A 46 6.797 16.443 -14.389 1.00 0.00 N ATOM 669 CD2 HIS A 46 4.890 16.140 -15.492 1.00 0.00 C ATOM 670 CE1 HIS A 46 7.016 15.658 -15.429 1.00 0.00 C ATOM 671 NE2 HIS A 46 5.889 15.449 -16.126 1.00 0.00 N ATOM 0 H HIS A 46 2.350 17.867 -13.592 1.00 0.00 H new ATOM 0 HA HIS A 46 4.083 15.843 -12.466 1.00 0.00 H new ATOM 0 HB2 HIS A 46 4.320 18.456 -13.884 1.00 0.00 H new ATOM 0 HB3 HIS A 46 5.622 18.073 -12.775 1.00 0.00 H new ATOM 0 HD2 HIS A 46 3.852 16.188 -15.787 1.00 0.00 H new ATOM 0 HE1 HIS A 46 7.978 15.239 -15.685 1.00 0.00 H new ATOM 0 HE2 HIS A 46 5.794 14.883 -16.969 1.00 0.00 H new ATOM 679 N VAL A 47 3.392 16.701 -10.099 1.00 0.00 N ATOM 680 CA VAL A 47 3.424 17.102 -8.698 1.00 0.00 C ATOM 681 C VAL A 47 4.457 16.299 -7.915 1.00 0.00 C ATOM 682 O VAL A 47 5.026 15.333 -8.426 1.00 0.00 O ATOM 683 CB VAL A 47 2.045 16.931 -8.033 1.00 0.00 C ATOM 684 CG1 VAL A 47 1.053 17.942 -8.588 1.00 0.00 C ATOM 685 CG2 VAL A 47 1.533 15.511 -8.220 1.00 0.00 C ATOM 0 H VAL A 47 2.907 15.821 -10.275 1.00 0.00 H new ATOM 0 HA VAL A 47 3.701 18.156 -8.680 1.00 0.00 H new ATOM 0 HB VAL A 47 2.154 17.115 -6.964 1.00 0.00 H new ATOM 0 HG11 VAL A 47 0.085 17.805 -8.106 1.00 0.00 H new ATOM 0 HG12 VAL A 47 1.415 18.952 -8.394 1.00 0.00 H new ATOM 0 HG13 VAL A 47 0.947 17.795 -9.663 1.00 0.00 H new ATOM 0 HG21 VAL A 47 0.558 15.410 -7.743 1.00 0.00 H new ATOM 0 HG22 VAL A 47 1.441 15.295 -9.284 1.00 0.00 H new ATOM 0 HG23 VAL A 47 2.233 14.809 -7.766 1.00 0.00 H new ATOM 695 N GLN A 48 4.691 16.704 -6.670 1.00 0.00 N ATOM 696 CA GLN A 48 5.653 16.025 -5.809 1.00 0.00 C ATOM 697 C GLN A 48 5.021 14.801 -5.149 1.00 0.00 C ATOM 698 O GLN A 48 4.142 14.161 -5.727 1.00 0.00 O ATOM 699 CB GLN A 48 6.176 16.991 -4.743 1.00 0.00 C ATOM 700 CG GLN A 48 7.693 17.048 -4.667 1.00 0.00 C ATOM 701 CD GLN A 48 8.217 18.464 -4.528 1.00 0.00 C ATOM 702 OE1 GLN A 48 8.079 19.090 -3.477 1.00 0.00 O ATOM 703 NE2 GLN A 48 8.824 18.976 -5.593 1.00 0.00 N ATOM 0 H GLN A 48 4.226 17.501 -6.235 1.00 0.00 H new ATOM 0 HA GLN A 48 6.488 15.688 -6.423 1.00 0.00 H new ATOM 0 HB2 GLN A 48 5.793 17.990 -4.950 1.00 0.00 H new ATOM 0 HB3 GLN A 48 5.782 16.694 -3.771 1.00 0.00 H new ATOM 0 HG2 GLN A 48 8.033 16.454 -3.819 1.00 0.00 H new ATOM 0 HG3 GLN A 48 8.115 16.595 -5.564 1.00 0.00 H new ATOM 0 HE21 GLN A 48 8.916 18.421 -6.444 1.00 0.00 H new ATOM 0 HE22 GLN A 48 9.198 19.924 -5.560 1.00 0.00 H new ATOM 712 N GLY A 49 5.466 14.484 -3.934 1.00 0.00 N ATOM 713 CA GLY A 49 4.927 13.339 -3.224 1.00 0.00 C ATOM 714 C GLY A 49 3.517 13.582 -2.725 1.00 0.00 C ATOM 715 O GLY A 49 3.277 14.507 -1.950 1.00 0.00 O ATOM 0 H GLY A 49 6.188 14.999 -3.431 1.00 0.00 H new ATOM 0 HA2 GLY A 49 4.932 12.471 -3.883 1.00 0.00 H new ATOM 0 HA3 GLY A 49 5.573 13.102 -2.379 1.00 0.00 H new ATOM 719 N GLN A 50 2.582 12.752 -3.178 1.00 0.00 N ATOM 720 CA GLN A 50 1.183 12.889 -2.787 1.00 0.00 C ATOM 721 C GLN A 50 0.836 11.946 -1.638 1.00 0.00 C ATOM 722 O GLN A 50 1.634 11.086 -1.264 1.00 0.00 O ATOM 723 CB GLN A 50 0.270 12.610 -3.984 1.00 0.00 C ATOM 724 CG GLN A 50 0.716 11.428 -4.829 1.00 0.00 C ATOM 725 CD GLN A 50 -0.293 11.063 -5.898 1.00 0.00 C ATOM 726 OE1 GLN A 50 -0.851 9.965 -5.893 1.00 0.00 O ATOM 727 NE2 GLN A 50 -0.537 11.986 -6.822 1.00 0.00 N ATOM 0 H GLN A 50 2.768 11.978 -3.816 1.00 0.00 H new ATOM 0 HA GLN A 50 1.028 13.913 -2.447 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -0.742 12.426 -3.623 1.00 0.00 H new ATOM 0 HB3 GLN A 50 0.228 13.499 -4.613 1.00 0.00 H new ATOM 0 HG2 GLN A 50 1.670 11.663 -5.300 1.00 0.00 H new ATOM 0 HG3 GLN A 50 0.883 10.566 -4.183 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -0.052 12.883 -6.788 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -1.210 11.798 -7.565 1.00 0.00 H new ATOM 736 N GLU A 51 -0.361 12.120 -1.086 1.00 0.00 N ATOM 737 CA GLU A 51 -0.828 11.289 0.017 1.00 0.00 C ATOM 738 C GLU A 51 -0.997 9.836 -0.429 1.00 0.00 C ATOM 739 O GLU A 51 -1.111 9.559 -1.623 1.00 0.00 O ATOM 740 CB GLU A 51 -2.157 11.830 0.552 1.00 0.00 C ATOM 741 CG GLU A 51 -3.169 12.144 -0.539 1.00 0.00 C ATOM 742 CD GLU A 51 -4.361 11.208 -0.515 1.00 0.00 C ATOM 743 OE1 GLU A 51 -4.274 10.120 -1.120 1.00 0.00 O ATOM 744 OE2 GLU A 51 -5.383 11.565 0.108 1.00 0.00 O ATOM 0 H GLU A 51 -1.027 12.832 -1.386 1.00 0.00 H new ATOM 0 HA GLU A 51 -0.081 11.319 0.810 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -2.588 11.100 1.237 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -1.966 12.734 1.130 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -3.516 13.171 -0.423 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -2.681 12.080 -1.512 1.00 0.00 H new ATOM 751 N PRO A 52 -1.009 8.878 0.522 1.00 0.00 N ATOM 752 CA PRO A 52 -0.885 9.149 1.956 1.00 0.00 C ATOM 753 C PRO A 52 0.567 9.177 2.427 1.00 0.00 C ATOM 754 O PRO A 52 1.480 9.422 1.639 1.00 0.00 O ATOM 755 CB PRO A 52 -1.625 7.967 2.572 1.00 0.00 C ATOM 756 CG PRO A 52 -1.368 6.834 1.634 1.00 0.00 C ATOM 757 CD PRO A 52 -1.175 7.436 0.261 1.00 0.00 C ATOM 0 HA PRO A 52 -1.280 10.126 2.233 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -1.255 7.745 3.573 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -2.692 8.171 2.665 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -0.484 6.274 1.938 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -2.204 6.135 1.635 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -0.301 7.018 -0.239 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -2.033 7.243 -0.383 1.00 0.00 H new ATOM 765 N LEU A 53 0.769 8.919 3.716 1.00 0.00 N ATOM 766 CA LEU A 53 2.107 8.909 4.297 1.00 0.00 C ATOM 767 C LEU A 53 2.911 7.719 3.785 1.00 0.00 C ATOM 768 O LEU A 53 2.345 6.684 3.430 1.00 0.00 O ATOM 769 CB LEU A 53 2.019 8.850 5.824 1.00 0.00 C ATOM 770 CG LEU A 53 2.977 9.785 6.569 1.00 0.00 C ATOM 771 CD1 LEU A 53 2.267 11.065 6.973 1.00 0.00 C ATOM 772 CD2 LEU A 53 3.556 9.096 7.795 1.00 0.00 C ATOM 0 H LEU A 53 0.021 8.714 4.379 1.00 0.00 H new ATOM 0 HA LEU A 53 2.613 9.827 3.999 1.00 0.00 H new ATOM 0 HB2 LEU A 53 0.998 9.089 6.123 1.00 0.00 H new ATOM 0 HB3 LEU A 53 2.214 7.826 6.144 1.00 0.00 H new ATOM 0 HG LEU A 53 3.796 10.038 5.895 1.00 0.00 H new ATOM 0 HD11 LEU A 53 2.964 11.716 7.501 1.00 0.00 H new ATOM 0 HD12 LEU A 53 1.899 11.574 6.082 1.00 0.00 H new ATOM 0 HD13 LEU A 53 1.428 10.825 7.627 1.00 0.00 H new ATOM 0 HD21 LEU A 53 4.234 9.778 8.309 1.00 0.00 H new ATOM 0 HD22 LEU A 53 2.747 8.811 8.468 1.00 0.00 H new ATOM 0 HD23 LEU A 53 4.103 8.205 7.487 1.00 0.00 H new ATOM 784 N THR A 54 4.231 7.874 3.739 1.00 0.00 N ATOM 785 CA THR A 54 5.110 6.806 3.280 1.00 0.00 C ATOM 786 C THR A 54 6.545 7.068 3.707 1.00 0.00 C ATOM 787 O THR A 54 6.830 8.055 4.388 1.00 0.00 O ATOM 788 CB THR A 54 5.044 6.664 1.758 1.00 0.00 C ATOM 789 OG1 THR A 54 3.906 7.326 1.234 1.00 0.00 O ATOM 790 CG2 THR A 54 4.994 5.225 1.299 1.00 0.00 C ATOM 0 H THR A 54 4.714 8.729 4.014 1.00 0.00 H new ATOM 0 HA THR A 54 4.769 5.877 3.736 1.00 0.00 H new ATOM 0 HB THR A 54 5.962 7.118 1.386 1.00 0.00 H new ATOM 0 HG1 THR A 54 3.887 7.222 0.260 1.00 0.00 H new ATOM 0 HG21 THR A 54 4.948 5.192 0.210 1.00 0.00 H new ATOM 0 HG22 THR A 54 5.888 4.703 1.641 1.00 0.00 H new ATOM 0 HG23 THR A 54 4.110 4.741 1.714 1.00 0.00 H new ATOM 798 N ALA A 55 7.448 6.186 3.293 1.00 0.00 N ATOM 799 CA ALA A 55 8.861 6.320 3.627 1.00 0.00 C ATOM 800 C ALA A 55 9.368 7.722 3.311 1.00 0.00 C ATOM 801 O ALA A 55 10.174 8.281 4.053 1.00 0.00 O ATOM 802 CB ALA A 55 9.683 5.283 2.883 1.00 0.00 C ATOM 0 H ALA A 55 7.226 5.369 2.724 1.00 0.00 H new ATOM 0 HA ALA A 55 8.971 6.152 4.698 1.00 0.00 H new ATOM 0 HB1 ALA A 55 10.735 5.397 3.144 1.00 0.00 H new ATOM 0 HB2 ALA A 55 9.347 4.284 3.161 1.00 0.00 H new ATOM 0 HB3 ALA A 55 9.558 5.422 1.809 1.00 0.00 H new ATOM 808 N SER A 56 8.887 8.283 2.205 1.00 0.00 N ATOM 809 CA SER A 56 9.280 9.626 1.797 1.00 0.00 C ATOM 810 C SER A 56 8.873 10.645 2.854 1.00 0.00 C ATOM 811 O SER A 56 9.659 11.517 3.225 1.00 0.00 O ATOM 812 CB SER A 56 8.643 9.981 0.453 1.00 0.00 C ATOM 813 OG SER A 56 8.739 8.901 -0.460 1.00 0.00 O ATOM 0 H SER A 56 8.225 7.828 1.576 1.00 0.00 H new ATOM 0 HA SER A 56 10.364 9.649 1.689 1.00 0.00 H new ATOM 0 HB2 SER A 56 7.595 10.243 0.602 1.00 0.00 H new ATOM 0 HB3 SER A 56 9.135 10.859 0.035 1.00 0.00 H new ATOM 0 HG SER A 56 8.323 9.154 -1.310 1.00 0.00 H new ATOM 819 N MET A 57 7.643 10.520 3.345 1.00 0.00 N ATOM 820 CA MET A 57 7.138 11.411 4.381 1.00 0.00 C ATOM 821 C MET A 57 8.001 11.300 5.632 1.00 0.00 C ATOM 822 O MET A 57 8.350 12.303 6.254 1.00 0.00 O ATOM 823 CB MET A 57 5.688 11.066 4.727 1.00 0.00 C ATOM 824 CG MET A 57 4.665 11.534 3.698 1.00 0.00 C ATOM 825 SD MET A 57 5.377 11.853 2.073 1.00 0.00 S ATOM 826 CE MET A 57 5.181 10.250 1.298 1.00 0.00 C ATOM 0 H MET A 57 6.978 9.809 3.041 1.00 0.00 H new ATOM 0 HA MET A 57 7.177 12.433 4.004 1.00 0.00 H new ATOM 0 HB2 MET A 57 5.602 9.985 4.841 1.00 0.00 H new ATOM 0 HB3 MET A 57 5.443 11.509 5.692 1.00 0.00 H new ATOM 0 HG2 MET A 57 3.885 10.778 3.603 1.00 0.00 H new ATOM 0 HG3 MET A 57 4.185 12.443 4.061 1.00 0.00 H new ATOM 0 HE1 MET A 57 5.510 10.305 0.260 1.00 0.00 H new ATOM 0 HE2 MET A 57 5.781 9.512 1.831 1.00 0.00 H new ATOM 0 HE3 MET A 57 4.132 9.956 1.330 1.00 0.00 H new ATOM 836 N LEU A 58 8.340 10.066 5.983 1.00 0.00 N ATOM 837 CA LEU A 58 9.173 9.794 7.146 1.00 0.00 C ATOM 838 C LEU A 58 10.520 10.490 7.015 1.00 0.00 C ATOM 839 O LEU A 58 11.006 11.116 7.957 1.00 0.00 O ATOM 840 CB LEU A 58 9.388 8.284 7.288 1.00 0.00 C ATOM 841 CG LEU A 58 8.199 7.467 7.817 1.00 0.00 C ATOM 842 CD1 LEU A 58 6.996 8.350 8.127 1.00 0.00 C ATOM 843 CD2 LEU A 58 7.827 6.388 6.812 1.00 0.00 C ATOM 0 H LEU A 58 8.048 9.232 5.474 1.00 0.00 H new ATOM 0 HA LEU A 58 8.666 10.176 8.032 1.00 0.00 H new ATOM 0 HB2 LEU A 58 9.668 7.886 6.312 1.00 0.00 H new ATOM 0 HB3 LEU A 58 10.236 8.122 7.953 1.00 0.00 H new ATOM 0 HG LEU A 58 8.503 6.998 8.753 1.00 0.00 H new ATOM 0 HD11 LEU A 58 6.178 7.733 8.498 1.00 0.00 H new ATOM 0 HD12 LEU A 58 7.269 9.084 8.885 1.00 0.00 H new ATOM 0 HD13 LEU A 58 6.679 8.865 7.220 1.00 0.00 H new ATOM 0 HD21 LEU A 58 6.983 5.812 7.192 1.00 0.00 H new ATOM 0 HD22 LEU A 58 7.552 6.852 5.865 1.00 0.00 H new ATOM 0 HD23 LEU A 58 8.679 5.726 6.657 1.00 0.00 H new ATOM 855 N ALA A 59 11.123 10.364 5.837 1.00 0.00 N ATOM 856 CA ALA A 59 12.420 10.973 5.568 1.00 0.00 C ATOM 857 C ALA A 59 12.302 12.489 5.455 1.00 0.00 C ATOM 858 O ALA A 59 13.309 13.197 5.401 1.00 0.00 O ATOM 859 CB ALA A 59 13.023 10.391 4.299 1.00 0.00 C ATOM 0 H ALA A 59 10.732 9.844 5.051 1.00 0.00 H new ATOM 0 HA ALA A 59 13.080 10.749 6.406 1.00 0.00 H new ATOM 0 HB1 