USER MOD reduce.3.24.130724 H: found=0, std=0, add=1037, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1041 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 142 ASN : amide:sc= -11.8! C(o=-12!,f=-14!) USER MOD Set 1.2: A 144 ASN : amide:sc= -0.903 K(o=-12,f=-18!) USER MOD Set 1.3: A 147 THR OG1 : rot -63:sc= 0.282 USER MOD Set 2.1: A 56 SER OG : rot 180:sc= -0.0176 USER MOD Set 2.2: A 57 ASN : amide:sc= -0.0119 X(o=-0.029,f=-0.018) USER MOD Set 3.1: A 38 TYR OH : rot -15:sc= 0.0131 USER MOD Set 3.2: A 47 ASN : amide:sc= -1.26 K(o=-1.3,f=-5.8!) USER MOD Set 4.1: A 35 THR OG1 : rot 152:sc= 1 USER MOD Set 4.2: A 66 TYR OH : rot 70:sc= -1.18 USER MOD Set 5.1: A 32 TYR OH : rot -140:sc= -0.284 USER MOD Set 5.2: A 96 HIS :FLIP no HD1:sc= -1.73 F(o=-2.7!,f=-2) USER MOD Single : A 9 SER OG : rot 180:sc= -0.0319 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 CYS SG : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot -103:sc= 0.451 USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 159:sc= 0 (180deg=-0.254) USER MOD Single : A 39 HIS : no HE2:sc= -3.64! C(o=-3.6!,f=-4.2!) USER MOD Single : A 45 CYS SG : rot 17:sc= 0.668 USER MOD Single : A 49 ASN : amide:sc= 0.296 K(o=0.3,f=-5.5!) USER MOD Single : A 50 THR OG1 : rot 119:sc= 1.69 USER MOD Single : A 51 GLN : amide:sc=-0.00588 K(o=-0.0059,f=-1.7!) USER MOD Single : A 55 CYS SG : rot 180:sc= -0.336 USER MOD Single : A 61 ASN :FLIP amide:sc= -2.55! C(o=-3.2!,f=-2.5!) USER MOD Single : A 65 ASN : amide:sc= -0.13 X(o=-0.13,f=-0.46) USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 CYS SG : rot 140:sc= -0.736 USER MOD Single : A 82 SER OG : rot 164:sc= -0.622 USER MOD Single : A 84 CYS SG : rot 3:sc= -1.05 USER MOD Single : A 85 SER OG : rot 29:sc= 0.447 USER MOD Single : A 87 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0619) USER MOD Single : A 97 CYS SG : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc= -0.696! K(o=-0.7!,f=-2.7) USER MOD Single : A 105 ASN : amide:sc= -0.161 X(o=-0.16,f=-0.013) USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 60:sc= 0.964 USER MOD Single : A 115 SER OG : rot 46:sc= 0.378 USER MOD Single : A 117 LYS NZ :NH3+ -143:sc= -0.157 (180deg=-1.46!) USER MOD Single : A 118 MET CE :methyl 172:sc= -0.208 (180deg=-0.287) USER MOD Single : A 121 ASN : amide:sc= -0.362 X(o=-0.36,f=-0.3) USER MOD Single : A 134 ASN : amide:sc= 0.139 K(o=0.14,f=-2.6) USER MOD Single : A 139 THR OG1 : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 40:sc= 0.0631 USER MOD Single : A 145 LYS NZ :NH3+ -129:sc= 0.00141 (180deg=-0.514) USER MOD Single : A 149 CYS SG : rot 39:sc= -3.79 USER MOD Single : A 158 SER OG : rot -6:sc= 0.553 USER MOD ----------------------------------------------------------------- ATOM 80 N SER A 9 -0.615 11.561 -7.724 1.00 0.00 N ATOM 81 CA SER A 9 -2.012 11.559 -7.306 1.00 0.00 C ATOM 82 C SER A 9 -2.484 10.142 -6.995 1.00 0.00 C ATOM 83 O SER A 9 -3.232 9.920 -6.044 1.00 0.00 O ATOM 84 CB SER A 9 -2.892 12.174 -8.396 1.00 0.00 C ATOM 85 OG SER A 9 -3.142 11.244 -9.435 1.00 0.00 O ATOM 0 HA SER A 9 -2.096 12.158 -6.399 1.00 0.00 H new ATOM 0 HB2 SER A 9 -3.837 12.502 -7.963 1.00 0.00 H new ATOM 0 HB3 SER A 9 -2.404 13.059 -8.805 1.00 0.00 H new ATOM 0 HG SER A 9 -3.708 11.661 -10.118 1.00 0.00 H new ATOM 91 N ALA A 10 -2.041 9.186 -7.806 1.00 0.00 N ATOM 92 CA ALA A 10 -2.416 7.790 -7.618 1.00 0.00 C ATOM 93 C ALA A 10 -1.186 6.918 -7.388 1.00 0.00 C ATOM 94 O ALA A 10 -0.141 7.126 -8.005 1.00 0.00 O ATOM 95 CB ALA A 10 -3.205 7.289 -8.818 1.00 0.00 C ATOM 0 H ALA A 10 -1.422 9.353 -8.599 1.00 0.00 H new ATOM 0 HA ALA A 10 -3.046 7.725 -6.731 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -3.478 6.245 -8.664 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -4.109 7.887 -8.935 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -2.594 7.375 -9.717 1.00 0.00 H new ATOM 101 N LEU A 11 -1.318 5.941 -6.497 1.00 0.00 N ATOM 102 CA LEU A 11 -0.216 5.037 -6.185 1.00 0.00 C ATOM 103 C LEU A 11 -0.407 3.689 -6.874 1.00 0.00 C ATOM 104 O LEU A 11 -1.520 3.170 -6.948 1.00 0.00 O ATOM 105 CB LEU A 11 -0.107 4.838 -4.672 1.00 0.00 C ATOM 106 CG LEU A 11 0.724 3.640 -4.211 1.00 0.00 C ATOM 107 CD1 LEU A 11 2.169 3.787 -4.661 1.00 0.00 C ATOM 108 CD2 LEU A 11 0.647 3.487 -2.699 1.00 0.00 C ATOM 0 H LEU A 11 -2.176 5.755 -5.978 1.00 0.00 H new ATOM 0 HA LEU A 11 0.706 5.486 -6.554 1.00 0.00 H new ATOM 0 HB2 LEU A 11 0.321 5.741 -4.237 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -1.113 4.735 -4.266 1.00 0.00 H new ATOM 0 HG LEU A 11 0.313 2.740 -4.668 1.00 0.00 H new ATOM 0 HD11 LEU A 11 2.745 2.925 -4.324 1.00 0.00 H new ATOM 0 HD12 LEU A 11 2.207 3.846 -5.749 1.00 0.00 H new ATOM 0 HD13 LEU A 11 2.593 4.696 -4.234 1.00 0.00 H new ATOM 0 HD21 LEU A 11 1.244 2.629 -2.389 1.00 0.00 H new ATOM 0 HD22 LEU A 11 1.032 4.388 -2.222 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -0.390 3.333 -2.401 1.00 0.00 H new ATOM 120 N ARG A 12 0.688 3.128 -7.376 1.00 0.00 N ATOM 121 CA ARG A 12 0.642 1.840 -8.058 1.00 0.00 C ATOM 122 C ARG A 12 1.933 1.058 -7.830 1.00 0.00 C ATOM 123 O ARG A 12 3.028 1.615 -7.902 1.00 0.00 O ATOM 124 CB ARG A 12 0.412 2.040 -9.557 1.00 0.00 C ATOM 125 CG ARG A 12 1.666 2.443 -10.317 1.00 0.00 C ATOM 126 CD ARG A 12 1.349 2.815 -11.757 1.00 0.00 C ATOM 127 NE ARG A 12 1.317 1.645 -12.630 1.00 0.00 N ATOM 128 CZ ARG A 12 0.249 0.870 -12.782 1.00 0.00 C ATOM 129 NH1 ARG A 12 -0.869 1.140 -12.123 1.00 0.00 N ATOM 130 NH2 ARG A 12 0.298 -0.178 -13.595 1.00 0.00 N ATOM 0 H ARG A 12 1.617 3.545 -7.323 1.00 0.00 H new ATOM 0 HA ARG A 12 -0.188 1.267 -7.644 1.00 0.00 H new ATOM 0 HB2 ARG A 12 0.021 1.116 -9.982 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -0.351 2.805 -9.700 1.00 0.00 H new ATOM 0 HG2 ARG A 12 2.140 3.288 -9.818 1.00 0.00 H new ATOM 0 HG3 ARG A 12 2.382 1.621 -10.301 1.00 0.00 H new ATOM 0 HD2 ARG A 12 0.386 3.323 -11.796 1.00 0.00 H new ATOM 0 HD3 ARG A 12 2.096 3.520 -12.122 1.00 0.00 H new ATOM 0 HE ARG A 12 2.161 1.410 -13.152 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -0.911 1.945 -11.497 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -1.688 0.543 -12.242 1.00 0.00 H new ATOM 0 HH21 ARG A 12 1.156 -0.389 -14.104 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -0.523 -0.772 -13.711 1.00 0.00 H new ATOM 144 N ILE A 13 1.794 -0.235 -7.556 1.00 0.00 N ATOM 145 CA ILE A 13 2.949 -1.093 -7.319 1.00 0.00 C ATOM 146 C ILE A 13 2.809 -2.419 -8.058 1.00 0.00 C ATOM 147 O ILE A 13 1.707 -2.949 -8.204 1.00 0.00 O ATOM 148 CB ILE A 13 3.143 -1.373 -5.817 1.00 0.00 C ATOM 149 CG1 ILE A 13 3.419 -0.070 -5.065 1.00 0.00 C ATOM 150 CG2 ILE A 13 4.278 -2.364 -5.606 1.00 0.00 C ATOM 151 CD1 ILE A 13 2.978 -0.102 -3.618 1.00 0.00 C ATOM 0 H ILE A 13 0.894 -0.711 -7.493 1.00 0.00 H new ATOM 0 HA ILE A 13 3.821 -0.560 -7.697 1.00 0.00 H new ATOM 0 HB ILE A 13 2.226 -1.811 -5.422 1.00 0.00 H new ATOM 0 HG12 