USER MOD reduce.3.24.130724 H: found=0, std=0, add=1318, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1314 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 94 LYS NZ :NH3+ 150:sc= 1.06 (180deg=0.0534) USER MOD Set 1.2: A 100 TYR OH : rot 150:sc= 0.956 USER MOD Set 1.3: A 110 GLN : amide:sc= 0.0024 K(o=2,f=1.4) USER MOD Set 2.1: A 22 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 62 TYR OH : rot 180:sc= -1.93! USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot 180:sc= -0.147 USER MOD Single : A 9 SER OG : rot 180:sc= -0.015 USER MOD Single : A -1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.217) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 81:sc= -0.0281 USER MOD Single : A 29 GLN : amide:sc= -0.0976 X(o=-0.098,f=-0.022) USER MOD Single : A 34 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 83:sc= 0.756 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 LYS NZ :NH3+ -137:sc= 0 (180deg=-0.0209) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= -0.419 K(o=-0.42,f=-3.8!) USER MOD Single : A 48 GLN : amide:sc= -0.402 X(o=-0.4,f=-0.4) USER MOD Single : A 53 MET CE :methyl -131:sc= -3.76 (180deg=-6.9!) USER MOD Single : A 54 GLN : amide:sc= -0.225 K(o=-0.23,f=-3.3!) USER MOD Single : A 56 HIS : no HE2:sc= -3.17! C(o=-3.2!,f=-11!) USER MOD Single : A 57 HIS : no HD1:sc= -6.89! C(o=-6.9!,f=-8.2!) USER MOD Single : A 58 GLN : amide:sc= 0.9 K(o=0.9,f=-5.3!) USER MOD Single : A 60 SER OG : rot -30:sc= 1.01 USER MOD Single : A 64 TYR OH : rot 30:sc= 0 USER MOD Single : A 65 THR OG1 : rot 85:sc= 0.828 USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ -147:sc= 0.36 (180deg=-0.581) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ -167:sc= -0.042 (180deg=-0.0925) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 TYR OH : rot 157:sc= 0.965 USER MOD Single : A 89 LYS NZ :NH3+ 169:sc= -0.0189 (180deg=-0.0922) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 ASN : amide:sc= -0.0268 X(o=-0.027,f=-0.3) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0.124 USER MOD Single : A 115 ASN : amide:sc=-0.00389 K(o=-0.0039,f=-0.87) USER MOD Single : A 116 ASN : amide:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 118 SER OG : rot 180:sc= -0.248 USER MOD Single : A 119 THR OG1 : rot 180:sc= -1.76! USER MOD Single : A 128 GLN : amide:sc=-0.00721 K(o=-0.0072,f=-1.4!) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0.037 USER MOD Single : A 139 GLN : amide:sc=-0.00142 X(o=-0.0014,f=-0.09) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 143 HIS : no HE2:sc= -0.301 K(o=-0.3,f=-2.3) USER MOD Single : A 144 GLN : amide:sc= -1.81 K(o=-1.8,f=-2.9!) USER MOD Single : A 147 HIS : no HD1:sc= -0.792 X(o=-0.79,f=-0.36) USER MOD Single : A 155 SER OG : rot 170:sc= 0.0917 USER MOD Single : A 156 THR OG1 : rot 180:sc= 0.0412 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -1 -43.629 -17.789 29.173 1.00 0.00 N ATOM 2 CA GLY A -1 -44.802 -18.451 28.537 1.00 0.00 C ATOM 3 C GLY A -1 -44.365 -19.129 27.230 1.00 0.00 C ATOM 4 O GLY A -1 -44.824 -18.771 26.162 1.00 0.00 O ATOM 0 H1 GLY A -1 -43.927 -17.330 30.058 1.00 0.00 H new ATOM 0 H2 GLY A -1 -42.899 -18.500 29.380 1.00 0.00 H new ATOM 0 H3 GLY A -1 -43.241 -17.073 28.526 1.00 0.00 H new ATOM 0 HA2 GLY A -1 -45.228 -19.189 29.216 1.00 0.00 H new ATOM 0 HA3 GLY A -1 -45.581 -17.716 28.334 1.00 0.00 H new ATOM 10 N GLY A 0 -43.481 -20.105 27.302 1.00 0.00 N ATOM 11 CA GLY A 0 -43.025 -20.793 26.058 1.00 0.00 C ATOM 12 C GLY A 0 -41.505 -20.632 25.909 1.00 0.00 C ATOM 13 O GLY A 0 -40.741 -21.315 26.568 1.00 0.00 O ATOM 0 H GLY A 0 -43.062 -20.448 28.166 1.00 0.00 H new ATOM 0 HA2 GLY A 0 -43.287 -21.850 26.098 1.00 0.00 H new ATOM 0 HA3 GLY A 0 -43.532 -20.372 25.190 1.00 0.00 H new ATOM 17 N SER A 1 -41.055 -19.737 25.052 1.00 0.00 N ATOM 18 CA SER A 1 -39.586 -19.544 24.872 1.00 0.00 C ATOM 19 C SER A 1 -39.228 -18.053 24.974 1.00 0.00 C ATOM 20 O SER A 1 -40.096 -17.209 24.867 1.00 0.00 O ATOM 21 CB SER A 1 -39.285 -20.073 23.470 1.00 0.00 C ATOM 22 OG SER A 1 -40.150 -19.441 22.536 1.00 0.00 O ATOM 0 H SER A 1 -41.645 -19.137 24.475 1.00 0.00 H new ATOM 0 HA SER A 1 -39.006 -20.062 25.636 1.00 0.00 H new ATOM 0 HB2 SER A 1 -38.245 -19.877 23.210 1.00 0.00 H new ATOM 0 HB3 SER A 1 -39.424 -21.154 23.439 1.00 0.00 H new ATOM 0 HG SER A 1 -39.959 -19.776 21.635 1.00 0.00 H new ATOM 28 N PRO A 2 -37.959 -17.766 25.180 1.00 0.00 N ATOM 29 CA PRO A 2 -37.519 -16.353 25.292 1.00 0.00 C ATOM 30 C PRO A 2 -37.548 -15.670 23.916 1.00 0.00 C ATOM 31 O PRO A 2 -36.838 -16.065 23.010 1.00 0.00 O ATOM 32 CB PRO A 2 -36.089 -16.460 25.814 1.00 0.00 C ATOM 33 CG PRO A 2 -35.619 -17.814 25.387 1.00 0.00 C ATOM 34 CD PRO A 2 -36.832 -18.704 25.325 1.00 0.00 C ATOM 0 HA PRO A 2 -38.161 -15.757 25.941 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -35.458 -15.674 25.399 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -36.056 -16.355 26.898 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -35.129 -17.763 24.415 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -34.888 -18.208 26.093 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -36.777 -19.394 24.483 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -36.930 -19.308 26.227 1.00 0.00 H new ATOM 42 N ARG A 3 -38.363 -14.647 23.747 1.00 0.00 N ATOM 43 CA ARG A 3 -38.427 -13.949 22.428 1.00 0.00 C ATOM 44 C ARG A 3 -38.089 -12.459 22.603 1.00 0.00 C ATOM 45 O ARG A 3 -38.843 -11.598 22.186 1.00 0.00 O ATOM 46 CB ARG A 3 -39.873 -14.124 21.958 1.00 0.00 C ATOM 47 CG ARG A 3 -39.894 -14.426 20.458 1.00 0.00 C ATOM 48 CD ARG A 3 -39.399 -13.201 19.684 1.00 0.00 C ATOM 49 NE ARG A 3 -39.507 -13.587 18.244 1.00 0.00 N ATOM 50 CZ ARG A 3 -38.647 -14.429 17.690 1.00 0.00 C ATOM 51 NH1 ARG A 3 -37.665 -14.959 18.383 1.00 0.00 N ATOM 52 NH2 ARG A 3 -38.773 -14.742 16.427 1.00 0.00 N ATOM 0 H ARG A 3 -38.981 -14.272 24.466 1.00 0.00 H new ATOM 0 HA ARG A 3 -37.715 -14.353 21.708 1.00 0.00 H new ATOM 0 HB2 ARG A 3 -40.349 -14.935 22.509 1.00 0.00 H new ATOM 0 HB3 ARG A 3 -40.445 -13.219 22.165 1.00 0.00 H new ATOM 0 HG2 ARG A 3 -39.262 -15.287 20.241 1.00 0.00 H new ATOM 0 HG3 ARG A 3 -40.905 -14.685 20.142 1.00 0.00 H new ATOM 0 HD2 ARG A 3 -40.006 -12.323 19.904 1.00 0.00 H new ATOM 0 HD3 ARG A 3 -38.372 -12.954 19.951 1.00 0.00 H new ATOM 0 HE ARG A 3 -40.258 -13.194 17.676 1.00 0.00 H new ATOM 0 HH11 ARG A 3 -37.552 -14.725 19.369 1.00 0.00 H new ATOM 0 HH12 ARG A 3 -37.015 -15.605 17.935 1.00 0.00 H new ATOM 0 HH21 ARG A 3 -39.530 -14.339 15.875 1.00 0.00 H new ATOM 0 HH22 ARG A 3 -38.115 -15.390 15.994 1.00 0.00 H new ATOM 66 N ILE A 4 -36.966 -12.145 23.217 1.00 0.00 N ATOM 67 CA ILE A 4 -36.595 -10.710 23.412 1.00 0.00 C ATOM 68 C ILE A 4 -35.287 -10.397 22.666 1.00 0.00 C ATOM 69 O ILE A 4 -34.538 -11.293 22.324 1.00 0.00 O ATOM 70 CB ILE A 4 -36.409 -10.548 24.925 1.00 0.00 C ATOM 71 CG1 ILE A 4 -37.715 -10.898 25.646 1.00 0.00 C ATOM 72 CG2 ILE A 4 -36.030 -9.100 25.247 1.00 0.00 C ATOM 73 CD1 ILE A 4 -37.435 -11.117 27.134 1.00 0.00 C ATOM 0 H ILE A 4 -36.297 -12.820 23.588 1.00 0.00 H new ATOM 0 HA ILE A 4 -37.352 -10.029 23.023 1.00 0.00 H new ATOM 0 HB ILE A 4 -35.616 -11.216 25.259 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -38.441 -10.095 25.516 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -38.153 -11.797 25.212 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -35.899 -8.989 26.323 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -35.099 -8.846 24.740 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -36.822 -8.432 24.907 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -38.364 -11.366 27.646 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -36.724 -11.935 27.254 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -37.017 -10.207 27.563 1.00 0.00 H new ATOM 85 N LYS A 5 -35.004 -9.135 22.410 1.00 0.00 N ATOM 86 CA LYS A 5 -33.746 -8.780 21.686 1.00 0.00 C ATOM 87 C LYS A 5 -33.019 -7.639 22.415 1.00 0.00 C ATOM 88 O LYS A 5 -33.631 -6.659 22.799 1.00 0.00 O ATOM 89 CB LYS A 5 -34.201 -8.327 20.300 1.00 0.00 C ATOM 90 CG LYS A 5 -34.223 -9.527 19.351 1.00 0.00 C ATOM 91 CD LYS A 5 -32.830 -9.733 18.755 1.00 0.00 C ATOM 92 CE LYS A 5 -32.662 -11.196 18.342 1.00 0.00 C ATOM 93 NZ LYS A 5 -33.350 -11.304 17.024 1.00 0.00 N ATOM 0 H LYS A 5 -35.591 -8.343 22.672 1.00 0.00 H new ATOM 0 HA LYS A 5 -33.050 -9.617 21.632 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -35.193 -7.879 20.360 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -33.528 -7.560 19.917 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -34.536 -10.423 19.888 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -34.949 -9.361 18.555 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -32.693 -9.082 17.891 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -32.067 -9.460 19.484 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -31.609 -11.465 18.261 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -33.107 -11.867 19.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -33.278 -12.281 16.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -34.352 -11.048 17.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -32.900 -10.659 16.344 1.00 0.00 H new ATOM 107 N THR A 6 -31.720 -7.752 22.611 1.00 0.00 N ATOM 108 CA THR A 6 -30.971 -6.666 23.318 1.00 0.00 C ATOM 109 C THR A 6 -29.524 -6.582 22.801 1.00 0.00 C ATOM 110 O THR A 6 -29.174 -7.223 21.828 1.00 0.00 O ATOM 111 CB THR A 6 -30.996 -7.060 24.800 1.00 0.00 C ATOM 112 OG1 THR A 6 -30.284 -6.090 25.555 1.00 0.00 O ATOM 113 CG2 THR A 6 -30.344 -8.434 24.990 1.00 0.00 C ATOM 0 H THR A 6 -31.154 -8.546 22.312 1.00 0.00 H new ATOM 0 HA THR A 6 -31.418 -5.686 23.151 1.00 0.00 H new ATOM 0 HB THR A 6 -32.030 -7.107 25.141 1.00 0.00 H new ATOM 0 HG1 THR A 6 -30.299 -6.338 26.503 1.00 0.00 H new ATOM 0 HG21 THR A 6 -30.367 -8.705 26.046 1.00 0.00 H new ATOM 0 HG22 THR A 6 -30.891 -9.179 24.412 1.00 0.00 H new ATOM 0 HG23 THR A 6 -29.310 -8.397 24.647 1.00 0.00 H new ATOM 121 N ARG A 7 -28.680 -5.799 23.444 1.00 0.00 N ATOM 122 CA ARG A 7 -27.262 -5.687 22.983 1.00 0.00 C ATOM 123 C ARG A 7 -26.313 -6.236 24.059 1.00 0.00 C ATOM 124 O ARG A 7 -25.810 -5.494 24.881 1.00 0.00 O ATOM 125 CB ARG A 7 -27.029 -4.189 22.774 1.00 0.00 C ATOM 126 CG ARG A 7 -27.939 -3.680 21.655 1.00 0.00 C ATOM 127 CD ARG A 7 -27.810 -2.158 21.545 1.00 0.00 C ATOM 128 NE ARG A 7 -28.643 -1.785 20.360 1.00 0.00 N ATOM 129 CZ ARG A 7 -29.966 -1.772 20.426 1.00 0.00 C ATOM 130 NH1 ARG A 7 -30.600 -2.087 21.532 1.00 0.00 N ATOM 131 NH2 ARG A 7 -30.662 -1.437 19.370 1.00 0.00 N ATOM 0 H ARG A 7 -28.915 -5.238 24.263 1.00 0.00 H new ATOM 0 HA ARG A 7 -27.076 -6.257 22.073 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -27.233 -3.647 23.697 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -25.985 -4.005 22.520 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -27.667 -4.148 20.709 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -28.974 -3.954 21.860 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -28.167 -1.665 22.449 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -26.771 -1.859 21.407 1.00 0.00 H new ATOM 0 HE ARG A 7 -28.183 -1.536 19.484 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -30.073 -2.349 22.365 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -31.620 -2.070 21.558 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -30.186 -1.188 18.503 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -31.681 -1.425 19.414 1.00 0.00 H new ATOM 145 N ARG A 8 -26.064 -7.531 24.066 1.00 0.00 N ATOM 146 CA ARG A 8 -25.144 -8.110 25.103 1.00 0.00 C ATOM 147 C ARG A 8 -23.738 -8.340 24.519 1.00 0.00 C ATOM 148 O ARG A 8 -22.747 -8.104 25.187 1.00 0.00 O ATOM 149 CB ARG A 8 -25.776 -9.445 25.524 1.00 0.00 C ATOM 150 CG ARG A 8 -26.892 -9.193 26.550 1.00 0.00 C ATOM 151 CD ARG A 8 -26.497 -9.786 27.907 1.00 0.00 C ATOM 152 NE ARG A 8 -27.726 -9.669 28.752 1.00 0.00 N ATOM 153 CZ ARG A 8 -28.776 -10.450 28.551 1.00 0.00 C ATOM 154 NH1 ARG A 8 -28.782 -11.360 27.602 1.00 0.00 N ATOM 155 NH2 ARG A 8 -29.833 -10.319 29.310 1.00 0.00 N ATOM 0 H ARG A 8 -26.454 -8.204 23.406 1.00 0.00 H new ATOM 0 HA ARG A 8 -25.026 -7.435 25.951 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -26.181 -9.957 24.651 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -25.016 -10.098 25.953 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -27.071 -8.122 26.650 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -27.823 -9.642 26.205 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -26.184 -10.825 27.808 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -25.662 -9.242 28.348 1.00 0.00 H new ATOM 0 HE ARG A 8 -27.756 -8.974 29.498 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -27.966 -11.476 27.001 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -29.603 -11.950 27.466 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -29.845 -9.618 30.051 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -30.645 -10.917 29.161 1.00 0.00 H new ATOM 169 N SER A 9 -23.633 -8.799 23.287 1.00 0.00 N ATOM 170 CA SER A 9 -22.281 -9.035 22.691 1.00 0.00 C ATOM 171 C SER A 9 -22.008 -8.025 21.566 1.00 0.00 C ATOM 172 O SER A 9 -22.925 -7.456 21.004 1.00 0.00 O ATOM 173 CB SER A 9 -22.327 -10.459 22.135 1.00 0.00 C ATOM 174 OG SER A 9 -21.466 -10.552 21.009 1.00 0.00 O ATOM 0 H SER A 9 -24.421 -9.017 22.677 1.00 0.00 H new ATOM 0 HA SER A 9 -21.485 -8.913 23.425 1.00 0.00 H new ATOM 0 HB2 SER A 9 -22.020 -11.171 22.901 1.00 0.00 H new ATOM 0 HB3 SER A 9 -23.347 -10.717 21.850 1.00 0.00 H new ATOM 0 HG SER A 9 -21.492 -11.464 20.652 1.00 0.00 H new ATOM 180 N LYS A 10 -20.754 -7.795 21.230 1.00 0.00 N ATOM 181 CA LYS A 10 -20.432 -6.822 20.141 1.00 0.00 C ATOM 182 C LYS A 10 -19.349 -7.400 19.215 1.00 0.00 C ATOM 183 O LYS A 10 -18.672 -8.339 19.583 1.00 0.00 O ATOM 184 CB LYS A 10 -19.921 -5.567 20.861 1.00 0.00 C ATOM 185 CG LYS A 10 -18.710 -5.914 21.735 1.00 0.00 C ATOM 186 CD LYS A 10 -19.170 -6.154 23.175 1.00 0.00 C ATOM 187 CE LYS A 10 -18.313 -7.251 23.811 1.00 0.00 C ATOM 188 NZ LYS A 10 -17.234 -6.524 24.534 1.00 0.00 N ATOM 0 H LYS A 10 -19.946 -8.240 21.665 1.00 0.00 H new ATOM 0 HA LYS A 10 -21.297 -6.602 19.515 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -19.645 -4.807 20.130 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -20.714 -5.144 21.477 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -18.212 -6.803 21.348 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -17.982 -5.103 21.705 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -19.087 -5.233 23.752 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -20.220 -6.445 23.188 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -18.901 -7.866 24.493 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -17.901 -7.919 23.054 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -16.604 -7.209 24.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -16.687 -5.953 23.858 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -17.656 -5.901 25.252 1.00 0.00 H new ATOM 202 N PRO A 11 -19.214 -6.826 18.038 1.00 0.00 N ATOM 203 CA PRO A 11 -18.194 -7.317 17.078 1.00 0.00 C ATOM 204 C PRO A 11 -16.781 -6.959 17.557 1.00 0.00 C ATOM 205 O PRO A 11 -16.597 -6.043 18.332 1.00 0.00 O ATOM 206 CB PRO A 11 -18.531 -6.586 15.781 1.00 0.00 C ATOM 207 CG PRO A 11 -19.251 -5.350 16.212 1.00 0.00 C ATOM 208 CD PRO A 11 -19.974 -5.688 17.490 1.00 0.00 C ATOM 0 HA PRO A 11 -18.207 -8.401 16.964 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -17.629 -6.342 15.219 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -19.155 -7.200 15.132 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -18.550 -4.530 16.370 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -19.954 -5.025 15.445 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -19.982 -4.844 18.180 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -21.014 -5.956 17.302 1.00 0.00 H new ATOM 216 N ALA A 12 -15.775 -7.679 17.093 1.00 0.00 N ATOM 217 CA ALA A 12 -14.359 -7.399 17.509 1.00 0.00 C ATOM 218 C ALA A 12 -14.185 -7.609 19.027 1.00 0.00 C ATOM 219 O ALA A 12 -15.069 -7.289 19.796 1.00 0.00 O ATOM 220 CB ALA A 12 -14.084 -5.938 17.128 1.00 0.00 C ATOM 0 H ALA A 12 -15.880 -8.454 16.439 1.00 0.00 H new ATOM 0 HA ALA A 12 -13.660 -8.075 17.016 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -13.064 -5.675 17.408 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -14.209 -5.813 16.052 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -14.783 -5.287 17.653 1.00 0.00 H new ATOM 226 N PRO A 13 -13.047 -8.146 19.420 1.00 0.00 N ATOM 227 CA PRO A 13 -12.790 -8.388 20.863 1.00 0.00 C ATOM 228 C PRO A 13 -12.498 -7.068 21.588 1.00 0.00 C ATOM 229 O PRO A 13 -12.188 -6.069 20.969 1.00 0.00 O ATOM 230 CB PRO A 13 -11.559 -9.289 20.866 1.00 0.00 C ATOM 231 CG PRO A 13 -10.859 -9.000 19.577 1.00 0.00 C ATOM 232 CD PRO A 13 -11.910 -8.575 18.585 1.00 0.00 C ATOM 0 HA PRO A 13 -13.641 -8.835 21.376 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -10.916 -9.075 21.720 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -11.840 -10.340 20.934 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -10.116 -8.214 19.711 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -10.328 -9.883 19.221 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -11.553 -7.763 17.951 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -12.189 -9.396 17.925 1.00 0.00 H new ATOM 240 N ASP A 14 -12.598 -7.057 22.904 1.00 0.00 N ATOM 241 CA ASP A 14 -12.324 -5.785 23.678 1.00 0.00 C ATOM 242 C ASP A 14 -10.991 -5.140 23.244 1.00 0.00 C ATOM 243 O ASP A 14 -10.851 -3.932 23.271 1.00 0.00 O ATOM 244 CB ASP A 14 -12.251 -6.182 25.162 1.00 0.00 C ATOM 245 CG ASP A 14 -13.667 -6.354 25.714 1.00 0.00 C ATOM 246 OD1 ASP A 14 -14.360 -5.359 25.832 1.00 0.00 O ATOM 247 OD2 ASP A 14 -14.032 -7.480 26.011 1.00 0.00 O ATOM 0 H ASP A 14 -12.855 -7.863 23.474 1.00 0.00 H new ATOM 0 HA ASP A 14 -13.110 -5.053 23.492 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -11.690 -7.110 25.274 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -11.719 -5.418 25.728 1.00 0.00 H new ATOM 252 N GLY A 15 -10.012 -5.928 22.842 1.00 0.00 N ATOM 253 CA GLY A 15 -8.701 -5.348 22.407 1.00 0.00 C ATOM 254 C GLY A 15 -8.914 -4.271 21.325 1.00 0.00 C ATOM 255 O GLY A 15 -8.186 -3.298 21.272 1.00 0.00 O ATOM 0 H GLY A 15 -10.069 -6.945 22.798 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -8.188 -4.913 23.264 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -8.059 -6.139 22.019 1.00 0.00 H new ATOM 259 N PHE A 16 -9.905 -4.425 20.462 1.00 0.00 N ATOM 260 CA PHE A 16 -10.139 -3.382 19.394 1.00 0.00 C ATOM 261 C PHE A 16 -10.299 -1.985 20.022 1.00 0.00 C ATOM 262 O PHE A 16 -9.909 -0.995 19.433 1.00 0.00 O ATOM 263 CB PHE A 16 -11.431 -3.776 18.660 1.00 0.00 C ATOM 264 CG PHE A 16 -11.638 -2.869 17.468 1.00 0.00 C ATOM 265 CD1 PHE A 16 -10.612 -2.690 16.530 1.00 0.00 C ATOM 266 CD2 PHE A 16 -12.862 -2.207 17.298 1.00 0.00 C ATOM 267 CE1 PHE A 16 -10.809 -1.851 15.427 1.00 0.00 C ATOM 268 CE2 PHE A 16 -13.057 -1.369 16.195 1.00 0.00 C ATOM 269 CZ PHE A 16 -12.032 -1.191 15.259 1.00 0.00 C ATOM 0 H PHE A 16 -10.552 -5.214 20.450 1.00 0.00 H new ATOM 0 HA PHE A 16 -9.291 -3.340 18.710 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -11.373 -4.814 18.333 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -12.282 -3.702 19.337 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -9.669 -3.200 16.658 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -13.655 -2.344 18.019 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -10.017 -1.713 14.705 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -14.000 -0.859 16.066 1.00 0.00 H new ATOM 0 HZ PHE A 16 -12.184 -0.545 14.407 1.00 0.00 H new ATOM 279 N GLU A 17 -10.864 -1.892 21.212 1.00 0.00 N ATOM 280 CA GLU A 17 -11.032 -0.536 21.859 1.00 0.00 C ATOM 281 C GLU A 17 -9.679 0.193 21.927 1.00 0.00 C ATOM 282 O GLU A 17 -9.607 1.391 21.728 1.00 0.00 O ATOM 283 CB GLU A 17 -11.567 -0.784 23.279 1.00 0.00 C ATOM 284 CG GLU A 17 -12.128 0.521 23.849 1.00 0.00 C ATOM 285 CD GLU A 17 -12.892 0.225 25.140 1.00 0.00 C ATOM 286 OE1 GLU A 17 -12.426 -0.604 25.904 1.00 0.00 O ATOM 287 OE2 GLU A 17 -13.929 0.834 25.344 1.00 0.00 O ATOM 0 H GLU A 17 -11.211 -2.681 21.757 1.00 0.00 H new ATOM 0 HA GLU A 17 -11.717 0.087 21.284 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -12.344 -1.548 23.258 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -10.769 -1.159 23.919 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -11.317 1.223 24.046 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -12.789 0.993 23.122 1.00 0.00 H new ATOM 294 N LYS A 18 -8.605 -0.522 22.197 1.00 0.00 N ATOM 295 CA LYS A 18 -7.255 0.151 22.263 1.00 0.00 C ATOM 296 C LYS A 18 -6.940 0.851 20.928 1.00 0.00 C ATOM 297 O LYS A 18 -6.325 1.899 20.910 1.00 0.00 O ATOM 298 CB LYS A 18 -6.221 -0.951 22.538 1.00 0.00 C ATOM 299 CG LYS A 18 -6.388 -1.464 23.970 1.00 0.00 C ATOM 300 CD LYS A 18 -5.215 -2.378 24.327 1.00 0.00 C ATOM 301 CE LYS A 18 -5.059 -2.439 25.847 1.00 0.00 C ATOM 302 NZ LYS A 18 -6.252 -3.192 26.324 1.00 0.00 N ATOM 0 H LYS A 18 -8.601 -1.527 22.372 1.00 0.00 H new ATOM 0 HA LYS A 18 -7.237 0.909 23.046 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -6.350 -1.770 21.830 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -5.213 -0.562 22.395 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -6.433 -0.625 24.665 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -7.328 -2.008 24.065 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -5.385 -3.378 23.928 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -4.298 -2.005 23.871 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -4.135 -2.943 26.129 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -5.023 -1.440 26.281 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -6.114 -3.468 27.