ALA A 59 13.991 10.855 4.110 1.00 0.00 H new ATOM 0 HB2 ALA A 59 13.153 9.315 4.418 1.00 0.00 H new ATOM 0 HB3 ALA A 59 12.358 10.585 3.458 1.00 0.00 H new ATOM 865 N SER A 60 11.068 12.981 5.412 1.00 0.00 N ATOM 866 CA SER A 60 10.821 14.415 5.308 1.00 0.00 C ATOM 867 C SER A 60 10.946 15.086 6.671 1.00 0.00 C ATOM 868 O SER A 60 10.928 16.312 6.775 1.00 0.00 O ATOM 869 CB SER A 60 9.431 14.675 4.723 1.00 0.00 C ATOM 870 OG SER A 60 9.298 16.022 4.304 1.00 0.00 O ATOM 0 H SER A 60 10.224 12.409 5.448 1.00 0.00 H new ATOM 0 HA SER A 60 11.571 14.841 4.642 1.00 0.00 H new ATOM 0 HB2 SER A 60 9.258 14.009 3.877 1.00 0.00 H new ATOM 0 HB3 SER A 60 8.670 14.446 5.469 1.00 0.00 H new ATOM 0 HG SER A 60 9.818 16.602 4.898 1.00 0.00 H new ATOM 876 N ALA A 61 11.077 14.270 7.713 1.00 0.00 N ATOM 877 CA ALA A 61 11.211 14.780 9.073 1.00 0.00 C ATOM 878 C ALA A 61 12.338 14.065 9.820 1.00 0.00 C ATOM 879 O ALA A 61 12.104 13.438 10.854 1.00 0.00 O ATOM 880 CB ALA A 61 9.894 14.625 9.821 1.00 0.00 C ATOM 0 H ALA A 61 11.093 13.253 7.641 1.00 0.00 H new ATOM 0 HA ALA A 61 11.465 15.839 9.018 1.00 0.00 H new ATOM 0 HB1 ALA A 61 10.004 15.009 10.835 1.00 0.00 H new ATOM 0 HB2 ALA A 61 9.114 15.184 9.304 1.00 0.00 H new ATOM 0 HB3 ALA A 61 9.619 13.571 9.860 1.00 0.00 H new ATOM 886 N PRO A 62 13.585 14.152 9.311 1.00 0.00 N ATOM 887 CA PRO A 62 14.739 13.487 9.930 1.00 0.00 C ATOM 888 C PRO A 62 14.891 13.809 11.425 1.00 0.00 C ATOM 889 O PRO A 62 14.992 12.893 12.242 1.00 0.00 O ATOM 890 CB PRO A 62 15.934 14.007 9.128 1.00 0.00 C ATOM 891 CG PRO A 62 15.364 14.385 7.804 1.00 0.00 C ATOM 892 CD PRO A 62 13.962 14.865 8.073 1.00 0.00 C ATOM 0 HA PRO A 62 14.637 12.402 9.901 1.00 0.00 H new ATOM 0 HB2 PRO A 62 16.398 14.863 9.618 1.00 0.00 H new ATOM 0 HB3 PRO A 62 16.704 13.243 9.024 1.00 0.00 H new ATOM 0 HG2 PRO A 62 15.960 15.167 7.332 1.00 0.00 H new ATOM 0 HG3 PRO A 62 15.360 13.533 7.124 1.00 0.00 H new ATOM 0 HD2 PRO A 62 13.927 15.946 8.206 1.00 0.00 H new ATOM 0 HD3 PRO A 62 13.290 14.623 7.250 1.00 0.00 H new ATOM 900 N PRO A 63 14.899 15.103 11.819 1.00 0.00 N ATOM 901 CA PRO A 63 15.048 15.494 13.213 1.00 0.00 C ATOM 902 C PRO A 63 13.709 15.736 13.900 1.00 0.00 C ATOM 903 O PRO A 63 13.650 16.366 14.957 1.00 0.00 O ATOM 904 CB PRO A 63 15.825 16.800 13.090 1.00 0.00 C ATOM 905 CG PRO A 63 15.333 17.417 11.818 1.00 0.00 C ATOM 906 CD PRO A 63 14.796 16.294 10.955 1.00 0.00 C ATOM 0 HA PRO A 63 15.532 14.727 13.817 1.00 0.00 H new ATOM 0 HB2 PRO A 63 15.641 17.452 13.944 1.00 0.00 H new ATOM 0 HB3 PRO A 63 16.899 16.620 13.053 1.00 0.00 H new ATOM 0 HG2 PRO A 63 14.554 18.151 12.023 1.00 0.00 H new ATOM 0 HG3 PRO A 63 16.140 17.942 11.308 1.00 0.00 H new ATOM 0 HD2 PRO A 63 13.766 16.480 10.652 1.00 0.00 H new ATOM 0 HD3 PRO A 63 15.380 16.177 10.042 1.00 0.00 H new ATOM 914 N GLN A 64 12.634 15.246 13.289 1.00 0.00 N ATOM 915 CA GLN A 64 11.296 15.436 13.838 1.00 0.00 C ATOM 916 C GLN A 64 10.559 14.107 13.997 1.00 0.00 C ATOM 917 O GLN A 64 10.694 13.432 15.018 1.00 0.00 O ATOM 918 CB GLN A 64 10.488 16.381 12.945 1.00 0.00 C ATOM 919 CG GLN A 64 11.262 17.613 12.505 1.00 0.00 C ATOM 920 CD GLN A 64 10.396 18.857 12.447 1.00 0.00 C ATOM 921 OE1 GLN A 64 9.946 19.363 13.476 1.00 0.00 O ATOM 922 NE2 GLN A 64 10.160 19.359 11.240 1.00 0.00 N ATOM 0 H GLN A 64 12.663 14.717 12.417 1.00 0.00 H new ATOM 0 HA GLN A 64 11.404 15.879 14.828 1.00 0.00 H new ATOM 0 HB2 GLN A 64 10.155 15.836 12.061 1.00 0.00 H new ATOM 0 HB3 GLN A 64 9.593 16.697 13.481 1.00 0.00 H new ATOM 0 HG2 GLN A 64 12.089 17.783 13.194 1.00 0.00 H new ATOM 0 HG3 GLN A 64 11.698 17.432 11.522 1.00 0.00 H new ATOM 0 HE21 GLN A 64 10.553 18.907 10.414 1.00 0.00 H new ATOM 0 HE22 GLN A 64 9.586 20.196 11.139 1.00 0.00 H new ATOM 931 N GLU A 65 9.759 13.750 12.994 1.00 0.00 N ATOM 932 CA GLU A 65 8.964 12.530 13.047 1.00 0.00 C ATOM 933 C GLU A 65 9.523 11.452 12.123 1.00 0.00 C ATOM 934 O GLU A 65 8.766 10.715 11.491 1.00 0.00 O ATOM 935 CB GLU A 65 7.514 12.834 12.661 1.00 0.00 C ATOM 936 CG GLU A 65 7.204 14.318 12.547 1.00 0.00 C ATOM 937 CD GLU A 65 6.273 14.808 13.638 1.00 0.00 C ATOM 938 OE1 GLU A 65 5.217 14.175 13.845 1.00 0.00 O ATOM 939 OE2 GLU A 65 6.601 15.824 14.287 1.00 0.00 O ATOM 0 H GLU A 65 9.646 14.290 12.136 1.00 0.00 H new ATOM 0 HA GLU A 65 9.004 12.153 14.069 1.00 0.00 H new ATOM 0 HB2 GLU A 65 7.294 12.353 11.708 1.00 0.00 H new ATOM 0 HB3 GLU A 65 6.850 12.390 13.403 1.00 0.00 H new ATOM 0 HG2 GLU A 65 8.135 14.883 12.589 1.00 0.00 H new ATOM 0 HG3 GLU A 65 6.754 14.517 11.575 1.00 0.00 H new ATOM 946 N GLN A 66 10.845 11.352 12.051 1.00 0.00 N ATOM 947 CA GLN A 66 11.483 10.348 11.208 1.00 0.00 C ATOM 948 C GLN A 66 11.071 8.946 11.642 1.00 0.00 C ATOM 949 O GLN A 66 10.643 8.131 10.826 1.00 0.00 O ATOM 950 CB GLN A 66 13.004 10.484 11.268 1.00 0.00 C ATOM 951 CG GLN A 66 13.683 10.231 9.934 1.00 0.00 C ATOM 952 CD GLN A 66 15.047 9.589 10.085 1.00 0.00 C ATOM 953 OE1 GLN A 66 16.072 10.204 9.792 1.00 0.00 O ATOM 954 NE2 GLN A 66 15.067 8.343 10.546 1.00 0.00 N ATOM 0 H GLN A 66 11.493 11.950 12.563 1.00 0.00 H new ATOM 0 HA GLN A 66 11.156 10.510 10.181 1.00 0.00 H new ATOM 0 HB2 GLN A 66 13.259 11.486 11.613 1.00 0.00 H new ATOM 0 HB3 GLN A 66 13.396 9.784 12.006 1.00 0.00 H new ATOM 0 HG2 GLN A 66 13.049 9.588 9.324 1.00 0.00 H new ATOM 0 HG3 GLN A 66 13.787 11.175 9.399 1.00 0.00 H new ATOM 0 HE21 GLN A 66 14.193 7.870 10.777 1.00 0.00 H new ATOM 0 HE22 GLN A 66 15.956 7.859 10.669 1.00 0.00 H new ATOM 963 N LYS A 67 11.193 8.681 12.938 1.00 0.00 N ATOM 964 CA LYS A 67 10.821 7.389 13.497 1.00 0.00 C ATOM 965 C LYS A 67 9.727 7.554 14.544 1.00 0.00 C ATOM 966 O LYS A 67 9.728 6.876 15.574 1.00 0.00 O ATOM 967 CB LYS A 67 12.041 6.708 14.120 1.00 0.00 C ATOM 968 CG LYS A 67 13.252 6.667 13.203 1.00 0.00 C ATOM 969 CD LYS A 67 14.047 5.385 13.388 1.00 0.00 C ATOM 970 CE LYS A 67 15.520 5.591 13.081 1.00 0.00 C ATOM 971 NZ LYS A 67 16.290 4.320 13.172 1.00 0.00 N ATOM 0 H LYS A 67 11.548 9.348 13.623 1.00 0.00 H new ATOM 0 HA LYS A 67 10.441 6.763 12.689 1.00 0.00 H new ATOM 0 HB2 LYS A 67 12.309 7.231 15.038 1.00 0.00 H new ATOM 0 HB3 LYS A 67 11.774 5.689 14.400 1.00 0.00 H new ATOM 0 HG2 LYS A 67 12.927 6.749 12.166 1.00 0.00 H new ATOM 0 HG3 LYS A 67 13.892 7.526 13.405 1.00 0.00 H new ATOM 0 HD2 LYS A 67 13.934 5.031 14.413 1.00 0.00 H new ATOM 0 HD3 LYS A 67 13.644 4.609 12.737 1.00 0.00 H new ATOM 0 HE2 LYS A 67 15.627 6.009 12.080 1.00 0.00 H new ATOM 0 HE3 LYS A 67 15.937 6.319 13.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 17.290 4.504 12.955 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 16.209 3.933 14.134 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 15.909 3.634 12.490 1.00 0.00 H new ATOM 985 N GLN A 68 8.793 8.463 14.278 1.00 0.00 N ATOM 986 CA GLN A 68 7.701 8.733 15.205 1.00 0.00 C ATOM 987 C GLN A 68 6.347 8.649 14.508 1.00 0.00 C ATOM 988 O GLN A 68 5.471 7.889 14.923 1.00 0.00 O ATOM 989 CB GLN A 68 7.877 10.115 15.833 1.00 0.00 C ATOM 990 CG GLN A 68 6.886 10.410 16.946 1.00 0.00 C ATOM 991 CD GLN A 68 7.192 11.706 17.674 1.00 0.00 C ATOM 992 OE1 GLN A 68 8.049 12.482 17.251 1.00 0.00 O ATOM 993 NE2 GLN A 68 6.489 11.945 18.774 1.00 0.00 N ATOM 0 H GLN A 68 8.772 9.025 13.427 1.00 0.00 H new ATOM 0 HA GLN A 68 7.728 7.973 15.986 1.00 0.00 H new ATOM 0 HB2 GLN A 68 8.889 10.199 16.228 1.00 0.00 H new ATOM 0 HB3 GLN A 68 7.774 10.873 15.057 1.00 0.00 H new ATOM 0 HG2 GLN A 68 5.881 10.462 16.528 1.00 0.00 H new ATOM 0 HG3 GLN A 68 6.892 9.587 17.660 1.00 0.00 H new ATOM 0 HE21 GLN A 68 5.788 11.273 19.088 1.00 0.00 H new ATOM 0 HE22 GLN A 68 6.649 12.800 19.306 1.00 0.00 H new ATOM 1002 N MET A 69 6.179 9.433 13.446 1.00 0.00 N ATOM 1003 CA MET A 69 4.919 9.463 12.708 1.00 0.00 C ATOM 1004 C MET A 69 4.743 8.218 11.840 1.00 0.00 C ATOM 1005 O MET A 69 3.743 8.083 11.135 1.00 0.00 O ATOM 1006 CB MET A 69 4.849 10.719 11.836 1.00 0.00 C ATOM 1007 CG MET A 69 5.819 10.708 10.667 1.00 0.00 C ATOM 1008 SD MET A 69 5.274 11.753 9.303 1.00 0.00 S ATOM 1009 CE MET A 69 6.812 12.561 8.866 1.00 0.00 C ATOM 0 H MET A 69 6.898 10.055 13.078 1.00 0.00 H new ATOM 0 HA MET A 69 4.109 9.480 13.438 1.00 0.00 H new ATOM 0 HB2 MET A 69 3.834 10.828 11.453 1.00 0.00 H new ATOM 0 HB3 MET A 69 5.051 11.592 12.456 1.00 0.00 H new ATOM 0 HG2 MET A 69 6.798 11.045 11.009 1.00 0.00 H new ATOM 0 HG3 MET A 69 5.940 9.685 10.310 1.00 0.00 H new ATOM 0 HE1 MET A 69 6.711 13.030 7.887 1.00 0.00 H new ATOM 0 HE2 MET A 69 7.048 13.322 9.610 1.00 0.00 H new ATOM 0 HE3 MET A 69 7.614 11.824 8.834 1.00 0.00 H new ATOM 1019 N LEU A 70 5.712 7.310 11.898 1.00 0.00 N ATOM 1020 CA LEU A 70 5.656 6.085 11.102 1.00 0.00 C ATOM 1021 C LEU A 70 4.495 5.190 11.526 1.00 0.00 C ATOM 1022 O LEU A 70 3.835 4.581 10.686 1.00 0.00 O ATOM 1023 CB LEU A 70 6.964 5.289 11.200 1.00 0.00 C ATOM 1024 CG LEU A 70 7.888 5.625 12.380 1.00 0.00 C ATOM 1025 CD1 LEU A 70 7.138 5.592 13.705 1.00 0.00 C ATOM 1026 CD2 LEU A 70 9.054 4.653 12.419 1.00 0.00 C ATOM 0 H LEU A 70 6.542 7.397 12.484 1.00 0.00 H new ATOM 0 HA LEU A 70 5.504 6.397 10.069 1.00 0.00 H new ATOM 0 HB2 LEU A 70 6.714 4.229 11.254 1.00 0.00 H new ATOM 0 HB3 LEU A 70 7.523 5.438 10.276 1.00 0.00 H new ATOM 0 HG LEU A 70 8.263 6.638 12.233 1.00 0.00 H new ATOM 0 HD11 LEU A 70 7.823 5.835 14.517 1.00 0.00 H new ATOM 0 HD12 LEU A 70 6.329 6.322 13.683 1.00 0.00 H new ATOM 0 HD13 LEU A 70 6.725 4.596 13.864 1.00 0.00 H new ATOM 0 HD21 LEU A 70 9.704 4.898 13.259 1.00 0.00 H new ATOM 0 HD22 LEU A 70 8.677 3.637 12.537 1.00 0.00 H new ATOM 0 HD23 LEU A 70 9.619 4.725 11.490 1.00 0.00 H new ATOM 1038 N GLY A 71 4.276 5.074 12.831 1.00 0.00 N ATOM 1039 CA GLY A 71 3.205 4.228 13.318 1.00 0.00 C ATOM 1040 C GLY A 71 2.374 4.902 14.393 1.00 0.00 C ATOM 1041 O GLY A 71 1.769 4.231 15.231 1.00 0.00 O ATOM 0 H GLY A 71 4.817 5.547 13.555 1.00 0.00 H new ATOM 0 HA2 GLY A 71 2.559 3.950 12.485 1.00 0.00 H new ATOM 0 HA3 GLY A 71 3.628 3.305 13.715 1.00 0.00 H new ATOM 1045 N GLU A 72 2.335 6.230 14.361 1.00 0.00 N ATOM 1046 CA GLU A 72 1.568 6.998 15.335 1.00 0.00 C ATOM 1047 C GLU A 72 0.846 8.163 14.663 1.00 0.00 C ATOM 1048 O GLU A 72 0.065 8.874 15.295 1.00 0.00 O ATOM 1049 CB GLU A 72 2.494 7.502 16.450 1.00 0.00 C ATOM 1050 CG GLU A 72 2.943 8.951 16.295 1.00 0.00 C ATOM 1051 CD GLU A 72 2.801 9.744 17.579 1.00 0.00 C ATOM 1052 OE1 GLU A 72 3.465 9.387 18.574 1.00 0.00 O ATOM 1053 OE2 GLU A 72 2.025 10.723 17.590 1.00 0.00 O ATOM 0 H GLU A 72 2.826 6.797 13.670 1.00 0.00 H new ATOM 0 HA GLU A 72 0.812 6.347 15.774 1.00 0.00 H new ATOM 0 HB2 GLU A 72 1.982 7.394 17.406 1.00 0.00 H new