ILE A 13 4.487 0.145 -5.106 1.00 0.00 H new ATOM 0 HG13 ILE A 13 2.910 0.748 -5.574 1.00 0.00 H new ATOM 0 HG21 ILE A 13 4.403 -2.552 -4.540 1.00 0.00 H new ATOM 0 HG22 ILE A 13 4.044 -3.299 -6.114 1.00 0.00 H new ATOM 0 HG23 ILE A 13 5.201 -1.952 -6.013 1.00 0.00 H new ATOM 0 HD11 ILE A 13 3.205 0.855 -3.147 1.00 0.00 H new ATOM 0 HD12 ILE A 13 1.905 -0.285 -3.569 1.00 0.00 H new ATOM 0 HD13 ILE A 13 3.506 -0.898 -3.094 1.00 0.00 H new ATOM 163 N LYS A 14 3.934 -2.953 -8.522 1.00 0.00 N ATOM 164 CA LYS A 14 3.939 -4.220 -9.244 1.00 0.00 C ATOM 165 C LYS A 14 4.794 -5.255 -8.520 1.00 0.00 C ATOM 166 O LYS A 14 5.995 -5.060 -8.333 1.00 0.00 O ATOM 167 CB LYS A 14 4.462 -4.017 -10.668 1.00 0.00 C ATOM 168 CG LYS A 14 4.371 -5.263 -11.533 1.00 0.00 C ATOM 169 CD LYS A 14 5.231 -5.140 -12.779 1.00 0.00 C ATOM 170 CE LYS A 14 5.570 -6.505 -13.359 1.00 0.00 C ATOM 171 NZ LYS A 14 6.793 -6.458 -14.208 1.00 0.00 N ATOM 0 H LYS A 14 4.854 -2.528 -8.411 1.00 0.00 H new ATOM 0 HA LYS A 14 2.914 -4.588 -9.289 1.00 0.00 H new ATOM 0 HB2 LYS A 14 3.898 -3.214 -11.142 1.00 0.00 H new ATOM 0 HB3 LYS A 14 5.501 -3.692 -10.621 1.00 0.00 H new ATOM 0 HG2 LYS A 14 4.687 -6.132 -10.956 1.00 0.00 H new ATOM 0 HG3 LYS A 14 3.333 -5.432 -11.821 1.00 0.00 H new ATOM 0 HD2 LYS A 14 4.707 -4.546 -13.527 1.00 0.00 H new ATOM 0 HD3 LYS A 14 6.151 -4.608 -12.537 1.00 0.00 H new ATOM 0 HE2 LYS A 14 5.718 -7.218 -12.548 1.00 0.00 H new ATOM 0 HE3 LYS A 14 4.730 -6.867 -13.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 6.991 -7.407 -14.585 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 6.643 -5.797 -14.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 7.600 -6.137 -13.636 1.00 0.00 H new ATOM 185 N ILE A 15 4.168 -6.355 -8.117 1.00 0.00 N ATOM 186 CA ILE A 15 4.872 -7.421 -7.416 1.00 0.00 C ATOM 187 C ILE A 15 5.584 -8.347 -8.396 1.00 0.00 C ATOM 188 O ILE A 15 5.040 -8.695 -9.445 1.00 0.00 O ATOM 189 CB ILE A 15 3.912 -8.254 -6.545 1.00 0.00 C ATOM 190 CG1 ILE A 15 3.083 -7.337 -5.643 1.00 0.00 C ATOM 191 CG2 ILE A 15 4.690 -9.262 -5.713 1.00 0.00 C ATOM 192 CD1 ILE A 15 3.898 -6.640 -4.577 1.00 0.00 C ATOM 0 H ILE A 15 3.174 -6.531 -8.264 1.00 0.00 H new ATOM 0 HA ILE A 15 5.609 -6.941 -6.772 1.00 0.00 H new ATOM 0 HB ILE A 15 3.233 -8.801 -7.199 1.00 0.00 H new ATOM 0 HG12 ILE A 15 2.588 -6.586 -6.259 1.00 0.00 H new ATOM 0 HG13 ILE A 15 2.299 -7.924 -5.164 1.00 0.00 H new ATOM 0 HG21 ILE A 15 3.997 -9.842 -5.103 1.00 0.00 H new ATOM 0 HG22 ILE A 15 5.241 -9.932 -6.374 1.00 0.00 H new ATOM 0 HG23 ILE A 15 5.390 -8.735 -5.065 1.00 0.00 H new ATOM 0 HD11 ILE A 15 3.245 -6.007 -3.976 1.00 0.00 H new ATOM 0 HD12 ILE A 15 4.372 -7.384 -3.937 1.00 0.00 H new ATOM 0 HD13 ILE A 15 4.665 -6.026 -5.049 1.00 0.00 H new ATOM 204 N LEU A 16 6.802 -8.745 -8.048 1.00 0.00 N ATOM 205 CA LEU A 16 7.589 -9.633 -8.897 1.00 0.00 C ATOM 206 C LEU A 16 7.419 -11.087 -8.468 1.00 0.00 C ATOM 207 O LEU A 16 6.745 -11.868 -9.142 1.00 0.00 O ATOM 208 CB LEU A 16 9.067 -9.244 -8.844 1.00 0.00 C ATOM 209 CG LEU A 16 9.546 -8.278 -9.928 1.00 0.00 C ATOM 210 CD1 LEU A 16 9.358 -8.889 -11.308 1.00 0.00 C ATOM 211 CD2 LEU A 16 8.808 -6.952 -9.825 1.00 0.00 C ATOM 0 H LEU A 16 7.267 -8.467 -7.184 1.00 0.00 H new ATOM 0 HA LEU A 16 7.229 -9.530 -9.921 1.00 0.00 H new ATOM 0 HB2 LEU A 16 9.270 -8.796 -7.871 1.00 0.00 H new ATOM 0 HB3 LEU A 16 9.664 -10.154 -8.907 1.00 0.00 H new ATOM 0 HG LEU A 16 10.609 -8.091 -9.777 1.00 0.00 H new