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -7.097 -2.590 26.246 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -6.380 -4.045 25.743 1.00 0.00 H new ATOM 316 N ILE A 19 -7.357 0.286 19.813 1.00 0.00 N ATOM 317 CA ILE A 19 -7.076 0.936 18.492 1.00 0.00 C ATOM 318 C ILE A 19 -8.393 1.319 17.784 1.00 0.00 C ATOM 319 O ILE A 19 -8.496 1.228 16.576 1.00 0.00 O ATOM 320 CB ILE A 19 -6.292 -0.106 17.673 1.00 0.00 C ATOM 321 CG1 ILE A 19 -7.142 -1.370 17.447 1.00 0.00 C ATOM 322 CG2 ILE A 19 -5.013 -0.488 18.425 1.00 0.00 C ATOM 323 CD1 ILE A 19 -6.935 -1.888 16.019 1.00 0.00 C ATOM 0 H ILE A 19 -7.876 -0.591 19.764 1.00 0.00 H new ATOM 0 HA ILE A 19 -6.507 1.858 18.609 1.00 0.00 H new ATOM 0 HB ILE A 19 -6.042 0.329 16.705 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.863 -2.140 18.167 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -8.196 -1.145 17.613 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -4.457 -1.226 17.846 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -4.397 0.399 18.569 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -5.274 -0.910 19.396 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -7.539 -2.782 15.865 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -7.236 -1.120 15.306 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -5.883 -2.130 15.869 1.00 0.00 H new ATOM 335 N LYS A 20 -9.406 1.733 18.525 1.00 0.00 N ATOM 336 CA LYS A 20 -10.715 2.101 17.871 1.00 0.00 C ATOM 337 C LYS A 20 -10.736 3.548 17.321 1.00 0.00 C ATOM 338 O LYS A 20 -11.238 3.760 16.234 1.00 0.00 O ATOM 339 CB LYS A 20 -11.799 1.935 18.949 1.00 0.00 C ATOM 340 CG LYS A 20 -13.179 1.812 18.285 1.00 0.00 C ATOM 341 CD LYS A 20 -14.137 2.853 18.875 1.00 0.00 C ATOM 342 CE LYS A 20 -14.061 4.144 18.055 1.00 0.00 C ATOM 343 NZ LYS A 20 -14.056 5.240 19.065 1.00 0.00 N ATOM 0 H LYS A 20 -9.384 1.831 19.540 1.00 0.00 H new ATOM 0 HA LYS A 20 -10.880 1.456 17.008 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -11.594 1.049 19.550 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -11.786 2.789 19.626 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -13.088 1.957 17.209 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -13.578 0.809 18.439 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -15.156 2.467 18.871 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -13.876 3.054 19.914 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -13.161 4.169 17.440 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -14.911 4.233 17.379 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -14.005 6.159 18.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -14.927 5.195 19.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -13.232 5.132 19.690 1.00 0.00 H new ATOM 357 N PRO A 21 -10.234 4.511 18.075 1.00 0.00 N ATOM 358 CA PRO A 21 -10.273 5.919 17.600 1.00 0.00 C ATOM 359 C PRO A 21 -9.217 6.181 16.513 1.00 0.00 C ATOM 360 O PRO A 21 -9.468 6.927 15.583 1.00 0.00 O ATOM 361 CB PRO A 21 -9.985 6.736 18.854 1.00 0.00 C ATOM 362 CG PRO A 21 -9.227 5.821 19.761 1.00 0.00 C ATOM 363 CD PRO A 21 -9.595 4.404 19.396 1.00 0.00 C ATOM 0 HA PRO A 21 -11.227 6.174 17.139 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -9.402 7.626 18.617 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -10.909 7.076 19.322 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -8.154 5.977 19.652 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -9.475 6.024 20.803 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -8.714 3.763 19.359 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -10.274 3.970 20.130 1.00 0.00 H new ATOM 371 N THR A 22 -8.044 5.588 16.611 1.00 0.00 N ATOM 372 CA THR A 22 -6.999 5.843 15.552 1.00 0.00 C ATOM 373 C THR A 22 -7.518 5.380 14.185 1.00 0.00 C ATOM 374 O THR A 22 -7.384 6.084 13.200 1.00 0.00 O ATOM 375 CB THR A 22 -5.751 5.039 15.949 1.00 0.00 C ATOM 376 OG1 THR A 22 -5.339 5.422 17.254 1.00 0.00 O ATOM 377 CG2 THR A 22 -4.623 5.317 14.953 1.00 0.00 C ATOM 0 H THR A 22 -7.767 4.952 17.359 1.00 0.00 H new ATOM 0 HA THR A 22 -6.765 6.905 15.479 1.00 0.00 H new ATOM 0 HB THR A 22 -5.986 3.975 15.939 1.00 0.00 H new ATOM 0 HG1 THR A 22 -4.544 4.909 17.510 1.00 0.00 H new ATOM 0 HG21 THR A 22 -3.739 4.746 15.236 1.00 0.00 H new ATOM 0 HG22 THR A 22 -4.940 5.023 13.953 1.00 0.00 H new ATOM 0 HG23 THR A 22 -4.386 6.381 14.960 1.00 0.00 H new ATOM 385 N LEU A 23 -8.117 4.212 14.114 1.00 0.00 N ATOM 386 CA LEU A 23 -8.649 3.733 12.790 1.00 0.00 C ATOM 387 C LEU A 23 -9.747 4.689 12.297 1.00 0.00 C ATOM 388 O LEU A 23 -9.836 4.975 11.118 1.00 0.00 O ATOM 389 CB LEU A 23 -9.230 2.331 13.023 1.00 0.00 C ATOM 390 CG LEU A 23 -8.124 1.290 12.849 1.00 0.00 C ATOM 391 CD1 LEU A 23 -8.379 0.110 13.790 1.00 0.00 C ATOM 392 CD2 LEU A 23 -8.114 0.798 11.401 1.00 0.00 C ATOM 0 H LEU A 23 -8.260 3.578 14.900 1.00 0.00 H new ATOM 0 HA LEU A 23 -7.863 3.704 12.035 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -9.655 2.263 14.024 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -10.040 2.139 12.319 1.00 0.00 H new ATOM 0 HG LEU A 23 -7.160 1.739 13.087 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -7.590 -0.632 13.665 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -8.386 0.462 14.822 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -9.342 -0.342 13.554 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -7.326 0.056 11.274 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -9.078 0.348 11.163 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -7.931 1.639 10.732 1.00 0.00 H new ATOM 404 N THR A 24 -10.583 5.196 13.188 1.00 0.00 N ATOM 405 CA THR A 24 -11.667 6.145 12.739 1.00 0.00 C ATOM 406 C THR A 24 -11.054 7.349 12.005 1.00 0.00 C ATOM 407 O THR A 24 -11.634 7.857 11.063 1.00 0.00 O ATOM 408 CB THR A 24 -12.400 6.614 14.008 1.00 0.00 C ATOM 409 OG1 THR A 24 -12.539 5.518 14.903 1.00 0.00 O ATOM 410 CG2 THR A 24 -13.786 7.148 13.633 1.00 0.00 C ATOM 0 H THR A 24 -10.562 4.998 14.188 1.00 0.00 H new ATOM 0 HA THR A 24 -12.353 5.654 12.049 1.00 0.00 H new ATOM 0 HB THR A 24 -11.826 7.407 14.488 1.00 0.00 H new ATOM 0 HG1 THR A 24 -11.701 5.388 15.394 1.00 0.00 H new ATOM 0 HG21 THR A 24 -14.304 7.480 14.533 1.00 0.00 H new ATOM 0 HG22 THR A 24 -13.679 7.987 12.946 1.00 0.00 H new ATOM 0 HG23 THR A 24 -14.363 6.357 13.153 1.00 0.00 H new ATOM 418 N ASP A 25 -9.886 7.810 12.415 1.00 0.00 N ATOM 419 CA ASP A 25 -9.258 8.987 11.703 1.00 0.00 C ATOM 420 C ASP A 25 -9.091 8.669 10.207 1.00 0.00 C ATOM 421 O ASP A 25 -9.295 9.524 9.365 1.00 0.00 O ATOM 422 CB ASP A 25 -7.882 9.217 12.349 1.00 0.00 C ATOM 423 CG ASP A 25 -8.016 10.228 13.490 1.00 0.00 C ATOM 424 OD1 ASP A 25 -8.295 11.381 13.203 1.00 0.00 O ATOM 425 OD2 ASP A 25 -7.836 9.833 14.630 1.00 0.00 O ATOM 0 H ASP A 25 -9.348 7.433 13.195 1.00 0.00 H new ATOM 0 HA ASP A 25 -9.884 9.875 11.789 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -7.485 8.275 12.728 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -7.176 9.584 11.604 1.00 0.00 H new ATOM 430 N PHE A 26 -8.728 7.447 9.867 1.00 0.00 N ATOM 431 CA PHE A 26 -8.561 7.095 8.409 1.00 0.00 C ATOM 432 C PHE A 26 -9.881 7.327 7.657 1.00 0.00 C ATOM 433 O PHE A 26 -9.882 7.805 6.538 1.00 0.00 O ATOM 434 CB PHE A 26 -8.192 5.603 8.356 1.00 0.00 C ATOM 435 CG PHE A 26 -6.702 5.446 8.517 1.00 0.00 C ATOM 436 CD1 PHE A 26 -6.131 5.462 9.794 1.00 0.00 C ATOM 437 CD2 PHE A 26 -5.892 5.282 7.388 1.00 0.00 C ATOM 438 CE1 PHE A 26 -4.748 5.314 9.943 1.00 0.00 C ATOM 439 CE2 PHE A 26 -4.509 5.134 7.536 1.00 0.00 C ATOM 440 CZ PHE A 26 -3.938 5.150 8.814 1.00 0.00 C ATOM 0 H PHE A 26 -8.543 6.689 10.523 1.00 0.00 H new ATOM 0 HA PHE A 26 -7.793 7.712 7.943 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -8.713 5.061 9.145 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -8.513 5.172 7.408 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -6.758 5.589 10.664 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -6.334 5.270 6.403 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -4.306 5.326 10.928 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -3.883 5.008 6.665 1.00 0.00 H new ATOM 0 HZ PHE A 26 -2.870 5.036 8.929 1.00 0.00 H new ATOM 450 N GLU A 27 -11.004 6.986 8.256 1.00 0.00 N ATOM 451 CA GLU A 27 -12.320 7.190 7.549 1.00 0.00 C ATOM 452 C GLU A 27 -12.564 8.677 7.228 1.00 0.00 C ATOM 453 O GLU A 27 -13.322 8.983 6.329 1.00 0.00 O ATOM 454 CB GLU A 27 -13.417 6.668 8.491 1.00 0.00 C ATOM 455 CG GLU A 27 -13.289 5.150 8.629 1.00 0.00 C ATOM 456 CD GLU A 27 -14.198 4.466 7.607 1.00 0.00 C ATOM 457 OE1 GLU A 27 -15.399 4.674 7.678 1.00 0.00 O ATOM 458 OE2 GLU A 27 -13.680 3.746 6.770 1.00 0.00 O ATOM 0 H GLU A 27 -11.068 6.581 9.190 1.00 0.00 H new ATOM 0 HA GLU A 27 -12.321 6.656 6.599 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -13.328 7.142 9.469 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -14.401 6.927 8.100 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -12.254 4.846 8.472 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -13.562 4.842 9.638 1.00 0.00 H new ATOM 465 N ILE A 28 -11.938 9.604 7.931 1.00 0.00 N ATOM 466 CA ILE A 28 -12.173 11.058 7.606 1.00 0.00 C ATOM 467 C ILE A 28 -11.308 11.463 6.396 1.00 0.00 C ATOM 468 O ILE A 28 -11.743 12.236 5.562 1.00 0.00 O ATOM 469 CB ILE A 28 -11.810 11.860 8.881 1.00 0.00 C ATOM 470 CG1 ILE A 28 -12.916 11.673 9.925 1.00 0.00 C ATOM 471 CG2 ILE A 28 -11.685 13.358 8.567 1.00 0.00 C ATOM 472 CD1 ILE A 28 -12.721 10.346 10.661 1.00 0.00 C ATOM 0 H ILE A 28 -11.290 9.423 8.698 1.00 0.00 H new ATOM 0 HA ILE A 28 -13.208 11.258 7.330 1.00 0.00 H new ATOM 0 HB ILE A 28 -10.855 11.494 9.259 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -12.900 12.499 10.636 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -13.892 11.689 9.440 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -11.430 13.900 9.477 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -10.903 13.510 7.823 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -12.633 13.729 8.178 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -13.511 10.221 11.401 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -12.760 9.524 9.946 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -11.752 10.346 11.161 1.00 0.00 H new ATOM 484 N GLN A 29 -10.107 10.937 6.273 1.00 0.00 N ATOM 485 CA GLN A 29 -9.270 11.296 5.079 1.00 0.00 C ATOM 486 C GLN A 29 -9.722 10.447 3.881 1.00 0.00 C ATOM 487 O GLN A 29 -9.764 10.926 2.763 1.00 0.00 O ATOM 488 CB GLN A 29 -7.811 10.987 5.448 1.00 0.00 C ATOM 489 CG GLN A 29 -6.897 11.364 4.280 1.00 0.00 C ATOM 490 CD GLN A 29 -5.499 11.703 4.812 1.00 0.00 C ATOM 491 OE1 GLN A 29 -5.324 12.697 5.489 1.00 0.00 O ATOM 492 NE2 GLN A 29 -4.485 10.918 4.536 1.00 0.00 N ATOM 0 H GLN A 29 -9.678 10.288 6.933 1.00 0.00 H new ATOM 0 HA GLN A 29 -9.374 12.347 4.809 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -7.525 11.543 6.341 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -7.701 9.928 5.683 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -6.837 10.539 3.570 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -7.310 12.218 3.742 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -4.627 10.083 3.968 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -3.555 11.143 4.889 1.00 0.00 H new ATOM 501 N LEU A 30 -10.082 9.194 4.103 1.00 0.00 N ATOM 502 CA LEU A 30 -10.553 8.345 2.955 1.00 0.00 C ATOM 503 C LEU A 30 -11.952 8.797 2.501 1.00 0.00 C ATOM 504 O LEU A 30 -12.262 8.734 1.325 1.00 0.00 O ATOM 505 CB LEU A 30 -10.597 6.894 3.463 1.00 0.00 C ATOM 506 CG LEU A 30 -10.116 5.955 2.357 1.00 0.00 C ATOM 507 CD1 LEU A 30 -9.365 4.775 2.976 1.00 0.00 C ATOM 508 CD2 LEU A 30 -11.323 5.438 1.570 1.00 0.00 C ATOM 0 H LEU A 30 -10.070 8.733 5.013 1.00 0.00 H new ATOM 0 HA LEU A 30 -9.884 8.436 2.099 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -9.967 6.787 4.346 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -11.612 6.632 3.762 1.00 0.00 H new ATOM 0 HG LEU A 30 -9.448 6.495 1.686 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -9.023 4.107 2.186 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -8.506 5.144 3.536 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -10.030 4.232 3.648 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -10.983 4.768 0.780 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -11.991 4.898 2.241 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -11.856 6.279 1.127 1.00 0.00 H new ATOM 520 N ARG A 31 -12.803 9.261 3.405 1.00 0.00 N ATOM 521 CA ARG A 31 -14.168 9.714 2.955 1.00 0.00 C ATOM 522 C ARG A 31 -14.045 11.023 2.154 1.00 0.00 C ATOM 523 O ARG A 31 -14.750 11.219 1.180 1.00 0.00 O ATOM 524 CB ARG A 31 -15.036 9.906 4.222 1.00 0.00 C ATOM 525 CG ARG A 31 -14.557 11.114 5.039 1.00 0.00 C ATOM 526 CD ARG A 31 -15.451 11.280 6.278 1.00 0.00 C ATOM 527 NE ARG A 31 -16.859 11.453 5.767 1.00 0.00 N ATOM 528 CZ ARG A 31 -17.905 11.128 6.515 1.00 0.00 C ATOM 529 NH1 ARG A 31 -17.763 10.687 7.744 1.00 0.00 N ATOM 530 NH2 ARG A 31 -19.112 11.267 6.030 1.00 0.00 N ATOM 0 H ARG A 31 -12.616 9.343 4.404 1.00 0.00 H new ATOM 0 HA ARG A 31 -14.633 8.976 2.301 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -16.078 10.047 3.935 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -14.993 9.007 4.836 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -13.519 10.974 5.342 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -14.592 12.016 4.429 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -15.378 10.409 6.929 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -15.143 12.144 6.867 1.00 0.00 H new ATOM 0 HE ARG A 31 -17.010 11.826 4.830 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -16.831 10.587 8.146 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -18.585 10.444 8.297 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -19.243 11.623 5.083 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -19.922 11.019 6.599 1.00 0.00 H new ATOM 544 N ASP A 32 -13.151 11.918 2.540 1.00 0.00 N ATOM 545 CA ASP A 32 -13.004 13.196 1.758 1.00 0.00 C ATOM 546 C ASP A 32 -12.491 12.878 0.346 1.00 0.00 C ATOM 547 O ASP A 32 -12.927 13.474 -0.619 1.00 0.00 O ATOM 548 CB ASP A 32 -11.990 14.071 2.513 1.00 0.00 C ATOM 549 CG ASP A 32 -12.681 14.749 3.697 1.00 0.00 C ATOM 550 OD1 ASP A 32 -13.259 14.041 4.505 1.00 0.00 O ATOM 551 OD2 ASP A 32 -12.621 15.965 3.775 1.00 0.00 O ATOM 0 H ASP A 32 -12.531 11.821 3.344 1.00 0.00 H new ATOM 0 HA ASP A 32 -13.958 13.714 1.661 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -11.158 13.461 2.865 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -11.573 14.823 1.843 1.00 0.00 H new ATOM 556 N ALA A 33 -11.576 11.934 0.212 1.00 0.00 N ATOM 557 CA ALA A 33 -11.065 11.590 -1.161 1.00 0.00 C ATOM 558 C ALA A 33 -12.196 10.958 -1.986 1.00 0.00 C ATOM 559 O ALA A 33 -12.345 11.246 -3.160 1.00 0.00 O ATOM 560 CB ALA A 33 -9.926 10.577 -0.970 1.00 0.00 C ATOM 0 H ALA A 33 -11.169 11.398 0.979 1.00 0.00 H new ATOM 0 HA ALA A 33 -10.713 12.477 -1.687 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -9.522 10.296 -1.943 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -9.138 11.025 -0.365 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -10.309 9.689 -0.466 1.00 0.00 H new ATOM 566 N GLN A 34 -12.997 10.099 -1.386 1.00 0.00 N ATOM 567 CA GLN A 34 -14.119 9.458 -2.159 1.00 0.00 C ATOM 568 C GLN A 34 -15.071 10.532 -2.717 1.00 0.00 C ATOM 569 O GLN A 34 -15.600 10.383 -3.802 1.00 0.00 O ATOM 570 CB GLN A 34 -14.874 8.547 -1.177 1.00 0.00 C ATOM 571 CG GLN A 34 -14.151 7.204 -1.063 1.00 0.00 C ATOM 572 CD GLN A 34 -15.093 6.166 -0.441 1.00 0.00 C ATOM 573 OE1 GLN A 34 -15.609 6.374 0.638 1.00 0.00 O ATOM 574 NE2 GLN A 34 -15.343 5.047 -1.077 1.00 0.00 N ATOM 0 H GLN A 34 -12.924 9.817 -0.408 1.00 0.00 H new ATOM 0 HA GLN A 34 -13.729 8.890 -3.004 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -14.935 9.023 -0.198 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -15.897 8.393 -1.521 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -13.825 6.870 -2.048 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -13.256 7.312 -0.450 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -14.911 4.868 -1.984 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -15.969 4.355 -0.665 1.00 0.00 H new ATOM 583 N LYS A 35 -15.300 11.611 -1.989 1.00 0.00 N ATOM 584 CA LYS A 35 -16.229 12.675 -2.508 1.00 0.00 C ATOM 585 C LYS A 35 -15.444 13.789 -3.223 1.00 0.00 C ATOM 586 O LYS A 35 -15.906 14.336 -4.207 1.00 0.00 O ATOM 587 CB LYS A 35 -16.959 13.237 -1.280 1.00 0.00 C ATOM 588 CG LYS A 35 -18.106 12.301 -0.895 1.00 0.00 C ATOM 589 CD LYS A 35 -18.365 12.399 0.609 1.00 0.00 C ATOM 590 CE LYS A 35 -19.795 11.947 0.912 1.00 0.00 C ATOM 591 NZ LYS A 35 -19.994 12.246 2.359 1.00 0.00 N ATOM 0 H LYS A 35 -14.890 11.797 -1.074 1.00 0.00 H new ATOM 0 HA LYS A 35 -16.928 12.265 -3.237 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -16.264 13.340 -0.446 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -17.346 14.233 -1.498 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -19.007 12.567 -1.448 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -17.858 11.275 -1.165 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -17.653 11.778 1.152 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -18.217 13.424 0.948 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -20.517 12.482 0.295 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -19.925 10.884 0.707 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -20.954 11.963 2.