ATOM 0 HB3 GLU A 72 3.377 6.864 16.488 1.00 0.00 H new ATOM 0 HG2 GLU A 72 3.984 8.973 15.972 1.00 0.00 H new ATOM 0 HG3 GLU A 72 2.356 9.428 15.510 1.00 0.00 H new ATOM 1060 N ARG A 73 1.108 8.341 13.372 1.00 0.00 N ATOM 1061 CA ARG A 73 0.490 9.410 12.601 1.00 0.00 C ATOM 1062 C ARG A 73 -0.167 8.839 11.355 1.00 0.00 C ATOM 1063 O ARG A 73 -1.100 9.421 10.803 1.00 0.00 O ATOM 1064 CB ARG A 73 1.543 10.442 12.204 1.00 0.00 C ATOM 1065 CG ARG A 73 1.007 11.560 11.325 1.00 0.00 C ATOM 1066 CD ARG A 73 0.642 12.787 12.141 1.00 0.00 C ATOM 1067 NE ARG A 73 -0.717 12.706 12.670 1.00 0.00 N ATOM 1068 CZ ARG A 73 -1.304 13.684 13.355 1.00 0.00 C ATOM 1069 NH1 ARG A 73 -0.654 14.816 13.593 1.00 0.00 N ATOM 1070 NH2 ARG A 73 -2.543 13.529 13.801 1.00 0.00 N ATOM 0 H ARG A 73 1.748 7.754 12.837 1.00 0.00 H new ATOM 0 HA ARG A 73 -0.270 9.894 13.214 1.00 0.00 H new ATOM 0 HB2 ARG A 73 1.971 10.876 13.107 1.00 0.00 H new ATOM 0 HB3 ARG A 73 2.353 9.937 11.679 1.00 0.00 H new ATOM 0 HG2 ARG A 73 1.756 11.828 10.579 1.00 0.00 H new ATOM 0 HG3 ARG A 73 0.129 11.208 10.783 1.00 0.00 H new ATOM 0 HD2 ARG A 73 1.346 12.897 12.966 1.00 0.00 H new ATOM 0 HD3 ARG A 73 0.737 13.677 11.520 1.00 0.00 H new ATOM 0 HE ARG A 73 -1.247 11.850 12.505 1.00 0.00 H new ATOM 0 HH11 ARG A 73 0.299 14.939 13.250 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -1.107 15.564 14.118 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -3.046 12.660 13.619 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -2.993 14.278 14.326 1.00 0.00 H new ATOM 1084 N LEU A 74 0.330 7.688 10.928 1.00 0.00 N ATOM 1085 CA LEU A 74 -0.197 7.013 9.752 1.00 0.00 C ATOM 1086 C LEU A 74 -1.530 6.353 10.046 1.00 0.00 C ATOM 1087 O LEU A 74 -2.352 6.174 9.152 1.00 0.00 O ATOM 1088 CB LEU A 74 0.782 5.948 9.285 1.00 0.00 C ATOM 1089 CG LEU A 74 1.562 6.304 8.037 1.00 0.00 C ATOM 1090 CD1 LEU A 74 2.953 5.704 8.115 1.00 0.00 C ATOM 1091 CD2 LEU A 74 0.819 5.830 6.797 1.00 0.00 C ATOM 0 H LEU A 74 1.102 7.200 11.382 1.00 0.00 H new ATOM 0 HA LEU A 74 -0.339 7.764 8.975 1.00 0.00 H new ATOM 0 HB2 LEU A 74 1.487 5.744 10.091 1.00 0.00 H new ATOM 0 HB3 LEU A 74 0.232 5.025 9.102 1.00 0.00 H new ATOM 0 HG LEU A 74 1.661 7.387 7.967 1.00 0.00 H new ATOM 0 HD11 LEU A 74 3.512 5.962 7.215 1.00 0.00 H new ATOM 0 HD12 LEU A 74 3.471 6.098 8.989 1.00 0.00 H new ATOM 0 HD13 LEU A 74 2.877 4.620 8.197 1.00 0.00 H new ATOM 0 HD21 LEU A 74 1.391 6.093 5.907 1.00 0.00 H new ATOM 0 HD22 LEU A 74 0.692 4.748 6.840 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -0.159 6.309 6.754 1.00 0.00 H new ATOM 1103 N PHE A 75 -1.701 5.942 11.296 1.00 0.00 N ATOM 1104 CA PHE A 75 -2.906 5.253 11.734 1.00 0.00 C ATOM 1105 C PHE A 75 -4.174 5.857 11.111 1.00 0.00 C ATOM 1106 O PHE A 75 -4.947 5.146 10.466 1.00 0.00 O ATOM 1107 CB PHE A 75 -2.978 5.285 13.263 1.00 0.00 C ATOM 1108 CG PHE A 75 -3.344 3.975 13.907 1.00 0.00 C ATOM 1109 CD1 PHE A 75 -3.263 2.781 13.206 1.00 0.00 C ATOM 1110 CD2 PHE A 75 -3.744 3.940 15.235 1.00 0.00 C ATOM 1111 CE1 PHE A 75 -3.587 1.583 13.811 1.00 0.00 C ATOM 1112 CE2 PHE A 75 -4.071 2.745 15.843 1.00 0.00 C ATOM 1113 CZ PHE A 75 -3.993 1.565 15.131 1.00 0.00 C ATOM 0 H PHE A 75 -1.009 6.077 12.033 1.00 0.00 H new ATOM 0 HA PHE A 75 -2.854 4.219 11.393 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -2.012 5.607 13.651 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -3.708 6.037 13.562 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -2.943 2.788 12.175 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -3.800 4.859 15.800 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -3.523 0.661 13.253 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -4.388 2.733 16.875 1.00 0.00 H new ATOM 0 HZ PHE A 75 -4.249 0.629 15.605 1.00 0.00 H new ATOM 1123 N PRO A 76 -4.400 7.181 11.262 1.00 0.00 N ATOM 1124 CA PRO A 76 -5.575 7.839 10.680 1.00 0.00 C ATOM 1125 C PRO A 76 -5.548 7.814 9.155 1.00 0.00 C ATOM 1126 O PRO A 76 -6.592 7.852 8.504 1.00 0.00 O ATOM 1127 CB PRO A 76 -5.485 9.278 11.195 1.00 0.00 C ATOM 1128 CG PRO A 76 -4.047 9.475 11.529 1.00 0.00 C ATOM 1129 CD PRO A 76 -3.544 8.137 11.992 1.00 0.00 C ATOM 0 HA PRO A 76 -6.501 7.338 10.961 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -5.816 9.990 10.439 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -6.118 9.425 12.070 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -3.488 9.823 10.660 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -3.927 10.228 12.308 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -2.490 7.998 11.751 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -3.642 8.022 13.071 1.00 0.00 H new ATOM 1137 N LEU A 77 -4.345 7.740 8.592 1.00 0.00 N ATOM 1138 CA LEU A 77 -4.179 7.704 7.144 1.00 0.00 C ATOM 1139 C LEU A 77 -4.398 6.294 6.602 1.00 0.00 C ATOM 1140 O LEU A 77 -4.681 6.117 5.418 1.00 0.00 O ATOM 1141 CB LEU A 77 -2.787 8.206 6.755 1.00 0.00 C ATOM 1142 CG LEU A 77 -2.560 9.708 6.955 1.00 0.00 C ATOM 1143 CD1 LEU A 77 -1.149 10.093 6.541 1.00 0.00 C ATOM 1144 CD2 LEU A 77 -3.584 10.513 6.170 1.00 0.00 C ATOM 0 H LEU A 77 -3.471 7.704 9.117 1.00 0.00 H new ATOM 0 HA LEU A 77 -4.929 8.360 6.703 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -2.045 7.661 7.338 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -2.610 7.964 5.707 1.00 0.00 H new ATOM 0 HG LEU A 77 -2.683 9.936 8.014 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -1.005 11.163 6.690 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -0.429 9.543 7.147 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -0.999 9.850 5.489 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -3.406 11.577 6.325 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -3.494 10.281 5.109 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -4.587 10.259 6.513 1.00 0.00 H new ATOM 1156 N ILE A 78 -4.266 5.293 7.470 1.00 0.00 N ATOM 1157 CA ILE A 78 -4.484 3.909 7.062 1.00 0.00 C ATOM 1158 C ILE A 78 -5.958 3.675 6.774 1.00 0.00 C ATOM 1159 O ILE A 78 -6.311 2.944 5.850 1.00 0.00 O ATOM 1160 CB ILE A 78 -4.034 2.904 8.131 1.00 0.00 C ATOM 1161 CG1 ILE A 78 -2.644 3.261 8.659 1.00 0.00 C ATOM 1162 CG2 ILE A 78 -4.048 1.494 7.560 1.00 0.00 C ATOM 1163 CD1 ILE A 78 -1.541 3.088 7.638 1.00 0.00 C ATOM 0 H ILE A 78 -4.012 5.413 8.450 1.00 0.00 H new ATOM 0 HA ILE A 78 -3.884 3.750 6.166 1.00 0.00 H new ATOM 0 HB ILE A 78 -4.732 2.948 8.967 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -2.650 4.296 9.002 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -2.424 2.639 9.527 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -3.727 0.788 8.326 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -5.058 1.243 7.235 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -3.369 1.439 6.709 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -0.585 3.360 8.085 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -1.506 2.048 7.312 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -1.736 3.731 6.779 1.00 0.00 H new ATOM 1175 N GLN A 79 -6.814 4.313 7.571 1.00 0.00 N ATOM 1176 CA GLN A 79 -8.259 4.212 7.381 1.00 0.00 C ATOM 1177 C GLN A 79 -8.627 4.571 5.945 1.00 0.00 C ATOM 1178 O GLN A 79 -9.739 4.315 5.486 1.00 0.00 O ATOM 1179 CB GLN A 79 -8.983 5.149 8.348 1.00 0.00 C ATOM 1180 CG GLN A 79 -9.652 4.432 9.510 1.00 0.00 C ATOM 1181 CD GLN A 79 -10.224 5.392 10.535 1.00 0.00 C ATOM 1182 OE1 GLN A 79 -9.392 6.307 11.019 1.00 0.00 O flip ATOM 1183 NE2 GLN A 79 -11.401 5.313 10.887 1.00 0.00 N flip ATOM 0 H GLN A 79 -6.532 4.904 8.353 1.00 0.00 H new ATOM 0 HA GLN A 79 -8.566 3.185 7.581 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -8.269 5.872 8.742 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -9.737 5.712 7.798 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -10.450 3.795 9.128 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -8.927 3.778 9.995 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -12.005 4.594 10.489 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -11.772 5.967 11.577 1.00 0.00 H new ATOM 1192 N ALA A 80 -7.675 5.183 5.254 1.00 0.00 N ATOM 1193 CA ALA A 80 -7.849 5.571 3.861 1.00 0.00 C ATOM 1194 C ALA A 80 -7.574 4.392 2.935 1.00 0.00 C ATOM 1195 O ALA A 80 -8.264 4.202 1.934 1.00 0.00 O ATOM 1196 CB ALA A 80 -6.926 6.729 3.517 1.00 0.00 C ATOM 0 H ALA A 80 -6.763 5.424 5.642 1.00 0.00 H new ATOM 0 HA ALA A 80 -8.882 5.888 3.721 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -7.067 7.009 2.473 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -7.158 7.581 4.155 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -5.890 6.428 3.676 1.00 0.00 H new ATOM 1202 N MET A 81 -6.543 3.616 3.263 1.00 0.00 N ATOM 1203 CA MET A 81 -6.187 2.447 2.466 1.00 0.00 C ATOM 1204 C MET A 81 -7.211 1.342 2.671 1.00 0.00 C ATOM 1205 O MET A 81 -7.677 0.719 1.716 1.00 0.00 O ATOM 1206 CB MET A 81 -4.794 1.938 2.847 1.00 0.00 C ATOM 1207 CG MET A 81 -3.811 3.038 3.214 1.00 0.00 C ATOM 1208 SD MET A 81 -2.741 2.575 4.586 1.00 0.00 S ATOM 1209 CE MET A 81 -1.200 2.269 3.729 1.00 0.00 C ATOM 0 H MET A 81 -5.942 3.776 4.072 1.00 0.00 H new ATOM 0 HA MET A 81 -6.178 2.738 1.416 1.00 0.00 H new ATOM 0 HB2 MET A 81 -4.887 1.253 3.689 1.00 0.00 H new ATOM 0 HB3 MET A 81 -4.387 1.365 2.013 1.00 0.00 H new ATOM 0 HG2 MET A 81 -3.199 3.279 2.345 1.00 0.00 H new ATOM 0 HG3 MET A 81 -4.362 3.941 3.476 1.00 0.00 H new ATOM 0 HE1 MET A 81 -0.415 2.058 4.456 1.00 0.00 H new ATOM 0 HE2 MET A 81 -1.317 1.414 3.064 1.00 0.00 H new ATOM 0 HE3 MET A 81 -0.928 3.148 3.145 1.00 0.00 H new ATOM 1219 N HIS A 82 -7.558 1.118 3.930 1.00 0.00 N ATOM 1220 CA HIS A 82 -8.536 0.107 4.298 1.00 0.00 C ATOM 1221 C HIS A 82 -9.793 0.775 4.847 1.00 0.00 C ATOM 1222 O HIS A 82 -9.705 1.831 5.467 1.00 0.00 O ATOM 1223 CB HIS A 82 -7.931 -0.835 5.340 1.00 0.00 C ATOM 1224 CG HIS A 82 -7.046 -1.884 4.742 1.00 0.00 C ATOM 1225 ND1 HIS A 82 -7.240 -3.219 4.998 1.00 0.00 N ATOM 1226 CD2 HIS A 82 -5.985 -1.742 3.911 1.00 0.00 C ATOM 1227 CE1 HIS A 82 -6.307 -3.858 4.311 1.00 0.00 C ATOM 1228 NE2 HIS A 82 -5.516 -3.001 3.652 1.00 0.00 N ATOM 0 H HIS A 82 -7.171 1.631 4.722 1.00 0.00 H new ATOM 0 HA HIS A 82 -8.809 -0.472 3.416 1.00 0.00 H new ATOM 0 HB2 HIS A 82 -7.357 -0.251 6.059 1.00 0.00 H new ATOM 0 HB3 HIS A 82 -8.736 -1.320 5.893 1.00 0.00 H new ATOM 0 HD2 HIS A 82 -5.587 -0.814 3.527 1.00 0.00 H new ATOM 0 HE1 HIS A 82 -6.197 -4.932 4.285 1.00 0.00 H new ATOM 0 HE2 HIS A 82 -4.715 -3.242 3.068 1.00 0.00 H new ATOM 1236 N PRO A 83 -10.983 0.193 4.588 1.00 0.00 N ATOM 1237 CA PRO A 83 -12.257 0.739 5.044 1.00 0.00 C ATOM 1238 C PRO A 83 -12.129 1.492 6.363 1.00 0.00 C ATOM 1239 O PRO A 83 -12.576 