ATOM 0 HD11 LEU A 16 9.704 -8.187 -12.067 1.00 0.00 H new ATOM 0 HD12 LEU A 16 9.933 -9.812 -11.378 1.00 0.00 H new ATOM 0 HD13 LEU A 16 8.302 -9.106 -11.469 1.00 0.00 H new ATOM 0 HD21 LEU A 16 9.162 -6.277 -10.604 1.00 0.00 H new ATOM 0 HD22 LEU A 16 7.738 -7.120 -9.949 1.00 0.00 H new ATOM 0 HD23 LEU A 16 8.994 -6.507 -8.848 1.00 0.00 H new ATOM 223 N CYS A 17 8.031 -11.443 -7.345 1.00 0.00 N ATOM 224 CA CYS A 17 7.946 -12.804 -6.825 1.00 0.00 C ATOM 225 C CYS A 17 8.532 -12.887 -5.420 1.00 0.00 C ATOM 226 O CYS A 17 9.058 -11.905 -4.897 1.00 0.00 O ATOM 227 CB CYS A 17 8.678 -13.773 -7.754 1.00 0.00 C ATOM 228 SG CYS A 17 10.479 -13.616 -7.714 1.00 0.00 S ATOM 0 H CYS A 17 8.592 -10.809 -6.776 1.00 0.00 H new ATOM 0 HA CYS A 17 6.893 -13.083 -6.777 1.00 0.00 H new ATOM 0 HB2 CYS A 17 8.407 -14.794 -7.483 1.00 0.00 H new ATOM 0 HB3 CYS A 17 8.333 -13.611 -8.775 1.00 0.00 H new ATOM 0 HG CYS A 17 11.008 -14.478 -8.530 1.00 0.00 H new ATOM 234 N ALA A 18 8.436 -14.065 -4.813 1.00 0.00 N ATOM 235 CA ALA A 18 8.957 -14.277 -3.468 1.00 0.00 C ATOM 236 C ALA A 18 10.019 -15.372 -3.457 1.00 0.00 C ATOM 237 O ALA A 18 10.094 -16.189 -4.375 1.00 0.00 O ATOM 238 CB ALA A 18 7.826 -14.626 -2.513 1.00 0.00 C ATOM 0 H ALA A 18 8.002 -14.888 -5.231 1.00 0.00 H new ATOM 0 HA ALA A 18 9.425 -13.350 -3.136 1.00 0.00 H new ATOM 0 HB1 ALA A 18 8.230 -14.782 -1.512 1.00 0.00 H new ATOM 0 HB2 ALA A 18 7.104 -13.810 -2.490 1.00 0.00 H new ATOM 0 HB3 ALA A 18 7.333 -15.537 -2.851 1.00 0.00 H new ATOM 244 N THR A 19 10.840 -15.383 -2.411 1.00 0.00 N ATOM 245 CA THR A 19 11.898 -16.376 -2.280 1.00 0.00 C ATOM 246 C THR A 19 11.854 -17.051 -0.914 1.00 0.00 C ATOM 247 O THR A 19 11.294 -16.508 0.039 1.00 0.00 O ATOM 248 CB THR A 19 13.289 -15.745 -2.484 1.00 0.00 C ATOM 249 OG1 THR A 19 14.282 -16.771 -2.589 1.00 0.00 O ATOM 250 CG2 THR A 19 13.634 -14.814 -1.332 1.00 0.00 C ATOM 0 H THR A 19 10.792 -14.715 -1.642 1.00 0.00 H new ATOM 0 HA THR A 19 11.728 -17.122 -3.056 1.00 0.00 H new ATOM 0 HB THR A 19 13.269 -15.164 -3.406 1.00 0.00 H new ATOM 0 HG1 THR A 19 14.780 -16.831 -1.747 1.00 0.00 H new ATOM 0 HG21 THR A 19 14.620 -14.380 -1.498 1.00 0.00 H new ATOM 0 HG22 THR A 19 12.892 -14.017 -1.273 1.00 0.00 H new ATOM 0 HG23 THR A 19 13.637 -15.376 -0.398 1.00 0.00 H new ATOM 258 N TYR A 20 12.448 -18.235 -0.825 1.00 0.00 N ATOM 259 CA TYR A 20 12.475 -18.985 0.425 1.00 0.00 C ATOM 260 C TYR A 20 11.117 -18.938 1.118 1.00 0.00 C ATOM 261 O TYR A 20 11.034 -18.831 2.341 1.00 0.00 O ATOM 262 CB TYR A 20 13.554 -18.427 1.355 1.00 0.00 C ATOM 263 CG TYR A 20 14.842 -18.075 0.646 1.00 0.00 C ATOM 264 CD1 TYR A 20 15.568 -19.042 -0.039 1.00 0.00 C ATOM 265 CD2 TYR A 20 15.334 -16.776 0.661 1.00 0.00 C ATOM 266 CE1 TYR A 20 16.746 -18.725 -0.687 1.00 0.00 C ATOM 267 CE2 TYR A 20 16.510 -16.450 0.015 1.00 0.00 C ATOM 268 CZ TYR A 20 17.213 -17.428 -0.658 1.00 0.00 C ATOM 269 OH TYR A 20 18.385 -17.108 -1.304 1.00 0.00 O ATOM 0 H TYR A 20 12.918 -18.697 -1.604 1.00 0.00 H new ATOM 0 HA TYR A 20 12.707 -20.024 0.191 1.00 0.00 H new ATOM 0 HB2 TYR A 20 13.168 -17.537 1.853 1.00 0.00 H new ATOM 0 HB3 TYR A 20 13.766 -19.161 2.133 1.00 0.00 H new ATOM 0 HD1 TYR A 20 15.205 -20.059 -0.065 1.00 0.00 H new ATOM 0 HD2 TYR A 20 14.787 -16.008 1.187 1.00 0.00 H new ATOM 0 HE1 TYR A 20 17.298 -19.489 -1.214 1.00 0.00 H new ATOM 0 HE2 TYR A 20 16.878 -15.435 0.036 1.00 0.00 H new ATOM 0 HH TYR A 20 18.573 -16.153 -1.188 1.00 0.00 H