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -19.297 11.718 2.922 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -19.871 13.266 2.523 1.00 0.00 H new ATOM 605 N ASP A 36 -14.265 14.134 -2.745 1.00 0.00 N ATOM 606 CA ASP A 36 -13.470 15.223 -3.424 1.00 0.00 C ATOM 607 C ASP A 36 -13.230 14.869 -4.902 1.00 0.00 C ATOM 608 O ASP A 36 -13.250 15.734 -5.758 1.00 0.00 O ATOM 609 CB ASP A 36 -12.127 15.321 -2.682 1.00 0.00 C ATOM 610 CG ASP A 36 -12.286 16.215 -1.451 1.00 0.00 C ATOM 611 OD1 ASP A 36 -13.350 16.185 -0.855 1.00 0.00 O ATOM 612 OD2 ASP A 36 -11.341 16.913 -1.124 1.00 0.00 O ATOM 0 H ASP A 36 -13.822 13.717 -1.926 1.00 0.00 H new ATOM 0 HA ASP A 36 -14.007 16.171 -3.394 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -11.792 14.328 -2.382 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -11.363 15.729 -3.344 1.00 0.00 H new ATOM 617 N LYS A 37 -12.998 13.606 -5.215 1.00 0.00 N ATOM 618 CA LYS A 37 -12.757 13.224 -6.656 1.00 0.00 C ATOM 619 C LYS A 37 -13.940 13.667 -7.532 1.00 0.00 C ATOM 620 O LYS A 37 -13.752 14.133 -8.640 1.00 0.00 O ATOM 621 CB LYS A 37 -12.622 11.693 -6.692 1.00 0.00 C ATOM 622 CG LYS A 37 -11.875 11.277 -7.961 1.00 0.00 C ATOM 623 CD LYS A 37 -12.865 11.159 -9.122 1.00 0.00 C ATOM 624 CE LYS A 37 -12.307 10.199 -10.174 1.00 0.00 C ATOM 625 NZ LYS A 37 -13.289 10.244 -11.294 1.00 0.00 N ATOM 0 H LYS A 37 -12.965 12.835 -4.548 1.00 0.00 H new ATOM 0 HA LYS A 37 -11.860 13.709 -7.041 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -12.085 11.344 -5.810 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -13.608 11.230 -6.669 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -11.105 12.011 -8.199 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -11.369 10.324 -7.802 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -13.827 10.797 -8.758 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -13.040 12.139 -9.565 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -11.316 10.509 -10.505 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -12.209 9.189 -9.775 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -12.975 9.610 -12.056 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -14.222 9.938 -10.950 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -13.356 11.216 -11.658 1.00 0.00 H new ATOM 639 N SER A 38 -15.163 13.529 -7.050 1.00 0.00 N ATOM 640 CA SER A 38 -16.356 13.945 -7.861 1.00 0.00 C ATOM 641 C SER A 38 -16.318 13.297 -9.258 1.00 0.00 C ATOM 642 O SER A 38 -15.558 12.378 -9.495 1.00 0.00 O ATOM 643 CB SER A 38 -16.259 15.468 -7.975 1.00 0.00 C ATOM 644 OG SER A 38 -15.952 16.016 -6.698 1.00 0.00 O ATOM 0 H SER A 38 -15.381 13.146 -6.130 1.00 0.00 H new ATOM 0 HA SER A 38 -17.289 13.630 -7.394 1.00 0.00 H new ATOM 0 HB2 SER A 38 -15.489 15.742 -8.696 1.00 0.00 H new ATOM 0 HB3 SER A 38 -17.200 15.877 -8.343 1.00 0.00 H new ATOM 0 HG SER A 38 -14.985 15.970 -6.546 1.00 0.00 H new ATOM 650 N SER A 39 -17.132 13.767 -10.184 1.00 0.00 N ATOM 651 CA SER A 39 -17.131 13.170 -11.554 1.00 0.00 C ATOM 652 C SER A 39 -17.340 14.264 -12.612 1.00 0.00 C ATOM 653 O SER A 39 -18.331 14.967 -12.592 1.00 0.00 O ATOM 654 CB SER A 39 -18.302 12.189 -11.558 1.00 0.00 C ATOM 655 OG SER A 39 -18.021 11.125 -12.457 1.00 0.00 O ATOM 0 H SER A 39 -17.791 14.533 -10.045 1.00 0.00 H new ATOM 0 HA SER A 39 -16.187 12.679 -11.790 1.00 0.00 H new ATOM 0 HB2 SER A 39 -18.467 11.798 -10.554 1.00 0.00 H new ATOM 0 HB3 SER A 39 -19.218 12.700 -11.856 1.00 0.00 H new ATOM 0 HG SER A 39 -18.770 10.493 -12.460 1.00 0.00 H new ATOM 661 N LYS A 40 -16.414 14.416 -13.544 1.00 0.00 N ATOM 662 CA LYS A 40 -16.565 15.467 -14.605 1.00 0.00 C ATOM 663 C LYS A 40 -16.842 16.846 -13.976 1.00 0.00 C ATOM 664 O LYS A 40 -17.912 17.404 -14.142 1.00 0.00 O ATOM 665 CB LYS A 40 -17.753 15.012 -15.459 1.00 0.00 C ATOM 666 CG LYS A 40 -17.522 15.424 -16.915 1.00 0.00 C ATOM 667 CD LYS A 40 -18.093 16.825 -17.145 1.00 0.00 C ATOM 668 CE LYS A 40 -18.320 17.044 -18.642 1.00 0.00 C ATOM 669 NZ LYS A 40 -16.963 17.293 -19.205 1.00 0.00 N ATOM 0 H LYS A 40 -15.564 13.856 -13.611 1.00 0.00 H new ATOM 0 HA LYS A 40 -15.657 15.576 -15.198 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -17.871 13.931 -15.390 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -18.675 15.458 -15.086 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -16.456 15.412 -17.143 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -17.999 14.710 -17.586 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -19.032 16.940 -16.603 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -17.407 17.577 -16.757 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -18.785 16.172 -19.103 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -18.983 17.890 -18.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -17.007 18.081 -19.882 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -16.307 17.535 -18.435 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -16.626 16.437 -19.691 1.00 0.00 H new ATOM 683 N LEU A 41 -15.889 17.402 -13.255 1.00 0.00 N ATOM 684 CA LEU A 41 -16.111 18.739 -12.625 1.00 0.00 C ATOM 685 C LEU A 41 -14.806 19.554 -12.629 1.00 0.00 C ATOM 686 O LEU A 41 -14.749 20.632 -13.190 1.00 0.00 O ATOM 687 CB LEU A 41 -16.551 18.436 -11.192 1.00 0.00 C ATOM 688 CG LEU A 41 -17.587 19.470 -10.747 1.00 0.00 C ATOM 689 CD1 LEU A 41 -18.398 18.911 -9.576 1.00 0.00 C ATOM 690 CD2 LEU A 41 -16.873 20.749 -10.305 1.00 0.00 C ATOM 0 H LEU A 41 -14.974 16.986 -13.080 1.00 0.00 H new ATOM 0 HA LEU A 41 -16.854 19.329 -13.162 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -16.974 17.433 -11.135 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -15.690 18.457 -10.524 1.00 0.00 H new ATOM 0 HG LEU A 41 -18.256 19.694 -11.578 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -19.136 19.648 -9.260 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -18.907 17.999 -9.888 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -17.730 18.687 -8.745 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -17.610 21.486 -9.988 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -16.204 20.524 -9.474 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -16.295 21.149 -11.138 1.00 0.00 H new ATOM 702 N ALA A 42 -13.757 19.051 -12.008 1.00 0.00 N ATOM 703 CA ALA A 42 -12.467 19.806 -11.985 1.00 0.00 C ATOM 704 C ALA A 42 -11.310 18.887 -12.407 1.00 0.00 C ATOM 705 O ALA A 42 -11.532 17.824 -12.955 1.00 0.00 O ATOM 706 CB ALA A 42 -12.299 20.254 -10.532 1.00 0.00 C ATOM 0 H ALA A 42 -13.744 18.155 -11.521 1.00 0.00 H new ATOM 0 HA ALA A 42 -12.467 20.651 -12.673 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -11.372 20.817 -10.430 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -13.140 20.885 -10.246 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -12.265 19.379 -9.883 1.00 0.00 H new ATOM 712 N ALA A 43 -10.077 19.283 -12.158 1.00 0.00 N ATOM 713 CA ALA A 43 -8.921 18.419 -12.550 1.00 0.00 C ATOM 714 C ALA A 43 -8.193 17.907 -11.297 1.00 0.00 C ATOM 715 O ALA A 43 -8.675 18.065 -10.192 1.00 0.00 O ATOM 716 CB ALA A 43 -8.003 19.325 -13.373 1.00 0.00 C ATOM 0 H ALA A 43 -9.828 20.162 -11.703 1.00 0.00 H new ATOM 0 HA ALA A 43 -9.236 17.542 -13.115 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -7.129 18.760 -13.697 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -8.542 19.693 -14.246 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -7.683 20.169 -12.763 1.00 0.00 H new ATOM 722 N LYS A 44 -7.034 17.293 -11.455 1.00 0.00 N ATOM 723 CA LYS A 44 -6.278 16.772 -10.267 1.00 0.00 C ATOM 724 C LYS A 44 -7.175 15.864 -9.405 1.00 0.00 C ATOM 725 O LYS A 44 -7.222 16.005 -8.198 1.00 0.00 O ATOM 726 CB LYS A 44 -5.852 18.013 -9.477 1.00 0.00 C ATOM 727 CG LYS A 44 -4.686 17.655 -8.553 1.00 0.00 C ATOM 728 CD LYS A 44 -4.738 18.533 -7.302 1.00 0.00 C ATOM 729 CE LYS A 44 -3.880 19.782 -7.518 1.00 0.00 C ATOM 730 NZ LYS A 44 -3.514 20.237 -6.148 1.00 0.00 N ATOM 0 H LYS A 44 -6.583 17.132 -12.356 1.00 0.00 H new ATOM 0 HA LYS A 44 -5.421 16.170 -10.569 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -5.557 18.809 -10.161 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -6.691 18.390 -8.892 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -4.739 16.603 -8.274 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -3.739 17.800 -9.073 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -5.768 18.819 -7.088 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -4.376 17.975 -6.438 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -2.993 19.554 -8.109 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -4.432 20.553 -8.056 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -2.924 21.091 -6.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -4.378 20.452 -5.611 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -2.984 19.486 -5.663 1.00 0.00 H new ATOM 744 N SER A 45 -7.887 14.935 -10.013 1.00 0.00 N ATOM 745 CA SER A 45 -8.774 14.028 -9.208 1.00 0.00 C ATOM 746 C SER A 45 -8.068 12.692 -8.923 1.00 0.00 C ATOM 747 O SER A 45 -8.180 12.151 -7.840 1.00 0.00 O ATOM 748 CB SER A 45 -10.030 13.801 -10.057 1.00 0.00 C ATOM 749 OG SER A 45 -10.195 14.892 -10.954 1.00 0.00 O ATOM 0 H SER A 45 -7.892 14.768 -11.019 1.00 0.00 H new ATOM 0 HA SER A 45 -9.020 14.469 -8.242 1.00 0.00 H new ATOM 0 HB2 SER A 45 -9.943 12.868 -10.614 1.00 0.00 H new ATOM 0 HB3 SER A 45 -10.905 13.708 -9.414 1.00 0.00 H new ATOM 0 HG SER A 45 -10.996 14.749 -11.499 1.00 0.00 H new ATOM 755 N ASN A 46 -7.340 12.154 -9.881 1.00 0.00 N ATOM 756 CA ASN A 46 -6.630 10.843 -9.635 1.00 0.00 C ATOM 757 C ASN A 46 -5.690 10.963 -8.422 1.00 0.00 C ATOM 758 O ASN A 46 -5.546 10.027 -7.659 1.00 0.00 O ATOM 759 CB ASN A 46 -5.815 10.536 -10.902 1.00 0.00 C ATOM 760 CG ASN A 46 -6.768 10.211 -12.059 1.00 0.00 C ATOM 761 OD1 ASN A 46 -7.872 10.717 -12.106 1.00 0.00 O ATOM 762 ND2 ASN A 46 -6.392 9.384 -13.004 1.00 0.00 N ATOM 0 H ASN A 46 -7.206 12.556 -10.809 1.00 0.00 H new ATOM 0 HA ASN A 46 -7.345 10.048 -9.423 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -5.190 11.391 -11.161 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -5.146 9.695 -10.721 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -7.025 9.168 -13.774 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -5.466 8.957 -12.969 1.00 0.00 H new ATOM 769 N GLU A 47 -5.049 12.102 -8.234 1.00 0.00 N ATOM 770 CA GLU A 47 -4.122 12.249 -7.052 1.00 0.00 C ATOM 771 C GLU A 47 -4.888 11.999 -5.742 1.00 0.00 C ATOM 772 O GLU A 47 -4.371 11.376 -4.834 1.00 0.00 O ATOM 773 CB GLU A 47 -3.586 13.690 -7.083 1.00 0.00 C ATOM 774 CG GLU A 47 -2.737 13.893 -8.339 1.00 0.00 C ATOM 775 CD GLU A 47 -1.625 14.903 -8.048 1.00 0.00 C ATOM 776 OE1 GLU A 47 -1.906 15.886 -7.381 1.00 0.00 O ATOM 777 OE2 GLU A 47 -0.513 14.676 -8.494 1.00 0.00 O ATOM 0 H GLU A 47 -5.125 12.922 -8.835 1.00 0.00 H new ATOM 0 HA GLU A 47 -3.307 11.527 -7.104 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -4.415 14.398 -7.074 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -2.989 13.886 -6.192 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -2.306 12.943 -8.656 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -3.361 14.250 -9.158 1.00 0.00 H new ATOM 784 N GLN A 48 -6.114 12.475 -5.635 1.00 0.00 N ATOM 785 CA GLN A 48 -6.890 12.241 -4.364 1.00 0.00 C ATOM 786 C GLN A 48 -7.119 10.736 -4.169 1.00 0.00 C ATOM 787 O GLN A 48 -6.972 10.223 -3.075 1.00 0.00 O ATOM 788 CB GLN A 48 -8.236 12.966 -4.520 1.00 0.00 C ATOM 789 CG GLN A 48 -8.846 13.225 -3.139 1.00 0.00 C ATOM 790 CD GLN A 48 -7.938 14.169 -2.340 1.00 0.00 C ATOM 791 OE1 GLN A 48 -7.757 15.311 -2.713 1.00 0.00 O ATOM 792 NE2 GLN A 48 -7.354 13.741 -1.246 1.00 0.00 N ATOM 0 H GLN A 48 -6.603 13.005 -6.357 1.00 0.00 H new ATOM 0 HA GLN A 48 -6.348 12.616 -3.496 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -8.093 13.909 -5.048 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -8.917 12.364 -5.122 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -9.838 13.663 -3.246 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -8.969 12.284 -2.603 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -7.503 12.783 -0.929 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -6.751 14.366 -0.712 1.00 0.00 H new ATOM 801 N LEU A 49 -7.473 10.017 -5.217 1.00 0.00 N ATOM 802 CA LEU A 49 -7.699 8.534 -5.063 1.00 0.00 C ATOM 803 C LEU A 49 -6.423 7.855 -4.540 1.00 0.00 C ATOM 804 O LEU A 49 -6.494 6.944 -3.736 1.00 0.00 O ATOM 805 CB LEU A 49 -8.054 7.988 -6.455 1.00 0.00 C ATOM 806 CG LEU A 49 -9.569 8.045 -6.655 1.00 0.00 C ATOM 807 CD1 LEU A 49 -9.911 7.641 -8.089 1.00 0.00 C ATOM 808 CD2 LEU A 49 -10.244 7.076 -5.678 1.00 0.00 C ATOM 0 H LEU A 49 -7.613 10.385 -6.158 1.00 0.00 H new ATOM 0 HA LEU A 49 -8.499 8.335 -4.350 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -7.553 8.574 -7.226 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -7.702 6.961 -6.555 1.00 0.00 H new ATOM 0 HG LEU A 49 -9.924 9.059 -6.471 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -10.991 7.682 -8.231 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -9.427 8.326 -8.785 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -9.559 6.626 -8.275 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -11.324 7.113 -5.817 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -9.889 6.063 -5.866 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -10.000 7.362 -4.655 1.00 0.00 H new ATOM 820 N TRP A 50 -5.256 8.288 -4.981 1.00 0.00 N ATOM 821 CA TRP A 50 -3.989 7.642 -4.479 1.00 0.00 C ATOM 822 C TRP A 50 -3.893 7.792 -2.955 1.00 0.00 C ATOM 823 O TRP A 50 -3.466 6.881 -2.271 1.00 0.00 O ATOM 824 CB TRP A 50 -2.814 8.348 -5.185 1.00 0.00 C ATOM 825 CG TRP A 50 -2.925 8.190 -6.683 1.00 0.00 C ATOM 826 CD1 TRP A 50 -3.675 7.259 -7.335 1.00 0.00 C ATOM 827 CD2 TRP A 50 -2.269 8.974 -7.724 1.00 0.00 C ATOM 828 NE1 TRP A 50 -3.526 7.436 -8.698 1.00 0.00 N ATOM 829 CE2 TRP A 50 -2.672 8.476 -8.987 1.00 0.00 C ATOM 830 CE3 TRP A 50 -1.376 10.060 -7.697 1.00 0.00 C ATOM 831 CZ2 TRP A 50 -2.209 9.034 -10.174 1.00 0.00 C ATOM 832 CZ3 TRP A 50 -0.904 10.621 -8.896 1.00 0.00 C ATOM 833 CH2 TRP A 50 -1.323 10.107 -10.131 1.00 0.00 C ATOM 0 H TRP A 50 -5.127 9.045 -5.653 1.00 0.00 H new ATOM 0 HA TRP A 50 -3.972 6.575 -4.699 1.00 0.00 H new ATOM 0 HB2 TRP A 50 -2.808 9.406 -4.924 1.00 0.00 H new ATOM 0 HB3 TRP A 50 -1.869 7.929 -4.838 1.00 0.00 H new ATOM 0 HD1 TRP A 50 -4.287 6.504 -6.864 1.00 0.00 H new ATOM 0 HE1 TRP A 50 -3.992 6.865 -9.403 1.00 0.00 H new ATOM 0 HE3 TRP A 50 -1.051 10.465 -6.750 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 -2.535 8.637 -11.124 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 -0.215 11.452 -8.866 1.00 0.00 H new ATOM 0 HH2 TRP A 50 -0.958 10.543 -11.049 1.00 0.00 H new ATOM 844 N GLU A 51 -4.310 8.916 -2.406 1.00 0.00 N ATOM 845 CA GLU A 51 -4.258 9.065 -0.907 1.00 0.00 C ATOM 846 C GLU A 51 -5.138 7.984 -0.246 1.00 0.00 C ATOM 847 O GLU A 51 -4.853 7.546 0.852 1.00 0.00 O ATOM 848 CB GLU A 51 -4.797 10.466 -0.577 1.00 0.00 C ATOM 849 CG GLU A 51 -4.553 10.773 0.902 1.00 0.00 C ATOM 850 CD GLU A 51 -4.508 12.287 1.110 1.00 0.00 C ATOM 851 OE1 GLU A 51 -5.563 12.900 1.088 1.00 0.00 O ATOM 852 OE2 GLU A 51 -3.421 12.809 1.289 1.00 0.00 O ATOM 0 H GLU A 51 -4.676 9.720 -2.916 1.00 0.00 H new ATOM 0 HA GLU A 51 -3.241 8.946 -0.533 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -4.304 11.213 -1.200 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -5.863 10.519 -0.799 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -5.345 10.335 1.510 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -3.615 10.323 1.228 1.00 0.00 H new ATOM 859 N ILE A 52 -6.197 7.537 -0.906 1.00 0.00 N ATOM 860 CA ILE A 52 -7.059 6.469 -0.289 1.00 0.00 C ATOM 861 C ILE A 52 -6.284 5.144 -0.286 1.00 0.00 C ATOM 862 O ILE A 52 -6.021 4.591 0.765 1.00 0.00 O ATOM 863 CB ILE A 52 -8.332 6.377 -1.154 1.00 0.00 C ATOM 864 CG1 ILE A 52 -9.084 7.710 -1.057 1.00 0.00 C ATOM 865 CG2 ILE A 52 -9.231 5.243 -0.645 1.00 0.00 C ATOM 866 CD1 ILE A 52 -10.324 7.689 -1.956 1.00 0.00 C ATOM 0 H ILE A 52 -6.493 7.861 -1.827 1.00 0.00 H new ATOM 0 HA ILE A 52 -7.327 6.696 0.743 1.00 0.00 H new ATOM 0 HB ILE A 52 -8.060 6.172 -2.189 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -9.379 7.894 -0.024 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -8.427 8.528 -1.352 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -10.128 5.185 -1.262 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -8.691 4.298 -0.700 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -9.514 5.439 0.389 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -10.847 8.642 -1.876 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -10.021 7.527 -2.990 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -10.988 6.883 -1.642 1.00 0.00 H new ATOM 878 N MET A 53 -5.894 4.635 -1.442 1.00 0.00 N ATOM 879 CA MET A 53 -5.107 3.348 -1.438 1.00 0.00 C ATOM 880 C MET A 53 -3.787 3.546 -0.666 1.00 0.00 C ATOM 881 O MET A 53 -3.294 2.618 -0.051 1.00 0.00 O ATOM 882 CB MET A 53 -4.841 2.934 -2.902 1.00 0.00 C ATOM 883 CG MET A 53 -4.085 4.030 -3.662 1.00 0.00 C ATOM 884 SD MET A 53 -4.738 4.147 -5.351 1.00 0.00 S ATOM 885 CE MET A 53 -4.091 2.571 -5.955 1.00 0.00 C ATOM 0 H MET A 53 -6.079 5.040 -2.360 1.00 0.00 H new ATOM 0 HA MET A 53 -5.668 2.558 -0.940 1.00 0.00 H new ATOM 0 HB2 MET A 53 -4.263 2.010 -2.922 1.00 0.00 H new ATOM 0 HB3 MET A 53 -5.788 2.729 -3.402 1.00 0.00 H new ATOM 0 HG2 MET A 53 -4.195 4.986 -3.150 1.00 0.00 H new ATOM 0 HG3 MET A 53 -3.019 3.803 -3.687 1.00 0.00 H new ATOM 0 HE1 MET A 53 -3.585 2.727 -6.908 1.00 0.00 H new ATOM 0 HE2 MET A 53 -3.385 2.166 -5.230 1.00 0.00 H new ATOM 0 HE3 MET A 53 -4.913 1.869 -6.092 1.00 0.00 H new ATOM 895 N GLN A 54 -3.223 4.744 -0.657 1.00 0.00 N ATOM 896 CA GLN A 54 -1.954 4.957 0.127 1.00 0.00 C ATOM 897 C GLN A 54 -2.262 4.842 1.629 1.00 0.00 C ATOM 898 O GLN A 54 -1.476 4.300 2.382 1.00 0.00 O ATOM 899 CB GLN A 54 -1.450 6.369 -0.210 1.00 0.00 C ATOM 900 CG GLN A 54 -0.772 6.357 -1.581 1.00 0.00 C ATOM 901 CD GLN A 54 0.700 5.954 -1.421 1.00 0.00 C ATOM 902 OE1 GLN A 54 1.003 4.986 -0.753 1.00 0.00 O ATOM 903 NE2 GLN A 54 1.637 6.658 -2.007 1.00 0.00 N ATOM 0 H GLN A 54 -3.579 5.564 -1.148 1.00 0.00 H new ATOM 0 HA GLN A 54 -1.198 4.213 -0.124 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -2.282 7.073 -0.211 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -0.747 6.707 0.552 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -1.281 5.658 -2.244 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -0.842 7.342 -2.042 1.00 0.00 H new ATOM 0 HE21 GLN A 54 1.387 7.472 -2.569 1.00 0.00 H new ATOM 0 HE22 GLN A 54 2.616 6.392 -1.901 1.00 0.00 H new ATOM 912 N LEU A 55 -3.411 5.331 2.078 1.00 0.00 N ATOM 913 CA LEU A 55 -3.755 5.216 3.545 1.00 0.00 C ATOM 914 C LEU A 55 -3.637 3.751 4.006 1.00 0.00 C ATOM 915 O LEU A 55 -3.273 3.486 5.136 1.00 0.00 O ATOM 916 CB LEU A 55 -5.210 5.694 3.705 1.00 0.00 C ATOM 917 CG LEU A 55 -5.237 7.200 3.977 1.00 0.00 C ATOM 918 CD1 LEU A 55 -6.672 7.720 3.832 1.00 0.00 C ATOM 919 CD2 LEU A 55 -4.742 7.467 5.402 1.00 0.00 C ATOM 0 H LEU A 55 -4.112 5.796 1.501 1.00 0.00 H new ATOM 0 HA LEU A 55 -3.074 5.816 4.148 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -5.777 5.469 2.802 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -5.690 5.159 4.525 1.00 0.00 H new ATOM 0 HG LEU A 55 -4.591 7.711 3.263 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.692 8.792 4.026 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -7.028 7.527 2.820 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -7.318 