2.633 6.484 1.00 0.00 O ATOM 1240 CB PRO A 83 -13.131 -0.510 5.215 1.00 0.00 C ATOM 1241 CG PRO A 83 -12.423 -1.631 4.504 1.00 0.00 C ATOM 1242 CD PRO A 83 -11.189 -1.056 3.855 1.00 0.00 C ATOM 0 HA PRO A 83 -12.664 1.469 4.345 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -13.268 -0.746 6.270 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -14.123 -0.349 4.793 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -12.153 -2.419 5.207 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -13.075 -2.081 3.755 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -10.334 -1.725 3.950 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -11.338 -0.879 2.790 1.00 0.00 H new ATOM 1250 N THR A 84 -11.478 0.853 7.330 1.00 0.00 N ATOM 1251 CA THR A 84 -11.242 1.447 8.643 1.00 0.00 C ATOM 1252 C THR A 84 -10.610 0.418 9.573 1.00 0.00 C ATOM 1253 O THR A 84 -10.705 0.523 10.796 1.00 0.00 O ATOM 1254 CB THR A 84 -12.552 1.965 9.251 1.00 0.00 C ATOM 1255 OG1 THR A 84 -12.304 2.642 10.472 1.00 0.00 O ATOM 1256 CG2 THR A 84 -13.560 0.871 9.526 1.00 0.00 C ATOM 0 H THR A 84 -11.100 -0.089 7.227 1.00 0.00 H new ATOM 0 HA THR A 84 -10.562 2.290 8.521 1.00 0.00 H new ATOM 0 HB THR A 84 -12.971 2.639 8.504 1.00 0.00 H new ATOM 0 HG1 THR A 84 -11.647 2.139 10.998 1.00 0.00 H new ATOM 0 HG21 THR A 84 -14.462 1.307 9.955 1.00 0.00 H new ATOM 0 HG22 THR A 84 -13.810 0.364 8.594 1.00 0.00 H new ATOM 0 HG23 THR A 84 -13.135 0.153 10.227 1.00 0.00 H new ATOM 1264 N LEU A 85 -9.970 -0.584 8.977 1.00 0.00 N ATOM 1265 CA LEU A 85 -9.334 -1.656 9.732 1.00 0.00 C ATOM 1266 C LEU A 85 -8.069 -1.174 10.432 1.00 0.00 C ATOM 1267 O LEU A 85 -7.289 -1.980 10.939 1.00 0.00 O ATOM 1268 CB LEU A 85 -8.992 -2.821 8.799 1.00 0.00 C ATOM 1269 CG LEU A 85 -10.158 -3.758 8.479 1.00 0.00 C ATOM 1270 CD1 LEU A 85 -9.798 -4.681 7.325 1.00 0.00 C ATOM 1271 CD2 LEU A 85 -10.550 -4.562 9.709 1.00 0.00 C ATOM 0 H LEU A 85 -9.879 -0.675 7.965 1.00 0.00 H new ATOM 0 HA LEU A 85 -10.038 -1.988 10.495 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -8.604 -2.416 7.864 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -8.190 -3.405 9.251 1.00 0.00 H new ATOM 0 HG LEU A 85 -11.014 -3.154 8.180 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -10.639 -5.341 7.111 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -9.569 -4.086 6.441 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -8.928 -5.279 7.595 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -11.381 -5.223 9.462 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -9.699 -5.157 10.041 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -10.851 -3.883 10.507 1.00 0.00 H new ATOM 1283 N ALA A 86 -7.869 0.141 10.457 1.00 0.00 N ATOM 1284 CA ALA A 86 -6.692 0.726 11.088 1.00 0.00 C ATOM 1285 C ALA A 86 -6.822 0.740 12.609 1.00 0.00 C ATOM 1286 O ALA A 86 -6.513 1.740 13.258 1.00 0.00 O ATOM 1287 CB ALA A 86 -6.461 2.136 10.563 1.00 0.00 C ATOM 0 H ALA A 86 -8.508 0.822 10.047 1.00 0.00 H new ATOM 0 HA ALA A 86 -5.832 0.106 10.834 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -5.579 2.563 11.042 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -6.308 2.102 9.484 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -7.330 2.754 10.787 1.00 0.00 H new ATOM 1293 N GLY A 87 -7.281 -0.373 13.172 1.00 0.00 N ATOM 1294 CA GLY A 87 -7.401 -0.479 14.613 1.00 0.00 C ATOM 1295 C GLY A 87 -6.098 -0.925 15.243 1.00 0.00 C ATOM 1296 O GLY A 87 -5.935 -0.875 16.462 1.00 0.00 O ATOM 0 H GLY A 87 -7.572 -1.203 12.655 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -7.696 0.485 15.027 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -8.190 -1.189 14.863 1.00 0.00 H new ATOM 1300 N LYS A 88 -5.166 -1.350 14.393 1.00 0.00 N ATOM 1301 CA LYS A 88 -3.854 -1.801 14.838 1.00 0.00 C ATOM 1302 C LYS A 88 -2.964 -2.111 13.633 1.00 0.00 C ATOM 1303 O LYS A 88 -2.107 -2.992 13.683 1.00 0.00 O ATOM 1304 CB LYS A 88 -3.988 -3.034 15.743 1.00 0.00 C ATOM 1305 CG LYS A 88 -2.670 -3.528 16.322 1.00 0.00 C ATOM 1306 CD LYS A 88 -2.028 -2.490 17.224 1.00 0.00 C ATOM 1307 CE LYS A 88 -0.568 -2.280 16.865 1.00 0.00 C ATOM 1308 NZ LYS A 88 0.222 -1.766 18.017 1.00 0.00 N ATOM 0 H LYS A 88 -5.300 -1.391 13.383 1.00 0.00 H new ATOM 0 HA LYS A 88 -3.388 -1.003 15.416 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -4.666 -2.797 16.563 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -4.447 -3.842 15.173 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -2.842 -4.444 16.887 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -1.987 -3.777 15.510 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -2.566 -1.546 17.137 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -2.108 -2.808 18.263 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -0.140 -3.222 16.524 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -0.496 -1.578 16.034 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 0.835 -0.989 17.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -0.424 -1.417 18.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 0.808 -2.532 18.406 1.00 0.00 H new ATOM 1322 N ILE A 89 -3.176 -1.386 12.536 1.00 0.00 N ATOM 1323 CA ILE A 89 -2.371 -1.589 11.342 1.00 0.00 C ATOM 1324 C ILE A 89 -1.021 -0.889 11.480 1.00 0.00 C ATOM 1325 O ILE A 89 -0.065 -1.477 11.979 1.00 0.00 O ATOM 1326 CB ILE A 89 -3.086 -1.099 10.070 1.00 0.00 C ATOM 1327 CG1 ILE A 89 -4.453 -1.784 9.945 1.00 0.00 C ATOM 1328 CG2 ILE A 89 -2.226 -1.384 8.850 1.00 0.00 C ATOM 1329 CD1 ILE A 89 -5.278 -1.311 8.766 1.00 0.00 C ATOM 0 H ILE A 89 -3.890 -0.662 12.453 1.00 0.00 H new ATOM 0 HA ILE A 89 -2.214 -2.663 11.242 1.00 0.00 H new ATOM 0 HB ILE A 89 -3.244 -0.022 10.135 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -4.301 -2.860 9.860 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -5.018 -1.613 10.861 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -2.739 -1.034 7.954 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -1.272 -0.866 8.948 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -2.049 -2.457 8.772 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -6.229 -1.844 8.750 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -5.464 -0.241 8.858 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -4.736 -1.507 7.841 1.00 0.00 H new ATOM 1341 N THR A 90 -0.961 0.376 11.066 1.00 0.00 N ATOM 1342 CA THR A 90 0.266 1.166 11.157 1.00 0.00 C ATOM 1343 C THR A 90 0.828 1.134 12.571 1.00 0.00 C ATOM 1344 O THR A 90 2.042 1.078 12.764 1.00 0.00 O ATOM 1345 CB THR A 90 -0.020 2.604 10.715 1.00 0.00 C ATOM 1346 OG1 THR A 90 0.658 2.890 9.505 1.00 0.00 O ATOM 1347 CG2 THR A 90 0.368 3.678 11.716 1.00 0.00 C ATOM 0 H THR A 90 -1.752 0.878 10.662 1.00 0.00 H new ATOM 0 HA THR A 90 1.017 0.734 10.496 1.00 0.00 H new ATOM 0 HB THR A 90 -1.104 2.639 10.605 1.00 0.00 H new ATOM 0 HG1 THR A 90 1.547 3.251 9.705 1.00 0.00 H new ATOM 0 HG21 THR A 90 0.125 4.660 11.309 1.00 0.00 H new ATOM 0 HG22 THR A 90 -0.181 3.525 12.645 1.00 0.00 H new ATOM 0 HG23 THR A 90 1.439 3.622 11.913 1.00 0.00 H new ATOM 1355 N GLY A 91 -0.060 1.177 13.558 1.00 0.00 N ATOM 1356 CA GLY A 91 0.378 1.108 14.933 1.00 0.00 C ATOM 1357 C GLY A 91 1.213 -0.129 15.174 1.00 0.00 C ATOM 1358 O GLY A 91 2.148 -0.117 15.976 1.00 0.00 O ATOM 0 H GLY A 91 -1.069 1.258 13.429 1.00 0.00 H new ATOM 0 HA2 GLY A 91 0.959 1.997 15.178 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -0.488 1.101 15.594 1.00 0.00 H new ATOM 1362 N MET A 92 0.894 -1.192 14.442 1.00 0.00 N ATOM 1363 CA MET A 92 1.631 -2.438 14.550 1.00 0.00 C ATOM 1364 C MET A 92 2.872 -2.392 13.694 1.00 0.00 C ATOM 1365 O MET A 92 3.837 -3.092 13.962 1.00 0.00 O ATOM 1366 CB MET A 92 0.759 -3.618 14.149 1.00 0.00 C ATOM 1367 CG MET A 92 1.502 -4.920 14.144 1.00 0.00 C ATOM 1368 SD MET A 92 0.435 -6.352 13.885 1.00 0.00 S ATOM 1369 CE MET A 92 -0.421 -5.882 12.382 1.00 0.00 C ATOM 0 H MET A 92 0.129 -1.211 13.768 1.00 0.00 H new ATOM 0 HA MET A 92 1.928 -2.568 15.591 1.00 0.00 H new ATOM 0 HB2 MET A 92 -0.084 -3.690 14.836 1.00 0.00 H new ATOM 0 HB3 MET A 92 0.347 -3.437 13.156 1.00 0.00 H new ATOM 0 HG2 MET A 92 2.260 -4.894 13.361 1.00 0.00 H new ATOM 0 HG3 MET A 92 2.027 -5.034 15.092 1.00 0.00 H new ATOM 0 HE1 MET A 92 -0.981 -6.736 12.000 1.00 0.00 H new ATOM 0 HE2 MET A 92 -1.108 -5.063 12.596 1.00 0.00 H new ATOM 0 HE3 MET A 92 0.305 -5.561 11.635 1.00 0.00 H new ATOM 1379 N LEU A 93 2.851 -1.535 12.687 1.00 0.00 N ATOM 1380 CA LEU A 93 3.993 -1.374 11.806 1.00 0.00 C ATOM 1381 C LEU A 93 5.202 -0.882 12.586 1.00 0.00 C ATOM 1382 O LEU A 93 6.310 -0.795 12.056 1.00 0.00 O ATOM 1383 CB LEU A 93 3.648 -0.408 10.687 1.00 0.00 C ATOM 1384 CG LEU A 93 3.005 -1.053 9.458 1.00 0.00 C ATOM 1385 CD1 LEU A 93 3.970 -2.034 8.810 1.00 0.00 C ATOM 1386 CD2 LEU A 93 1.711 -1.750 9.842 1.00 0.00 C ATOM 0 H LEU A 93 2.054 -0.940 12.460 1.00 0.00 H new ATOM 0 HA LEU A 93 4.243 -2.341 11.370 1.00 0.00 H new ATOM 0 HB2 LEU A 93 2.971 0.351 11.078 1.00 0.00 H new ATOM 0 HB3 LEU A 93 4.558 0.106 10.376 1.00 0.00 H new ATOM 0 HG LEU A 93 2.772 -0.271 8.735 1.00 0.00 H new ATOM 0 HD11 LEU A 93 3.499 -2.485 7.937 1.00 0.00 H new ATOM 0 HD12 LEU A 93 4.873 -1.507 8.503 1.00 0.00 H new ATOM 0 HD13 LEU A 93 4.231 -2.814 9.525 1.00 0.00 H new ATOM 0 HD21 LEU A 93 1.266 -2.204 8.957 1.00 0.00 H new ATOM 0 HD22 LEU A 93 1.920 -2.524 10.581 1.00 0.00 H new ATOM 0 HD23 LEU A 93 1.018 -1.023 10.265 1.00 0.00 H new ATOM 1398 N LEU A 94 4.979 -0.571 13.857 1.00 0.00 N ATOM 1399 CA LEU A 94 6.047 -0.161 14.742 1.00 0.00 C ATOM 1400 C LEU A 94 6.312 -1.271 15.750 1.00 0.00 C ATOM 1401 O LEU A 94 6.862 -1.040 16.827 1.00 0.00 O ATOM 1402 CB LEU A 94 5.671 1.139 15.455 1.00 0.00 C ATOM 1403 CG LEU A 94 6.243 2.416 14.827 1.00 0.00 C ATOM 1404 CD1 LEU A 94 7.715 2.568 15.179 1.00 0.00 C ATOM 1405 CD2 LEU A 94 6.047 2.414 13.314 1.00 0.00 C ATOM 0 H LEU A 94 4.058 -0.597 14.295 1.00 0.00 H new ATOM 0 HA LEU A 94 6.953 0.021 14.164 1.00 0.00 H new ATOM 0 HB2 LEU A 94 4.584 1.220 15.479 1.00 0.00 H new ATOM 0 HB3 LEU A 94 6.009 1.079 16.489 1.00 0.00 H new ATOM 0 HG LEU A 94 5.701 3.269 15.235 1.00 0.00 H new ATOM 0 HD11 LEU A 94 8.105 3.479 14.726 1.00 0.00 H new ATOM 0 HD12 LEU A 94 7.826 2.625 16.262 1.00 0.00 H new ATOM 0 HD13 LEU A 94 8.270 1.709 14.802 1.00 0.00 H new ATOM 0 HD21 LEU A 94 6.461 3.330 12.892 1.00 0.00 H new ATOM 0 HD22 LEU A 94 6.557 1.553 12.882 1.00 0.00 H new ATOM 0 HD23 LEU A 94 4.983 2.358 13.085 1.00 0.00 H new ATOM 1417 N GLU A 95 5.885 -2.481 15.386 1.00 0.00 N ATOM 1418 CA GLU A 95 6.048 -3.650 16.244 1.00 0.00 C ATOM 1419 C GLU A 95 5.882 -4.952 15.455 1.00 0.00 C ATOM 1420 O GLU A 95 6.026 -6.040 