new ATOM 279 N VAL A 21 10.053 -19.020 0.325 1.00 0.00 N ATOM 280 CA VAL A 21 8.697 -18.989 0.860 1.00 0.00 C ATOM 281 C VAL A 21 8.412 -20.225 1.706 1.00 0.00 C ATOM 282 O VAL A 21 8.828 -21.331 1.367 1.00 0.00 O ATOM 283 CB VAL A 21 7.651 -18.899 -0.267 1.00 0.00 C ATOM 284 CG1 VAL A 21 6.245 -18.844 0.312 1.00 0.00 C ATOM 285 CG2 VAL A 21 7.920 -17.689 -1.148 1.00 0.00 C ATOM 0 H VAL A 21 10.104 -19.108 -0.690 1.00 0.00 H new ATOM 0 HA VAL A 21 8.623 -18.099 1.485 1.00 0.00 H new ATOM 0 HB VAL A 21 7.730 -19.794 -0.884 1.00 0.00 H new ATOM 0 HG11 VAL A 21 5.520 -18.781 -0.499 1.00 0.00 H new ATOM 0 HG12 VAL A 21 6.057 -19.744 0.897 1.00 0.00 H new ATOM 0 HG13 VAL A 21 6.150 -17.968 0.953 1.00 0.00 H new ATOM 0 HG21 VAL A 21 7.171 -17.641 -1.939 1.00 0.00 H new ATOM 0 HG22 VAL A 21 7.870 -16.782 -0.546 1.00 0.00 H new ATOM 0 HG23 VAL A 21 8.912 -17.775 -1.592 1.00 0.00 H new ATOM 394 N ILE A 28 -1.439 -27.095 -0.952 1.00 0.00 N ATOM 395 CA ILE A 28 -1.960 -25.768 -1.255 1.00 0.00 C ATOM 396 C ILE A 28 -2.319 -25.642 -2.731 1.00 0.00 C ATOM 397 O ILE A 28 -1.566 -26.075 -3.603 1.00 0.00 O ATOM 398 CB ILE A 28 -0.946 -24.668 -0.889 1.00 0.00 C ATOM 399 CG1 ILE A 28 -0.731 -24.626 0.626 1.00 0.00 C ATOM 400 CG2 ILE A 28 -1.424 -23.316 -1.398 1.00 0.00 C ATOM 401 CD1 ILE A 28 0.630 -24.101 1.028 1.00 0.00 C ATOM 0 HA ILE A 28 -2.859 -25.637 -0.653 1.00 0.00 H new ATOM 0 HB ILE A 28 0.006 -24.899 -1.367 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -1.501 -24.000 1.077 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -0.859 -25.630 1.031 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -0.697 -22.549 -1.132 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -1.532 -23.353 -2.482 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -2.386 -23.076 -0.946 1.00 0.00 H new ATOM 0 HD11 ILE A 28 0.713 -24.099 2.115 1.00 0.00 H new ATOM 0 HD12 ILE A 28 1.406 -24.740 0.606 1.00 0.00 H new ATOM 0 HD13 ILE A 28 0.753 -23.085 0.653 1.00 0.00 H new ATOM 413 N ASP A 29 -3.474 -25.043 -3.005 1.00 0.00 N ATOM 414 CA ASP A 29 -3.932 -24.857 -4.376 1.00 0.00 C ATOM 415 C ASP A 29 -3.201 -23.694 -5.040 1.00 0.00 C ATOM 416 O ASP A 29 -2.461 -23.882 -6.006 1.00 0.00 O ATOM 417 CB ASP A 29 -5.441 -24.608 -4.403 1.00 0.00 C ATOM 418 CG ASP A 29 -6.237 -25.893 -4.521 1.00 0.00 C ATOM 419 OD1 ASP A 29 -5.657 -26.913 -4.946 1.00 0.00 O ATOM 420 OD2 ASP A 29 -7.441 -25.877 -4.189 1.00 0.00 O ATOM 0 H ASP A 29 -4.109 -24.678 -2.295 1.00 0.00 H new ATOM 0 HA ASP A 29 -3.711 -25.768 -4.933 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -5.736 -24.083 -3.494 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -5.684 -23.955 -5.241 1.00 0.00 H new ATOM 425 N LYS A 30 -3.413 -22.492 -4.516 1.00 0.00 N ATOM 426 CA LYS A 30 -2.774 -21.298 -5.057 1.00 0.00 C ATOM 427 C LYS A 30 -2.456 -20.301 -3.947 1.00 0.00 C ATOM 428 O LYS A 30 -2.933 -20.440 -2.820 1.00 0.00 O ATOM 429 CB LYS A 30 -3.678 -20.640 -6.103 1.00 0.00 C ATOM 430 CG LYS A 30 -3.725 -21.389 -7.423 1.00 0.00 C ATOM 431 CD LYS A 30 -2.645 -20.905 -8.377 1.00 0.00 C ATOM 432 CE LYS A 30 -2.988 -21.237 -9.822 1.00 0.00 C ATOM 433 NZ LYS A 30 -2.588 -22.626 -10.181 1.00 0.00 N ATOM 0 H LYS A 30 -4.023 -22.318 -3.717 1.00 0.00 H new ATOM 0 HA LYS A 30 -1.840 -21.599 -5.530 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -4.689 -20.564 -5.702 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -3.330 -19.623 -6.284 