7.210 4.547 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -4.760 8.539 5.599 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.390 6.956 6.114 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -3.723 7.096 5.509 1.00 0.00 H new ATOM 931 N HIS A 56 -3.938 2.793 3.143 1.00 0.00 N ATOM 932 CA HIS A 56 -3.827 1.348 3.563 1.00 0.00 C ATOM 933 C HIS A 56 -2.411 1.056 4.092 1.00 0.00 C ATOM 934 O HIS A 56 -2.246 0.306 5.035 1.00 0.00 O ATOM 935 CB HIS A 56 -4.112 0.499 2.315 1.00 0.00 C ATOM 936 CG HIS A 56 -4.544 -0.877 2.739 1.00 0.00 C ATOM 937 ND1 HIS A 56 -5.878 -1.221 2.883 1.00 0.00 N ATOM 938 CD2 HIS A 56 -3.829 -2.002 3.061 1.00 0.00 C ATOM 939 CE1 HIS A 56 -5.925 -2.506 3.277 1.00 0.00 C ATOM 940 NE2 HIS A 56 -4.703 -3.030 3.401 1.00 0.00 N ATOM 0 H HIS A 56 -4.250 2.947 2.184 1.00 0.00 H new ATOM 0 HA HIS A 56 -4.533 1.118 4.361 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -4.890 0.967 1.712 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -3.220 0.437 1.692 1.00 0.00 H new ATOM 0 HD1 HIS A 56 -6.679 -0.611 2.720 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -2.752 -2.078 3.052 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -6.839 -3.048 3.470 1.00 0.00 H new ATOM 948 N HIS A 57 -1.385 1.652 3.505 1.00 0.00 N ATOM 949 CA HIS A 57 0.011 1.397 4.017 1.00 0.00 C ATOM 950 C HIS A 57 0.102 1.833 5.483 1.00 0.00 C ATOM 951 O HIS A 57 0.550 1.081 6.328 1.00 0.00 O ATOM 952 CB HIS A 57 0.968 2.237 3.156 1.00 0.00 C ATOM 953 CG HIS A 57 1.420 1.431 1.974 1.00 0.00 C ATOM 954 ND1 HIS A 57 2.567 1.745 1.263 1.00 0.00 N ATOM 955 CD2 HIS A 57 0.898 0.313 1.372 1.00 0.00 C ATOM 956 CE1 HIS A 57 2.697 0.834 0.284 1.00 0.00 C ATOM 957 NE2 HIS A 57 1.707 -0.063 0.305 1.00 0.00 N ATOM 0 H HIS A 57 -1.452 2.289 2.712 1.00 0.00 H new ATOM 0 HA HIS A 57 0.268 0.340 3.956 1.00 0.00 H new ATOM 0 HB2 HIS A 57 0.468 3.146 2.820 1.00 0.00 H new ATOM 0 HB3 HIS A 57 1.829 2.547 3.748 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -0.003 -0.197 1.680 1.00 0.00 H new ATOM 0 HE1 HIS A 57 3.504 0.828 -0.433 1.00 0.00 H new ATOM 0 HE2 HIS A 57 1.573 -0.853 -0.326 1.00 0.00 H new ATOM 965 N GLN A 58 -0.343 3.033 5.798 1.00 0.00 N ATOM 966 CA GLN A 58 -0.297 3.483 7.234 1.00 0.00 C ATOM 967 C GLN A 58 -1.160 2.537 8.088 1.00 0.00 C ATOM 968 O GLN A 58 -0.798 2.205 9.202 1.00 0.00 O ATOM 969 CB GLN A 58 -0.861 4.912 7.272 1.00 0.00 C ATOM 970 CG GLN A 58 -0.468 5.582 8.592 1.00 0.00 C ATOM 971 CD GLN A 58 0.850 6.343 8.407 1.00 0.00 C ATOM 972 OE1 GLN A 58 1.904 5.742 8.352 1.00 0.00 O ATOM 973 NE2 GLN A 58 0.842 7.651 8.309 1.00 0.00 N ATOM 0 H GLN A 58 -0.729 3.708 5.138 1.00 0.00 H new ATOM 0 HA GLN A 58 0.718 3.466 7.630 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -0.476 5.489 6.431 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -1.946 4.889 7.173 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -1.253 6.266 8.913 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -0.360 4.831 9.375 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -0.040 8.160 8.355 1.00 0.00 H new ATOM 0 HE22 GLN A 58 1.718 8.159 8.187 1.00 0.00 H new ATOM 982 N ARG A 59 -2.288 2.080 7.569 1.00 0.00 N ATOM 983 CA ARG A 59 -3.144 1.133 8.369 1.00 0.00 C ATOM 984 C ARG A 59 -2.351 -0.154 8.644 1.00 0.00 C ATOM 985 O ARG A 59 -2.276 -0.606 9.771 1.00 0.00 O ATOM 986 CB ARG A 59 -4.383 0.817 7.513 1.00 0.00 C ATOM 987 CG ARG A 59 -5.478 1.858 7.778 1.00 0.00 C ATOM 988 CD ARG A 59 -6.115 2.288 6.452 1.00 0.00 C ATOM 989 NE ARG A 59 -6.840 1.077 5.958 1.00 0.00 N ATOM 990 CZ ARG A 59 -8.023 0.736 6.446 1.00 0.00 C ATOM 991 NH1 ARG A 59 -8.599 1.431 7.401 1.00 0.00 N ATOM 992 NH2 ARG A 59 -8.636 -0.319 5.974 1.00 0.00 N ATOM 0 H ARG A 59 -2.645 2.318 6.644 1.00 0.00 H new ATOM 0 HA ARG A 59 -3.437 1.569 9.324 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -4.116 0.818 6.456 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -4.753 -0.181 7.747 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -6.238 1.440 8.439 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -5.054 2.724 8.287 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -6.798 3.125 6.596 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -5.358 2.613 5.738 1.00 0.00 H new ATOM 0 HE ARG A 59 -6.415 0.502 5.231 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -8.134 2.254 7.784 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -9.511 1.147 7.759 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -8.203 -0.873 5.235 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -9.547 -0.588 6.345 1.00 0.00 H new ATOM 1006 N SER A 60 -1.744 -0.742 7.627 1.00 0.00 N ATOM 1007 CA SER A 60 -0.945 -1.993 7.867 1.00 0.00 C ATOM 1008 C SER A 60 0.232 -1.671 8.796 1.00 0.00 C ATOM 1009 O SER A 60 0.557 -2.450 9.667 1.00 0.00 O ATOM 1010 CB SER A 60 -0.432 -2.471 6.500 1.00 0.00 C ATOM 1011 OG SER A 60 0.409 -1.472 5.938 1.00 0.00 O ATOM 0 H SER A 60 -1.768 -0.415 6.661 1.00 0.00 H new ATOM 0 HA SER A 60 -1.550 -2.768 8.338 1.00 0.00 H new ATOM 0 HB2 SER A 60 0.118 -3.405 6.612 1.00 0.00 H new ATOM 0 HB3 SER A 60 -1.271 -2.673 5.834 1.00 0.00 H new ATOM 0 HG SER A 60 0.119 -0.588 6.247 1.00 0.00 H new ATOM 1017 N ARG A 61 0.865 -0.524 8.635 1.00 0.00 N ATOM 1018 CA ARG A 61 2.008 -0.179 9.551 1.00 0.00 C ATOM 1019 C ARG A 61 1.475 -0.024 10.985 1.00 0.00 C ATOM 1020 O ARG A 61 2.096 -0.470 11.929 1.00 0.00 O ATOM 1021 CB ARG A 61 2.597 1.152 9.055 1.00 0.00 C ATOM 1022 CG ARG A 61 3.810 1.524 9.909 1.00 0.00 C ATOM 1023 CD ARG A 61 4.715 2.476 9.125 1.00 0.00 C ATOM 1024 NE ARG A 61 4.075 3.819 9.263 1.00 0.00 N ATOM 1025 CZ ARG A 61 4.106 4.482 10.410 1.00 0.00 C ATOM 1026 NH1 ARG A 61 4.701 3.986 11.471 1.00 0.00 N ATOM 1027 NH2 ARG A 61 3.536 5.656 10.493 1.00 0.00 N ATOM 0 H ARG A 61 0.645 0.174 7.924 1.00 0.00 H new ATOM 0 HA ARG A 61 2.771 -0.957 9.550 1.00 0.00 H new ATOM 0 HB2 ARG A 61 2.889 1.065 8.008 1.00 0.00 H new ATOM 0 HB3 ARG A 61 1.844 1.938 9.112 1.00 0.00 H new ATOM 0 HG2 ARG A 61 3.484 1.996 10.836 1.00 0.00 H new ATOM 0 HG3 ARG A 61 4.362 0.626 10.186 1.00 0.00 H new ATOM 0 HD2 ARG A 61 5.728 2.478 9.527 1.00 0.00 H new ATOM 0 HD3 ARG A 61 4.788 2.179 8.079 1.00 0.00 H new ATOM 0 HE ARG A 61 3.605 4.234 8.458 1.00 0.00 H new ATOM 0 HH11 ARG A 61 5.152 3.072 11.422 1.00 0.00 H new ATOM 0 HH12 ARG A 61 4.712 4.515 12.343 1.00 0.00 H new ATOM 0 HH21 ARG A 61 3.071 6.056 9.678 1.00 0.00 H new ATOM 0 HH22 ARG A 61 3.556 6.172 11.373 1.00 0.00 H new ATOM 1041 N TYR A 62 0.318 0.591 11.156 1.00 0.00 N ATOM 1042 CA TYR A 62 -0.243 0.747 12.546 1.00 0.00 C ATOM 1043 C TYR A 62 -0.528 -0.644 13.139 1.00 0.00 C ATOM 1044 O TYR A 62 -0.095 -0.952 14.235 1.00 0.00 O ATOM 1045 CB TYR A 62 -1.550 1.552 12.402 1.00 0.00 C ATOM 1046 CG TYR A 62 -2.211 1.714 13.752 1.00 0.00 C ATOM 1047 CD1 TYR A 62 -3.016 0.689 14.260 1.00 0.00 C ATOM 1048 CD2 TYR A 62 -2.020 2.887 14.492 1.00 0.00 C ATOM 1049 CE1 TYR A 62 -3.631 0.834 15.508 1.00 0.00 C ATOM 1050 CE2 TYR A 62 -2.634 3.034 15.742 1.00 0.00 C ATOM 1051 CZ TYR A 62 -3.440 2.007 16.249 1.00 0.00 C ATOM 1052 OH TYR A 62 -4.047 2.151 17.481 1.00 0.00 O ATOM 0 H TYR A 62 -0.252 0.985 10.407 1.00 0.00 H new ATOM 0 HA TYR A 62 0.453 1.259 13.210 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -1.338 2.531 11.972 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -2.226 1.042 11.716 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -3.163 -0.215 13.688 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -1.399 3.678 14.099 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -4.252 0.042 15.900 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -2.486 3.938 16.314 1.00 0.00 H new ATOM 0 HH TYR A 62 -3.810 3.022 17.862 1.00 0.00 H new ATOM 1062 N ILE A 63 -1.237 -1.492 12.419 1.00 0.00 N ATOM 1063 CA ILE A 63 -1.520 -2.869 12.964 1.00 0.00 C ATOM 1064 C ILE A 63 -0.216 -3.685 12.989 1.00 0.00 C ATOM 1065 O ILE A 63 0.030 -4.434 13.916 1.00 0.00 O ATOM 1066 CB ILE A 63 -2.560 -3.512 12.024 1.00 0.00 C ATOM 1067 CG1 ILE A 63 -3.864 -2.707 12.094 1.00 0.00 C ATOM 1068 CG2 ILE A 63 -2.834 -4.956 12.456 1.00 0.00 C ATOM 1069 CD1 ILE A 63 -4.877 -3.264 11.089 1.00 0.00 C ATOM 0 H ILE A 63 -1.625 -1.297 11.496 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.905 -2.833 13.983 1.00 0.00 H new ATOM 0 HB ILE A 63 -2.174 -3.511 11.005 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -4.276 -2.753 13.102 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -3.665 -1.657 11.879 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -3.570 -5.403 11.787 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -1.909 -5.530 12.413 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -3.219 -4.964 13.476 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -5.800 -2.687 11.145 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -4.466 -3.194 10.082 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -5.087 -4.308 11.324 1.00 0.00 H new ATOM 1081 N TYR A 64 0.631 -3.537 11.990 1.00 0.00 N ATOM 1082 CA TYR A 64 1.924 -4.302 11.994 1.00 0.00 C ATOM 1083 C TYR A 64 2.798 -3.799 13.150 1.00 0.00 C ATOM 1084 O TYR A 64 3.411 -4.577 13.851 1.00 0.00 O ATOM 1085 CB TYR A 64 2.616 -4.013 10.650 1.00 0.00 C ATOM 1086 CG TYR A 64 3.829 -4.899 10.495 1.00 0.00 C ATOM 1087 CD1 TYR A 64 4.972 -4.677 11.274 1.00 0.00 C ATOM 1088 CD2 TYR A 64 3.807 -5.944 9.569 1.00 0.00 C ATOM 1089 CE1 TYR A 64 6.092 -5.504 11.122 1.00 0.00 C ATOM 1090 CE2 TYR A 64 4.923 -6.770 9.417 1.00 0.00 C ATOM 1091 CZ TYR A 64 6.067 -6.552 10.194 1.00 0.00 C ATOM 1092 OH TYR A 64 7.169 -7.368 10.043 1.00 0.00 O ATOM 0 H TYR A 64 0.485 -2.929 11.184 1.00 0.00 H new ATOM 0 HA TYR A 64 1.758 -5.372 12.122 1.00 0.00 H new ATOM 0 HB2 TYR A 64 1.921 -4.186 9.829 1.00 0.00 H new ATOM 0 HB3 TYR A 64 2.912 -2.965 10.601 1.00 0.00 H new ATOM 0 HD1 TYR A 64 4.989 -3.869 11.991 1.00 0.00 H new ATOM 0 HD2 TYR A 64 2.925 -6.114 8.969 1.00 0.00 H new ATOM 0 HE1 TYR A 64 6.975 -5.333 11.720 1.00 0.00 H new ATOM 0 HE2 TYR A 64 4.903 -7.577 8.700 1.00 0.00 H new ATOM 0 HH TYR A 64 7.652 -7.426 10.894 1.00 0.00 H new ATOM 1102 N THR A 65 2.861 -2.500 13.354 1.00 0.00 N ATOM 1103 CA THR A 65 3.714 -1.971 14.472 1.00 0.00 C ATOM 1104 C THR A 65 3.225 -2.512 15.823 1.00 0.00 C ATOM 1105 O THR A 65 4.024 -2.843 16.677 1.00 0.00 O ATOM 1106 CB THR A 65 3.600 -0.434 14.438 1.00 0.00 C ATOM 1107 OG1 THR A 65 4.049 0.042 13.178 1.00 0.00 O ATOM 1108 CG2 THR A 65 4.464 0.177 15.546 1.00 0.00 C ATOM 0 H THR A 65 2.368 -1.795 12.806 1.00 0.00 H new ATOM 0 HA THR A 65 4.750 -2.287 14.349 1.00 0.00 H new ATOM 0 HB THR A 65 2.560 -0.147 14.593 1.00 0.00 H new ATOM 0 HG1 THR A 65 3.311 0.011 12.534 1.00 0.00 H new ATOM 0 HG21 THR A 65 4.379 1.263 15.516 1.00 0.00 H new ATOM 0 HG22 THR A 65 4.124 -0.187 16.515 1.00 0.00 H new ATOM 0 HG23 THR A 65 5.505 -0.110 15.396 1.00 0.00 H new ATOM 1116 N LEU A 66 1.928 -2.589 16.044 1.00 0.00 N ATOM 1117 CA LEU A 66 1.449 -3.097 17.376 1.00 0.00 C ATOM 1118 C LEU A 66 1.412 -4.643 17.443 1.00 0.00 C ATOM 1119 O LEU A 66 1.655 -5.212 18.490 1.00 0.00 O ATOM 1120 CB LEU A 66 0.054 -2.473 17.622 1.00 0.00 C ATOM 1121 CG LEU A 66 -1.006 -3.084 16.695 1.00 0.00 C ATOM 1122 CD1 LEU A 66 -1.562 -4.371 17.320 1.00 0.00 C ATOM 1123 CD2 LEU A 66 -2.144 -2.075 16.499 1.00 0.00 C ATOM 0 H LEU A 66 1.199 -2.330 15.380 1.00 0.00 H new ATOM 0 HA LEU A 66 2.145 -2.801 18.161 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -0.237 -2.628 18.661 1.00 0.00 H new ATOM 0 HB3 LEU A 66 0.102 -1.396 17.461 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.555 -3.321 15.732 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -2.314 -4.801 16.659 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -0.752 -5.086 17.462 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -2.016 -4.141 18.284 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.900 -2.503 15.841 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.593 -1.841 17.464 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.749 -1.163 16.052 1.00 0.00 H new ATOM 1135 N TYR A 67 1.099 -5.332 16.359 1.00 0.00 N ATOM 1136 CA TYR A 67 1.045 -6.843 16.428 1.00 0.00 C ATOM 1137 C TYR A 67 2.425 -7.487 16.182 1.00 0.00 C ATOM 1138 O TYR A 67 2.706 -8.546 16.713 1.00 0.00 O ATOM 1139 CB TYR A 67 0.040 -7.299 15.350 1.00 0.00 C ATOM 1140 CG TYR A 67 -0.089 -8.814 15.372 1.00 0.00 C ATOM 1141 CD1 TYR A 67 0.877 -9.605 14.736 1.00 0.00 C ATOM 1142 CD2 TYR A 67 -1.164 -9.426 16.035 1.00 0.00 C ATOM 1143 CE1 TYR A 67 0.767 -11.002 14.760 1.00 0.00 C ATOM 1144 CE2 TYR A 67 -1.272 -10.824 16.060 1.00 0.00 C ATOM 1145 CZ TYR A 67 -0.306 -11.610 15.422 1.00 0.00 C ATOM 1146 OH TYR A 67 -0.410 -12.986 15.444 1.00 0.00 O ATOM 0 H TYR A 67 0.883 -4.926 15.448 1.00 0.00 H new ATOM 0 HA TYR A 67 0.737 -7.158 17.425 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -0.932 -6.840 15.529 1.00 0.00 H new ATOM 0 HB3 TYR A 67 0.373 -6.968 14.366 1.00 0.00 H new ATOM 0 HD1 TYR A 67 1.707 -9.138 14.227 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -1.910 -8.819 16.527 1.00 0.00 H new ATOM 0 HE1 TYR A 67 1.511 -11.610 14.267 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -2.100 -11.293 16.571 1.00 0.00 H new ATOM 0 HH TYR A 67 -1.211 -13.246 15.946 1.00 0.00 H new ATOM 1156 N TYR A 68 3.276 -6.894 15.366 1.00 0.00 N ATOM 1157 CA TYR A 68 4.609 -7.543 15.095 1.00 0.00 C ATOM 1158 C TYR A 68 5.755 -6.955 15.947 1.00 0.00 C ATOM 1159 O TYR A 68 6.791 -7.582 16.075 1.00 0.00 O ATOM 1160 CB TYR A 68 4.883 -7.336 13.596 1.00 0.00 C ATOM 1161 CG TYR A 68 4.264 -8.469 12.809 1.00 0.00 C ATOM 1162 CD1 TYR A 68 4.632 -9.792 13.087 1.00 0.00 C ATOM 1163 CD2 TYR A 68 3.323 -8.203 11.801 1.00 0.00 C ATOM 1164 CE1 TYR A 68 4.064 -10.846 12.362 1.00 0.00 C ATOM 1165 CE2 TYR A 68 2.757 -9.258 11.077 1.00 0.00 C ATOM 1166 CZ TYR A 68 3.127 -10.579 11.358 1.00 0.00 C ATOM 1167 OH TYR A 68 2.568 -11.619 10.643 1.00 0.00 O ATOM 0 H TYR A 68 3.111 -6.009 14.886 1.00 0.00 H new ATOM 0 HA TYR A 68 4.569 -8.598 15.366 1.00 0.00 H new ATOM 0 HB2 TYR A 68 4.469 -6.383 13.268 1.00 0.00 H new ATOM 0 HB3 TYR A 68 5.957 -7.297 13.414 1.00 0.00 H new ATOM 0 HD1 TYR A 68 5.355 -9.999 13.862 1.00 0.00 H new ATOM 0 HD2 TYR A 68 3.036 -7.184 11.585 1.00 0.00 H new ATOM 0 HE1 TYR A 68 4.349 -11.865 12.578 1.00 0.00 H new ATOM 0 HE2 TYR A 68 2.034 -9.053 10.301 1.00 0.00 H new ATOM 0 HH TYR A 68 1.936 -11.261 9.985 1.00 0.00 H new ATOM 1177 N LYS A 69 5.609 -5.778 16.527 1.00 0.00 N ATOM 1178 CA LYS A 69 6.734 -5.218 17.350 1.00 0.00 C ATOM 1179 C LYS A 69 6.322 -5.081 18.826 1.00 0.00 C ATOM 1180 O LYS A 69 6.963 -5.635 19.699 1.00 0.00 O ATOM 1181 CB LYS A 69 7.040 -3.835 16.766 1.00 0.00 C ATOM 1182 CG LYS A 69 7.374 -3.948 15.277 1.00 0.00 C ATOM 1183 CD LYS A 69 7.178 -2.583 14.613 1.00 0.00 C ATOM 1184 CE LYS A 69 8.525 -1.857 14.518 1.00 0.00 C ATOM 1185 NZ LYS A 69 8.965 -2.048 13.108 1.00 0.00 N ATOM 0 H LYS A 69 4.775 -5.193 16.467 1.00 0.00 H new ATOM 0 HA LYS A 69 7.602 -5.876 17.318 1.00 0.00 H new ATOM 0 HB2 LYS A 69 6.182 -3.177 16.904 1.00 0.00 H new ATOM 0 HB3 LYS A 69 7.877 -3.385 17.300 1.00 0.00 H new ATOM 0 HG2 LYS A 69 8.403 -4.285 15.147 1.00 0.00 H new ATOM 0 HG3 LYS A 69 6.733 -4.692 14.804 1.00 0.00 H new ATOM 0 HD2 LYS A 69 6.751 -2.710 13.618 1.00 0.00 H new ATOM 0 HD3 LYS A 69 6.472 -1.985 15.189 1.00 0.00 H new ATOM 0 HE2 LYS A 69 8.422 -0.799 14.760 1.00 0.00 H new ATOM 0 HE3 LYS A 69 9.249 -2.274 15.218 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 9.882 -1.579 12.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 9.061 -3.064 12.909 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 8.260 -1.635 12.465 1.00 0.00 H new ATOM 1199 N ARG A 70 5.263 -4.350 19.116 1.00 0.00 N ATOM 1200 CA ARG A 70 4.840 -4.194 20.556 1.00 0.00 C ATOM 1201 C ARG A 70 4.141 -5.468 21.060 1.00 0.00 C ATOM 1202 O ARG A 70 4.203 -5.782 22.234 1.00 0.00 O ATOM 1203 CB ARG A 70 3.866 -3.009 20.605 1.00 0.00 C ATOM 1204 CG ARG A 70 4.654 -1.697 20.605 1.00 0.00 C ATOM 1205 CD ARG A 70 3.926 -0.663 21.466 1.00 0.00 C ATOM 1206 NE ARG A 70 4.314 0.661 20.892 1.00 0.00 N ATOM 1207 CZ ARG A 70 3.778 1.107 19.765 1.00 0.00 C ATOM 1208 NH1 ARG A 70 2.887 0.401 19.105 1.00 0.00 N ATOM 1209 NH2 ARG A 70 4.139 2.272 19.295 1.00 0.00 N ATOM 0 H ARG A 70 4.682 -3.863 18.433 1.00 0.00 H new ATOM 0 HA ARG A 70 5.707 -4.023 21.194 1.00 0.00 H new ATOM 0 HB2 ARG A 70 3.194 -3.042 19.747 1.00 0.00 H new ATOM 0 HB3 ARG A 70 3.245 -3.072 21.499 1.00 0.00 H new ATOM 0 HG2 ARG A 70 5.659 -1.865 20.992 1.00 0.00 H new ATOM 0 HG3 ARG A 70 4.762 -1.326 19.586 1.00 0.00 H new ATOM 0 HD2 ARG A 70 2.846 -0.808 21.429 1.00 0.00 H new ATOM 0 HD3 ARG A 70 4.222 -0.742 22.512 1.00 0.00 H new ATOM 0 HE ARG A 70 5.005 1.233 21.377 1.00 0.00 H new ATOM 0 HH11 ARG A 70 2.595 -0.510 19.458 1.00 0.00 H new ATOM 0 HH12 ARG A 70 2.488 0.764 18.240 1.00 0.00 H new ATOM 0 HH21 ARG A 70 4.829 2.832 19.795 1.00 0.00 H new ATOM 0 HH22 ARG A 70 3.730 2.621 18.428 1.00 0.00 H new ATOM 1223 N LYS A 71 3.467 -6.208 20.195 1.00 0.00 N ATOM 1224 CA LYS A 71 2.765 -7.454 20.643 1.00 0.00 C ATOM 1225 C LYS A 71 1.716 -7.110 21.710 1.00 0.00 C ATOM 1226 O LYS A 71 1.599 -7.791 22.712 1.00 0.00 O ATOM 1227 CB LYS A 71 3.848 -8.377 21.219 1.00 0.00 C ATOM 1228 CG LYS A 71 3.434 -9.835 21.018 1.00 0.00 C ATOM 1229 CD LYS A 71 3.902 -10.316 19.643 1.00 0.00 C ATOM 1230 CE LYS A 71 4.148 -11.826 19.685 1.00 0.00 C ATOM 1231 NZ LYS A 71 4.089 -12.264 18.264 1.00 0.00 N ATOM 0 H LYS A 71 3.377 -5.997 19.201 1.00 0.00 H new ATOM 0 HA LYS A 71 2.241 -7.939 19.819 1.00 0.00 H new ATOM 0 HB2 LYS A 71 4.802 -8.187 20.727 1.00 0.00 H new ATOM 0 HB3 LYS A 71 3.990 -8.171 22.280 1.00 0.00 H new ATOM 0 HG2 LYS A 71 3.868 -10.458 21.800 1.00 0.00 H new ATOM 0 HG3 LYS A 71 2.351 -9.931 21.099 1.00 0.00 H new ATOM 0 HD2 LYS A 71 3.151 -10.080 18.889 1.00 0.00 H new ATOM 0 HD3 LYS A 71 4.816 -9.796 19.356 1.00 0.00 H new ATOM 0 HE2 LYS A 71 5.116 -12.056 20.129 1.00 0.00 H new ATOM 0 HE3 LYS A 71 3.393 -12.333 20.286 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 4.249 -13.290 18.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 3.154 -12.038 17.