16.015 1.00 0.00 O ATOM 1421 CB GLU A 95 5.044 -3.608 17.402 1.00 0.00 C ATOM 1422 CG GLU A 95 3.643 -4.054 17.017 1.00 0.00 C ATOM 1423 CD GLU A 95 2.766 -4.329 18.224 1.00 0.00 C ATOM 1424 OE1 GLU A 95 2.740 -3.484 19.143 1.00 0.00 O ATOM 1425 OE2 GLU A 95 2.107 -5.390 18.249 1.00 0.00 O ATOM 0 H GLU A 95 5.422 -2.675 14.498 1.00 0.00 H new ATOM 0 HA GLU A 95 7.061 -3.625 16.647 1.00 0.00 H new ATOM 0 HB2 GLU A 95 5.408 -4.243 18.209 1.00 0.00 H new ATOM 0 HB3 GLU A 95 4.997 -2.592 17.793 1.00 0.00 H new ATOM 0 HG2 GLU A 95 3.177 -3.284 16.402 1.00 0.00 H new ATOM 0 HG3 GLU A 95 3.707 -4.955 16.406 1.00 0.00 H new ATOM 1432 N ILE A 96 5.658 -4.837 14.144 1.00 0.00 N ATOM 1433 CA ILE A 96 5.481 -6.016 13.288 1.00 0.00 C ATOM 1434 C ILE A 96 6.731 -6.898 13.272 1.00 0.00 C ATOM 1435 O ILE A 96 7.528 -6.897 14.211 1.00 0.00 O ATOM 1436 CB ILE A 96 5.179 -5.636 11.818 1.00 0.00 C ATOM 1437 CG1 ILE A 96 6.376 -4.918 11.178 1.00 0.00 C ATOM 1438 CG2 ILE A 96 3.920 -4.799 11.697 1.00 0.00 C ATOM 1439 CD1 ILE A 96 6.761 -3.624 11.852 1.00 0.00 C ATOM 0 H ILE A 96 5.595 -3.945 13.653 1.00 0.00 H new ATOM 0 HA ILE A 96 4.636 -6.554 13.717 1.00 0.00 H new ATOM 0 HB ILE A 96 5.006 -6.565 11.274 1.00 0.00 H new ATOM 0 HG12 ILE A 96 7.235 -5.589 11.190 1.00 0.00 H new ATOM 0 HG13 ILE A 96 6.145 -4.714 10.132 1.00 0.00 H new ATOM 0 HG21 ILE A 96 3.745 -4.554 10.649 1.00 0.00 H new ATOM 0 HG22 ILE A 96 3.071 -5.361 12.085 1.00 0.00 H new ATOM 0 HG23 ILE A 96 4.038 -3.879 12.269 1.00 0.00 H new ATOM 0 HD11 ILE A 96 7.614 -3.185 11.336 1.00 0.00 H new ATOM 0 HD12 ILE A 96 5.920 -2.931 11.817 1.00 0.00 H new ATOM 0 HD13 ILE A 96 7.027 -3.820 12.891 1.00 0.00 H new ATOM 1451 N ASP A 97 6.907 -7.621 12.166 1.00 0.00 N ATOM 1452 CA ASP A 97 8.061 -8.486 11.966 1.00 0.00 C ATOM 1453 C ASP A 97 9.365 -7.693 12.028 1.00 0.00 C ATOM 1454 O ASP A 97 10.451 -8.261 11.900 1.00 0.00 O ATOM 1455 CB ASP A 97 7.940 -9.179 10.610 1.00 0.00 C ATOM 1456 CG ASP A 97 8.562 -10.562 10.605 1.00 0.00 C ATOM 1457 OD1 ASP A 97 8.097 -11.424 11.379 1.00 0.00 O ATOM 1458 OD2 ASP A 97 9.515 -10.782 9.828 1.00 0.00 O ATOM 0 H ASP A 97 6.251 -7.621 11.385 1.00 0.00 H new ATOM 0 HA ASP A 97 8.081 -9.228 12.764 1.00 0.00 H new ATOM 0 HB2 ASP A 97 6.887 -9.257 10.339 1.00 0.00 H new ATOM 0 HB3 ASP A 97 8.421 -8.565 9.848 1.00 0.00 H new ATOM 1463 N ASN A 98 9.237 -6.376 12.202 1.00 0.00 N ATOM 1464 CA ASN A 98 10.380 -5.469 12.291 1.00 0.00 C ATOM 1465 C ASN A 98 10.958 -5.161 10.915 1.00 0.00 C ATOM 1466 O ASN A 98 11.479 -4.069 10.683 1.00 0.00 O ATOM 1467 CB ASN A 98 11.470 -6.033 13.209 1.00 0.00 C ATOM 1468 CG ASN A 98 11.419 -5.436 14.601 1.00 0.00 C ATOM 1469 OD1 ASN A 98 11.858 -4.307 14.823 1.00 0.00 O ATOM 1470 ND2 ASN A 98 10.883 -6.195 15.550 1.00 0.00 N ATOM 0 H ASN A 98 8.334 -5.908 12.285 1.00 0.00 H new ATOM 0 HA ASN A 98 10.014 -4.538 12.723 1.00 0.00 H new ATOM 0 HB2 ASN A 98 11.360 -7.115 13.277 1.00 0.00 H new ATOM 0 HB3 ASN A 98 12.448 -5.839 12.769 1.00 0.00 H new ATOM 0 HD21 ASN A 98 10.823 -5.848 16.507 1.00 0.00 H new ATOM 0 HD22 ASN A 98 10.531 -7.125 15.322 1.00 0.00 H new ATOM 1477 N SER A 99 10.858 -6.119 10.006 1.00 0.00 N ATOM 1478 CA SER A 99 11.343 -5.925 8.646 1.00 0.00 C ATOM 1479 C SER A 99 10.408 -4.991 7.890 1.00 0.00 C ATOM 1480 O SER A 99 10.832 -4.251 7.002 1.00 0.00 O ATOM 1481 CB SER A 99 11.455 -7.264 7.918 1.00 0.00 C ATOM 1482 OG SER A 99 11.870 -8.291 8.800 1.00 0.00 O ATOM 0 H SER A 99 10.447 -7.036 10.183 1.00 0.00 H new ATOM 0 HA SER A 99 12.335 -5.476 8.691 1.00 0.00 H new ATOM 0 HB2 SER A 99 10.492 -7.524 7.479 1.00 0.00 H new ATOM 0 HB3 SER A 99 12.166 -7.176 7.097 1.00 0.00 H new ATOM 0 HG SER A 99 11.932 -9.138 8.310 1.00 0.00 H new ATOM 1488 N GLU A 100 9.135 -5.017 8.271 1.00 0.00 N ATOM 1489 CA GLU A 100 8.135 -4.141 7.676 1.00 0.00 C ATOM 1490 C GLU A 100 8.257 -2.748 8.266 1.00 0.00 C ATOM 1491 O GLU A 100 7.845 -1.767 7.652 1.00 0.00 O ATOM 1492 CB GLU A 100 6.736 -4.706 7.901 1.00 0.00 C ATOM 1493 CG GLU A 100 6.704 -6.224 7.931 1.00 0.00 C ATOM 1494 CD GLU A 100 5.496 -6.799 7.219 1.00 0.00 C ATOM 1495 OE1 GLU A 100 4.360 -6.460 7.609 1.00 0.00 O ATOM 1496 OE2 GLU A 100 5.687 -7.593 6.273 1.00 0.00 O ATOM 0 H GLU A 100 8.771 -5.639 8.993 1.00 0.00 H new ATOM 0 HA GLU A 100 8.306 -4.080 6.601 1.00 0.00 H new ATOM 0 HB2 GLU A 100 6.343 -4.322 8.842 1.00 0.00 H new ATOM 0 HB3 GLU A 100 6.075 -4.350 7.110 1.00 0.00 H new ATOM 0 HG2 GLU A 100 7.612 -6.611 7.468 1.00 0.00 H new ATOM 0 HG3 GLU A 100 6.705 -6.563 8.967 1.00 0.00 H new ATOM 1503 N LEU A 101 8.858 -2.673 9.449 1.00 0.00 N ATOM 1504 CA LEU A 101 9.105 -1.399 10.109 1.00 0.00 C ATOM 1505 C LEU A 101 10.269 -0.681 9.433 1.00 0.00 C ATOM 1506 O LEU A 101 10.383 0.541 9.492 1.00 0.00 O ATOM 1507 CB LEU A 101 9.416 -1.625 11.592 1.00 0.00 C ATOM 1508 CG LEU A 101 10.147 -0.478 12.295 1.00 0.00 C ATOM 1509 CD1 LEU A 101 9.148 0.488 12.909 1.00 0.00 C ATOM 1510 CD2 LEU A 101 11.094 -1.020 13.354 1.00 0.00 C ATOM 0 H LEU A 101 9.184 -3.486 9.972 1.00 0.00 H new ATOM 0 HA LEU A 101 8.212 -0.780 10.029 1.00 0.00 H new ATOM 0 HB2 LEU A 101 8.479 -1.812 12.117 1.00 0.00 H new ATOM 0 HB3 LEU A 101 10.019 -2.528 11.685 1.00 0.00 H new ATOM 0 HG LEU A 101 10.737 0.063 11.556 1.00 0.00 H new ATOM 0 HD11 LEU A 101 9.683 1.298 13.405 1.00 0.00 H new ATOM 0 HD12 LEU A 101 8.511 0.900 12.126 1.00 0.00 H new ATOM 0 HD13 LEU A 101 8.532 -0.040 13.637 1.00 0.00 H new ATOM 0 HD21 LEU A 101 11.605 -0.191 13.844 1.00 0.00 H new ATOM 0 HD22 LEU A 101 10.527 -1.585 14.094 1.00 0.00 H new ATOM 0 HD23 LEU A 101 11.829 -1.673 12.884 1.00 0.00 H new ATOM 1522 N LEU A 102 11.134 -1.465 8.798 1.00 0.00 N ATOM 1523 CA LEU A 102 12.310 -0.933 8.118 1.00 0.00 C ATOM 1524 C LEU A 102 12.008 -0.610 6.667 1.00 0.00 C ATOM 1525 O LEU A 102 12.374 0.455 6.172 1.00 0.00 O ATOM 1526 CB LEU A 102 13.455 -1.944 8.195 1.00 0.00 C ATOM 1527 CG LEU A 102 14.511 -1.648 9.262 1.00 0.00 C ATOM 1528 CD1 LEU A 102 13.996 -2.032 10.641 1.00 0.00 C ATOM 1529 CD2 LEU A 102 15.805 -2.383 8.949 1.00 0.00 C ATOM 0 H LEU A 102 11.041 -2.479 8.740 1.00 0.00 H new ATOM 0 HA LEU A 102 12.601 -0.009 8.618 1.00 0.00 H new ATOM 0 HB2 LEU A 102 13.035 -2.932 8.386 1.00 0.00 H new ATOM 0 HB3 LEU A 102 13.946 -1.989 7.223 1.00 0.00 H new ATOM 0 HG LEU A 102 14.716 -0.577 9.258 1.00 0.00 H new ATOM 0 HD11 LEU A 102 14.760 -1.815 11.388 1.00 0.00 H new ATOM 0 HD12 LEU A 102 13.096 -1.460 10.865 1.00 0.00 H new ATOM 0 HD13 LEU A 102 13.763 -3.097 10.659 1.00 0.00 H new ATOM 0 HD21 LEU A 102 16.545 -2.161 9.718 1.00 0.00 H new ATOM 0 HD22 LEU A 102 15.617 -3.456 8.925 1.00 0.00 H new ATOM 0 HD23 LEU A 102 16.182 -2.059 7.979 1.00 0.00 H new ATOM 1541 N HIS A 103 11.350 -1.531 5.985 1.00 0.00 N ATOM 1542 CA HIS A 103 11.027 -1.342 4.587 1.00 0.00 C ATOM 1543 C HIS A 103 10.065 -0.171 4.398 1.00 0.00 C ATOM 1544 O HIS A 103 10.190 0.594 3.442 1.00 0.00 O ATOM 1545 CB HIS A 103 10.433 -2.629 4.022 1.00 0.00 C ATOM 1546 CG HIS A 103 11.035 -3.044 2.716 1.00 0.00 C ATOM 1547 ND1 HIS A 103 11.437 -2.115 1.786 1.00 0.00 N ATOM 1548 CD2 HIS A 103 11.284 -4.287 2.236 1.00 0.00 C ATOM 1549 CE1 HIS A 103 11.916 -2.805 0.768 1.00 0.00 C ATOM 1550 NE2 HIS A 103 11.844 -4.124 0.995 1.00 0.00 N ATOM 0 H HIS A 103 11.030 -2.416 6.379 1.00 0.00 H new ATOM 0 HA HIS A 103 11.942 -1.104 4.045 1.00 0.00 H new ATOM 0 HB2 HIS A 103 10.570 -3.431 4.747 1.00 0.00 H new ATOM 0 HB3 HIS A 103 9.359 -2.497 3.892 1.00 0.00 H new ATOM 0 HD2 HIS A 103 11.081 -5.224 2.734 1.00 0.00 H new ATOM 0 HE1 HIS A 103 12.315 -2.363 -0.133 1.00 0.00 H new ATOM 0 HE2 HIS A 103 12.148 -4.866 0.364 1.00 0.00 H new ATOM 1558 N MET A 104 9.120 -0.022 5.323 1.00 0.00 N ATOM 1559 CA MET A 104 8.136 1.052 5.253 1.00 0.00 C ATOM 1560 C MET A 104 8.801 2.425 5.293 1.00 0.00 C ATOM 1561 O MET A 104 8.325 3.368 4.666 1.00 0.00 O ATOM 1562 CB MET A 104 7.147 0.927 6.413 1.00 0.00 C ATOM 1563 CG MET A 104 7.799 1.098 7.768 1.00 0.00 C ATOM 1564 SD MET A 104 6.784 2.048 8.914 1.00 0.00 S ATOM 1565 CE MET A 104 5.165 1.390 8.535 1.00 0.00 C ATOM 0 H MET A 104 9.016 -0.634 6.132 1.00 0.00 H new ATOM 0 HA MET A 104 7.607 0.959 4.304 1.00 0.00 H new ATOM 0 HB2 MET A 104 6.363 1.675 6.297 1.00 0.00 H new ATOM 0 HB3 MET A 104 6.665 -0.050 6.369 1.00 0.00 H new ATOM 0 HG2 MET A 104 8.001 0.116 8.196 1.00 0.00 H new ATOM 0 HG3 MET A 104 8.761 1.595 7.643 1.00 0.00 H new ATOM 0 HE1 MET A 104 4.492 1.575 9.372 1.00 0.00 H new ATOM 0 HE2 MET A 104 4.775 1.876 7.641 1.00 0.00 H new ATOM 0 HE3 MET A 104 5.240 0.317 8.360 1.00 0.00 H new ATOM 1575 N LEU A 105 9.870 2.544 6.078 1.00 0.00 N ATOM 1576 CA LEU A 105 10.597 3.803 6.195 1.00 0.00 C ATOM 1577 C LEU A 105 11.655 3.907 5.117 1.00 0.00 C ATOM 1578 O LEU A 105 12.327 4.930 4.982 1.00 0.00 O ATOM 1579 CB LEU A 105 11.268 3.914 7.566 1.00 0.00 C ATOM 1580 CG LEU A 105 10.431 3.419 8.740 1.00 0.00 C ATOM 1581 CD1 LEU A 105 11.261 3.400 10.015 1.00 0.00 C ATOM 1582 CD2 LEU A 105 9.202 4.291 8.912 1.00 0.00 C ATOM 0 H LEU A 105 10.250 1.784 6.641 1.00 0.00 H new ATOM 0 HA LEU A 105 9.879 4.615 6.079 1.00 0.00 H new ATOM 0 HB2 LEU A 105 12.201 3.351 7.543 1.00 0.00 H new ATOM 0 HB3 LEU A 105 11.530 4.958 7.741 1.00 0.00 H new ATOM 0 HG LEU A 105 10.105 2.400 8.532 1.00 0.00 H new ATOM 0 HD11 LEU A 105 10.648 3.044 10.843 1.00 0.00 H new ATOM 0 HD12 LEU A 105 12.115 2.735 9.884 1.00 0.00 H new ATOM 0 HD13 LEU A 105 11.616 4.407 10.233 1.00 0.00 H new ATOM 0 HD21 LEU A 105 8.613 3.927 9.754 1.00 0.00 H new ATOM 0 HD22 LEU A 105 9.509 5.319 9.102 1.00 0.00 H new ATOM 0 HD23 LEU A 105 8.600 4.254 8.004 1.00 0.00 H new ATOM 1594 N GLU A 106 11.816 2.829 4.369 1.00 0.00 N ATOM 1595 CA GLU A 106 12.854 2.759 3.364 1.00 0.00 C ATOM 1596 C GLU A 106 12.300 2.795 1.945 1.00 0.00 C ATOM 1597 O GLU A 106 13.051 2.986 0.989 1.00 0.00 O ATOM 1598 CB GLU A 106 13.654 1.473 3.569 1.00 0.00 C ATOM 1599 CG GLU A 106 14.656 1.560 4.703 1.00 0.00 C ATOM 1600 CD GLU A 106 15.582 2.756 4.584 1.00 0.00 C ATOM 1601 OE1 GLU A 106 16.057 3.029 3.463 1.00 0.00 O ATOM 1602 OE2 GLU A 106 15.831 3.417 5.614 1.00 0.00 O ATOM 0 H GLU A 106 11.239 1.991 4.441 1.00 0.00 H new ATOM 0 HA GLU A 106 13.490 3.636 3.481 1.00 0.00 H new ATOM 0 HB2 GLU A 106 12.964 0.653 3.766 1.00 0.00 H new ATOM 0 HB3 GLU A 106 14.181 1.231 2.646 1.00 0.00 H new ATOM 0 HG2 GLU A 106 14.120 1.615 5.651 1.00 0.00 H new ATOM 0 HG3 GLU A 106 15.251 0.647 4.726 1.00 0.00 H new ATOM 1609 N SER A 107 10.994 2.606 1.801 1.00 0.00 N ATOM 1610 CA SER A 107 10.392 2.556 0.480 1.00 0.00 C ATOM 1611 C SER A 107 9.066 3.313 0.419 1.00 0.00 C ATOM 1612 O SER A 107 8.234 3.199 1.319 1.00 0.00 O ATOM 1613 CB