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -3.600 -22.456 -7.241 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -4.704 -21.257 -7.883 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -2.520 -19.828 -8.270 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -1.692 -21.364 -8.113 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -4.060 -21.116 -9.978 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -2.488 -20.532 -10.486 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -3.131 -22.940 -11.011 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -1.572 -22.648 -10.403 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -2.781 -23.261 -9.380 1.00 0.00 H new ATOM 447 N ILE A 31 -1.648 -19.297 -4.273 1.00 0.00 N ATOM 448 CA ILE A 31 -1.269 -18.277 -3.304 1.00 0.00 C ATOM 449 C ILE A 31 -1.544 -16.877 -3.843 1.00 0.00 C ATOM 450 O ILE A 31 -1.738 -16.690 -5.044 1.00 0.00 O ATOM 451 CB ILE A 31 0.220 -18.386 -2.926 1.00 0.00 C ATOM 452 CG1 ILE A 31 1.078 -18.535 -4.183 1.00 0.00 C ATOM 453 CG2 ILE A 31 0.443 -19.559 -1.984 1.00 0.00 C ATOM 454 CD1 ILE A 31 2.509 -18.081 -3.996 1.00 0.00 C ATOM 0 H ILE A 31 -1.244 -19.169 -5.201 1.00 0.00 H new ATOM 0 HA ILE A 31 -1.875 -18.446 -2.414 1.00 0.00 H new ATOM 0 HB ILE A 31 0.517 -17.472 -2.413 1.00 0.00 H new ATOM 0 HG12 ILE A 31 1.075 -19.580 -4.493 1.00 0.00 H new ATOM 0 HG13 ILE A 31 0.626 -17.961 -4.992 1.00 0.00 H new ATOM 0 HG21 ILE A 31 1.500 -19.623 -1.726 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -0.144 -19.414 -1.077 1.00 0.00 H new ATOM 0 HG23 ILE A 31 0.133 -20.482 -2.473 1.00 0.00 H new ATOM 0 HD11 ILE A 31 3.058 -18.216 -4.928 1.00 0.00 H new ATOM 0 HD12 ILE A 31 2.523 -17.028 -3.715 1.00 0.00 H new ATOM 0 HD13 ILE A 31 2.978 -18.672 -3.210 1.00 0.00 H new ATOM 466 N TYR A 32 -1.558 -15.897 -2.947 1.00 0.00 N ATOM 467 CA TYR A 32 -1.810 -14.513 -3.332 1.00 0.00 C ATOM 468 C TYR A 32 -1.238 -13.547 -2.298 1.00 0.00 C ATOM 469 O TYR A 32 -1.024 -13.912 -1.142 1.00 0.00 O ATOM 470 CB TYR A 32 -3.312 -14.273 -3.495 1.00 0.00 C ATOM 471 CG TYR A 32 -4.011 -13.913 -2.204 1.00 0.00 C ATOM 472 CD1 TYR A 32 -4.113 -12.590 -1.791 1.00 0.00 C ATOM 473 CD2 TYR A 32 -4.571 -14.896 -1.397 1.00 0.00 C ATOM 474 CE1 TYR A 32 -4.751 -12.257 -0.612 1.00 0.00 C ATOM 475 CE2 TYR A 32 -5.212 -14.572 -0.217 1.00 0.00 C ATOM 476 CZ TYR A 32 -5.299 -13.251 0.172 1.00 0.00 C ATOM 477 OH TYR A 32 -5.936 -12.923 1.346 1.00 0.00 O ATOM 0 H TYR A 32 -1.398 -16.035 -1.949 1.00 0.00 H new ATOM 0 HA TYR A 32 -1.314 -14.331 -4.285 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -3.467 -13.472 -4.218 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -3.772 -15.170 -3.910 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -3.686 -11.809 -2.402 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -4.504 -15.931 -1.698 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -4.820 -11.224 -0.306 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -5.643 -15.348 0.398 1.00 0.00 H new ATOM 0 HH TYR A 32 -5.711 -13.582 2.036 1.00 0.00 H new ATOM 487 N VAL A 33 -0.994 -12.312 -2.724 1.00 0.00 N ATOM 488 CA VAL A 33 -0.449 -11.292 -1.837 1.00 0.00 C ATOM 489 C VAL A 33 -1.528 -10.304 -1.407 1.00 0.00 C ATOM 490 O VAL A 33 -2.378 -9.911 -2.206 1.00 0.00 O ATOM 491 CB VAL A 33 0.701 -10.519 -2.510 1.00 0.00 C ATOM 492 CG1 VAL A 33 1.196 -9.401 -1.604 1.00 0.00 C ATOM 493 CG2 VAL A 33 1.836 -11.463 -2.874 1.00 0.00 C ATOM 0 H VAL A 33 -1.165 -11.994 -3.678 