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 4.823 -11.770 17.718 1.00 0.00 H new ATOM 1245 N ALA A 72 0.936 -6.071 21.492 1.00 0.00 N ATOM 1246 CA ALA A 72 -0.122 -5.706 22.485 1.00 0.00 C ATOM 1247 C ALA A 72 -1.506 -6.056 21.912 1.00 0.00 C ATOM 1248 O ALA A 72 -2.474 -5.359 22.149 1.00 0.00 O ATOM 1249 CB ALA A 72 0.010 -4.195 22.692 1.00 0.00 C ATOM 0 H ALA A 72 0.989 -5.466 20.673 1.00 0.00 H new ATOM 0 HA ALA A 72 -0.011 -6.245 23.426 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -0.738 -3.859 23.410 1.00 0.00 H new ATOM 0 HB2 ALA A 72 1.006 -3.965 23.071 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -0.144 -3.683 21.742 1.00 0.00 H new ATOM 1255 N ILE A 73 -1.606 -7.131 21.153 1.00 0.00 N ATOM 1256 CA ILE A 73 -2.923 -7.521 20.560 1.00 0.00 C ATOM 1257 C ILE A 73 -2.969 -9.046 20.353 1.00 0.00 C ATOM 1258 O ILE A 73 -1.941 -9.698 20.352 1.00 0.00 O ATOM 1259 CB ILE A 73 -2.988 -6.778 19.214 1.00 0.00 C ATOM 1260 CG1 ILE A 73 -4.291 -7.135 18.488 1.00 0.00 C ATOM 1261 CG2 ILE A 73 -1.795 -7.176 18.338 1.00 0.00 C ATOM 1262 CD1 ILE A 73 -4.420 -6.297 17.212 1.00 0.00 C ATOM 0 H ILE A 73 -0.829 -7.751 20.922 1.00 0.00 H new ATOM 0 HA ILE A 73 -3.767 -7.263 21.200 1.00 0.00 H new ATOM 0 HB ILE A 73 -2.956 -5.705 19.401 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -4.301 -8.196 18.240 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -5.144 -6.953 19.142 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -1.849 -6.646 17.387 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -0.867 -6.915 18.847 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -1.820 -8.250 18.156 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -5.347 -6.554 16.700 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -4.430 -5.238 17.471 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -3.574 -6.501 16.556 1.00 0.00 H new ATOM 1274 N SER A 74 -4.138 -9.621 20.173 1.00 0.00 N ATOM 1275 CA SER A 74 -4.210 -11.100 19.964 1.00 0.00 C ATOM 1276 C SER A 74 -4.543 -11.408 18.497 1.00 0.00 C ATOM 1277 O SER A 74 -5.273 -10.673 17.862 1.00 0.00 O ATOM 1278 CB SER A 74 -5.332 -11.591 20.884 1.00 0.00 C ATOM 1279 OG SER A 74 -6.545 -10.938 20.532 1.00 0.00 O ATOM 0 H SER A 74 -5.034 -9.134 20.162 1.00 0.00 H new ATOM 0 HA SER A 74 -3.264 -11.591 20.190 1.00 0.00 H new ATOM 0 HB2 SER A 74 -5.447 -12.671 20.793 1.00 0.00 H new ATOM 0 HB3 SER A 74 -5.082 -11.384 21.925 1.00 0.00 H new ATOM 0 HG SER A 74 -7.266 -11.250 21.117 1.00 0.00 H new ATOM 1285 N LYS A 75 -4.006 -12.488 17.948 1.00 0.00 N ATOM 1286 CA LYS A 75 -4.296 -12.842 16.501 1.00 0.00 C ATOM 1287 C LYS A 75 -5.799 -12.710 16.178 1.00 0.00 C ATOM 1288 O LYS A 75 -6.160 -12.353 15.073 1.00 0.00 O ATOM 1289 CB LYS A 75 -3.855 -14.301 16.308 1.00 0.00 C ATOM 1290 CG LYS A 75 -3.472 -14.529 14.844 1.00 0.00 C ATOM 1291 CD LYS A 75 -4.686 -15.050 14.072 1.00 0.00 C ATOM 1292 CE LYS A 75 -4.264 -15.408 12.644 1.00 0.00 C ATOM 1293 NZ LYS A 75 -5.537 -15.707 11.928 1.00 0.00 N ATOM 0 H LYS A 75 -3.385 -13.135 18.433 1.00 0.00 H new ATOM 0 HA LYS A 75 -3.762 -12.163 15.836 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -3.007 -14.525 16.956 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -4.661 -14.977 16.594 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -3.118 -13.598 14.401 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -2.652 -15.245 14.779 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -5.100 -15.926 14.571 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -5.471 -14.294 14.053 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -3.730 -14.583 12.172 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -3.595 -16.268 12.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -5.369 -16.445 11.214 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -6.249 -16.040 12.609 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -5.883 -14.845 11.460 1.00 0.00 H new ATOM 1307 N ASP A 76 -6.680 -12.979 17.127 1.00 0.00 N ATOM 1308 CA ASP A 76 -8.152 -12.839 16.829 1.00 0.00 C ATOM 1309 C ASP A 76 -8.457 -11.384 16.450 1.00 0.00 C ATOM 1310 O ASP A 76 -9.088 -11.126 15.442 1.00 0.00 O ATOM 1311 CB ASP A 76 -8.910 -13.229 18.109 1.00 0.00 C ATOM 1312 CG ASP A 76 -8.595 -14.683 18.465 1.00 0.00 C ATOM 1313 OD1 ASP A 76 -8.695 -15.523 17.585 1.00 0.00 O ATOM 1314 OD2 ASP A 76 -8.258 -14.932 19.611 1.00 0.00 O ATOM 0 H ASP A 76 -6.450 -13.282 18.073 1.00 0.00 H new ATOM 0 HA ASP A 76 -8.453 -13.478 15.999 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -8.622 -12.572 18.930 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -9.983 -13.104 17.962 1.00 0.00 H new ATOM 1319 N LEU A 77 -7.992 -10.426 17.231 1.00 0.00 N ATOM 1320 CA LEU A 77 -8.249 -8.991 16.863 1.00 0.00 C ATOM 1321 C LEU A 77 -7.451 -8.668 15.593 1.00 0.00 C ATOM 1322 O LEU A 77 -7.965 -8.062 14.671 1.00 0.00 O ATOM 1323 CB LEU A 77 -7.766 -8.123 18.039 1.00 0.00 C ATOM 1324 CG LEU A 77 -7.996 -6.641 17.713 1.00 0.00 C ATOM 1325 CD1 LEU A 77 -9.498 -6.346 17.690 1.00 0.00 C ATOM 1326 CD2 LEU A 77 -7.315 -5.765 18.775 1.00 0.00 C ATOM 0 H LEU A 77 -7.458 -10.572 18.088 1.00 0.00 H new ATOM 0 HA LEU A 77 -9.305 -8.802 16.673 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -8.303 -8.393 18.948 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -6.708 -8.304 18.228 1.00 0.00 H new ATOM 0 HG LEU A 77 -7.569 -6.418 16.735 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -9.658 -5.293 17.458 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -9.978 -6.962 16.930 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -9.928 -6.573 18.666 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -7.481 -4.714 18.540 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -7.736 -5.988 19.755 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -6.245 -5.971 18.784 1.00 0.00 H new ATOM 1338 N TYR A 78 -6.200 -9.088 15.528 1.00 0.00 N ATOM 1339 CA TYR A 78 -5.385 -8.814 14.292 1.00 0.00 C ATOM 1340 C TYR A 78 -6.070 -9.455 13.070 1.00 0.00 C ATOM 1341 O TYR A 78 -6.079 -8.881 11.996 1.00 0.00 O ATOM 1342 CB TYR A 78 -3.991 -9.434 14.532 1.00 0.00 C ATOM 1343 CG TYR A 78 -3.107 -9.244 13.313 1.00 0.00 C ATOM 1344 CD1 TYR A 78 -3.085 -8.017 12.637 1.00 0.00 C ATOM 1345 CD2 TYR A 78 -2.303 -10.300 12.866 1.00 0.00 C ATOM 1346 CE1 TYR A 78 -2.262 -7.846 11.518 1.00 0.00 C ATOM 1347 CE2 TYR A 78 -1.481 -10.130 11.746 1.00 0.00 C ATOM 1348 CZ TYR A 78 -1.460 -8.903 11.072 1.00 0.00 C ATOM 1349 OH TYR A 78 -0.648 -8.736 9.969 1.00 0.00 O ATOM 0 H TYR A 78 -5.716 -9.600 16.266 1.00 0.00 H new ATOM 0 HA TYR A 78 -5.296 -7.745 14.096 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -3.525 -8.971 15.402 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -4.092 -10.497 14.753 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -3.704 -7.201 12.980 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -2.317 -11.246 13.386 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -2.246 -6.899 10.999 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -0.863 -10.946 11.402 1.00 0.00 H new ATOM 0 HH TYR A 78 -0.158 -9.566 9.795 1.00 0.00 H new ATOM 1359 N ASP A 79 -6.664 -10.626 13.224 1.00 0.00 N ATOM 1360 CA ASP A 79 -7.366 -11.259 12.053 1.00 0.00 C ATOM 1361 C ASP A 79 -8.704 -10.541 11.830 1.00 0.00 C ATOM 1362 O ASP A 79 -9.077 -10.255 10.709 1.00 0.00 O ATOM 1363 CB ASP A 79 -7.600 -12.733 12.415 1.00 0.00 C ATOM 1364 CG ASP A 79 -8.139 -13.479 11.193 1.00 0.00 C ATOM 1365 OD1 ASP A 79 -7.337 -13.868 10.359 1.00 0.00 O ATOM 1366 OD2 ASP A 79 -9.344 -13.651 11.113 1.00 0.00 O ATOM 0 H ASP A 79 -6.692 -11.160 14.093 1.00 0.00 H new ATOM 0 HA ASP A 79 -6.778 -11.184 11.138 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -6.668 -13.188 12.751 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -8.307 -12.808 13.241 1.00 0.00 H new ATOM 1371 N TRP A 80 -9.424 -10.224 12.891 1.00 0.00 N ATOM 1372 CA TRP A 80 -10.731 -9.491 12.712 1.00 0.00 C ATOM 1373 C TRP A 80 -10.469 -8.159 11.988 1.00 0.00 C ATOM 1374 O TRP A 80 -11.244 -7.748 11.145 1.00 0.00 O ATOM 1375 CB TRP A 80 -11.290 -9.236 14.123 1.00 0.00 C ATOM 1376 CG TRP A 80 -12.656 -8.635 14.028 1.00 0.00 C ATOM 1377 CD1 TRP A 80 -13.800 -9.332 13.849 1.00 0.00 C ATOM 1378 CD2 TRP A 80 -13.039 -7.232 14.110 1.00 0.00 C ATOM 1379 NE1 TRP A 80 -14.863 -8.447 13.814 1.00 0.00 N ATOM 1380 CE2 TRP A 80 -14.444 -7.139 13.970 1.00 0.00 C ATOM 1381 CE3 TRP A 80 -12.312 -6.041 14.288 1.00 0.00 C ATOM 1382 CZ2 TRP A 80 -15.103 -5.911 14.006 1.00 0.00 C ATOM 1383 CZ3 TRP A 80 -12.972 -4.802 14.326 1.00 0.00 C ATOM 1384 CH2 TRP A 80 -14.365 -4.737 14.184 1.00 0.00 C ATOM 0 H TRP A 80 -9.170 -10.436 13.856 1.00 0.00 H new ATOM 0 HA TRP A 80 -11.440 -10.066 12.117 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -11.333 -10.171 14.681 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -10.626 -8.567 14.671 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -13.873 -10.405 13.749 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -15.836 -8.726 13.689 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -11.238 -6.080 14.396 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -16.177 -5.867 13.897 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -12.403 -3.894 14.465 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -14.867 -3.781 14.212 1.00 0.00 H new ATOM 1395 N LEU A 81 -9.370 -7.491 12.292 1.00 0.00 N ATOM 1396 CA LEU A 81 -9.068 -6.200 11.586 1.00 0.00 C ATOM 1397 C LEU A 81 -8.778 -6.495 10.109 1.00 0.00 C ATOM 1398 O LEU A 81 -9.442 -5.984 9.229 1.00 0.00 O ATOM 1399 CB LEU A 81 -7.812 -5.608 12.249 1.00 0.00 C ATOM 1400 CG LEU A 81 -8.128 -5.188 13.685 1.00 0.00 C ATOM 1401 CD1 LEU A 81 -6.861 -5.283 14.536 1.00 0.00 C ATOM 1402 CD2 LEU A 81 -8.625 -3.744 13.687 1.00 0.00 C ATOM 0 H LEU A 81 -8.682 -7.781 12.987 1.00 0.00 H new ATOM 0 HA LEU A 81 -9.906 -5.505 11.651 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -7.008 -6.344 12.245 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.461 -4.748 11.679 1.00 0.00 H new ATOM 0 HG LEU A 81 -8.894 -5.845 14.097 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -7.087 -4.983 15.559 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -6.495 -6.310 14.531 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -6.097 -4.623 14.125 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -8.852 -3.439 14.708 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -7.853 -3.093 13.277 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -9.525 -3.668 13.077 1.00 0.00 H new ATOM 1414 N ILE A 82 -7.791 -7.326 9.827 1.00 0.00 N ATOM 1415 CA ILE A 82 -7.472 -7.643 8.388 1.00 0.00 C ATOM 1416 C ILE A 82 -8.722 -8.197 7.657 1.00 0.00 C ATOM 1417 O ILE A 82 -8.847 -8.050 6.455 1.00 0.00 O ATOM 1418 CB ILE A 82 -6.289 -8.656 8.412 1.00 0.00 C ATOM 1419 CG1 ILE A 82 -5.449 -8.481 7.141 1.00 0.00 C ATOM 1420 CG2 ILE A 82 -6.776 -10.112 8.508 1.00 0.00 C ATOM 1421 CD1 ILE A 82 -4.240 -7.591 7.445 1.00 0.00 C ATOM 0 H ILE A 82 -7.202 -7.791 10.518 1.00 0.00 H new ATOM 0 HA ILE A 82 -7.183 -6.752 7.831 1.00 0.00 H new ATOM 0 HB ILE A 82 -5.690 -8.450 9.299 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.116 -9.453 6.776 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -6.053 -8.034 6.352 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -5.917 -10.783 8.522 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -7.353 -10.243 9.423 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -7.403 -10.343 7.647 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -3.643 -7.467 6.541 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -4.584 -6.616 7.790 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -3.632 -8.056 8.221 1.00 0.00 H new ATOM 1433 N LYS A 83 -9.647 -8.825 8.365 1.00 0.00 N ATOM 1434 CA LYS A 83 -10.873 -9.366 7.678 1.00 0.00 C ATOM 1435 C LYS A 83 -12.010 -8.320 7.619 1.00 0.00 C ATOM 1436 O LYS A 83 -12.940 -8.479 6.850 1.00 0.00 O ATOM 1437 CB LYS A 83 -11.317 -10.586 8.498 1.00 0.00 C ATOM 1438 CG LYS A 83 -12.251 -11.457 7.656 1.00 0.00 C ATOM 1439 CD LYS A 83 -12.254 -12.885 8.206 1.00 0.00 C ATOM 1440 CE LYS A 83 -13.421 -13.055 9.182 1.00 0.00 C ATOM 1441 NZ LYS A 83 -12.833 -12.815 10.529 1.00 0.00 N ATOM 0 H LYS A 83 -9.605 -8.983 9.372 1.00 0.00 H new ATOM 0 HA LYS A 83 -10.645 -9.628 6.645 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -10.447 -11.164 8.810 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -11.826 -10.261 9.406 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -13.261 -11.047 7.673 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -11.925 -11.458 6.616 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -12.343 -13.600 7.389 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -11.311 -13.093 8.711 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -14.221 -12.346 8.968 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -13.853 -14.053 9.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -13.504 -13.125 11.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -11.947 -13.352 10.622 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -12.637 -11.800 10.646 1.00 0.00 H new ATOM 1455 N GLU A 84 -11.963 -7.260 8.410 1.00 0.00 N ATOM 1456 CA GLU A 84 -13.071 -6.241 8.354 1.00 0.00 C ATOM 1457 C GLU A 84 -12.632 -4.948 7.629 1.00 0.00 C ATOM 1458 O GLU A 84 -13.180 -3.892 7.874 1.00 0.00 O ATOM 1459 CB GLU A 84 -13.397 -5.928 9.807 1.00 0.00 C ATOM 1460 CG GLU A 84 -14.069 -7.130 10.464 1.00 0.00 C ATOM 1461 CD GLU A 84 -15.421 -7.395 9.800 1.00 0.00 C ATOM 1462 OE1 GLU A 84 -16.336 -6.622 10.034 1.00 0.00 O ATOM 1463 OE2 GLU A 84 -15.520 -8.367 9.069 1.00 0.00 O ATOM 0 H GLU A 84 -11.219 -7.061 9.079 1.00 0.00 H new ATOM 0 HA GLU A 84 -13.925 -6.629 7.799 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -12.485 -5.672 10.346 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -14.053 -5.060 9.862 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -13.431 -8.009 10.374 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -14.207 -6.944 11.529 1.00 0.00 H new ATOM 1470 N LYS A 85 -11.655 -5.025 6.738 1.00 0.00 N ATOM 1471 CA LYS A 85 -11.160 -3.823 5.965 1.00 0.00 C ATOM 1472 C LYS A 85 -10.267 -2.917 6.823 1.00 0.00 C ATOM 1473 O LYS A 85 -10.628 -1.800 7.143 1.00 0.00 O ATOM 1474 CB LYS A 85 -12.391 -3.058 5.448 1.00 0.00 C ATOM 1475 CG LYS A 85 -12.065 -2.415 4.099 1.00 0.00 C ATOM 1476 CD LYS A 85 -13.349 -2.269 3.279 1.00 0.00 C ATOM 1477 CE LYS A 85 -13.812 -3.649 2.806 1.00 0.00 C ATOM 1478 NZ LYS A 85 -13.262 -3.787 1.429 1.00 0.00 N ATOM 0 H LYS A 85 -11.169 -5.892 6.510 1.00 0.00 H new ATOM 0 HA LYS A 85 -10.541 -4.155 5.132 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -13.237 -3.738 5.344 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -12.684 -2.292 6.166 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -11.605 -1.439 4.251 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -11.343 -3.026 3.558 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -14.127 -1.800 3.882 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -13.174 -1.619 2.422 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -13.439 -4.437 3.461 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -14.900 -3.722 2.806 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -13.537 -4.710 1.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -13.639 -3.028 0.827 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -12.225 -3.720 1.461 1.00 0.00 H new ATOM 1492 N TYR A 86 -9.090 -3.390 7.181 1.00 0.00 N ATOM 1493 CA TYR A 86 -8.153 -2.563 7.996 1.00 0.00 C ATOM 1494 C TYR A 86 -6.764 -2.596 7.344 1.00 0.00 C ATOM 1495 O TYR A 86 -6.253 -1.583 6.905 1.00 0.00 O ATOM 1496 CB TYR A 86 -8.108 -3.238 9.367 1.00 0.00 C ATOM 1497 CG TYR A 86 -9.375 -2.941 10.127 1.00 0.00 C ATOM 1498 CD1 TYR A 86 -10.597 -3.504 9.728 1.00 0.00 C ATOM 1499 CD2 TYR A 86 -9.323 -2.102 11.244 1.00 0.00 C ATOM 1500 CE1 TYR A 86 -11.762 -3.217 10.453 1.00 0.00 C ATOM 1501 CE2 TYR A 86 -10.485 -1.818 11.967 1.00 0.00 C ATOM 1502 CZ TYR A 86 -11.704 -2.376 11.572 1.00 0.00 C ATOM 1503 OH TYR A 86 -12.853 -2.097 12.284 1.00 0.00 O ATOM 0 H TYR A 86 -8.743 -4.318 6.939 1.00 0.00 H new ATOM 0 HA TYR A 86 -8.467 -1.522 8.072 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -7.989 -4.315 9.248 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -7.245 -2.882 9.929 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -10.640 -4.155 8.867 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -8.381 -1.671 11.550 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -12.706 -3.645 10.148 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -10.441 -1.169 12.829 1.00 0.00 H new ATOM 0 HH TYR A 86 -12.615 -1.820 13.194 1.00 0.00 H new ATOM 1513 N ALA A 87 -6.159 -3.760 7.264 1.00 0.00 N ATOM 1514 CA ALA A 87 -4.815 -3.876 6.630 1.00 0.00 C ATOM 1515 C ALA A 87 -4.801 -5.089 5.688 1.00 0.00 C ATOM 1516 O ALA A 87 -5.711 -5.898 5.713 1.00 0.00 O ATOM 1517 CB ALA A 87 -3.840 -4.081 7.790 1.00 0.00 C ATOM 0 H ALA A 87 -6.545 -4.637 7.614 1.00 0.00 H new ATOM 0 HA ALA A 87 -4.551 -2.999 6.039 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -2.826 -4.175 7.401 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -3.892 -3.226 8.464 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -4.106 -4.988 8.333 1.00 0.00 H new ATOM 1523 N ASP A 88 -3.787 -5.231 4.859 1.00 0.00 N ATOM 1524 CA ASP A 88 -3.747 -6.401 3.930 1.00 0.00 C ATOM 1525 C ASP A 88 -2.549 -7.305 4.253 1.00 0.00 C ATOM 1526 O ASP A 88 -1.412 -6.938 4.017 1.00 0.00 O ATOM 1527 CB ASP A 88 -3.599 -5.795 2.534 1.00 0.00 C ATOM 1528 CG ASP A 88 -3.771 -6.891 1.480 1.00 0.00 C ATOM 1529 OD1 ASP A 88 -3.141 -7.926 1.624 1.00 0.00 O ATOM 1530 OD2 ASP A 88 -4.529 -6.676 0.550 1.00 0.00 O ATOM 0 H ASP A 88 -2.995 -4.591 4.789 1.00 0.00 H new ATOM 0 HA ASP A 88 -4.640 -7.021 4.015 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -4.343 -5.013 2.385 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -2.620 -5.327 2.431 1.00 0.00 H new ATOM 1535 N LYS A 89 -2.789 -8.489 4.785 1.00 0.00 N ATOM 1536 CA LYS A 89 -1.637 -9.408 5.108 1.00 0.00 C ATOM 1537 C LYS A 89 -0.833 -9.710 3.831 1.00 0.00 C ATOM 1538 O LYS A 89 0.382 -9.793 3.869 1.00 0.00 O ATOM 1539 CB LYS A 89 -2.244 -10.705 5.668 1.00 0.00 C ATOM 1540 CG LYS A 89 -2.389 -10.584 7.187 1.00 0.00 C ATOM 1541 CD LYS A 89 -2.405 -11.983 7.810 1.00 0.00 C ATOM 1542 CE LYS A 89 -3.207 -11.952 9.113 1.00 0.00 C ATOM 1543 NZ LYS A 89 -2.664 -13.076 9.925 1.00 0.00 N ATOM 0 H LYS A 89 -3.715 -8.854 5.006 1.00 0.00 H new ATOM 0 HA LYS A 89 -0.961 -8.950 5.830 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -3.217 -10.891 5.212 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -1.608 -11.554 5.419 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -1.564 -10.001 7.597 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -3.308 -10.053 7.434 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -2.847 -12.697 7.115 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -1.386 -12.317 8.005 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -3.087 -10.999 9.628 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -4.273 -12.080 8.924 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -3.026 -13.009 10.