SER A 107 10.169 1.100 0.097 1.00 0.00 C ATOM 1614 OG SER A 107 11.103 0.673 -0.878 1.00 0.00 O ATOM 0 H SER A 107 10.340 2.486 2.575 1.00 0.00 H new ATOM 0 HA SER A 107 11.072 3.040 -0.221 1.00 0.00 H new ATOM 0 HB2 SER A 107 10.254 0.472 0.984 1.00 0.00 H new ATOM 0 HB3 SER A 107 9.157 0.974 -0.287 1.00 0.00 H new ATOM 0 HG SER A 107 10.936 -0.266 -1.102 1.00 0.00 H new ATOM 1620 N PRO A 108 8.827 4.058 -0.681 1.00 0.00 N ATOM 1621 CA PRO A 108 7.591 4.828 -0.874 1.00 0.00 C ATOM 1622 C PRO A 108 6.397 3.936 -1.213 1.00 0.00 C ATOM 1623 O PRO A 108 5.385 4.407 -1.732 1.00 0.00 O ATOM 1624 CB PRO A 108 7.913 5.757 -2.057 1.00 0.00 C ATOM 1625 CG PRO A 108 9.380 5.613 -2.300 1.00 0.00 C ATOM 1626 CD PRO A 108 9.752 4.248 -1.805 1.00 0.00 C ATOM 0 HA PRO A 108 7.306 5.360 0.034 1.00 0.00 H new ATOM 0 HB2 PRO A 108 7.341 5.477 -2.941 1.00 0.00 H new ATOM 0 HB3 PRO A 108 7.655 6.790 -1.824 1.00 0.00 H new ATOM 0 HG2 PRO A 108 9.612 5.720 -3.360 1.00 0.00 H new ATOM 0 HG3 PRO A 108 9.940 6.385 -1.772 1.00 0.00 H new ATOM 0 HD2 PRO A 108 9.619 3.487 -2.574 1.00 0.00 H new ATOM 0 HD3 PRO A 108 10.793 4.201 -1.487 1.00 0.00 H new ATOM 1634 N GLU A 109 6.518 2.651 -0.897 1.00 0.00 N ATOM 1635 CA GLU A 109 5.456 1.684 -1.164 1.00 0.00 C ATOM 1636 C GLU A 109 5.421 0.603 -0.093 1.00 0.00 C ATOM 1637 O GLU A 109 4.372 0.023 0.170 1.00 0.00 O ATOM 1638 CB GLU A 109 5.653 1.062 -2.552 1.00 0.00 C ATOM 1639 CG GLU A 109 5.456 -0.444 -2.595 1.00 0.00 C ATOM 1640 CD GLU A 109 5.213 -0.961 -3.999 1.00 0.00 C ATOM 1641 OE1 GLU A 109 4.102 -0.746 -4.526 1.00 0.00 O ATOM 1642 OE2 GLU A 109 6.134 -1.580 -4.572 1.00 0.00 O ATOM 0 H GLU A 109 7.345 2.252 -0.453 1.00 0.00 H new ATOM 0 HA GLU A 109 4.499 2.206 -1.143 1.00 0.00 H new ATOM 0 HB2 GLU A 109 4.956 1.528 -3.249 1.00 0.00 H new ATOM 0 HB3 GLU A 109 6.658 1.296 -2.903 1.00 0.00 H new ATOM 0 HG2 GLU A 109 6.336 -0.934 -2.179 1.00 0.00 H new ATOM 0 HG3 GLU A 109 4.611 -0.714 -1.961 1.00 0.00 H new ATOM 1649 N SER A 110 6.558 0.350 0.547 1.00 0.00 N ATOM 1650 CA SER A 110 6.615 -0.642 1.605 1.00 0.00 C ATOM 1651 C SER A 110 5.719 -0.211 2.747 1.00 0.00 C ATOM 1652 O SER A 110 4.941 -0.999 3.265 1.00 0.00 O ATOM 1653 CB SER A 110 8.041 -0.834 2.095 1.00 0.00 C ATOM 1654 OG SER A 110 8.559 -2.077 1.659 1.00 0.00 O ATOM 0 H SER A 110 7.444 0.816 0.351 1.00 0.00 H new ATOM 0 HA SER A 110 6.267 -1.597 1.211 1.00 0.00 H new ATOM 0 HB2 SER A 110 8.669 -0.023 1.726 1.00 0.00 H new ATOM 0 HB3 SER A 110 8.066 -0.786 3.184 1.00 0.00 H new ATOM 0 HG SER A 110 9.479 -1.956 1.345 1.00 0.00 H new ATOM 1660 N LEU A 111 5.756 1.076 3.055 1.00 0.00 N ATOM 1661 CA LEU A 111 4.873 1.650 4.054 1.00 0.00 C ATOM 1662 C LEU A 111 3.445 1.165 3.801 1.00 0.00 C ATOM 1663 O LEU A 111 2.657 0.984 4.727 1.00 0.00 O ATOM 1664 CB LEU A 111 4.963 3.180 3.953 1.00 0.00 C ATOM 1665 CG LEU A 111 4.466 4.003 5.150 1.00 0.00 C ATOM 1666 CD1 LEU A 111 3.069 3.584 5.576 1.00 0.00 C ATOM 1667 CD2 LEU A 111 5.444 3.910 6.308 1.00 0.00 C ATOM 0 H LEU A 111 6.393 1.745 2.623 1.00 0.00 H new ATOM 0 HA LEU A 111 5.164 1.340 5.058 1.00 0.00 H new ATOM 0 HB2 LEU A 111 6.005 3.444 3.774 1.00 0.00 H new ATOM 0 HB3 LEU A 111 4.399 3.492 3.074 1.00 0.00 H new ATOM 0 HG LEU A 111 4.408 5.045 4.836 1.00 0.00 H new ATOM 0 HD11 LEU A 111 2.751 4.188 6.426 1.00 0.00 H new ATOM 0 HD12 LEU A 111 2.377 3.731 4.747 1.00 0.00 H new ATOM 0 HD13 LEU A 111 3.076 2.532 5.861 1.00 0.00 H new ATOM 0 HD21 LEU A 111 5.073 4.500 7.146 1.00 0.00 H new ATOM 0 HD22 LEU A 111 5.547 2.869 6.615 1.00 0.00 H new ATOM 0 HD23 LEU A 111 6.415 4.294 5.996 1.00 0.00 H new ATOM 1679 N ARG A 112 3.156 0.868 2.538 1.00 0.00 N ATOM 1680 CA ARG A 112 1.837 0.399 2.137 1.00 0.00 C ATOM 1681 C ARG A 112 1.771 -1.117 2.053 1.00 0.00 C ATOM 1682 O ARG A 112 1.042 -1.751 2.809 1.00 0.00 O ATOM 1683 CB ARG A 112 1.467 1.021 0.802 1.00 0.00 C ATOM 1684 CG ARG A 112 1.092 2.469 0.958 1.00 0.00 C ATOM 1685 CD ARG A 112 1.297 3.252 -0.328 1.00 0.00 C ATOM 1686 NE ARG A 112 0.744 2.557 -1.486 1.00 0.00 N ATOM 1687 CZ ARG A 112 1.166 2.745 -2.733 1.00 0.00 C ATOM 1688 NH1 ARG A 112 2.144 3.606 -2.982 1.00 0.00 N ATOM 1689 NH2 ARG A 112 0.611 2.072 -3.731 1.00 0.00 N ATOM 0 H ARG A 112 3.824 0.945 1.771 1.00 0.00 H new ATOM 0 HA ARG A 112 1.121 0.707 2.899 1.00 0.00 H new ATOM 0 HB2 ARG A 112 2.307 0.933 0.112 1.00 0.00 H new ATOM 0 HB3 ARG A 112 0.634 0.473 0.362 1.00 0.00 H new ATOM 0 HG2 ARG A 112 0.049 2.542 1.265 1.00 0.00 H new ATOM 0 HG3 ARG A 112 1.690 2.915 1.753 1.00 0.00 H new ATOM 0 HD2 ARG A 112 0.828 4.231 -0.235 1.00 0.00 H new ATOM 0 HD3 ARG A 112 2.362 3.423 -0.482 1.00 0.00 H new ATOM 0 HE ARG A 112 -0.010 1.888 -1.330 1.00 0.00 H new ATOM 0 HH11 ARG A 112 2.574 4.125 -2.216 1.00 0.00 H new ATOM 0 HH12 ARG A 112 2.466 3.749 -3.939 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -0.141 1.409 -3.543 1.00 0.00 H new ATOM 0 HH22 ARG A 112 0.936 2.217 -4.687 1.00 0.00 H new ATOM 1703 N SER A 113 2.520 -1.693 1.121 1.00 0.00 N ATOM 1704 CA SER A 113 2.548 -3.141 0.956 1.00 0.00 C ATOM 1705 C SER A 113 2.718 -3.823 2.308 1.00 0.00 C ATOM 1706 O SER A 113 2.281 -4.956 2.503 1.00 0.00 O ATOM 1707 CB SER A 113 3.685 -3.548 0.016 1.00 0.00 C ATOM 1708 OG SER A 113 3.798 -4.959 -0.067 1.00 0.00 O ATOM 0 H SER A 113 3.115 -1.181 0.469 1.00 0.00 H new ATOM 0 HA SER A 113 1.601 -3.458 0.518 1.00 0.00 H new ATOM 0 HB2 SER A 113 3.506 -3.135 -0.977 1.00 0.00 H new ATOM 0 HB3 SER A 113 4.624 -3.125 0.372 1.00 0.00 H new ATOM 0 HG SER A 113 4.530 -5.193 -0.675 1.00 0.00 H new ATOM 1714 N LYS A 114 3.386 -3.131 3.227 1.00 0.00 N ATOM 1715 CA LYS A 114 3.579 -3.646 4.577 1.00 0.00 C ATOM 1716 C LYS A 114 2.337 -3.411 5.426 1.00 0.00 C ATOM 1717 O LYS A 114 1.933 -4.284 6.189 1.00 0.00 O ATOM 1718 CB LYS A 114 4.801 -3.011 5.245 1.00 0.00 C ATOM 1719 CG LYS A 114 6.110 -3.309 4.529 1.00 0.00 C ATOM 1720 CD LYS A 114 6.388 -4.803 4.455 1.00 0.00 C ATOM 1721 CE LYS A 114 7.182 -5.163 3.210 1.00 0.00 C ATOM 1722 NZ LYS A 114 7.294 -6.637 3.029 1.00 0.00 N ATOM 0 H LYS A 114 3.801 -2.214 3.061 1.00 0.00 H new ATOM 0 HA LYS A 114 3.753 -4.719 4.498 1.00 0.00 H new ATOM 0 HB2 LYS A 114 4.659 -1.931 5.291 1.00 0.00 H new ATOM 0 HB3 LYS A 114 4.869 -3.368 6.273 1.00 0.00 H new ATOM 0 HG2 LYS A 114 6.075 -2.896 3.521 1.00 0.00 H new ATOM 0 HG3 LYS A 114 6.929 -2.812 5.049 1.00 0.00 H new ATOM 0 HD2 LYS A 114 6.939 -5.116 5.342 1.00 0.00 H new ATOM 0 HD3 LYS A 114 5.445 -5.350 4.457 1.00 0.00 H new ATOM 0 HE2 LYS A 114 6.702 -4.725 2.335 1.00 0.00 H new ATOM 0 HE3 LYS A 114 8.179 -4.729 3.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 7.842 -6.840 2.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 7.774 -7.052 3.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 6.343 -7.049 2.939 1.00 0.00 H new ATOM 1736 N VAL A 115 1.741 -2.222 5.305 1.00 0.00 N ATOM 1737 CA VAL A 115 0.536 -1.905 6.060 1.00 0.00 C ATOM 1738 C VAL A 115 -0.612 -2.807 5.621 1.00 0.00 C ATOM 1739 O VAL A 115 -1.138 -3.579 6.421 1.00 0.00 O ATOM 1740 CB VAL A 115 0.146 -0.415 5.911 1.00 0.00 C ATOM 1741 CG1 VAL A 115 -1.362 -0.211 5.994 1.00 0.00 C ATOM 1742 CG2 VAL A 115 0.844 0.410 6.979 1.00 0.00 C ATOM 0 H VAL A 115 2.072 -1.473 4.697 1.00 0.00 H new ATOM 0 HA VAL A 115 0.744 -2.085 7.115 1.00 0.00 H new ATOM 0 HB VAL A 115 0.468 -0.084 4.924 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -1.592 0.849 5.885 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -1.850 -0.772 5.197 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -1.724 -0.563 6.960 1.00 0.00 H new ATOM 0 HG21 VAL A 115 0.566 1.458 6.869 1.00 0.00 H new ATOM 0 HG22 VAL A 115 0.544 0.057 7.966 1.00 0.00 H new ATOM 0 HG23 VAL A 115 1.924 0.308 6.870 1.00 0.00 H new ATOM 1752 N ASP A 116 -0.967 -2.733 4.340 1.00 0.00 N ATOM 1753 CA ASP A 116 -2.037 -3.559 3.791 1.00 0.00 C ATOM 1754 C ASP A 116 -1.846 -5.025 4.178 1.00 0.00 C ATOM 1755 O ASP A 116 -2.808 -5.720 4.514 1.00 0.00 O ATOM 1756 CB ASP A 116 -2.084 -3.422 2.267 1.00 0.00 C ATOM 1757 CG ASP A 116 -2.905 -4.515 1.608 1.00 0.00 C ATOM 1758 OD1 ASP A 116 -3.971 -4.871 2.154 1.00 0.00 O ATOM 1759 OD2 ASP A 116 -2.483 -5.013 0.542 1.00 0.00 O ATOM 0 H ASP A 116 -0.528 -2.109 3.663 1.00 0.00 H new ATOM 0 HA ASP A 116 -2.982 -3.212 4.209 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -2.503 -2.450 2.006 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -1.068 -3.447 1.872 1.00 0.00 H new ATOM 1764 N GLU A 117 -0.600 -5.490 4.136 1.00 0.00 N ATOM 1765 CA GLU A 117 -0.289 -6.866 4.502 1.00 0.00 C ATOM 1766 C GLU A 117 -0.378 -7.045 6.010 1.00 0.00 C ATOM 1767 O GLU A 117 -0.772 -8.104 6.499 1.00 0.00 O ATOM 1768 CB GLU A 117 1.110 -7.250 4.014 1.00 0.00 C ATOM 1769 CG GLU A 117 1.137 -7.852 2.614 1.00 0.00 C ATOM 1770 CD GLU A 117 -0.127 -7.577 1.820 1.00 0.00 C ATOM 1771 OE1 GLU A 117 -0.273 -6.447 1.308 1.00 0.00 O ATOM 1772 OE2 GLU A 117 -0.969 -8.493 1.710 1.00 0.00 O ATOM 0 H GLU A 117 0.207 -4.935 3.853 1.00 0.00 H new ATOM 0 HA GLU A 117 -1.018 -7.520 4.023 1.00 0.00 H new ATOM 0 HB2 GLU A 117 1.744 -6.364 4.029 1.00 0.00 H new ATOM 0 HB3 GLU A 117 1.544 -7.964 4.714 1.00 0.00 H new ATOM 0 HG2 GLU A 117 1.994 -7.453 2.071 1.00 0.00 H new ATOM 0 HG3 GLU A 117 1.282 -8.929 2.692 1.00 0.00 H new ATOM 1779 N ALA A 118 -0.016 -5.998 6.745 1.00 0.00 N ATOM 1780 CA ALA A 118 -0.092 -6.030 8.196 1.00 0.00 C ATOM 1781 C ALA A 118 -1.542 -6.072 8.638 1.00 0.00 C ATOM 1782 O ALA A 118 -1.851 -6.507 9.743 1.00 0.00 O ATOM 1783 CB ALA A 118 0.625 -4.841 8.810 1.00 0.00 C ATOM 0 H ALA A 118 0.332 -5.121 6.358 1.00 0.00 H new ATOM 0 HA ALA A 118 0.409 -6.932 8.547 1.00 0.00 H new ATOM 0 HB1 ALA A 118 0.551 -4.893 9.896 1.00 0.00 H new ATOM 0 HB2 ALA A 118 1.675 -4.858 8.517 1.00 0.00 H new ATOM 0 HB3 ALA A 118 0.165 -3.917 8.458 1.00 0.00 H new ATOM 1789 N VAL A 119 -2.431 -5.632 7.753 1.00 0.00 N ATOM 1790 CA VAL A 119 -3.856 -5.682 8.024 1.00 0.00 C ATOM 1791 C VAL A 119 -4.319 -7.123 8.062 1.00 0.00 C ATOM 1792 O VAL A 119 -5.042 -7.533 8.966 1.00 0.00 O ATOM 1793 CB VAL A 119 -4.665 -4.931 6.967 1.00 0.00 C ATOM 1794 CG1 VAL A 119 -6.124 -4.865 7.385 1.00 0.00 C ATOM 1795 CG2 VAL A 119 -4.087 -3.545 6.750 1.00 0.00 C ATOM 0 H VAL A 119 -2.186 -5.238 6.845 1.00 0.00 H new ATOM 0 HA VAL A 119 -4.022 -5.201 8.988 1.00 0.00 H new ATOM 0 HB VAL A 119 -4.607 -5.467 6.019 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -6.696 -4.329 6.628 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -6.519 -5.876 7.489 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -6.206 -4.343 8.339 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -4.673 -3.021 5.995 