1.00 0.00 H new ATOM 0 HA VAL A 33 -0.064 -11.810 -0.959 1.00 0.00 H new ATOM 0 HB VAL A 33 0.324 -10.069 -3.429 1.00 0.00 H new ATOM 0 HG11 VAL A 33 2.008 -8.866 -2.096 1.00 0.00 H new ATOM 0 HG12 VAL A 33 0.378 -8.710 -1.399 1.00 0.00 H new ATOM 0 HG13 VAL A 33 1.556 -9.825 -0.667 1.00 0.00 H new ATOM 0 HG21 VAL A 33 2.640 -10.900 -3.348 1.00 0.00 H new ATOM 0 HG22 VAL A 33 2.213 -11.943 -1.971 1.00 0.00 H new ATOM 0 HG23 VAL A 33 1.470 -12.223 -3.564 1.00 0.00 H new ATOM 503 N ARG A 34 -1.487 -9.906 -0.140 1.00 0.00 N ATOM 504 CA ARG A 34 -2.462 -8.964 0.397 1.00 0.00 C ATOM 505 C ARG A 34 -1.790 -7.652 0.792 1.00 0.00 C ATOM 506 O ARG A 34 -0.942 -7.620 1.684 1.00 0.00 O ATOM 507 CB ARG A 34 -3.175 -9.569 1.607 1.00 0.00 C ATOM 508 CG ARG A 34 -4.121 -8.604 2.303 1.00 0.00 C ATOM 509 CD ARG A 34 -5.029 -9.325 3.286 1.00 0.00 C ATOM 510 NE ARG A 34 -6.260 -9.791 2.653 1.00 0.00 N ATOM 511 CZ ARG A 34 -7.339 -9.033 2.498 1.00 0.00 C ATOM 512 NH1 ARG A 34 -7.340 -7.778 2.927 1.00 0.00 N ATOM 513 NH2 ARG A 34 -8.422 -9.529 1.911 1.00 0.00 N ATOM 0 H ARG A 34 -0.789 -10.221 0.534 1.00 0.00 H new ATOM 0 HA ARG A 34 -3.196 -8.756 -0.382 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -3.736 -10.446 1.286 1.00 0.00 H new ATOM 0 HB3 ARG A 34 -2.429 -9.913 2.323 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -3.544 -7.844 2.829 1.00 0.00 H new ATOM 0 HG3 ARG A 34 -4.727 -8.086 1.559 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -4.497 -10.175 3.714 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -5.276 -8.655 4.110 1.00 0.00 H new ATOM 0 HE ARG A 34 -6.293 -10.751 2.311 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -6.510 -7.392 3.378 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -8.171 -7.198 2.806 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -8.426 -10.493 1.579 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -9.250 -8.946 1.793 1.00 0.00 H new ATOM 527 N THR A 35 -2.174 -6.571 0.121 1.00 0.00 N ATOM 528 CA THR A 35 -1.608 -5.257 0.400 1.00 0.00 C ATOM 529 C THR A 35 -2.687 -4.278 0.849 1.00 0.00 C ATOM 530 O THR A 35 -3.878 -4.520 0.657 1.00 0.00 O ATOM 531 CB THR A 35 -0.889 -4.681 -0.834 1.00 0.00 C ATOM 532 OG1 THR A 35 -1.835 -4.431 -1.880 1.00 0.00 O ATOM 533 CG2 THR A 35 0.184 -5.638 -1.331 1.00 0.00 C ATOM 0 H THR A 35 -2.875 -6.579 -0.620 1.00 0.00 H new ATOM 0 HA THR A 35 -0.884 -5.389 1.204 1.00 0.00 H new ATOM 0 HB THR A 35 -0.412 -3.744 -0.545 1.00 0.00 H new ATOM 0 HG1 THR A 35 -1.511 -3.700 -2.446 1.00 0.00 H new ATOM 0 HG21 THR A 35 0.678 -5.210 -2.203 1.00 0.00 H new ATOM 0 HG22 THR A 35 0.918 -5.803 -0.542 1.00 0.00 H new ATOM 0 HG23 THR A 35 -0.274 -6.588 -1.604 1.00 0.00 H new ATOM 541 N GLY A 36 -2.262 -3.169 1.447 1.00 0.00 N ATOM 542 CA GLY A 36 -3.205 -2.169 1.913 1.00 0.00 C ATOM 543 C GLY A 36 -2.572 -1.174 2.865 1.00 0.00 C ATOM 544 O GLY A 36 -1.715 -1.536 3.672 1.00 0.00 O ATOM 0 H GLY A 36 -1.281 -2.945 1.617 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -3.617 -1.636 1.056 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -4.038 -2.664 2.411 1.00 0.00 H new ATOM 548 N ILE A 37 -2.992 0.083 2.771 1.00 0.00 N ATOM 549 CA ILE A 37 -2.460 1.132 3.631 1.00 0.00 C ATOM 550 C ILE A 37 -3.254 1.235 4.929 1.00 0.00 C ATOM 551 O ILE A 37 -4.456 0.971 4.956 1.00 0.00 O ATOM 552 CB ILE A 37 -2.474 2.501 2.925 1.00 0.00 C ATOM 553 CG1 ILE A 37 -1.634 2.448 1.647 1.00 0.00 C ATOM 554 CG2 ILE A 37 -1.960 3.585 3.859 