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -2.960 -13.981 9.507 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -1.625 -13.024 9.938 1.00 0.00 H new ATOM 1557 N LEU A 90 -1.494 -9.873 2.698 1.00 0.00 N ATOM 1558 CA LEU A 90 -0.734 -10.166 1.426 1.00 0.00 C ATOM 1559 C LEU A 90 0.269 -9.037 1.140 1.00 0.00 C ATOM 1560 O LEU A 90 1.375 -9.291 0.698 1.00 0.00 O ATOM 1561 CB LEU A 90 -1.773 -10.250 0.296 1.00 0.00 C ATOM 1562 CG LEU A 90 -1.107 -10.794 -0.969 1.00 0.00 C ATOM 1563 CD1 LEU A 90 -0.865 -12.297 -0.814 1.00 0.00 C ATOM 1564 CD2 LEU A 90 -2.023 -10.548 -2.171 1.00 0.00 C ATOM 0 H LEU A 90 -2.508 -9.817 2.599 1.00 0.00 H new ATOM 0 HA LEU A 90 -0.173 -11.097 1.510 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -2.598 -10.898 0.593 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -2.196 -9.264 0.102 1.00 0.00 H new ATOM 0 HG LEU A 90 -0.155 -10.287 -1.125 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -0.390 -12.684 -1.716 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -0.215 -12.474 0.043 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -1.817 -12.805 -0.659 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -1.550 -10.935 -3.074 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -2.974 -11.056 -2.013 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -2.197 -9.478 -2.283 1.00 0.00 H new ATOM 1576 N LEU A 91 -0.091 -7.792 1.399 1.00 0.00 N ATOM 1577 CA LEU A 91 0.882 -6.674 1.141 1.00 0.00 C ATOM 1578 C LEU A 91 2.026 -6.768 2.158 1.00 0.00 C ATOM 1579 O LEU A 91 3.188 -6.716 1.795 1.00 0.00 O ATOM 1580 CB LEU A 91 0.113 -5.351 1.306 1.00 0.00 C ATOM 1581 CG LEU A 91 1.053 -4.162 1.061 1.00 0.00 C ATOM 1582 CD1 LEU A 91 1.638 -4.229 -0.361 1.00 0.00 C ATOM 1583 CD2 LEU A 91 0.267 -2.859 1.233 1.00 0.00 C ATOM 0 H LEU A 91 -0.998 -7.508 1.770 1.00 0.00 H new ATOM 0 HA LEU A 91 1.308 -6.733 0.139 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -0.721 -5.316 0.605 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -0.310 -5.290 2.309 1.00 0.00 H new ATOM 0 HG LEU A 91 1.873 -4.198 1.778 1.00 0.00 H new ATOM 0 HD11 LEU A 91 2.303 -3.380 -0.521 1.00 0.00 H new ATOM 0 HD12 LEU A 91 2.198 -5.156 -0.481 1.00 0.00 H new ATOM 0 HD13 LEU A 91 0.828 -4.198 -1.090 1.00 0.00 H new ATOM 0 HD21 LEU A 91 0.928 -2.010 1.061 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -0.553 -2.832 0.516 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -0.134 -2.807 2.245 1.00 0.00 H new ATOM 1595 N ILE A 92 1.714 -6.941 3.432 1.00 0.00 N ATOM 1596 CA ILE A 92 2.816 -7.073 4.452 1.00 0.00 C ATOM 1597 C ILE A 92 3.685 -8.293 4.080 1.00 0.00 C ATOM 1598 O ILE A 92 4.896 -8.246 4.182 1.00 0.00 O ATOM 1599 CB ILE A 92 2.137 -7.264 5.828 1.00 0.00 C ATOM 1600 CG1 ILE A 92 1.412 -5.966 6.215 1.00 0.00 C ATOM 1601 CG2 ILE A 92 3.191 -7.590 6.894 1.00 0.00 C ATOM 1602 CD1 ILE A 92 0.667 -6.149 7.545 1.00 0.00 C ATOM 0 H ILE A 92 0.765 -6.995 3.802 1.00 0.00 H new ATOM 0 HA ILE A 92 3.461 -6.195 4.482 1.00 0.00 H new ATOM 0 HB ILE A 92 1.425 -8.087 5.766 1.00 0.00 H new ATOM 0 HG12 ILE A 92 2.131 -5.152 6.302 1.00 0.00 H new ATOM 0 HG13 ILE A 92 0.708 -5.687 5.431 1.00 0.00 H new ATOM 0 HG21 ILE A 92 2.703 -7.723 7.860 1.00 0.00 H new ATOM 0 HG22 ILE A 92 3.712 -8.508 6.622 1.00 0.00 H new ATOM 0 HG23 ILE A 92 3.908 -6.771 6.959 1.00 0.00 H new ATOM 0 HD11 ILE A 92 0.158 -5.222 7.807 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -0.066 -6.950 7.444 1.00 0.00 H new ATOM 0 HD13 ILE A 92 1.380 -6.406 8.329 1.00 0.00 H new ATOM 1614 N ALA A 93 3.079 -9.375 3.622 1.00 0.00 N ATOM 1615 CA ALA A 93 3.900 -10.571 3.220 1.00 0.00 C ATOM 1616 C ALA A 93 4.771 -10.202 2.008 1.00 0.00 C ATOM 1617 O ALA A 93 5.921 -10.590 1.931 1.00 0.00 O ATOM 1618 CB ALA A 93 2.912 -11.688 2.847 1.00 0.00 C ATOM 0 H ALA A 93 2.070 -9.479 3.512 1.00 0.00 H new ATOM 0 HA ALA A 93 4.557 -10.896 4.027 1.00 0.00 H new ATOM 0 HB1 ALA A 93 3.465 -12.578 2.548 1.00 0.00 H new ATOM 0 HB2 ALA A 93 2.286 -11.922 3.708 1.00 0.00 H new ATOM 0 HB3 ALA A 93 2.283 -11.357 2.020 1.00 0.00 H new ATOM 1624 N LYS A 94 4.241 -9.440 1.061 1.00 0.00 N ATOM 1625 CA LYS A 94 5.075 -9.046 -0.134 1.00 0.00 C ATOM 1626 C LYS A 94 6.349 -8.328 0.341 1.00 0.00 C ATOM 1627 O LYS A 94 7.427 -8.568 -0.170 1.00 0.00 O ATOM 1628 CB LYS A 94 4.224 -8.082 -0.983 1.00 0.00 C ATOM 1629 CG LYS A 94 3.406 -8.867 -2.012 1.00 0.00 C ATOM 1630 CD LYS A 94 4.345 -9.589 -2.982 1.00 0.00 C ATOM 1631 CE LYS A 94 3.607 -9.881 -4.297 1.00 0.00 C ATOM 1632 NZ LYS A 94 3.503 -11.366 -4.364 1.00 0.00 N ATOM 0 H LYS A 94 3.286 -9.082 1.065 1.00 0.00 H new ATOM 0 HA LYS A 94 5.366 -9.922 -0.713 1.00 0.00 H new ATOM 0 HB2 LYS A 94 3.558 -7.509 -0.338 1.00 0.00 H new ATOM 0 HB3 LYS A 94 4.870 -7.366 -1.491 1.00 0.00 H new ATOM 0 HG2 LYS A 94 2.766 -9.590 -1.506 1.00 0.00 H new ATOM 0 HG3 LYS A 94 2.751 -8.191 -2.561 1.00 0.00 H new ATOM 0 HD2 LYS A 94 5.225 -8.975 -3.176 1.00 0.00 H new ATOM 0 HD3 LYS A 94 4.697 -10.520 -2.537 1.00 0.00 H new ATOM 0 HE2 LYS A 94 2.621 -9.416 -4.307 1.00 0.00 H new ATOM 0 HE3 LYS A 94 4.155 -9.485 -5.152 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 2.643 -11.631 -4.886 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 4.337 -11.751 -4.852 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 3.456 -11.755 -3.400 1.00 0.00 H new ATOM 1646 N TRP A 95 6.235 -7.454 1.323 1.00 0.00 N ATOM 1647 CA TRP A 95 7.462 -6.737 1.825 1.00 0.00 C ATOM 1648 C TRP A 95 8.447 -7.739 2.458 1.00 0.00 C ATOM 1649 O TRP A 95 9.648 -7.565 2.364 1.00 0.00 O ATOM 1650 CB TRP A 95 6.986 -5.715 2.876 1.00 0.00 C ATOM 1651 CG TRP A 95 6.601 -4.427 2.209 1.00 0.00 C ATOM 1652 CD1 TRP A 95 7.272 -3.842 1.185 1.00 0.00 C ATOM 1653 CD2 TRP A 95 5.473 -3.550 2.506 1.00 0.00 C ATOM 1654 NE1 TRP A 95 6.628 -2.669 0.838 1.00 0.00 N ATOM 1655 CE2 TRP A 95 5.515 -2.446 1.621 1.00 0.00 C ATOM 1656 CE3 TRP A 95 4.428 -3.605 3.445 1.00 0.00 C ATOM 1657 CZ2 TRP A 95 4.557 -1.434 1.667 1.00 0.00 C ATOM 1658 CZ3 TRP A 95 3.461 -2.587 3.494 1.00 0.00 C ATOM 1659 CH2 TRP A 95 3.526 -1.503 2.605 1.00 0.00 C ATOM 0 H TRP A 95 5.362 -7.209 1.791 1.00 0.00 H new ATOM 0 HA TRP A 95 7.983 -6.239 1.007 1.00 0.00 H new ATOM 0 HB2 TRP A 95 6.135 -6.117 3.425 1.00 0.00 H new ATOM 0 HB3 TRP A 95 7.778 -5.534 3.603 1.00 0.00 H new ATOM 0 HD1 TRP A 95 8.165 -4.230 0.717 1.00 0.00 H new ATOM 0 HE1 TRP A 95 6.938 -2.045 0.094 1.00 0.00 H new ATOM 0 HE3 TRP A 95 4.368 -4.435 4.133 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 4.612 -0.602 0.981 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 2.663 -2.639 4.220 1.00 0.00 H new ATOM 0 HH2 TRP A 95 2.780 -0.724 2.647 1.00 0.00 H new ATOM 1670 N ARG A 96 7.958 -8.788 3.092 1.00 0.00 N ATOM 1671 CA ARG A 96 8.900 -9.791 3.712 1.00 0.00 C ATOM 1672 C ARG A 96 9.410 -10.782 2.651 1.00 0.00 C ATOM 1673 O ARG A 96 10.542 -11.226 2.716 1.00 0.00 O ATOM 1674 CB ARG A 96 8.107 -10.535 4.799 1.00 0.00 C ATOM 1675 CG ARG A 96 8.249 -9.799 6.134 1.00 0.00 C ATOM 1676 CD ARG A 96 7.034 -8.897 6.358 1.00 0.00 C ATOM 1677 NE ARG A 96 5.952 -9.818 6.827 1.00 0.00 N ATOM 1678 CZ ARG A 96 5.983 -10.353 8.038 1.00 0.00 C ATOM 1679 NH1 ARG A 96 6.964 -10.100 8.875 1.00 0.00 N ATOM 1680 NH2 ARG A 96 5.019 -11.152 8.416 1.00 0.00 N ATOM 0 H ARG A 96 6.965 -8.992 3.206 1.00 0.00 H new ATOM 0 HA ARG A 96 9.771 -9.292 4.136 1.00 0.00 H new ATOM 0 HB2 ARG A 96 7.056 -10.598 4.517 1.00 0.00 H new ATOM 0 HB3 ARG A 96 8.473 -11.557 4.895 1.00 0.00 H new ATOM 0 HG2 ARG A 96 8.335 -10.518 6.949 1.00 0.00 H new ATOM 0 HG3 ARG A 96 9.162 -9.203 6.136 1.00 0.00 H new ATOM 0 HD2 ARG A 96 7.245 -8.126 7.099 1.00 0.00 H new ATOM 0 HD3 ARG A 96 6.747 -8.386 5.439 1.00 0.00 H new ATOM 0 HE ARG A 96 5.176 -10.038 6.202 1.00 0.00 H new ATOM 0 HH11 ARG A 96 7.724 -9.479 8.597 1.00 0.00 H new ATOM 0 HH12 ARG A 96 6.965 -10.524 9.803 1.00 0.00 H new ATOM 0 HH21 ARG A 96 4.250 -11.360 7.779 1.00 0.00 H new ATOM 0 HH22 ARG A 96 5.037 -11.568 9.347 1.00 0.00 H new ATOM 1694 N LYS A 97 8.594 -11.140 1.675 1.00 0.00 N ATOM 1695 CA LYS A 97 9.061 -12.115 0.614 1.00 0.00 C ATOM 1696 C LYS A 97 10.411 -11.672 0.019 1.00 0.00 C ATOM 1697 O LYS A 97 10.911 -10.609 0.336 1.00 0.00 O ATOM 1698 CB LYS A 97 7.993 -12.103 -0.494 1.00 0.00 C ATOM 1699 CG LYS A 97 6.926 -13.161 -0.212 1.00 0.00 C ATOM 1700 CD LYS A 97 7.559 -14.554 -0.243 1.00 0.00 C ATOM 1701 CE LYS A 97 6.512 -15.583 -0.678 1.00 0.00 C ATOM 1702 NZ LYS A 97 7.191 -16.901 -0.544 1.00 0.00 N ATOM 0 H LYS A 97 7.637 -10.806 1.565 1.00 0.00 H new ATOM 0 HA LYS A 97 9.194 -13.108 1.043 1.00 0.00 H new ATOM 0 HB2 LYS A 97 7.531 -11.117 -0.553 1.00 0.00 H new ATOM 0 HB3 LYS A 97 8.459 -12.295 -1.460 1.00 0.00 H new ATOM 0 HG2 LYS A 97 6.469 -12.980 0.761 1.00 0.00 H new ATOM 0 HG3 LYS A 97 6.131 -13.096 -0.954 1.00 0.00 H new ATOM 0 HD2 LYS A 97 8.404 -14.566 -0.932 1.00 0.00 H new ATOM 0 HD3 LYS A 97 7.948 -14.810 0.743 1.00 0.00 H new ATOM 0 HE2 LYS A 97 5.623 -15.531 -0.050 1.00 0.00 H new ATOM 0 HE3 LYS A 97 6.188 -15.408 -1.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 6.536 -17.659 -0.825 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 8.030 -16.923 -1.158 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 7.482 -17.043 0.444 1.00 0.00 H new ATOM 1716 N THR A 98 10.999 -12.471 -0.850 1.00 0.00 N ATOM 1717 CA THR A 98 12.307 -12.071 -1.465 1.00 0.00 C ATOM 1718 C THR A 98 12.067 -11.518 -2.879 1.00 0.00 C ATOM 1719 O THR A 98 11.222 -12.011 -3.605 1.00 0.00 O ATOM 1720 CB THR A 98 13.181 -13.342 -1.494 1.00 0.00 C ATOM 1721 OG1 THR A 98 14.487 -12.998 -1.936 1.00 0.00 O ATOM 1722 CG2 THR A 98 12.590 -14.398 -2.439 1.00 0.00 C ATOM 0 H THR A 98 10.632 -13.372 -1.155 1.00 0.00 H new ATOM 0 HA THR A 98 12.804 -11.285 -0.896 1.00 0.00 H new ATOM 0 HB THR A 98 13.217 -13.761 -0.488 1.00 0.00 H new ATOM 0 HG1 THR A 98 15.048 -13.801 -1.955 1.00 0.00 H new ATOM 0 HG21 THR A 98 13.227 -15.283 -2.440 1.00 0.00 H new ATOM 0 HG22 THR A 98 11.590 -14.670 -2.101 1.00 0.00 H new ATOM 0 HG23 THR A 98 12.533 -13.991 -3.449 1.00 0.00 H new ATOM 1730 N GLY A 99 12.785 -10.487 -3.276 1.00 0.00 N ATOM 1731 CA GLY A 99 12.569 -9.909 -4.637 1.00 0.00 C ATOM 1732 C GLY A 99 11.706 -8.633 -4.552 1.00 0.00 C ATOM 1733 O GLY A 99 11.787 -7.783 -5.419 1.00 0.00 O ATOM 0 H GLY A 99 13.504 -10.028 -2.717 1.00 0.00 H new ATOM 0 HA2 GLY A 99 13.530 -9.675 -5.096 1.00 0.00 H new ATOM 0 HA3 GLY A 99 12.080 -10.644 -5.277 1.00 0.00 H new ATOM 1737 N TYR A 100 10.883 -8.477 -3.525 1.00 0.00 N ATOM 1738 CA TYR A 100 10.039 -7.237 -3.428 1.00 0.00 C ATOM 1739 C TYR A 100 10.772 -6.157 -2.613 1.00 0.00 C ATOM 1740 O TYR A 100 10.268 -5.685 -1.608 1.00 0.00 O ATOM 1741 CB TYR A 100 8.746 -7.651 -2.710 1.00 0.00 C ATOM 1742 CG TYR A 100 7.973 -8.636 -3.551 1.00 0.00 C ATOM 1743 CD1 TYR A 100 7.430 -8.240 -4.778 1.00 0.00 C ATOM 1744 CD2 TYR A 100 7.787 -9.944 -3.092 1.00 0.00 C ATOM 1745 CE1 TYR A 100 6.704 -9.156 -5.549 1.00 0.00 C ATOM 1746 CE2 TYR A 100 7.059 -10.860 -3.858 1.00 0.00 C ATOM 1747 CZ TYR A 100 6.517 -10.467 -5.089 1.00 0.00 C ATOM 1748 OH TYR A 100 5.798 -11.368 -5.847 1.00 0.00 O ATOM 0 H TYR A 100 10.764 -9.146 -2.764 1.00 0.00 H new ATOM 0 HA TYR A 100 9.832 -6.822 -4.414 1.00 0.00 H new ATOM 0 HB2 TYR A 100 8.985 -8.096 -1.744 1.00 0.00 H new ATOM 0 HB3 TYR A 100 8.134 -6.771 -2.513 1.00 0.00 H new ATOM 0 HD1 TYR A 100 7.571 -7.229 -5.130 1.00 0.00 H new ATOM 0 HD2 TYR A 100 8.206 -10.247 -2.144 1.00 0.00 H new ATOM 0 HE1 TYR A 100 6.288 -8.852 -6.498 1.00 0.00 H new ATOM 0 HE2 TYR A 100 6.915 -11.869 -3.501 1.00 0.00 H new ATOM 0 HH TYR A 100 6.133 -12.274 -5.683 1.00 0.00 H new ATOM 1758 N GLU A 101 11.954 -5.756 -3.032 1.00 0.00 N ATOM 1759 CA GLU A 101 12.694 -4.694 -2.259 1.00 0.00 C ATOM 1760 C GLU A 101 12.017 -3.327 -2.456 1.00 0.00 C ATOM 1761 O GLU A 101 11.950 -2.532 -1.537 1.00 0.00 O ATOM 1762 CB GLU A 101 14.129 -4.661 -2.808 1.00 0.00 C ATOM 1763 CG GLU A 101 14.987 -5.680 -2.056 1.00 0.00 C ATOM 1764 CD GLU A 101 16.120 -6.164 -2.962 1.00 0.00 C ATOM 1765 OE1 GLU A 101 16.947 -5.346 -3.330 1.00 0.00 O ATOM 1766 OE2 GLU A 101 16.141 -7.343 -3.274 1.00 0.00 O ATOM 0 H GLU A 101 12.433 -6.109 -3.860 1.00 0.00 H new ATOM 0 HA GLU A 101 12.691 -4.914 -1.191 1.00 0.00 H new ATOM 0 HB2 GLU A 101 14.127 -4.888 -3.874 1.00 0.00 H new ATOM 0 HB3 GLU A 101 14.550 -3.662 -2.695 1.00 0.00 H new ATOM 0 HG2 GLU A 101 15.398 -5.229 -1.153 1.00 0.00 H new ATOM 0 HG3 GLU A 101 14.374 -6.524 -1.740 1.00 0.00 H new ATOM 1773 N LYS A 102 11.516 -3.041 -3.644 1.00 0.00 N ATOM 1774 CA LYS A 102 10.853 -1.723 -3.877 1.00 0.00 C ATOM 1775 C LYS A 102 9.427 -1.929 -4.415 1.00 0.00 C ATOM 1776 O LYS A 102 9.211 -1.910 -5.613 1.00 0.00 O ATOM 1777 CB LYS A 102 11.723 -1.029 -4.928 1.00 0.00 C ATOM 1778 CG LYS A 102 12.952 -0.411 -4.255 1.00 0.00 C ATOM 1779 CD LYS A 102 12.712 1.086 -4.004 1.00 0.00 C ATOM 1780 CE LYS A 102 13.560 1.918 -4.972 1.00 0.00 C ATOM 1781 NZ LYS A 102 13.869 3.172 -4.232 1.00 0.00 N ATOM 0 H LYS A 102 11.541 -3.663 -4.452 1.00 0.00 H new ATOM 0 HA LYS A 102 10.765 -1.138 -2.962 1.00 0.00 H new ATOM 0 HB2 LYS A 102 12.034 -1.746 -5.687 1.00 0.00 H new ATOM 0 HB3 LYS A 102 11.148 -0.256 -5.437 1.00 0.00 H new ATOM 0 HG2 LYS A 102 13.155 -0.919 -3.312 1.00 0.00 H new ATOM 0 HG3 LYS A 102 13.830 -0.547 -4.886 1.00 0.00 H new ATOM 0 HD2 LYS A 102 11.656 1.321 -4.137 1.00 0.00 H new ATOM 0 HD3 LYS A 102 12.968 1.337 -2.975 1.00 0.00 H new ATOM 0 HE2 LYS A 102 14.472 1.390 -5.252 1.00 0.00 H new ATOM 0 HE3 LYS A 102 13.017 2.127 -5.893 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 14.448 3.795 -4.831 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 12.983 3.656 -3.984 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 14.392 2.942 -3.363 1.00 0.00 H new ATOM 1795 N LEU A 103 8.450 -2.119 -3.548 1.00 0.00 N ATOM 1796 CA LEU A 103 7.052 -2.316 -4.038 1.00 0.00 C ATOM 1797 C LEU A 103 6.097 -1.307 -3.359 1.00 0.00 C ATOM 1798 O LEU A 103 6.328 -0.892 -2.238 1.00 0.00 O ATOM 1799 CB LEU A 103 6.710 -3.791 -3.705 1.00 0.00 C ATOM 1800 CG LEU A 103 6.029 -3.934 -2.332 1.00 0.00 C ATOM 1801 CD1 LEU A 103 4.523 -3.699 -2.488 1.00 0.00 C ATOM 1802 CD2 LEU A 103 6.273 -5.340 -1.782 1.00 0.00 C ATOM 0 H LEU A 103 8.565 -2.145 -2.535 1.00 0.00 H new ATOM 0 HA LEU A 103 6.946 -2.134 -5.107 1.00 0.00 H new ATOM 0 HB2 LEU A 103 6.055 -4.194 -4.477 1.00 0.00 H new ATOM 0 HB3 LEU A 103 7.623 -4.386 -3.720 1.00 0.00 H new ATOM 0 HG LEU A 103 6.444 -3.200 -1.641 1.00 0.00 H new ATOM 0 HD11 LEU A 103 4.037 -3.799 -1.518 1.00 0.00 H new ATOM 0 HD12 LEU A 103 4.350 -2.696 -2.879 1.00 0.00 H new ATOM 0 HD13 LEU A 103 4.110 -4.434 -3.179 1.00 0.00 H new ATOM 0 HD21 LEU A 103 5.790 -5.439 -0.810 1.00 0.00 H new ATOM 0 HD22 LEU A 103 5.859 -6.077 -2.470 1.00 0.00 H new ATOM 0 HD23 LEU A 103 7.345 -5.507 -1.674 1.00 0.00 H new ATOM 1814 N CYS A 104 5.035 -0.908 -4.030 1.00 0.00 N ATOM 1815 CA CYS A 104 4.088 0.077 -3.408 1.00 0.00 C ATOM 1816 C CYS A 104 2.685 -0.517 -3.135 1.00 0.00 C ATOM 1817 O CYS A 104 2.042 -0.118 -2.185 1.00 0.00 O ATOM 1818 CB CYS A 104 4.032 1.277 -4.369 1.00 0.00 C ATOM 1819 SG CYS A 104 3.448 0.801 -6.017 1.00 0.00 S ATOM 0 H CYS A 104 4.787 -1.218 -4.969 1.00 0.00 H new ATOM 0 HA CYS A 104 4.445 0.374 -2.422 1.00 0.00 H new ATOM 0 HB2 CYS A 104 3.372 2.041 -3.957 1.00 0.00 H new ATOM 0 HB3 CYS A 104 5.023 1.723 -4.451 1.00 0.00 H new ATOM 1824 N CYS A 105 2.193 -1.457 -3.922 1.00 0.00 N ATOM 1825 CA CYS A 105 0.832 -2.033 -3.626 1.00 0.00 C ATOM 1826 C CYS A 105 0.823 -3.544 -3.932 1.00 0.00 C ATOM 1827 O CYS A 105 1.861 -4.138 -4.155 1.00 0.00 O ATOM 1828 CB CYS A 105 -0.177 -1.338 -4.557 1.00 0.00 C ATOM 1829 SG CYS A 105 0.075 0.460 -4.642 1.00 0.00 S ATOM 0 H CYS A 105 2.664 -1.843 -4.740 1.00 0.00 H new ATOM 0 HA CYS A 105 0.579 -1.880 -2.577 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -0.093 -1.761 -5.558 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -1.189 -1.543 -4.208 1.00 0.00 H new ATOM 1834 N LEU A 106 -0.345 -4.166 -3.964 1.00 0.00 N ATOM 1835 CA LEU A 106 -0.403 -5.635 -4.280 1.00 0.00 C ATOM 1836 C LEU A 106 -0.701 -5.839 -5.778 1.00 0.00 C ATOM 1837 O LEU A 106 -0.123 -6.702 -6.411 1.00 0.00 O ATOM 1838 CB LEU A 106 -1.534 -6.214 -3.422 1.00 0.00 C ATOM 1839 CG LEU A 106 -1.004 -6.582 -2.034 1.00 0.00 C ATOM 1840 CD1 LEU A 106 -2.158 -7.103 -1.177 1.00 0.00 C ATOM 1841 CD2 LEU A 106 0.071 -7.669 -2.155 1.00 0.00 C ATOM 0 H LEU A 106 -1.247 -3.723 -3.787 1.00 0.00 H new ATOM 0 HA LEU A 106 0.544 -6.130 -4.065 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -2.341 -5.487 -3.331 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -1.953 -7.096 -3.906 1.00 0.00 H new ATOM 0 HG LEU A 106 -0.567 -5.698 -1.570 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -1.786 -7.367 -0.187 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -2.920 -6.329 -1.084 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.592 -7.985 -1.648 1.00 0.00 H new ATOM 0 HD21 LEU A 106 0.443 -7.925 -1.163 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -0.359 -8.555 -2.621 1.00 0.00 H new ATOM 0 HD23 LEU A 106 0.894 -7.300 -2.767 1.00 0.00 H new ATOM 1853 N ARG A 107 -1.576 -5.036 -6.363 1.00 0.00 N ATOM 1854 CA ARG A 107 -1.865 -5.183 -7.832 1.00 0.00 C ATOM 1855 C ARG A 107 -1.122 -4.088 -8.633 1.00 0.00 C ATOM 1856 O ARG A 107 -1.575 -3.658 -9.676 1.00 0.00 O ATOM 1857 CB ARG A 107 -3.382 -5.018 -7.975 1.00 0.00 C ATOM 1858 CG ARG A 107 -3.809 -5.420 -9.388 1.00 0.00 C ATOM 1859 CD ARG A 107 -5.289 -5.811 -9.383 1.00 0.00 C ATOM 1860 NE ARG A 107 -5.589 -6.207 -10.793 1.00 0.00 N ATOM 1861 CZ ARG A 107 -5.739 -5.299 -11.746 1.00 0.00 C ATOM 1862 NH1 ARG A 107 -5.631 -4.015 -11.492 1.00 0.00 N ATOM 1863 NH2 ARG A 107 -6.003 -5.682 -12.967 1.00 0.00 N ATOM 0 H ARG A 107 -2.094 -4.296 -5.890 1.00 0.00 H new ATOM 0 HA ARG A 107 -1.530 -6.146 -8.217 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -3.896 -5.636 -7.239 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -3.666 -3.984 -7.778 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -3.643 -4.593 -10.079 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -3.203 -6.255 -9.739 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -5.478 -6.634 -8.693 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -5.916 -4.978 -9.065 1.00 0.00 H new ATOM 0 HE ARG A 107 -5.680 -7.196 -11.026 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -5.427 -3.698 -10.544 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -5.751 -3.335 -12.243 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -6.092 -6.675 -13.182 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -6.120 -4.988 -13.705 1.00 0.00 H new ATOM 1877 N CYS A 108 0.016 -3.632 -8.147 1.00 0.00 N ATOM 1878 CA CYS A 108 0.801 -2.569 -8.852 1.00 0.00 C ATOM 1879 C CYS A 108 2.257 -3.075 -9.066 1.00 0.00 C ATOM 1880 O CYS A 108 3.152 -2.293 -9.319 1.00 0.00 O ATOM 1881 CB CYS A 108 0.761 -1.434 -7.820 1.00 0.00 C ATOM 1882 SG CYS A 108 0.803 0.233 -8.518 1.00 0.00 S ATOM 0 H CYS A 108 0.436 -3.960 -7.277 1.00 0.00 H new ATOM 0 HA CYS A 108 0.425 -2.281 -9.834 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -0.144 -1.539 -7.222 1.00 0.00 H new ATOM 0 HB3 CYS A 108 1.607 -1.549 -7.142 1.00 0.00 H new ATOM 1887 N ILE A 109 2.505 -4.382 -8.944 1.00 0.00 N ATOM 1888 CA ILE A 109 3.896 -4.924 -9.113 1.00 0.00 C ATOM 1889 C ILE A 109 3.858 -6.417 -9.513 1.00 0.00 C ATOM 1890 O ILE A 109 4.712 -7.181 -9.102 1.00 0.00 O ATOM 1891 CB ILE A 109 4.548 -4.805 -7.721 1.00 0.00 C ATOM 1892 CG1 ILE A 109 3.668 -5.513 -6.668 1.00 0.00 C ATOM 1893 CG2 ILE A 109 4.711 -3.333 -7.339 1.00 0.00 C ATOM 1894 CD1 ILE A 109 4.537 -6.380 -5.751 1.00 0.00 C ATOM 0 H ILE A 109 1.796 -5.085 -8.735 1.00 0.00 H new ATOM 0 HA ILE A 109 4.437 -4.383 -9.889 1.00 0.00 H new ATOM 0 HB ILE A 109 5.530 -5.278 -7.753 1.00 0.00 H new ATOM 0 HG12 ILE A 109 3.128 -4.773 -6.077 1.00 0.00 H new ATOM 0 HG13 ILE A 109 2.920 -6.131 -7.164 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.172 -3.262 -6.354 1.00 0.00 H new ATOM 0 HG22 ILE A 109 5.344 -2.834 -8.073 1.00 0.00 H new ATOM 0 HG23 ILE A 109 3.733 -2.852 -7.317 1.00 0.00 H new ATOM 0 HD11 ILE A 109 3.906 -6.874 -5.012 1.00 0.00 H new ATOM 0 HD12 ILE A 109 5.056 -7.131 -6.346 1.00 0.00 H new ATOM 0 HD13 ILE A 109 5.268 -5.752 -5.242 1.00 0.00 H new ATOM 1906 N GLN A 110 2.882 -6.849 -10.290 1.00 0.00 N ATOM 1907 CA GLN A 110 2.823 -8.296 -10.671 1.00 0.00 C ATOM 1908 C GLN A 110 2.031 -8.494 -11.973 1.00 0.00 C ATOM 1909 O GLN A 110 1.260 -7.639 -12.368 1.00 0.00 O ATOM 1910 CB GLN A 110 2.102 -8.980 -9.508 1.00 0.00 C ATOM 1911 CG GLN A 110 3.101 -9.284 -8.388 1.00 0.00 C ATOM 1912 CD GLN A 110 2.754 -10.631 -7.740 1.00 0.00 C ATOM 1913 OE1 GLN A 110 1.857 -10.707 -6.924 1.00 0.00 O ATOM 1914 NE2 GLN A 110 3.427 -11.708 -8.070 1.00 0.00 N ATOM 0 H GLN A 110 2.136 -6.267 -10.670 1.00 0.00 H new ATOM 0 HA GLN A 110 3.818 -8.706 -10.847 1.00 0.00 H new ATOM 0 HB2 GLN A 110 1.305 -8.337 -9.133 1.00 0.00 H new ATOM 0 HB3 GLN A 110 1.633 -9.902 -9.850 1.00 0.00 H new ATOM 0 HG2 GLN A 110 4.114 -9.312 -8.789 1.00 0.00 H new ATOM 0 HG3 GLN A 110 3.076 -8.492 -7.640 1.00 0.00 H new ATOM 0 HE21 GLN A 110 4.181 -11.649 -8.755 1.00 0.00 H new ATOM 0 HE22 GLN A 110 3.196 -12.605 -7.642 1.00 0.00 H new ATOM 1923 N LYS A 111 2.211 -9.614 -12.644 1.00 0.00 N ATOM 1924 CA LYS A 111 1.464 -9.853 -13.913 1.00 0.00 C ATOM 1925 C LYS A 111 0.531 -11.072 -13.765 1.00 0.00 C ATOM 1926 O LYS A 111 0.406 -11.630 -12.691 1.00 0.00 O ATOM 1927 CB LYS A 111 2.543 -10.096 -14.982 1.00 0.00 C ATOM 1928 CG LYS A 111 3.292 -11.417 -14.718 1.00 0.00 C ATOM 1929 CD LYS A 111 4.804 -11.160 -14.660 1.00 0.00 C ATOM 1930 CE LYS A 111 5.268 -11.121 -13.202 1.00 0.00 C ATOM 1931 NZ LYS A 111 6.753 -11.201 -13.269 1.00 0.00 N ATOM 0 H LYS A 111 2.841 -10.365 -12.364 1.00 0.00 H new ATOM 0 HA LYS A 111 0.826 -9.011 -14.182 1.00 0.00 H new ATOM 0 HB2 LYS A 111 2.082 -10.126 -15.969 1.00 0.00 H new ATOM 0 HB3 LYS A 111 3.250 -9.267 -14.985 1.00 0.00 H new ATOM 0 HG2 LYS A 111 2.953 -11.856 -13.779 1.00 0.00 H new ATOM 0 HG3 LYS A 111 3.067 -12.136 -15.506 1.00 0.00 H new ATOM 0 HD2 LYS A 111 5.336 -11.943 -15.200 1.00 0.00 H new ATOM 0 HD3 LYS A 111 5.041 -10.217 -15.152 1.00 0.00 H new ATOM 0 HE2 LYS A 111 4.944 -10.205 -12.709 1.00 0.00 H new ATOM 0 HE3 LYS A 111 4.853 -11.953 -12.