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -4.119 -2.987 7.686 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -3.054 -3.630 6.413 1.00 0.00 H new ATOM 1805 N ALA A 120 -3.882 -7.888 7.073 1.00 0.00 N ATOM 1806 CA ALA A 120 -4.195 -9.302 7.009 1.00 0.00 C ATOM 1807 C ALA A 120 -3.621 -10.008 8.232 1.00 0.00 C ATOM 1808 O ALA A 120 -4.195 -10.968 8.748 1.00 0.00 O ATOM 1809 CB ALA A 120 -3.633 -9.897 5.729 1.00 0.00 C ATOM 0 H ALA A 120 -3.307 -7.548 6.302 1.00 0.00 H new ATOM 0 HA ALA A 120 -5.277 -9.438 7.005 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -3.871 -10.960 5.687 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -4.073 -9.392 4.869 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -2.551 -9.767 5.712 1.00 0.00 H new ATOM 1815 N VAL A 121 -2.494 -9.485 8.703 1.00 0.00 N ATOM 1816 CA VAL A 121 -1.814 -10.016 9.873 1.00 0.00 C ATOM 1817 C VAL A 121 -2.492 -9.535 11.153 1.00 0.00 C ATOM 1818 O VAL A 121 -2.492 -10.228 12.170 1.00 0.00 O ATOM 1819 CB VAL A 121 -0.335 -9.575 9.869 1.00 0.00 C ATOM 1820 CG1 VAL A 121 0.285 -9.693 11.251 1.00 0.00 C ATOM 1821 CG2 VAL A 121 0.450 -10.384 8.851 1.00 0.00 C ATOM 0 H VAL A 121 -2.028 -8.681 8.282 1.00 0.00 H new ATOM 0 HA VAL A 121 -1.866 -11.104 9.838 1.00 0.00 H new ATOM 0 HB VAL A 121 -0.296 -8.523 9.585 1.00 0.00 H new ATOM 0 HG11 VAL A 121 1.327 -9.374 11.211 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -0.261 -9.060 11.950 1.00 0.00 H new ATOM 0 HG13 VAL A 121 0.235 -10.729 11.585 1.00 0.00 H new ATOM 0 HG21 VAL A 121 1.492 -10.064 8.857 1.00 0.00 H new ATOM 0 HG22 VAL A 121 0.394 -11.442 9.106 1.00 0.00 H new ATOM 0 HG23 VAL A 121 0.028 -10.227 7.858 1.00 0.00 H new ATOM 1831 N LEU A 122 -3.066 -8.341 11.087 1.00 0.00 N ATOM 1832 CA LEU A 122 -3.752 -7.753 12.227 1.00 0.00 C ATOM 1833 C LEU A 122 -5.097 -8.433 12.442 1.00 0.00 C ATOM 1834 O LEU A 122 -5.484 -8.723 13.572 1.00 0.00 O ATOM 1835 CB LEU A 122 -3.929 -6.242 12.011 1.00 0.00 C ATOM 1836 CG LEU A 122 -5.365 -5.713 12.100 1.00 0.00 C ATOM 1837 CD1 LEU A 122 -5.532 -4.857 13.341 1.00 0.00 C ATOM 1838 CD2 LEU A 122 -5.720 -4.919 10.854 1.00 0.00 C ATOM 0 H LEU A 122 -3.069 -7.758 10.250 1.00 0.00 H new ATOM 0 HA LEU A 122 -3.149 -7.904 13.122 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -3.323 -5.716 12.749 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -3.529 -5.986 11.030 1.00 0.00 H new ATOM 0 HG LEU A 122 -6.044 -6.563 12.169 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -6.556 -4.487 13.393 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -5.317 -5.455 14.227 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -4.843 -4.013 13.296 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -6.743 -4.552 10.936 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -5.038 -4.074 10.754 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -5.634 -5.560 9.977 1.00 0.00 H new ATOM 1850 N GLN A 123 -5.799 -8.687 11.344 1.00 0.00 N ATOM 1851 CA GLN A 123 -7.087 -9.361 11.402 1.00 0.00 C ATOM 1852 C GLN A 123 -6.913 -10.749 11.998 1.00 0.00 C ATOM 1853 O GLN A 123 -7.799 -11.266 12.679 1.00 0.00 O ATOM 1854 CB GLN A 123 -7.700 -9.451 10.003 1.00 0.00 C ATOM 1855 CG GLN A 123 -8.356 -8.159 9.544 1.00 0.00 C ATOM 1856 CD GLN A 123 -9.520 -7.751 10.425 1.00 0.00 C ATOM 1857 OE1 GLN A 123 -9.341 -7.068 11.434 1.00 0.00 O ATOM 1858 NE2 GLN A 123 -10.723 -8.168 10.048 1.00 0.00 N ATOM 0 H GLN A 123 -5.496 -8.436 10.403 1.00 0.00 H new ATOM 0 HA GLN A 123 -7.763 -8.787 12.036 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -6.922 -9.727 9.291 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -8.441 -10.250 9.991 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -7.613 -7.361 9.537 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -8.706 -8.278 8.518 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -10.826 -8.732 9.205 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -11.544 -7.924 10.602 1.00 0.00 H new ATOM 1867 N ALA A 124 -5.740 -11.328 11.763 1.00 0.00 N ATOM 1868 CA ALA A 124 -5.399 -12.632 12.313 1.00 0.00 C ATOM 1869 C ALA A 124 -5.137 -12.526 13.807 1.00 0.00 C ATOM 1870 O ALA A 124 -5.737 -13.233 14.600 1.00 0.00 O ATOM 1871 CB ALA A 124 -4.183 -13.199 11.597 1.00 0.00 C ATOM 0 H ALA A 124 -5.006 -10.910 11.191 1.00 0.00 H new ATOM 0 HA ALA A 124 -6.240 -13.308 12.160 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -3.936 -14.175 12.016 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -4.403 -13.305 10.535 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -3.337 -12.524 11.726 1.00 0.00 H new ATOM 1877 N HIS A 125 -4.263 -11.616 14.196 1.00 0.00 N ATOM 1878 CA HIS A 125 -3.931 -11.460 15.603 1.00 0.00 C ATOM 1879 C HIS A 125 -5.119 -10.936 16.403 1.00 0.00 C ATOM 1880 O HIS A 125 -5.136 -11.026 17.631 1.00 0.00 O ATOM 1881 CB HIS A 125 -2.740 -10.513 15.768 1.00 0.00 C ATOM 1882 CG HIS A 125 -1.967 -10.737 17.030 1.00 0.00 C ATOM 1883 ND1 HIS A 125 -2.251 -11.790 17.868 1.00 0.00 N ATOM 1884 CD2 HIS A 125 -0.947 -10.015 17.557 1.00 0.00 C ATOM 1885 CE1 HIS A 125 -1.403 -11.691 18.875 1.00 0.00 C ATOM 1886 NE2 HIS A 125 -0.594 -10.632 18.729 1.00 0.00 N ATOM 0 H HIS A 125 -3.774 -10.979 13.567 1.00 0.00 H new ATOM 0 HA HIS A 125 -3.667 -12.445 15.989 1.00 0.00 H new ATOM 0 HB2 HIS A 125 -2.071 -10.632 14.916 1.00 0.00 H new ATOM 0 HB3 HIS A 125 -3.099 -9.484 15.750 1.00 0.00 H new ATOM 0 HD2 HIS A 125 -0.500 -9.127 17.135 1.00 0.00 H new ATOM 0 HE1 HIS A 125 -1.366 -12.376 19.710 1.00 0.00 H new ATOM 0 HE2 HIS A 125 0.145 -10.340 19.369 1.00 0.00 H new ATOM 1894 N GLN A 126 -6.105 -10.383 15.707 1.00 0.00 N ATOM 1895 CA GLN A 126 -7.288 -9.844 16.366 1.00 0.00 C ATOM 1896 C GLN A 126 -8.343 -10.925 16.565 1.00 0.00 C ATOM 1897 O GLN A 126 -8.871 -11.096 17.665 1.00 0.00 O ATOM 1898 CB GLN A 126 -7.871 -8.690 15.547 1.00 0.00 C ATOM 1899 CG GLN A 126 -7.143 -7.369 15.751 1.00 0.00 C ATOM 1900 CD GLN A 126 -7.550 -6.672 17.034 1.00 0.00 C ATOM 1901 OE1 GLN A 126 -7.101 -7.034 18.121 1.00 0.00 O ATOM 1902 NE2 GLN A 126 -8.405 -5.662 16.912 1.00 0.00 N ATOM 0 H GLN A 126 -6.109 -10.296 14.691 1.00 0.00 H new ATOM 0 HA GLN A 126 -6.989 -9.472 17.346 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -7.839 -8.953 14.490 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -8.921 -8.562 15.812 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -6.068 -7.549 15.765 1.00 0.00 H new ATOM 0 HG3 GLN A 126 -7.345 -6.712 14.905 1.00 0.00 H new ATOM 0 HE21 GLN A 126 -8.752 -5.396 15.990 1.00 0.00 H new ATOM 0 HE22 GLN A 126 -8.714 -5.153 17.740 1.00 0.00 H new ATOM 1911 N ALA A 127 -8.656 -11.645 15.492 1.00 0.00 N ATOM 1912 CA ALA A 127 -9.663 -12.698 15.545 1.00 0.00 C ATOM 1913 C ALA A 127 -9.037 -14.073 15.763 1.00 0.00 C ATOM 1914 O ALA A 127 -9.565 -14.890 16.518 1.00 0.00 O ATOM 1915 CB ALA A 127 -10.493 -12.692 14.270 1.00 0.00 C ATOM 0 H ALA A 127 -8.227 -11.518 14.576 1.00 0.00 H new ATOM 0 HA ALA A 127 -10.310 -12.494 16.398 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -11.242 -13.482 14.320 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -10.990 -11.727 14.164 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -9.843 -12.862 13.412 1.00 0.00 H new ATOM 1921 N LYS A 128 -7.934 -14.342 15.069 1.00 0.00 N ATOM 1922 CA LYS A 128 -7.263 -15.626 15.167 1.00 0.00 C ATOM 1923 C LYS A 128 -6.106 -15.579 16.157 1.00 0.00 C ATOM 1924 O LYS A 128 -5.822 -14.549 16.769 1.00 0.00 O ATOM 1925 CB LYS A 128 -6.759 -16.060 13.780 1.00 0.00 C ATOM 1926 CG LYS A 128 -5.280 -15.808 13.532 1.00 0.00 C ATOM 1927 CD LYS A 128 -4.489 -17.106 13.502 1.00 0.00 C ATOM 1928 CE LYS A 128 -4.271 -17.592 12.079 1.00 0.00 C ATOM 1929 NZ LYS A 128 -5.557 -17.883 11.389 1.00 0.00 N ATOM 0 H LYS A 128 -7.488 -13.682 14.432 1.00 0.00 H new ATOM 0 HA LYS A 128 -7.984 -16.356 15.535 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -6.958 -17.124 13.653 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -7.335 -15.535 13.019 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -5.154 -15.282 12.586 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -4.885 -15.158 14.313 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -3.525 -16.957 13.989 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -5.019 -17.870 14.071 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -3.721 -16.837 11.518 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -3.655 -18.491 12.093 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -5.364 -18.292 10.452 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -6.109 -18.559 11.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -6.098 -17.002 11.277 1.00 0.00 H new ATOM 1943 N GLU A 129 -5.511 -16.736 16.359 1.00 0.00 N ATOM 1944 CA GLU A 129 -4.339 -16.872 17.213 1.00 0.00 C ATOM 1945 C GLU A 129 -3.069 -16.693 16.389 1.00 0.00 C ATOM 1946 O GLU A 129 -2.284 -17.628 16.233 1.00 0.00 O ATOM 1947 CB GLU A 129 -4.332 -18.239 17.905 1.00 0.00 C ATOM 1948 CG GLU A 129 -4.762 -19.384 17.002 1.00 0.00 C ATOM 1949 CD GLU A 129 -4.185 -20.717 17.437 1.00 0.00 C ATOM 1950 OE1 GLU A 129 -3.031 -21.015 17.063 1.00 0.00 O ATOM 1951 OE2 GLU A 129 -4.886 -21.462 18.152 1.00 0.00 O ATOM 0 H GLU A 129 -5.822 -17.611 15.938 1.00 0.00 H new ATOM 0 HA GLU A 129 -4.376 -16.098 17.980 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -3.329 -18.441 18.280 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -4.994 -18.202 18.770 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -5.850 -19.448 16.995 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -4.449 -19.173 15.979 1.00 0.00 H new ATOM 1958 N ALA A 130 -2.890 -15.500 15.831 1.00 0.00 N ATOM 1959 CA ALA A 130 -1.743 -15.232 14.974 1.00 0.00 C ATOM 1960 C ALA A 130 -0.431 -15.498 15.705 1.00 0.00 C ATOM 1961 O ALA A 130 0.295 -16.435 15.372 1.00 0.00 O ATOM 1962 CB ALA A 130 -1.784 -13.801 14.461 1.00 0.00 C ATOM 0 H ALA A 130 -3.521 -14.708 15.956 1.00 0.00 H new ATOM 0 HA ALA A 130 -1.796 -15.911 14.123 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -0.920 -13.618 13.823 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -2.698 -13.646 13.888 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -1.764 -13.111 15.305 1.00 0.00 H new ATOM 1968 N ALA A 131 -0.136 -14.674 16.705 1.00 0.00 N ATOM 1969 CA ALA A 131 1.088 -14.827 17.484 1.00 0.00 C ATOM 1970 C ALA A 131 0.941 -15.933 18.524 1.00 0.00 C ATOM 1971 O ALA A 131 -0.150 -16.168 19.044 1.00 0.00 O ATOM 1972 CB ALA A 131 1.455 -13.514 18.157 1.00 0.00 C ATOM 0 H ALA A 131 -0.727 -13.895 16.995 1.00 0.00 H new ATOM 0 HA ALA A 131 1.890 -15.108 16.802 1.00 0.00 H new ATOM 0 HB1 ALA A 131 2.370 -13.644 18.734 1.00 