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 7.146 -11.180 -12.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 7.032 -12.087 -13.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 7.120 -10.393 -13.810 1.00 0.00 H new ATOM 1945 N ASN A 112 -0.121 -11.488 -14.831 1.00 0.00 N ATOM 1946 CA ASN A 112 -1.036 -12.667 -14.735 1.00 0.00 C ATOM 1947 C ASN A 112 -0.658 -13.725 -15.786 1.00 0.00 C ATOM 1948 O ASN A 112 -0.374 -14.859 -15.448 1.00 0.00 O ATOM 1949 CB ASN A 112 -2.434 -12.109 -15.008 1.00 0.00 C ATOM 1950 CG ASN A 112 -3.484 -13.018 -14.358 1.00 0.00 C ATOM 1951 OD1 ASN A 112 -3.383 -13.334 -13.188 1.00 0.00 O ATOM 1952 ND2 ASN A 112 -4.497 -13.458 -15.065 1.00 0.00 N ATOM 0 H ASN A 112 -0.057 -11.062 -15.756 1.00 0.00 H new ATOM 0 HA ASN A 112 -0.977 -13.156 -13.763 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -2.517 -11.097 -14.611 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -2.608 -12.045 -16.082 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -5.196 -14.063 -14.633 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -4.586 -13.196 -16.047 1.00 0.00 H new ATOM 1959 N GLU A 113 -0.652 -13.371 -17.056 1.00 0.00 N ATOM 1960 CA GLU A 113 -0.291 -14.366 -18.110 1.00 0.00 C ATOM 1961 C GLU A 113 0.563 -13.695 -19.199 1.00 0.00 C ATOM 1962 O GLU A 113 1.091 -12.618 -18.994 1.00 0.00 O ATOM 1963 CB GLU A 113 -1.633 -14.830 -18.682 1.00 0.00 C ATOM 1964 CG GLU A 113 -1.585 -16.337 -18.948 1.00 0.00 C ATOM 1965 CD GLU A 113 -2.437 -16.667 -20.175 1.00 0.00 C ATOM 1966 OE1 GLU A 113 -2.275 -15.997 -21.180 1.00 0.00 O ATOM 1967 OE2 GLU A 113 -3.234 -17.587 -20.087 1.00 0.00 O ATOM 0 H GLU A 113 -0.881 -12.439 -17.401 1.00 0.00 H new ATOM 0 HA GLU A 113 0.295 -15.198 -17.719 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -2.437 -14.599 -17.983 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -1.851 -14.294 -19.606 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -0.555 -16.655 -19.111 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -1.954 -16.882 -18.079 1.00 0.00 H new ATOM 1974 N THR A 114 0.699 -14.312 -20.358 1.00 0.00 N ATOM 1975 CA THR A 114 1.520 -13.680 -21.446 1.00 0.00 C ATOM 1976 C THR A 114 0.609 -12.886 -22.395 1.00 0.00 C ATOM 1977 O THR A 114 0.941 -11.788 -22.801 1.00 0.00 O ATOM 1978 CB THR A 114 2.199 -14.835 -22.193 1.00 0.00 C ATOM 1979 OG1 THR A 114 1.426 -16.017 -22.036 1.00 0.00 O ATOM 1980 CG2 THR A 114 3.600 -15.061 -21.624 1.00 0.00 C ATOM 0 H THR A 114 0.282 -15.213 -20.593 1.00 0.00 H new ATOM 0 HA THR A 114 2.257 -12.985 -21.044 1.00 0.00 H new ATOM 0 HB THR A 114 2.276 -14.587 -23.252 1.00 0.00 H new ATOM 0 HG1 THR A 114 1.857 -16.756 -22.514 1.00 0.00 H new ATOM 0 HG21 THR A 114 4.081 -15.882 -22.156 1.00 0.00 H new ATOM 0 HG22 THR A 114 4.192 -14.154 -21.745 1.00 0.00 H new ATOM 0 HG23 THR A 114 3.527 -15.308 -20.565 1.00 0.00 H new ATOM 1988 N ASN A 115 -0.541 -13.425 -22.749 1.00 0.00 N ATOM 1989 CA ASN A 115 -1.462 -12.688 -23.665 1.00 0.00 C ATOM 1990 C ASN A 115 -2.798 -12.404 -22.956 1.00 0.00 C ATOM 1991 O ASN A 115 -3.851 -12.495 -23.559 1.00 0.00 O ATOM 1992 CB ASN A 115 -1.675 -13.626 -24.853 1.00 0.00 C ATOM 1993 CG ASN A 115 -0.399 -13.671 -25.703 1.00 0.00 C ATOM 1994 OD1 ASN A 115 0.245 -12.660 -25.898 1.00 0.00 O ATOM 1995 ND2 ASN A 115 0.000 -14.807 -26.223 1.00 0.00 N ATOM 0 H ASN A 115 -0.874 -14.339 -22.442 1.00 0.00 H new ATOM 0 HA ASN A 115 -1.054 -11.726 -23.975 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -1.925 -14.626 -24.500 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -2.515 -13.281 -25.456 1.00 0.00 H new ATOM 0 HD21 ASN A 115 0.848 -14.839 -26.789 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -0.538 -15.659 -26.062 1.00 0.00 H new ATOM 2002 N ASN A 116 -2.768 -12.062 -21.682 1.00 0.00 N ATOM 2003 CA ASN A 116 -4.047 -11.779 -20.953 1.00 0.00 C ATOM 2004 C ASN A 116 -3.768 -11.068 -19.614 1.00 0.00 C ATOM 2005 O ASN A 116 -4.265 -11.474 -18.580 1.00 0.00 O ATOM 2006 CB ASN A 116 -4.673 -13.153 -20.710 1.00 0.00 C ATOM 2007 CG ASN A 116 -6.182 -12.997 -20.483 1.00 0.00 C ATOM 2008 OD1 ASN A 116 -6.874 -12.443 -21.316 1.00 0.00 O ATOM 2009 ND2 ASN A 116 -6.732 -13.463 -19.389 1.00 0.00 N ATOM 0 H ASN A 116 -1.920 -11.968 -21.124 1.00 0.00 H new ATOM 0 HA ASN A 116 -4.704 -11.121 -21.522 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -4.489 -13.804 -21.564 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -4.211 -13.626 -19.843 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -7.736 -13.360 -19.239 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -6.156 -13.928 -18.687 1.00 0.00 H new ATOM 2016 N GLY A 117 -2.978 -10.014 -19.624 1.00 0.00 N ATOM 2017 CA GLY A 117 -2.675 -9.292 -18.353 1.00 0.00 C ATOM 2018 C GLY A 117 -1.189 -8.903 -18.329 1.00 0.00 C ATOM 2019 O GLY A 117 -0.373 -9.534 -18.973 1.00 0.00 O ATOM 0 H GLY A 117 -2.534 -9.628 -20.458 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -3.297 -8.401 -18.271 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -2.911 -9.925 -17.497 1.00 0.00 H new ATOM 2023 N SER A 118 -0.828 -7.868 -17.595 1.00 0.00 N ATOM 2024 CA SER A 118 0.607 -7.453 -17.546 1.00 0.00 C ATOM 2025 C SER A 118 0.964 -6.920 -16.147 1.00 0.00 C ATOM 2026 O SER A 118 0.219 -7.103 -15.203 1.00 0.00 O ATOM 2027 CB SER A 118 0.729 -6.344 -18.589 1.00 0.00 C ATOM 2028 OG SER A 118 0.133 -6.776 -19.805 1.00 0.00 O ATOM 0 H SER A 118 -1.464 -7.301 -17.034 1.00 0.00 H new ATOM 0 HA SER A 118 1.284 -8.283 -17.748 1.00 0.00 H new ATOM 0 HB2 SER A 118 0.239 -5.438 -18.232 1.00 0.00 H new ATOM 0 HB3 SER A 118 1.778 -6.096 -18.752 1.00 0.00 H new ATOM 0 HG SER A 118 0.208 -6.066 -20.476 1.00 0.00 H new ATOM 2034 N THR A 119 2.097 -6.258 -16.007 1.00 0.00 N ATOM 2035 CA THR A 119 2.490 -5.716 -14.668 1.00 0.00 C ATOM 2036 C THR A 119 2.431 -4.184 -14.685 1.00 0.00 C ATOM 2037 O THR A 119 2.562 -3.575 -15.731 1.00 0.00 O ATOM 2038 CB THR A 119 3.936 -6.180 -14.450 1.00 0.00 C ATOM 2039 OG1 THR A 119 4.167 -7.372 -15.188 1.00 0.00 O ATOM 2040 CG2 THR A 119 4.181 -6.442 -12.963 1.00 0.00 C ATOM 0 H THR A 119 2.759 -6.073 -16.761 1.00 0.00 H new ATOM 0 HA THR A 119 1.825 -6.063 -13.877 1.00 0.00 H new ATOM 0 HB THR A 119 4.618 -5.401 -14.792 1.00 0.00 H new ATOM 0 HG1 THR A 119 5.091 -7.668 -15.051 1.00 0.00 H new ATOM 0 HG21 THR A 119 5.210 -6.771 -12.816 1.00 0.00 H new ATOM 0 HG22 THR A 119 4.009 -5.525 -12.399 1.00 0.00 H new ATOM 0 HG23 THR A 119 3.499 -7.217 -12.613 1.00 0.00 H new ATOM 2048 N CYS A 120 2.253 -3.547 -13.541 1.00 0.00 N ATOM 2049 CA CYS A 120 2.214 -2.043 -13.543 1.00 0.00 C ATOM 2050 C CYS A 120 3.572 -1.508 -14.027 1.00 0.00 C ATOM 2051 O CYS A 120 4.581 -2.176 -13.890 1.00 0.00 O ATOM 2052 CB CYS A 120 1.931 -1.583 -12.106 1.00 0.00 C ATOM 2053 SG CYS A 120 1.667 0.203 -12.125 1.00 0.00 S ATOM 0 H CYS A 120 2.136 -3.991 -12.630 1.00 0.00 H new ATOM 0 HA CYS A 120 1.438 -1.666 -14.210 1.00 0.00 H new ATOM 0 HB2 CYS A 120 1.053 -2.093 -11.710 1.00 0.00 H new ATOM 0 HB3 CYS A 120 2.767 -1.836 -11.454 1.00 0.00 H new ATOM 2058 N ILE A 121 3.613 -0.328 -14.612 1.00 0.00 N ATOM 2059 CA ILE A 121 4.929 0.205 -15.119 1.00 0.00 C ATOM 2060 C ILE A 121 5.813 0.709 -13.964 1.00 0.00 C ATOM 2061 O ILE A 121 7.022 0.578 -14.016 1.00 0.00 O ATOM 2062 CB ILE A 121 4.584 1.343 -16.112 1.00 0.00 C ATOM 2063 CG1 ILE A 121 5.834 1.725 -16.938 1.00 0.00 C ATOM 2064 CG2 ILE A 121 4.025 2.571 -15.372 1.00 0.00 C ATOM 2065 CD1 ILE A 121 6.895 2.445 -16.085 1.00 0.00 C ATOM 0 H ILE A 121 2.808 0.281 -14.759 1.00 0.00 H new ATOM 0 HA ILE A 121 5.505 -0.578 -15.612 1.00 0.00 H new ATOM 0 HB ILE A 121 3.811 0.984 -16.792 1.00 0.00 H new ATOM 0 HG12 ILE A 121 6.269 0.825 -17.373 1.00 0.00 H new ATOM 0 HG13 ILE A 121 5.538 2.369 -17.766 1.00 0.00 H new ATOM 0 HG21 ILE A 121 3.791 3.355 -16.093 1.00 0.00 H new ATOM 0 HG22 ILE A 121 3.119 2.291 -14.834 1.00 0.00 H new ATOM 0 HG23 ILE A 121 4.768 2.939 -14.664 1.00 0.00 H new ATOM 0 HD11 ILE A 121 7.755 2.694 -16.707 1.00 0.00 H new ATOM 0 HD12 ILE A 121 6.470 3.359 -15.671 1.00 0.00 H new ATOM 0 HD13 ILE A 121 7.213 1.792 -15.272 1.00 0.00 H new ATOM 2077 N CYS A 122 5.242 1.303 -12.934 1.00 0.00 N ATOM 2078 CA CYS A 122 6.108 1.826 -11.812 1.00 0.00 C ATOM 2079 C CYS A 122 7.044 0.727 -11.265 1.00 0.00 C ATOM 2080 O CYS A 122 8.157 1.014 -10.863 1.00 0.00 O ATOM 2081 CB CYS A 122 5.156 2.407 -10.734 1.00 0.00 C ATOM 2082 SG CYS A 122 4.409 1.106 -9.702 1.00 0.00 S ATOM 0 H CYS A 122 4.239 1.447 -12.820 1.00 0.00 H new ATOM 0 HA CYS A 122 6.776 2.612 -12.165 1.00 0.00 H new ATOM 0 HB2 CYS A 122 5.709 3.099 -10.099 1.00 0.00 H new ATOM 0 HB3 CYS A 122 4.367 2.981 -11.220 1.00 0.00 H new ATOM 2087 N ARG A 123 6.629 -0.527 -11.272 1.00 0.00 N ATOM 2088 CA ARG A 123 7.554 -1.612 -10.774 1.00 0.00 C ATOM 2089 C ARG A 123 8.836 -1.627 -11.627 1.00 0.00 C ATOM 2090 O ARG A 123 9.911 -1.894 -11.125 1.00 0.00 O ATOM 2091 CB ARG A 123 6.809 -2.949 -10.923 1.00 0.00 C ATOM 2092 CG ARG A 123 7.180 -3.872 -9.761 1.00 0.00 C ATOM 2093 CD ARG A 123 8.522 -4.549 -10.050 1.00 0.00 C ATOM 2094 NE ARG A 123 8.351 -5.960 -9.584 1.00 0.00 N ATOM 2095 CZ ARG A 123 7.671 -6.844 -10.298 1.00 0.00 C ATOM 2096 NH1 ARG A 123 7.118 -6.519 -11.445 1.00 0.00 N ATOM 2097 NH2 ARG A 123 7.545 -8.069 -9.859 1.00 0.00 N ATOM 0 H ARG A 123 5.713 -0.842 -11.592 1.00 0.00 H new ATOM 0 HA ARG A 123 7.834 -1.442 -9.735 1.00 0.00 H new ATOM 0 HB2 ARG A 123 5.733 -2.778 -10.936 1.00 0.00 H new ATOM 0 HB3 ARG A 123 7.069 -3.419 -11.872 1.00 0.00 H new ATOM 0 HG2 ARG A 123 7.242 -3.300 -8.835 1.00 0.00 H new ATOM 0 HG3 ARG A 123 6.405 -4.625 -9.620 1.00 0.00 H new ATOM 0 HD2 ARG A 123 8.763 -4.511 -11.112 1.00 0.00 H new ATOM 0 HD3 ARG A 123 9.336 -4.054 -9.520 1.00 0.00 H new ATOM 0 HE ARG A 123 8.767 -6.247 -8.698 1.00 0.00 H new ATOM 0 HH11 ARG A 123 7.208 -5.568 -11.803 1.00 0.00 H new ATOM 0 HH12 ARG A 123 6.599 -7.218 -11.977 1.00 0.00 H new ATOM 0 HH21 ARG A 123 7.969 -8.339 -8.971 1.00 0.00 H new ATOM 0 HH22 ARG A 123 7.023 -8.755 -10.404 1.00 0.00 H new ATOM 2111 N VAL A 124 8.738 -1.330 -12.913 1.00 0.00 N ATOM 2112 CA VAL A 124 9.969 -1.322 -13.776 1.00 0.00 C ATOM 2113 C VAL A 124 10.706 0.022 -13.615 1.00 0.00 C ATOM 2114 O VAL A 124 10.113 1.064 -13.812 1.00 0.00 O ATOM 2115 CB VAL A 124 9.484 -1.485 -15.227 1.00 0.00 C ATOM 2116 CG1 VAL A 124 10.686 -1.536 -16.173 1.00 0.00 C ATOM 2117 CG2 VAL A 124 8.681 -2.783 -15.356 1.00 0.00 C ATOM 0 H VAL A 124 7.869 -1.096 -13.393 1.00 0.00 H new ATOM 0 HA VAL A 124 10.657 -2.120 -13.498 1.00 0.00 H new ATOM 0 HB VAL A 124 8.853 -0.636 -15.491 1.00 0.00 H new ATOM 0 HG11 VAL A 124 10.337 -1.652 -17.199 1.00 0.00 H new ATOM 0 HG12 VAL A 124 11.257 -0.612 -16.086 1.00 0.00 H new ATOM 0 HG13 VAL A 124 11.321 -2.381 -15.909 1.00 0.00 H new ATOM 0 HG21 VAL A 124 8.338 -2.898 -16.384 1.00 0.00 H new ATOM 0 HG22 VAL A 124 9.313 -3.630 -15.088 1.00 0.00 H new ATOM 0 HG23 VAL A 124 7.820 -2.746 -14.688 1.00 0.00 H new ATOM 2127 N PRO A 125 11.976 -0.030 -13.270 1.00 0.00 N ATOM 2128 CA PRO A 125 12.761 1.224 -13.103 1.00 0.00 C ATOM 2129 C PRO A 125 12.908 1.957 -14.447 1.00 0.00 C ATOM 2130 O PRO A 125 12.413 1.501 -15.461 1.00 0.00 O ATOM 2131 CB PRO A 125 14.114 0.737 -12.583 1.00 0.00 C ATOM 2132 CG PRO A 125 14.206 -0.680 -13.040 1.00 0.00 C ATOM 2133 CD PRO A 125 12.802 -1.219 -13.007 1.00 0.00 C ATOM 0 HA PRO A 125 12.288 1.938 -12.429 1.00 0.00 H new ATOM 0 HB2 PRO A 125 14.932 1.336 -12.984 1.00 0.00 H new ATOM 0 HB3 PRO A 125 14.170 0.807 -11.497 1.00 0.00 H new ATOM 0 HG2 PRO A 125 14.623 -0.739 -14.045 1.00 0.00 H new ATOM 0 HG3 PRO A 125 14.861 -1.258 -12.388 1.00 0.00 H new ATOM 0 HD2 PRO A 125 12.649 -1.990 -13.762 1.00 0.00 H new ATOM 0 HD3 PRO A 125 12.566 -1.667 -12.042 1.00 0.00 H new ATOM 2141 N ARG A 126 13.579 3.093 -14.465 1.00 0.00 N ATOM 2142 CA ARG A 126 13.739 3.847 -15.761 1.00 0.00 C ATOM 2143 C ARG A 126 14.777 3.166 -16.669 1.00 0.00 C ATOM 2144 O ARG A 126 14.624 3.154 -17.877 1.00 0.00 O ATOM 2145 CB ARG A 126 14.208 5.264 -15.390 1.00 0.00 C ATOM 2146 CG ARG A 126 14.121 6.170 -16.621 1.00 0.00 C ATOM 2147 CD ARG A 126 12.654 6.472 -16.934 1.00 0.00 C ATOM 2148 NE ARG A 126 12.397 7.811 -16.322 1.00 0.00 N ATOM 2149 CZ ARG A 126 12.831 8.924 -16.893 1.00 0.00 C ATOM 2150 NH1 ARG A 126 13.507 8.897 -18.019 1.00 0.00 N ATOM 2151 NH2 ARG A 126 12.583 10.078 -16.330 1.00 0.00 N ATOM 0 H ARG A 126 14.017 3.526 -13.652 1.00 0.00 H new ATOM 0 HA ARG A 126 12.798 3.870 -16.311 1.00 0.00 H new ATOM 0 HB2 ARG A 126 13.590 5.664 -14.586 1.00 0.00 H new ATOM 0 HB3 ARG A 126 15.233 5.234 -15.019 1.00 0.00 H new ATOM 0 HG2 ARG A 126 14.663 7.098 -16.441 1.00 0.00 H new ATOM 0 HG3 ARG A 126 14.593 5.686 -17.476 1.00 0.00 H new ATOM 0 HD2 ARG A 126 12.475 6.488 -18.009 1.00 0.00 H new ATOM 0 HD3 ARG A 126 11.996 5.712 -16.513 1.00 0.00 H new ATOM 0 HE ARG A 126 11.877 7.869 -15.447 1.00 0.00 H new ATOM 0 HH11 ARG A 126 13.708 8.005 -18.472 1.00 0.00 H new ATOM 0 HH12 ARG A 126 13.831 9.768 -18.440 1.00 0.00 H new ATOM 0 HH21 ARG A 126 12.058 10.117 -15.456 1.00 0.00 H new ATOM 0 HH22 ARG A 126 12.914 10.939 -16.765 1.00 0.00 H new ATOM 2165 N ALA A 127 15.832 2.601 -16.111 1.00 0.00 N ATOM 2166 CA ALA A 127 16.864 1.932 -16.986 1.00 0.00 C ATOM 2167 C ALA A 127 16.213 0.790 -17.777 1.00 0.00 C ATOM 2168 O ALA A 127 16.402 0.680 -18.975 1.00 0.00 O ATOM 2169 CB ALA A 127 17.951 1.377 -16.052 1.00 0.00 C ATOM 0 H ALA A 127 16.022 2.573 -15.109 1.00 0.00 H new ATOM 0 HA ALA A 127 17.290 2.636 -17.700 1.00 0.00 H new ATOM 0 HB1 ALA A 127 18.721 0.883 -16.644 1.00 0.00 H new ATOM 0 HB2 ALA A 127 18.397 2.195 -15.486 1.00 0.00 H new ATOM 0 HB3 ALA A 127 17.507 0.659 -15.363 1.00 0.00 H new ATOM 2175 N GLN A 128 15.442 -0.057 -17.127 1.00 0.00 N ATOM 2176 CA GLN A 128 14.780 -1.181 -17.879 1.00 0.00 C ATOM 2177 C GLN A 128 13.784 -0.596 -18.891 1.00 0.00 C ATOM 2178 O GLN A 128 13.703 -1.051 -20.016 1.00 0.00 O ATOM 2179 CB GLN A 128 14.043 -2.044 -16.841 1.00 0.00 C ATOM 2180 CG GLN A 128 13.405 -3.247 -17.539 1.00 0.00 C ATOM 2181 CD GLN A 128 13.378 -4.441 -16.576 1.00 0.00 C ATOM 2182 OE1 GLN A 128 12.376 -4.694 -15.940 1.00 0.00 O ATOM 2183 NE2 GLN A 128 14.443 -5.195 -16.439 1.00 0.00 N ATOM 0 H GLN A 128 15.244 -0.022 -16.127 1.00 0.00 H new ATOM 0 HA GLN A 128 15.509 -1.781 -18.425 1.00 0.00 H new ATOM 0 HB2 GLN A 128 14.739 -2.382 -16.073 1.00 0.00 H new ATOM 0 HB3 GLN A 128 13.277 -1.453 -16.339 1.00 0.00 H new ATOM 0 HG2 GLN A 128 12.392 -3.001 -17.859 1.00 0.00 H new ATOM 0 HG3 GLN A 128 13.969 -3.502 -18.436 1.00 0.00 H new ATOM 0 HE21 GLN A 128 15.288 -4.986 -16.971 1.00 0.00 H new ATOM 0 HE22 GLN A 128 14.426 -5.990 -15.800 1.00 0.00 H new ATOM 2192 N LEU A 129 13.032 0.418 -18.506 1.00 0.00 N ATOM 2193 CA LEU A 129 12.054 1.027 -19.476 1.00 0.00 C ATOM 2194 C LEU A 129 12.814 1.622 -20.672 1.00 0.00 C ATOM 2195 O LEU A 129 12.372 1.517 -21.801 1.00 0.00 O ATOM 2196 CB LEU A 129 11.307 2.136 -18.718 1.00 0.00 C ATOM 2197 CG LEU A 129 10.440 1.516 -17.624 1.00 0.00 C ATOM 2198 CD1 LEU A 129 10.034 2.597 -16.621 1.00 0.00 C ATOM 2199 CD2 LEU A 129 9.184 0.907 -18.253 1.00 0.00 C ATOM 0 H LEU A 129 13.052 0.843 -17.579 1.00 0.00 H new ATOM 0 HA LEU A 129 11.357 0.281 -19.857 1.00 0.00 H new ATOM 0 HB2 LEU A 129 12.020 2.834 -18.279 1.00 0.00 H new ATOM 0 HB3 LEU A 129 10.686 2.707 -19.408 1.00 0.00 H new ATOM 0 HG LEU A 129 11.004 0.737 -17.111 1.00 0.00 H new ATOM 0 HD11 LEU A 129 9.415 2.155 -15.840 1.00 0.00 H new ATOM 0 HD12 LEU A 129 10.928 3.032 -16.173 1.00 0.00 H new ATOM 0 HD13 LEU A 129 9.469 3.376 -17.134 1.00 0.00 H new ATOM 0 HD21 LEU A 129 8.565 0.464 -17.473 1.00 0.00 H new ATOM 0 HD22 LEU A 129 8.620 1.686 -18.766 1.00 0.00 H new ATOM 0 HD23 LEU A 129 9.472 0.137 -18.968 1.00 0.00 H new ATOM 2211 N GLU A 130 13.956 2.247 -20.441 1.00 0.00 N ATOM 2212 CA GLU A 130 14.727 2.840 -21.595 1.00 0.00 C ATOM 2213 C GLU A 130 15.091 1.741 -22.606 1.00 0.00 C ATOM 2214 O GLU A 130 15.031 1.957 -23.802 1.00 0.00 O ATOM 2215 CB GLU A 130 16.006 3.457 -21.004 1.00 0.00 C ATOM 2216 CG GLU A 130 15.685 4.833 -20.417 1.00 0.00 C ATOM 2217 CD GLU A 130 16.889 5.759 -20.597 1.00 0.00 C ATOM 2218 OE1 GLU A 130 17.125 6.180 -21.717 1.00 0.00 O ATOM 2219 OE2 GLU A 130 17.555 6.031 -19.611 1.00 0.00 O ATOM 0 H GLU A 130 14.380 2.370 -19.522 1.00 0.00 H new ATOM 0 HA GLU A 130 14.134 3.591 -22.117 1.00 0.00 H new ATOM 0 HB2 GLU A 130 16.413 2.806 -20.230 1.00 0.00 H new ATOM 0 HB3 GLU A 130 16.769 3.549 -21.777 1.00 0.00 H new ATOM 0 HG2 GLU A 130 14.811 5.256 -20.912 1.00 0.00 H new ATOM 0 HG3 GLU A 130 15.439 4.740 -19.359 1.00 0.00 H new ATOM 2226 N GLU A 131 15.465 0.563 -22.143 1.00 0.00 N ATOM 2227 CA GLU A 131 15.825 -0.538 -23.110 1.00 0.00 C ATOM 2228 C GLU A 131 14.643 -0.836 -24.051 1.00 0.00 C ATOM 2229 O GLU A 131 14.838 -1.129 -25.216 1.00 0.00 O ATOM 2230 CB GLU A 131 16.154 -1.781 -22.268 1.00 0.00 C ATOM 2231 CG GLU A 131 17.079 -2.706 -23.062 1.00 0.00 C ATOM 2232 CD GLU A 131 17.903 -3.557 -22.093 1.00 0.00 C ATOM 2233 OE1 GLU A 131 18.726 -2.993 -21.392 1.00 0.00 O ATOM 2234 OE2 GLU A 131 17.696 -4.760 -22.070 1.00 0.00 O ATOM 0 H GLU A 131 15.536 0.318 -21.155 1.00 0.00 H new ATOM 0 HA GLU A 131 16.674 -0.246 -23.729 1.00 0.00 H new ATOM 0 HB2 GLU A 131 16.633 -1.485 -21.335 1.00 0.00 H new ATOM 0 HB3 GLU A 131 15.237 -2.307 -22.003 1.00 0.00 H new ATOM 0 HG2 GLU A 131 16.492 -3.348 -23.719 1.00 0.00 H new ATOM 0 HG3 GLU A 131 17.740 -2.118 -23.699 1.00 0.00 H new ATOM 2241 N GLU A 132 13.422 -0.768 -23.560 1.00 0.00 N ATOM 2242 CA GLU A 132 12.242 -1.056 -24.455 1.00 0.00 C ATOM 2243 C GLU A 132 12.219 -0.075 -25.638 1.00 0.00 C ATOM 2244 O GLU A 132 11.913 -0.458 -26.753 1.00 0.00 O ATOM 2245 CB GLU A 132 10.974 -0.885 -23.607 1.00 0.00 C ATOM 2246 CG GLU A 132 9.937 -1.932 -24.019 1.00 0.00 C ATOM 2247 CD GLU A 132 9.012 -2.228 -22.836 1.00 0.00 C ATOM 2248 OE1 GLU A 132 9.444 -2.925 -21.932 1.00 0.00 O ATOM 2249 OE2 GLU A 132 7.889 -1.753 -22.855 1.00 0.00 O ATOM 0 H GLU A 132 13.192 -0.530 -22.595 1.00 0.00 H new ATOM 0 HA GLU A 132 12.305 -2.066 -24.859 1.00 0.00 H new ATOM 0 HB2 GLU A 132 11.214 -0.993 -22.549 1.00 0.00 H new ATOM 0 HB3 GLU A 132 10.567 0.117 -23.741 1.00 0.00 H new ATOM 0 HG2 GLU A 132 9.356 -1.570 -24.867 1.00 0.00 H new ATOM 0 HG3 GLU A 132 10.436 -2.846 -24.342 1.00 0.00 H new ATOM 2256 N ALA A 133 12.537 1.187 -25.414 1.00 0.00 N ATOM 2257 CA ALA A 133 12.522 2.170 -26.558 1.00 0.00 C ATOM 2258 C ALA A 133 13.528 1.737 -27.633 1.00 0.00 C ATOM 2259 O ALA A 133 13.221 1.748 -28.810 1.00 0.00 O ATOM 2260 CB ALA A 133 12.919 3.538 -25.980 1.00 0.00 C ATOM 0 H ALA A 133 12.801 1.573 -24.508 1.00 0.00 H new ATOM 0 HA ALA A 133 11.536 2.217 -27.021 1.00 0.00 H new ATOM 0 HB1 ALA A 133 12.921 4.283 -26.776 1.00 0.00 H new ATOM 0 HB2 ALA A 133 12.203 3.830 -25.212 1.00 0.00 H new ATOM 0 HB3 ALA A 133 13.915 3.473 -25.542 1.00 0.00 H new ATOM 2266 N ARG A 134 14.727 1.346 -27.244 1.00 0.00 N ATOM 2267 CA ARG A 134 15.735 0.906 -28.275 1.00 0.00 C ATOM 2268 C ARG A 134 15.185 -0.294 -29.066 1.00 0.00 C ATOM 2269 O ARG A 134 15.382 -0.392 -30.262 1.00 0.00 O ATOM 2270 CB ARG A 134 17.005 0.498 -27.510 1.00 0.00 C ATOM 2271 CG ARG A 134 17.892 1.727 -27.301 1.00 0.00 C ATOM 2272 CD ARG A 134 18.732 1.971 -28.557 1.00 0.00 C ATOM 2273 NE ARG A 134 19.787 2.943 -28.133 1.00 0.00 N ATOM 2274 CZ ARG A 134 20.787 2.573 -27.348 1.00 0.00 C ATOM 2275 NH1 ARG A 134 20.894 1.339 -26.909 1.00 0.00 N ATOM 2276 NH2 ARG A 134 21.691 3.451 -26.999 1.00 0.00 N ATOM 0 H ARG A 134 15.047 1.312 -26.276 1.00 0.00 H new ATOM 0 HA ARG A 134 15.948 1.706 -28.984 1.00 0.00 H new ATOM 0 HB2 ARG A 134 16.738 0.061 -26.548 1.00 0.00 H new ATOM 0 HB3 ARG A 134 17.548 -0.265 -28.067 1.00 0.00 H new ATOM 0 HG2 ARG A 134 17.276 2.601 -27.087 1.00 0.00 H new ATOM 0 HG3 ARG A 134 18.542 1.577 -26.439 1.00 0.00 H new ATOM 0 HD2 ARG A 134 19.173 1.044 -28.923 1.00 0.00 H new ATOM 0 HD3 ARG A 134 18.124 2.376 -29.366 1.00 0.00 H new ATOM 0 HE ARG A 134 19.735 3.909 -28.455 1.00 0.00 H new ATOM 0 HH11 ARG A 134 20.197 0.642 -27.172 1.00 0.00 H new ATOM 0 HH12 ARG A 134 21.674 1.078 -26.305 1.00 0.00 H new ATOM 0 HH21 ARG A 134 21.623 4.413 -27.331 1.00 0.00 H new ATOM 0 HH22 ARG A 134 22.464 3.174 -26.395 1.00 0.00 H new ATOM 2290 N LYS A 135 14.497 -1.210 -28.410 1.00 0.00 N ATOM 2291 CA LYS A 135 13.942 -2.400 -29.150 1.00 0.00 C ATOM 2292 C LYS A 135 12.992 -1.944 -30.271 1.00 0.00 C ATOM 2293 O LYS A 135 12.953 -2.546 -31.328 1.00 0.00 O ATOM 2294 CB LYS A 135 13.171 -3.244 -28.122 1.00 0.00 C ATOM 2295 CG LYS A 135 14.160 -3.920 -27.171 1.00 0.00 C ATOM 2296 CD LYS A 135 13.392 -4.620 -26.048 1.00 0.00 C ATOM 2297 CE LYS A 135 14.380 -5.324 -25.115 1.00 0.00 C ATOM 2298 NZ LYS A 135 13.672 -5.421 -23.809 1.00 0.00 N ATOM 0 H LYS A 135 14.298 -1.186 -27.410 1.00 0.00 H new ATOM 0 HA LYS A 135 14.745 -2.975 -29.611 1.00 0.00 H new ATOM 0 HB2 LYS A 135 12.483 -2.612 -27.560 1.00 0.00 H new ATOM 0 HB3 LYS A 135 12.569 -3.996 -28.632 1.00 0.00 H new ATOM 0 HG2 LYS A 135 14.768 -4.643 -27.715 1.00 0.00 H new ATOM 0 HG3 LYS A 135 14.842 -3.180 -26.753 1.00 0.00 H new ATOM 0 HD2 LYS A 135 12.802 -3.894 -25.489 1.00 0.00 H new ATOM 0 HD3 LYS A 135 12.693 -5.343 -26.467 1.00 0.00 H new ATOM 0 HE2 LYS A 135 14.647 -6.311 -25.494 1.00 0.00 H new ATOM 0 HE3 LYS A 135 15.307 -4.758 -25.