0.00 H new ATOM 0 HB2 ALA A 131 1.611 -12.747 17.398 1.00 0.00 H new ATOM 0 HB3 ALA A 131 0.647 -13.208 18.822 1.00 0.00 H new ATOM 1978 N GLN A 132 2.047 -16.607 18.823 1.00 0.00 N ATOM 1979 CA GLN A 132 2.043 -17.687 19.802 1.00 0.00 C ATOM 1980 C GLN A 132 2.053 -17.133 21.224 1.00 0.00 C ATOM 1981 O GLN A 132 2.014 -15.919 21.426 1.00 0.00 O ATOM 1982 CB GLN A 132 3.251 -18.600 19.589 1.00 0.00 C ATOM 1983 CG GLN A 132 3.200 -19.383 18.286 1.00 0.00 C ATOM 1984 CD GLN A 132 4.517 -20.057 17.954 1.00 0.00 C ATOM 1985 OE1 GLN A 132 5.527 -19.838 18.624 1.00 0.00 O ATOM 1986 NE2 GLN A 132 4.514 -20.884 16.915 1.00 0.00 N ATOM 0 H GLN A 132 2.957 -16.424 18.401 1.00 0.00 H new ATOM 0 HA GLN A 132 1.130 -18.266 19.664 1.00 0.00 H new ATOM 0 HB2 GLN A 132 4.159 -17.997 19.606 1.00 0.00 H new ATOM 0 HB3 GLN A 132 3.318 -19.300 20.422 1.00 0.00 H new ATOM 0 HG2 GLN A 132 2.417 -20.138 18.352 1.00 0.00 H new ATOM 0 HG3 GLN A 132 2.926 -18.710 17.473 1.00 0.00 H new ATOM 0 HE21 GLN A 132 3.655 -21.037 16.387 1.00 0.00 H new ATOM 0 HE22 GLN A 132 5.371 -21.367 16.645 1.00 0.00 H new ATOM 1995 N LYS A 133 2.103 -18.030 22.203 1.00 0.00 N ATOM 1996 CA LYS A 133 2.118 -17.632 23.608 1.00 0.00 C ATOM 1997 C LYS A 133 3.538 -17.324 24.072 1.00 0.00 C ATOM 1998 O LYS A 133 4.482 -17.366 23.283 1.00 0.00 O ATOM 1999 CB LYS A 133 1.510 -18.733 24.480 1.00 0.00 C ATOM 2000 CG LYS A 133 2.035 -20.124 24.163 1.00 0.00 C ATOM 2001 CD LYS A 133 1.409 -21.175 25.065 1.00 0.00 C ATOM 2002 CE LYS A 133 0.312 -21.946 24.347 1.00 0.00 C ATOM 2003 NZ LYS A 133 0.824 -23.205 23.739 1.00 0.00 N ATOM 0 H LYS A 133 2.134 -19.038 22.050 1.00 0.00 H new ATOM 0 HA LYS A 133 1.519 -16.727 23.709 1.00 0.00 H new ATOM 0 HB2 LYS A 133 1.712 -18.508 25.527 1.00 0.00 H new ATOM 0 HB3 LYS A 133 0.427 -18.726 24.356 1.00 0.00 H new ATOM 0 HG2 LYS A 133 1.824 -20.365 23.121 1.00 0.00 H new ATOM 0 HG3 LYS A 133 3.118 -20.141 24.281 1.00 0.00 H new ATOM 0 HD2 LYS A 133 2.178 -21.868 25.406 1.00 0.00 H new ATOM 0 HD3 LYS A 133 0.996 -20.695 25.952 1.00 0.00 H new ATOM 0 HE2 LYS A 133 -0.486 -22.181 25.051 1.00 0.00 H new ATOM 0 HE3 LYS A 133 -0.123 -21.318 23.569 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 0.045 -23.701 23.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 1.568 -22.979 23.048 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 1.216 -23.816 24.484 1.00 0.00 H new ATOM 2017 N ALA A 134 3.682 -17.015 25.357 1.00 0.00 N ATOM 2018 CA ALA A 134 4.987 -16.699 25.927 1.00 0.00 C ATOM 2019 C ALA A 134 5.784 -17.969 26.207 1.00 0.00 C ATOM 2020 O ALA A 134 5.661 -18.568 27.276 1.00 0.00 O ATOM 2021 CB ALA A 134 4.825 -15.882 27.199 1.00 0.00 C ATOM 0 H ALA A 134 2.911 -16.977 26.023 1.00 0.00 H new ATOM 0 HA ALA A 134 5.541 -16.107 25.199 1.00 0.00 H new ATOM 0 HB1 ALA A 134 5.807 -15.654 27.613 1.00 0.00 H new ATOM 0 HB2 ALA A 134 4.303 -14.953 26.971 1.00 0.00 H new ATOM 0 HB3 ALA A 134 4.248 -16.453 27.927 1.00 0.00 H new ATOM 2027 N VAL A 135 6.601 -18.374 25.240 1.00 0.00 N ATOM 2028 CA VAL A 135 7.420 -19.574 25.382 1.00 0.00 C ATOM 2029 C VAL A 135 8.782 -19.241 25.982 1.00 0.00 C ATOM 2030 O VAL A 135 9.373 -18.207 25.673 1.00 0.00 O ATOM 2031 CB VAL A 135 7.626 -20.282 24.029 1.00 0.00 C ATOM 2032 CG1 VAL A 135 6.360 -21.016 23.613 1.00 0.00 C ATOM 2033 CG2 VAL A 135 8.050 -19.286 22.961 1.00 0.00 C ATOM 0 H VAL A 135 6.714 -17.889 24.350 1.00 0.00 H new ATOM 0 HA VAL A 135 6.883 -20.244 26.053 1.00 0.00 H new ATOM 0 HB VAL A 135 8.424 -21.016 24.142 1.00 0.00 H new ATOM 0 HG11 VAL A 135 6.524 -21.510 22.655 1.00 0.00 H new ATOM 0 HG12 VAL A 135 6.107 -21.761 24.367 1.00 0.00 H new ATOM 0 HG13 VAL A 135 5.541 -20.303 23.518 1.00 0.00 H new ATOM 0 HG21 VAL A 135 8.190 -19.806 22.013 1.00 0.00 H new ATOM 0 HG22 VAL A 135 7.278 -18.525 22.846 1.00 0.00 H new ATOM 0 HG23 VAL A 135 8.986 -18.812 23.257 1.00 0.00 H new ATOM 2043 N ASN A 136 9.273 -20.127 26.844 1.00 0.00 N ATOM 2044 CA ASN A 136 10.565 -19.932 27.491 1.00 0.00 C ATOM 2045 C ASN A 136 11.708 -20.208 26.519 1.00 0.00 C ATOM 2046 O ASN A 136 12.343 -19.282 26.014 1.00 0.00 O ATOM 2047 CB ASN A 136 10.688 -20.845 28.712 1.00 0.00 C ATOM 2048 CG ASN A 136 9.360 -21.053 29.413 1.00 0.00 C ATOM 2049 OD1 ASN A 136 8.815 -20.131 30.021 1.00 0.00 O ATOM 2050 ND2 ASN A 136 8.831 -22.268 29.332 1.00 0.00 N ATOM 0 H ASN A 136 8.794 -20.988 27.110 1.00 0.00 H new ATOM 0 HA ASN A 136 10.629 -18.893 27.813 1.00 0.00 H new ATOM 0 HB2 ASN A 136 11.087 -21.811 28.402 1.00 0.00 H new ATOM 0 HB3 ASN A 136 11.403 -20.415 29.414 1.00 0.00 H new ATOM 0 HD21 ASN A 136 7.939 -22.467 29.784 1.00 0.00 H new ATOM 0 HD22 ASN A 136 9.317 -23.003 28.818 1.00 0.00 H new ATOM 2057 N SER A 137 11.962 -21.487 26.262 1.00 0.00 N ATOM 2058 CA SER A 137 13.028 -21.887 25.351 1.00 0.00 C ATOM 2059 C SER A 137 12.513 -21.985 23.919 1.00 0.00 C ATOM 2060 O SER A 137 11.383 -22.414 23.683 1.00 0.00 O ATOM 2061 CB SER A 137 13.620 -23.230 25.785 1.00 0.00 C ATOM 2062 OG SER A 137 15.036 -23.183 25.793 1.00 0.00 O ATOM 0 H SER A 137 11.444 -22.264 26.672 1.00 0.00 H new ATOM 0 HA SER A 137 13.807 -21.125 25.386 1.00 0.00 H new ATOM 0 HB2 SER A 137 13.256 -23.487 26.780 1.00 0.00 H new ATOM 0 HB3 SER A 137 13.283 -24.016 25.109 1.00 0.00 H new ATOM 0 HG SER A 137 15.391 -24.052 26.075 1.00 0.00 H new ATOM 2068 N ALA A 138 13.348 -21.582 22.967 1.00 0.00 N ATOM 2069 CA ALA A 138 12.978 -21.621 21.558 1.00 0.00 C ATOM 2070 C ALA A 138 12.925 -23.055 21.043 1.00 0.00 C ATOM 2071 O ALA A 138 13.898 -23.561 20.483 1.00 0.00 O ATOM 2072 CB ALA A 138 13.952 -20.796 20.732 1.00 0.00 C ATOM 0 H ALA A 138 14.286 -21.224 23.146 1.00 0.00 H new ATOM 0 HA ALA A 138 11.981 -21.191 21.459 1.00 0.00 H new ATOM 0 HB1 ALA A 138 13.662 -20.835 19.682 1.00 0.00 H new ATOM 0 HB2 ALA A 138 13.935 -19.762 21.075 1.00 0.00 H new ATOM 0 HB3 ALA A 138 14.958 -21.199 20.846 1.00 0.00 H new ATOM 2078 N THR A 139 11.782 -23.706 21.234 1.00 0.00 N ATOM 2079 CA THR A 139 11.600 -25.082 20.787 1.00 0.00 C ATOM 2080 C THR A 139 10.498 -25.174 19.737 1.00 0.00 C ATOM 2081 O THR A 139 10.440 -26.133 18.967 1.00 0.00 O ATOM 2082 CB THR A 139 11.266 -25.986 21.975 1.00 0.00 C ATOM 2083 OG1 THR A 139 11.025 -27.313 21.541 1.00 0.00 O ATOM 2084 CG2 THR A 139 10.053 -25.529 22.755 1.00 0.00 C ATOM 0 H THR A 139 10.967 -23.302 21.696 1.00 0.00 H new ATOM 0 HA THR A 139 12.534 -25.417 20.335 1.00 0.00 H new ATOM 0 HB THR A 139 12.136 -25.936 22.630 1.00 0.00 H new ATOM 0 HG1 THR A 139 10.815 -27.877 22.314 1.00 0.00 H new ATOM 0 HG21 THR A 139 9.873 -26.215 23.583 1.00 0.00 H new ATOM 0 HG22 THR A 139 10.228 -24.527 23.146 1.00 0.00 H new ATOM 0 HG23 THR A 139 9.182 -25.516 22.099 1.00 0.00 H new ATOM 2092 N GLY A 140 9.628 -24.169 19.710 1.00 0.00 N ATOM 2093 CA GLY A 140 8.539 -24.153 18.749 1.00 0.00 C ATOM 2094 C GLY A 140 8.886 -23.378 17.494 1.00 0.00 C ATOM 2095 O GLY A 140 8.726 -23.881 16.381 1.00 0.00 O ATOM 0 H GLY A 140 9.657 -23.365 20.337 1.00 0.00 H new ATOM 0 HA2 GLY A 140 8.280 -25.177 18.480 1.00 0.00 H new ATOM 0 HA3 GLY A 140 7.656 -23.712 19.212 1.00 0.00 H new ATOM 2099 N VAL A 141 9.362 -22.149 17.673 1.00 0.00 N ATOM 2100 CA VAL A 141 9.733 -21.301 16.545 1.00 0.00 C ATOM 2101 C VAL A 141 11.013 -21.801 15.879 1.00 0.00 C ATOM 2102 O VAL A 141 11.987 -22.127 16.558 1.00 0.00 O ATOM 2103 CB VAL A 141 9.934 -19.834 16.977 1.00 0.00 C ATOM 2104 CG1 VAL A 141 8.605 -19.094 16.992 1.00 0.00 C ATOM 2105 CG2 VAL A 141 10.609 -19.759 18.339 1.00 0.00 C ATOM 0 H VAL A 141 9.500 -21.719 18.587 1.00 0.00 H new ATOM 0 HA VAL A 141 8.909 -21.350 15.833 1.00 0.00 H new ATOM 0 HB VAL A 141 10.586 -19.351 16.250 1.00 0.00 H new ATOM 0 HG11 VAL A 141 8.767 -18.061 17.299 1.00 0.00 H new ATOM 0 HG12 VAL A 141 8.168 -19.111 15.994 1.00 0.00 H new ATOM 0 HG13 VAL A 141 7.926 -19.579 17.694 1.00 0.00 H new ATOM 0 HG21 VAL A 141 10.740 -18.715 18.623 1.00 0.00 H new ATOM 0 HG22 VAL A 141 9.988 -20.261 19.081 1.00 0.00 H new ATOM 0 HG23 VAL A 141 11.582 -20.247 18.290 1.00 0.00 H new ATOM 2115 N PRO A 142 11.028 -21.872 14.534 1.00 0.00 N ATOM 2116 CA PRO A 142 12.197 -22.340 13.783 1.00 0.00 C ATOM 2117 C PRO A 142 13.313 -21.302 13.741 1.00 0.00 C ATOM 2118 O PRO A 142 13.089 -20.148 13.373 1.00 0.00 O ATOM 2119 CB PRO A 142 11.638 -22.581 12.380 1.00 0.00 C ATOM 2120 CG PRO A 142 10.498 -21.628 12.262 1.00 0.00 C ATOM 2121 CD PRO A 142 9.909 -21.507 13.643 1.00 0.00 C ATOM 0 HA PRO A 142 12.648 -23.223 14.236 1.00 0.00 H new ATOM 0 HB2 PRO A 142 12.392 -22.394 11.615 1.00 0.00 H new ATOM 0 HB3 PRO A 142 11.307 -23.612 12.257 1.00 0.00 H new ATOM 0 HG2 PRO A 142 10.837 -20.659 11.897 1.00 0.00 H new ATOM 0 HG3 PRO A 142 9.756 -21.994 11.553 1.00 0.00 H new ATOM 0 HD2 PRO A 142 9.554 -20.495 13.840 1.00 0.00 H new ATOM 0 HD3 PRO A 142 9.058 -22.175 13.775 1.00 0.00 H new ATOM 2129 N THR A 143 14.518 -21.722 14.117 1.00 0.00 N ATOM 2130 CA THR A 143 15.671 -20.829 14.122 1.00 0.00 C ATOM 2131 C THR A 143 16.370 -20.833 12.766 1.00 0.00 C ATOM 2132 O THR A 143 16.375 -19.826 12.057 1.00 0.00 O ATOM 2133 CB THR A 143 16.655 -21.244 15.218 1.00 0.00 C ATOM 2134 OG1 THR A 143 16.784 -22.653 15.267 1.00 0.00 O ATOM 2135 CG2 THR A 143 16.250 -20.770 16.597 1.00 0.00 C ATOM 0 H THR A 143 14.720 -22.674 14.422 1.00 0.00 H new ATOM 0 HA THR A 143 15.317 -19.818 14.323 1.00 0.00 H new ATOM 0 HB THR A 143 17.600 -20.770 14.953 1.00 0.00 H new ATOM 0 HG1 THR A 143 17.418 -22.899 15.972 1.00 0.00 H new ATOM 0 HG21 THR A 143 16.990 -21.098 17.327 1.00 0.00 H new ATOM 0 HG22 THR A 143 16.190 -19.682 16.605 1.00 0.00 H new ATOM 0 HG23 THR A 143 15.277 -21.188 16.854 1.00 0.00 H new ATOM 2143 N VAL A 144 16.958 -21.974 12.414 1.00 0.00 N ATOM 2144 CA VAL A 144 17.665 -22.117 11.143 1.00 0.00 C ATOM 2145 C VAL A 144 18.736 -21.041 10.984 1.00 0.00 C ATOM 2146 O VAL A 144 19.851 -21.235 11.511 1.00 0.00 O ATOM 2147 CB VAL A 144 16.697 -22.052 9.946 1.00 0.00 C ATOM 2148 CG1 VAL A 144 17.380 -22.545 8.679 1.00 0.00 C ATOM 2149 CG2 VAL A 144 15.438 -22.859 10.229 1.00 0.00 C ATOM 2150 OXT VAL A 144 18.450 -20.012 10.335 1.00 0.00 O ATOM 0 H VAL A 144 16.959 -22.814 12.992 1.00 0.00 H new ATOM 0 HA VAL A 144 18.141 -23.097 11.156 1.00 0.00 H new ATOM 0 HB VAL A 144 16.407 -21.012 9.795 1.00 0.00 H new ATOM 0 HG11 VAL A 144 16.681 -22.492 7.844 1.00 0.00 H new ATOM 0 HG12 VAL A 144 18.247 -21.920 8.466 1.00 0.00 H new ATOM 0 HG13 VAL A 144 17.702 -23.577 8.817 1.00 0.00 H new ATOM 0 HG21 VAL A 144 14.768 -22.800 9.372 1.00 0.00 H new ATOM 0 HG22 VAL A 144 15.706 -23.900 10.409 1.00 0.00 H new ATOM 0 HG23 VAL A 144 14.937 -22.456 11.109 1.00 0.00 H new TER 2160 VAL A 144