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 14.286 -5.893 -23.115 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 13.437 -4.466 -23.470 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 12.798 -5.971 -23.928 1.00 0.00 H new ATOM 2312 N LYS A 136 12.223 -0.890 -30.059 1.00 0.00 N ATOM 2313 CA LYS A 136 11.286 -0.427 -31.136 1.00 0.00 C ATOM 2314 C LYS A 136 11.772 0.882 -31.795 1.00 0.00 C ATOM 2315 O LYS A 136 10.986 1.592 -32.394 1.00 0.00 O ATOM 2316 CB LYS A 136 9.944 -0.201 -30.433 1.00 0.00 C ATOM 2317 CG LYS A 136 9.377 -1.546 -29.973 1.00 0.00 C ATOM 2318 CD LYS A 136 7.848 -1.477 -29.955 1.00 0.00 C ATOM 2319 CE LYS A 136 7.393 -0.524 -28.847 1.00 0.00 C ATOM 2320 NZ LYS A 136 6.083 -1.066 -28.390 1.00 0.00 N ATOM 0 H LYS A 136 12.206 -0.341 -29.199 1.00 0.00 H new ATOM 0 HA LYS A 136 11.219 -1.162 -31.938 1.00 0.00 H new ATOM 0 HB2 LYS A 136 10.076 0.462 -29.578 1.00 0.00 H new ATOM 0 HB3 LYS A 136 9.244 0.288 -31.110 1.00 0.00 H new ATOM 0 HG2 LYS A 136 9.708 -2.340 -30.642 1.00 0.00 H new ATOM 0 HG3 LYS A 136 9.752 -1.790 -28.979 1.00 0.00 H new ATOM 0 HD2 LYS A 136 7.478 -1.132 -30.920 1.00 0.00 H new ATOM 0 HD3 LYS A 136 7.430 -2.470 -29.789 1.00 0.00 H new ATOM 0 HE2 LYS A 136 8.115 -0.494 -28.031 1.00 0.00 H new ATOM 0 HE3 LYS A 136 7.291 0.495 -29.220 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 5.705 -0.466 -27.629 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 5.415 -1.076 -29.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 6.213 -2.035 -28.035 1.00 0.00 H new ATOM 2334 N GLY A 137 13.051 1.213 -31.710 1.00 0.00 N ATOM 2335 CA GLY A 137 13.553 2.471 -32.354 1.00 0.00 C ATOM 2336 C GLY A 137 12.714 3.680 -31.904 1.00 0.00 C ATOM 2337 O GLY A 137 12.320 4.497 -32.717 1.00 0.00 O ATOM 0 H GLY A 137 13.760 0.665 -31.223 1.00 0.00 H new ATOM 0 HA2 GLY A 137 14.599 2.629 -32.091 1.00 0.00 H new ATOM 0 HA3 GLY A 137 13.509 2.374 -33.439 1.00 0.00 H new ATOM 2341 N THR A 138 12.440 3.809 -30.622 1.00 0.00 N ATOM 2342 CA THR A 138 11.633 4.972 -30.144 1.00 0.00 C ATOM 2343 C THR A 138 12.195 5.495 -28.812 1.00 0.00 C ATOM 2344 O THR A 138 13.302 5.162 -28.433 1.00 0.00 O ATOM 2345 CB THR A 138 10.208 4.431 -29.967 1.00 0.00 C ATOM 2346 OG1 THR A 138 9.363 5.477 -29.510 1.00 0.00 O ATOM 2347 CG2 THR A 138 10.202 3.287 -28.949 1.00 0.00 C ATOM 0 H THR A 138 12.741 3.161 -29.894 1.00 0.00 H new ATOM 0 HA THR A 138 11.657 5.808 -30.843 1.00 0.00 H new ATOM 0 HB THR A 138 9.846 4.055 -30.924 1.00 0.00 H new ATOM 0 HG1 THR A 138 8.451 5.136 -29.397 1.00 0.00 H new ATOM 0 HG21 THR A 138 9.186 2.910 -28.831 1.00 0.00 H new ATOM 0 HG22 THR A 138 10.848 2.483 -29.301 1.00 0.00 H new ATOM 0 HG23 THR A 138 10.567 3.652 -27.989 1.00 0.00 H new ATOM 2355 N GLN A 139 11.447 6.313 -28.098 1.00 0.00 N ATOM 2356 CA GLN A 139 11.955 6.846 -26.798 1.00 0.00 C ATOM 2357 C GLN A 139 10.934 6.588 -25.679 1.00 0.00 C ATOM 2358 O GLN A 139 9.837 6.128 -25.933 1.00 0.00 O ATOM 2359 CB GLN A 139 12.130 8.347 -27.029 1.00 0.00 C ATOM 2360 CG GLN A 139 13.539 8.619 -27.555 1.00 0.00 C ATOM 2361 CD GLN A 139 13.519 9.860 -28.456 1.00 0.00 C ATOM 2362 OE1 GLN A 139 12.839 9.876 -29.464 1.00 0.00 O ATOM 2363 NE2 GLN A 139 14.238 10.909 -28.141 1.00 0.00 N ATOM 0 H GLN A 139 10.514 6.629 -28.362 1.00 0.00 H new ATOM 0 HA GLN A 139 12.885 6.368 -26.492 1.00 0.00 H new ATOM 0 HB2 GLN A 139 11.388 8.705 -27.743 1.00 0.00 H new ATOM 0 HB3 GLN A 139 11.966 8.891 -26.099 1.00 0.00 H new ATOM 0 HG2 GLN A 139 14.226 8.772 -26.723 1.00 0.00 H new ATOM 0 HG3 GLN A 139 13.903 7.757 -28.114 1.00 0.00 H new ATOM 0 HE21 GLN A 139 14.810 10.900 -27.296 1.00 0.00 H new ATOM 0 HE22 GLN A 139 14.226 11.734 -28.740 1.00 0.00 H new ATOM 2372 N VAL A 140 11.282 6.881 -24.443 1.00 0.00 N ATOM 2373 CA VAL A 140 10.319 6.647 -23.319 1.00 0.00 C ATOM 2374 C VAL A 140 10.691 7.504 -22.093 1.00 0.00 C ATOM 2375 O VAL A 140 11.810 7.967 -21.976 1.00 0.00 O ATOM 2376 CB VAL A 140 10.439 5.152 -22.993 1.00 0.00 C ATOM 2377 CG1 VAL A 140 11.874 4.823 -22.566 1.00 0.00 C ATOM 2378 CG2 VAL A 140 9.474 4.802 -21.856 1.00 0.00 C ATOM 0 H VAL A 140 12.185 7.269 -24.168 1.00 0.00 H new ATOM 0 HA VAL A 140 9.301 6.924 -23.592 1.00 0.00 H new ATOM 0 HB VAL A 140 10.189 4.570 -23.880 1.00 0.00 H new ATOM 0 HG11 VAL A 140 11.951 3.760 -22.336 1.00 0.00 H new ATOM 0 HG12 VAL A 140 12.560 5.070 -23.376 1.00 0.00 H new ATOM 0 HG13 VAL A 140 12.133 5.405 -21.681 1.00 0.00 H new ATOM 0 HG21 VAL A 140 9.557 3.741 -21.622 1.00 0.00 H new ATOM 0 HG22 VAL A 140 9.725 5.389 -20.972 1.00 0.00 H new ATOM 0 HG23 VAL A 140 8.453 5.027 -22.163 1.00 0.00 H new ATOM 2388 N SER A 141 9.764 7.719 -21.181 1.00 0.00 N ATOM 2389 CA SER A 141 10.082 8.545 -19.973 1.00 0.00 C ATOM 2390 C SER A 141 8.961 8.440 -18.922 1.00 0.00 C ATOM 2391 O SER A 141 8.069 9.266 -18.879 1.00 0.00 O ATOM 2392 CB SER A 141 10.188 9.972 -20.500 1.00 0.00 C ATOM 2393 OG SER A 141 10.300 10.874 -19.407 1.00 0.00 O ATOM 0 H SER A 141 8.810 7.360 -21.224 1.00 0.00 H new ATOM 0 HA SER A 141 10.996 8.213 -19.480 1.00 0.00 H new ATOM 0 HB2 SER A 141 11.055 10.066 -21.153 1.00 0.00 H new ATOM 0 HB3 SER A 141 9.310 10.216 -21.098 1.00 0.00 H new ATOM 0 HG SER A 141 10.369 11.791 -19.745 1.00 0.00 H new ATOM 2399 N PHE A 142 8.997 7.428 -18.078 1.00 0.00 N ATOM 2400 CA PHE A 142 7.924 7.283 -17.041 1.00 0.00 C ATOM 2401 C PHE A 142 8.377 7.905 -15.702 1.00 0.00 C ATOM 2402 O PHE A 142 9.552 8.095 -15.458 1.00 0.00 O ATOM 2403 CB PHE A 142 7.694 5.761 -16.900 1.00 0.00 C ATOM 2404 CG PHE A 142 6.875 5.455 -15.656 1.00 0.00 C ATOM 2405 CD1 PHE A 142 5.484 5.621 -15.656 1.00 0.00 C ATOM 2406 CD2 PHE A 142 7.524 5.021 -14.497 1.00 0.00 C ATOM 2407 CE1 PHE A 142 4.749 5.346 -14.492 1.00 0.00 C ATOM 2408 CE2 PHE A 142 6.794 4.755 -13.345 1.00 0.00 C ATOM 2409 CZ PHE A 142 5.409 4.911 -13.333 1.00 0.00 C ATOM 0 H PHE A 142 9.716 6.705 -18.064 1.00 0.00 H new ATOM 0 HA PHE A 142 7.007 7.800 -17.325 1.00 0.00 H new ATOM 0 HB2 PHE A 142 7.179 5.383 -17.783 1.00 0.00 H new ATOM 0 HB3 PHE A 142 8.653 5.247 -16.846 1.00 0.00 H new ATOM 0 HD1 PHE A 142 4.979 5.959 -16.549 1.00 0.00 H new ATOM 0 HD2 PHE A 142 8.596 4.892 -14.497 1.00 0.00 H new ATOM 0 HE1 PHE A 142 3.676 5.469 -14.489 1.00 0.00 H new ATOM 0 HE2 PHE A 142 7.304 4.425 -12.452 1.00 0.00 H new ATOM 0 HZ PHE A 142 4.847 4.698 -12.436 1.00 0.00 H new ATOM 2419 N HIS A 143 7.436 8.201 -14.832 1.00 0.00 N ATOM 2420 CA HIS A 143 7.779 8.786 -13.500 1.00 0.00 C ATOM 2421 C HIS A 143 6.868 8.163 -12.430 1.00 0.00 C ATOM 2422 O HIS A 143 7.330 7.513 -11.511 1.00 0.00 O ATOM 2423 CB HIS A 143 7.505 10.284 -13.639 1.00 0.00 C ATOM 2424 CG HIS A 143 8.595 10.920 -14.458 1.00 0.00 C ATOM 2425 ND1 HIS A 143 8.387 11.344 -15.761 1.00 0.00 N ATOM 2426 CD2 HIS A 143 9.906 11.210 -14.174 1.00 0.00 C ATOM 2427 CE1 HIS A 143 9.546 11.861 -16.209 1.00 0.00 C ATOM 2428 NE2 HIS A 143 10.505 11.805 -15.281 1.00 0.00 N ATOM 0 H HIS A 143 6.439 8.060 -14.993 1.00 0.00 H new ATOM 0 HA HIS A 143 8.811 8.597 -13.205 1.00 0.00 H new ATOM 0 HB2 HIS A 143 6.537 10.445 -14.114 1.00 0.00 H new ATOM 0 HB3 HIS A 143 7.457 10.749 -12.654 1.00 0.00 H new ATOM 0 HD1 HIS A 143 7.514 11.277 -16.285 1.00 0.00 H new ATOM 0 HD2 HIS A 143 10.398 11.007 -13.234 1.00 0.00 H new ATOM 0 HE1 HIS A 143 9.684 12.271 -17.198 1.00 0.00 H new ATOM 2436 N GLN A 144 5.571 8.339 -12.561 1.00 0.00 N ATOM 2437 CA GLN A 144 4.617 7.744 -11.578 1.00 0.00 C ATOM 2438 C GLN A 144 3.493 7.026 -12.340 1.00 0.00 C ATOM 2439 O GLN A 144 3.172 7.395 -13.456 1.00 0.00 O ATOM 2440 CB GLN A 144 4.063 8.928 -10.773 1.00 0.00 C ATOM 2441 CG GLN A 144 3.412 9.955 -11.709 1.00 0.00 C ATOM 2442 CD GLN A 144 4.421 11.062 -12.038 1.00 0.00 C ATOM 2443 OE1 GLN A 144 4.710 11.306 -13.193 1.00 0.00 O ATOM 2444 NE2 GLN A 144 4.974 11.754 -11.070 1.00 0.00 N ATOM 0 H GLN A 144 5.135 8.873 -13.312 1.00 0.00 H new ATOM 0 HA GLN A 144 5.090 7.013 -10.922 1.00 0.00 H new ATOM 0 HB2 GLN A 144 3.331 8.572 -10.048 1.00 0.00 H new ATOM 0 HB3 GLN A 144 4.867 9.400 -10.208 1.00 0.00 H new ATOM 0 HG2 GLN A 144 3.080 9.468 -12.626 1.00 0.00 H new ATOM 0 HG3 GLN A 144 2.528 10.383 -11.237 1.00 0.00 H new ATOM 0 HE21 GLN A 144 4.735 11.553 -10.099 1.00 0.00 H new ATOM 0 HE22 GLN A 144 5.643 12.492 -11.289 1.00 0.00 H new ATOM 2453 N CYS A 145 2.892 6.004 -11.763 1.00 0.00 N ATOM 2454 CA CYS A 145 1.794 5.288 -12.499 1.00 0.00 C ATOM 2455 C CYS A 145 0.414 5.828 -12.089 1.00 0.00 C ATOM 2456 O CYS A 145 0.243 6.347 -11.002 1.00 0.00 O ATOM 2457 CB CYS A 145 1.933 3.785 -12.184 1.00 0.00 C ATOM 2458 SG CYS A 145 1.600 3.428 -10.431 1.00 0.00 S ATOM 0 H CYS A 145 3.109 5.642 -10.834 1.00 0.00 H new ATOM 0 HA CYS A 145 1.880 5.453 -13.573 1.00 0.00 H new ATOM 0 HB2 CYS A 145 1.243 3.218 -12.808 1.00 0.00 H new ATOM 0 HB3 CYS A 145 2.939 3.452 -12.438 1.00 0.00 H new ATOM 2463 N VAL A 146 -0.569 5.720 -12.962 1.00 0.00 N ATOM 2464 CA VAL A 146 -1.939 6.248 -12.617 1.00 0.00 C ATOM 2465 C VAL A 146 -2.639 5.365 -11.564 1.00 0.00 C ATOM 2466 O VAL A 146 -3.497 5.843 -10.846 1.00 0.00 O ATOM 2467 CB VAL A 146 -2.760 6.279 -13.924 1.00 0.00 C ATOM 2468 CG1 VAL A 146 -2.050 7.162 -14.953 1.00 0.00 C ATOM 2469 CG2 VAL A 146 -2.917 4.862 -14.494 1.00 0.00 C ATOM 0 H VAL A 146 -0.485 5.296 -13.886 1.00 0.00 H new ATOM 0 HA VAL A 146 -1.854 7.244 -12.184 1.00 0.00 H new ATOM 0 HB VAL A 146 -3.748 6.684 -13.706 1.00 0.00 H new ATOM 0 HG11 VAL A 146 -2.630 7.184 -15.876 1.00 0.00 H new ATOM 0 HG12 VAL A 146 -1.955 8.174 -14.560 1.00 0.00 H new ATOM 0 HG13 VAL A 146 -1.059 6.758 -15.157 1.00 0.00 H new ATOM 0 HG21 VAL A 146 -3.498 4.903 -15.415 1.00 0.00 H new ATOM 0 HG22 VAL A 146 -1.933 4.443 -14.704 1.00 0.00 H new ATOM 0 HG23 VAL A 146 -3.431 4.233 -13.768 1.00 0.00 H new ATOM 2479 N HIS A 147 -2.298 4.086 -11.460 1.00 0.00 N ATOM 2480 CA HIS A 147 -2.981 3.208 -10.433 1.00 0.00 C ATOM 2481 C HIS A 147 -2.954 3.884 -9.047 1.00 0.00 C ATOM 2482 O HIS A 147 -3.991 4.190 -8.487 1.00 0.00 O ATOM 2483 CB HIS A 147 -2.198 1.879 -10.389 1.00 0.00 C ATOM 2484 CG HIS A 147 -2.285 1.152 -11.718 1.00 0.00 C ATOM 2485 ND1 HIS A 147 -3.153 1.531 -12.743 1.00 0.00 N ATOM 2486 CD2 HIS A 147 -1.608 0.052 -12.201 1.00 0.00 C ATOM 2487 CE1 HIS A 147 -2.972 0.677 -13.765 1.00 0.00 C ATOM 2488 NE2 HIS A 147 -2.045 -0.242 -13.488 1.00 0.00 N ATOM 0 H HIS A 147 -1.591 3.622 -12.030 1.00 0.00 H new ATOM 0 HA HIS A 147 -4.025 3.040 -10.699 1.00 0.00 H new ATOM 0 HB2 HIS A 147 -1.154 2.076 -10.146 1.00 0.00 H new ATOM 0 HB3 HIS A 147 -2.596 1.245 -9.597 1.00 0.00 H new ATOM 0 HD2 HIS A 147 -0.852 -0.498 -11.661 1.00 0.00 H new ATOM 0 HE1 HIS A 147 -3.512 0.728 -14.699 1.00 0.00 H new ATOM 0 HE2 HIS A 147 -1.725 -0.999 -14.092 1.00 0.00 H new ATOM 2496 N CYS A 148 -1.782 4.133 -8.497 1.00 0.00 N ATOM 2497 CA CYS A 148 -1.706 4.796 -7.161 1.00 0.00 C ATOM 2498 C CYS A 148 -0.837 6.070 -7.237 1.00 0.00 C ATOM 2499 O CYS A 148 -0.536 6.555 -8.312 1.00 0.00 O ATOM 2500 CB CYS A 148 -1.076 3.738 -6.239 1.00 0.00 C ATOM 2501 SG CYS A 148 0.663 3.442 -6.685 1.00 0.00 S ATOM 0 H CYS A 148 -0.882 3.904 -8.919 1.00 0.00 H new ATOM 0 HA CYS A 148 -2.681 5.120 -6.797 1.00 0.00 H new ATOM 0 HB2 CYS A 148 -1.139 4.069 -5.202 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -1.638 2.807 -6.310 1.00 0.00 H new ATOM 2506 N GLY A 149 -0.412 6.596 -6.106 1.00 0.00 N ATOM 2507 CA GLY A 149 0.456 7.810 -6.121 1.00 0.00 C ATOM 2508 C GLY A 149 1.910 7.360 -5.923 1.00 0.00 C ATOM 2509 O GLY A 149 2.556 7.735 -4.962 1.00 0.00 O ATOM 0 H GLY A 149 -0.632 6.233 -5.178 1.00 0.00 H new ATOM 0 HA2 GLY A 149 0.348 8.343 -7.065 1.00 0.00 H new ATOM 0 HA3 GLY A 149 0.160 8.499 -5.330 1.00 0.00 H new ATOM 2513 N CYS A 150 2.426 6.542 -6.819 1.00 0.00 N ATOM 2514 CA CYS A 150 3.836 6.053 -6.673 1.00 0.00 C ATOM 2515 C CYS A 150 4.757 6.828 -7.626 1.00 0.00 C ATOM 2516 O CYS A 150 4.381 7.129 -8.741 1.00 0.00 O ATOM 2517 CB CYS A 150 3.760 4.558 -7.041 1.00 0.00 C ATOM 2518 SG CYS A 150 5.406 3.807 -7.142 1.00 0.00 S ATOM 0 H CYS A 150 1.931 6.195 -7.641 1.00 0.00 H new ATOM 0 HA CYS A 150 4.243 6.198 -5.673 1.00 0.00 H new ATOM 0 HB2 CYS A 150 3.164 4.030 -6.296 1.00 0.00 H new ATOM 0 HB3 CYS A 150 3.249 4.444 -7.997 1.00 0.00 H new ATOM 2523 N ARG A 151 5.967 7.138 -7.205 1.00 0.00 N ATOM 2524 CA ARG A 151 6.903 7.881 -8.111 1.00 0.00 C ATOM 2525 C ARG A 151 7.878 6.893 -8.767 1.00 0.00 C ATOM 2526 O ARG A 151 9.076 7.108 -8.772 1.00 0.00 O ATOM 2527 CB ARG A 151 7.659 8.875 -7.218 1.00 0.00 C ATOM 2528 CG ARG A 151 6.970 10.239 -7.274 1.00 0.00 C ATOM 2529 CD ARG A 151 8.010 11.346 -7.092 1.00 0.00 C ATOM 2530 NE ARG A 151 7.383 12.569 -7.683 1.00 0.00 N ATOM 2531 CZ ARG A 151 6.445 13.243 -7.035 1.00 0.00 C ATOM 2532 NH1 ARG A 151 6.024 12.863 -5.850 1.00 0.00 N ATOM 2533 NH2 ARG A 151 5.922 14.309 -7.582 1.00 0.00 N ATOM 0 H ARG A 151 6.341 6.910 -6.284 1.00 0.00 H new ATOM 0 HA ARG A 151 6.373 8.399 -8.910 1.00 0.00 H new ATOM 0 HB2 ARG A 151 7.684 8.511 -6.191 1.00 0.00 H new ATOM 0 HB3 ARG A 151 8.693 8.964 -7.550 1.00 0.00 H new ATOM 0 HG2 ARG A 151 6.458 10.360 -8.229 1.00 0.00 H new ATOM 0 HG3 ARG A 151 6.211 10.307 -6.494 1.00 0.00 H new ATOM 0 HD2 ARG A 151 8.248 11.494 -6.039 1.00 0.00 H new ATOM 0 HD3 ARG A 151 8.943 11.098 -7.598 1.00 0.00 H new ATOM 0 HE ARG A 151 7.684 12.890 -8.603 1.00 0.00 H new ATOM 0 HH11 ARG A 151 6.421 12.033 -5.410 1.00 0.00 H new ATOM 0 HH12 ARG A 151 5.300 13.398 -5.370 1.00 0.00 H new ATOM 0 HH21 ARG A 151 6.237 14.617 -8.502 1.00 0.00 H new ATOM 0 HH22 ARG A 151 5.199 14.833 -7.089 1.00 0.00 H new ATOM 2547 N GLY A 152 7.375 5.810 -9.326 1.00 0.00 N ATOM 2548 CA GLY A 152 8.270 4.816 -9.979 1.00 0.00 C ATOM 2549 C GLY A 152 9.039 4.027 -8.911 1.00 0.00 C ATOM 2550 O GLY A 152 10.063 4.472 -8.428 1.00 0.00 O ATOM 0 H GLY A 152 6.382 5.580 -9.353 1.00 0.00 H new ATOM 0 HA2 GLY A 152 7.683 4.135 -10.595 1.00 0.00 H new ATOM 0 HA3 GLY A 152 8.970 5.324 -10.643 1.00 0.00 H new ATOM 2554 N CYS A 153 8.563 2.853 -8.542 1.00 0.00 N ATOM 2555 CA CYS A 153 9.285 2.045 -7.512 1.00 0.00 C ATOM 2556 C CYS A 153 9.952 0.818 -8.165 1.00 0.00 C ATOM 2557 O CYS A 153 9.310 0.051 -8.859 1.00 0.00 O ATOM 2558 CB CYS A 153 8.223 1.642 -6.464 1.00 0.00 C ATOM 2559 SG CYS A 153 7.007 0.475 -7.147 1.00 0.00 S ATOM 0 H CYS A 153 7.712 2.428 -8.910 1.00 0.00 H new ATOM 0 HA CYS A 153 10.089 2.608 -7.038 1.00 0.00 H new ATOM 0 HB2 CYS A 153 8.716 1.191 -5.603 1.00 0.00 H new ATOM 0 HB3 CYS A 153 7.709 2.534 -6.106 1.00 0.00 H new ATOM 2564 N ALA A 154 11.240 0.637 -7.964 1.00 0.00 N ATOM 2565 CA ALA A 154 11.941 -0.530 -8.585 1.00 0.00 C ATOM 2566 C ALA A 154 13.160 -0.937 -7.740 1.00 0.00 C ATOM 2567 O ALA A 154 13.778 -0.104 -7.103 1.00 0.00 O ATOM 2568 CB ALA A 154 12.384 -0.035 -9.960 1.00 0.00 C ATOM 0 H ALA A 154 11.831 1.246 -7.398 1.00 0.00 H new ATOM 0 HA ALA A 154 11.299 -1.408 -8.652 1.00 0.00 H new ATOM 0 HB1 ALA A 154 12.908 -0.835 -10.483 1.00 0.00 H new ATOM 0 HB2 ALA A 154 11.510 0.264 -10.538 1.00 0.00 H new ATOM 0 HB3 ALA A 154 13.051 0.819 -9.842 1.00 0.00 H new ATOM 2574 N SER A 155 13.510 -2.206 -7.728 1.00 0.00 N ATOM 2575 CA SER A 155 14.696 -2.641 -6.913 1.00 0.00 C ATOM 2576 C SER A 155 15.952 -2.742 -7.797 1.00 0.00 C ATOM 2577 O SER A 155 17.036 -2.396 -7.367 1.00 0.00 O ATOM 2578 CB SER A 155 14.332 -4.014 -6.337 1.00 0.00 C ATOM 2579 OG SER A 155 12.986 -3.988 -5.870 1.00 0.00 O ATOM 0 H SER A 155 13.034 -2.949 -8.239 1.00 0.00 H new ATOM 0 HA SER A 155 14.920 -1.924 -6.123 1.00 0.00 H new ATOM 0 HB2 SER A 155 14.449 -4.784 -7.100 1.00 0.00 H new ATOM 0 HB3 SER A 155 15.007 -4.269 -5.520 1.00 0.00 H new ATOM 0 HG SER A 155 12.698 -4.899 -5.651 1.00 0.00 H new ATOM 2585 N THR A 156 15.826 -3.213 -9.025 1.00 0.00 N ATOM 2586 CA THR A 156 17.043 -3.325 -9.914 1.00 0.00 C ATOM 2587 C THR A 156 17.756 -1.967 -10.025 1.00 0.00 C ATOM 2588 O THR A 156 18.972 -1.902 -10.034 1.00 0.00 O ATOM 2589 CB THR A 156 16.542 -3.767 -11.299 1.00 0.00 C ATOM 2590 OG1 THR A 156 15.575 -4.797 -11.144 1.00 0.00 O ATOM 2591 CG2 THR A 156 17.718 -4.290 -12.126 1.00 0.00 C ATOM 0 H THR A 156 14.949 -3.520 -9.446 1.00 0.00 H new ATOM 0 HA THR A 156 17.756 -4.040 -9.503 1.00 0.00 H new ATOM 0 HB THR A 156 16.090 -2.917 -11.811 1.00 0.00 H new ATOM 0 HG1 THR A 156 15.253 -5.079 -12.026 1.00 0.00 H new ATOM 0 HG21 THR A 156 17.362 -4.603 -13.107 1.00 0.00 H new ATOM 0 HG22 THR A 156 18.460 -3.500 -12.244 1.00 0.00 H new ATOM 0 HG23 THR A 156 18.172 -5.140 -11.616 1.00 0.00 H new ATOM 2599 N ASP A 157 17.015 -0.883 -10.107 1.00 0.00 N ATOM 2600 CA ASP A 157 17.658 0.461 -10.215 1.00 0.00 C ATOM 2601 C ASP A 157 16.964 1.457 -9.281 1.00 0.00 C ATOM 2602 O ASP A 157 17.660 2.114 -8.525 1.00 0.00 O ATOM 2603 CB ASP A 157 17.471 0.873 -11.675 1.00 0.00 C ATOM 2604 CG ASP A 157 18.662 0.384 -12.502 1.00 0.00 C ATOM 2605 OD1 ASP A 157 18.609 -0.739 -12.974 1.00 0.00 O ATOM 2606 OD2 ASP A 157 19.607 1.142 -12.649 1.00 0.00 O ATOM 2607 OXT ASP A 157 15.748 1.545 -9.341 1.00 0.00 O ATOM 0 H ASP A 157 15.995 -0.875 -10.103 1.00 0.00 H new ATOM 0 HA ASP A 157 18.710 0.440 -9.929 1.00 0.00 H new ATOM 0 HB2 ASP A 157 16.545 0.451 -12.067 1.00 0.00 H new ATOM 0 HB3 ASP A 157 17.384 1.957 -11.749 1.00 0.00 H new TER 2612 ASP A 157 HETATM 2613 ZN ZN A1000 1.237 1.230 -6.488 1.00 0.00 ZN HETATM 2614 ZN ZN A1001 5.017 1.567 -7.525 1.00 0.00 ZN HETATM 2615 ZN ZN A1002 2.146 1.202 -10.124 1.00 0.00 ZN