1.00 0.00 C ATOM 555 CD1 ILE A 37 -2.349 1.807 0.479 1.00 0.00 C ATOM 0 H ILE A 37 -3.699 0.400 2.108 1.00 0.00 H new ATOM 0 HA ILE A 37 -1.429 0.860 3.858 1.00 0.00 H new ATOM 0 HB ILE A 37 -3.501 2.742 2.653 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -1.342 3.461 1.372 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -0.716 1.895 1.848 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.976 4.546 3.345 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -2.596 3.635 4.743 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -0.939 3.352 4.160 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -1.693 1.804 -0.392 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -2.617 0.782 0.735 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -3.253 2.372 0.251 1.00 0.00 H new ATOM 567 N TYR A 38 -2.574 1.621 6.003 1.00 0.00 N ATOM 568 CA TYR A 38 -3.215 1.758 7.305 1.00 0.00 C ATOM 569 C TYR A 38 -2.784 3.051 7.991 1.00 0.00 C ATOM 570 O TYR A 38 -1.596 3.371 8.049 1.00 0.00 O ATOM 571 CB TYR A 38 -2.877 0.559 8.193 1.00 0.00 C ATOM 572 CG TYR A 38 -3.606 -0.707 7.804 1.00 0.00 C ATOM 573 CD1 TYR A 38 -3.307 -1.368 6.619 1.00 0.00 C ATOM 574 CD2 TYR A 38 -4.595 -1.241 8.620 1.00 0.00 C ATOM 575 CE1 TYR A 38 -3.971 -2.525 6.259 1.00 0.00 C ATOM 576 CE2 TYR A 38 -5.263 -2.398 8.269 1.00 0.00 C ATOM 577 CZ TYR A 38 -4.948 -3.036 7.088 1.00 0.00 C ATOM 578 OH TYR A 38 -5.612 -4.188 6.734 1.00 0.00 O ATOM 0 H TYR A 38 -1.579 1.845 5.997 1.00 0.00 H new ATOM 0 HA TYR A 38 -4.293 1.793 7.149 1.00 0.00 H new ATOM 0 HB2 TYR A 38 -1.803 0.377 8.151 1.00 0.00 H new ATOM 0 HB3 TYR A 38 -3.118 0.804 9.227 1.00 0.00 H new ATOM 0 HD1 TYR A 38 -2.542 -0.971 5.968 1.00 0.00 H new ATOM 0 HD2 TYR A 38 -4.846 -0.743 9.545 1.00 0.00 H new ATOM 0 HE1 TYR A 38 -3.727 -3.026 5.334 1.00 0.00 H new ATOM 0 HE2 TYR A 38 -6.028 -2.801 8.916 1.00 0.00 H new ATOM 0 HH TYR A 38 -5.454 -4.379 5.786 1.00 0.00 H new ATOM 588 N HIS A 39 -3.758 3.790 8.512 1.00 0.00 N ATOM 589 CA HIS A 39 -3.481 5.048 9.196 1.00 0.00 C ATOM 590 C HIS A 39 -3.939 4.988 10.650 1.00 0.00 C ATOM 591 O HIS A 39 -5.103 5.242 10.956 1.00 0.00 O ATOM 592 CB HIS A 39 -4.173 6.207 8.478 1.00 0.00 C ATOM 593 CG HIS A 39 -3.859 7.549 9.065 1.00 0.00 C ATOM 594 ND1 HIS A 39 -4.816 8.518 9.283 1.00 0.00 N ATOM 595 CD2 HIS A 39 -2.686 8.080 9.483 1.00 0.00 C ATOM 596 CE1 HIS A 39 -4.244 9.588 9.807 1.00 0.00 C ATOM 597 NE2 HIS A 39 -2.952 9.348 9.939 1.00 0.00 N ATOM 0 H HIS A 39 -4.746 3.540 8.474 1.00 0.00 H new ATOM 0 HA HIS A 39 -2.404 5.212 9.179 1.00 0.00 H new ATOM 0 HB2 HIS A 39 -3.879 6.201 7.428 1.00 0.00 H new ATOM 0 HB3 HIS A 39 -5.251 6.050 8.508 1.00 0.00 H new ATOM 0 HD1 HIS A 39 -5.810 8.424 9.073 1.00 0.00 H new ATOM 0 HD2 HIS A 39 -1.721 7.596 9.462 1.00 0.00 H new ATOM 0 HE1 HIS A 39 -4.748 10.503 10.081 1.00 0.00 H new ATOM 606 N GLY A 40 -3.013 4.651 11.544 1.00 0.00 N ATOM 607 CA GLY A 40 -3.342 4.562 12.954 1.00 0.00 C ATOM 608 C GLY A 40 -3.837 3.185 13.349 1.00 0.00 C ATOM 609 O GLY A 40 -4.704 3.053 14.213 1.00 0.00 O ATOM 0 H GLY A 40 -2.042 4.438 11.316 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -2.461 4.811 13.546 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -4.106 5.302 13.193 1.00 0.00 H new ATOM 613 N GLY A 41 -3.286 2.155 12.714 1.00 0.00 N ATOM 614 CA GLY A 41 -3.691 0.795 13.017 1.00 0.00 C ATOM 615 C GLY A 41 -4.963 0.394 12.296 1.00 0.00 C ATOM 616 O GLY A 41 -5.188 -0.786 12.031 1.00 0.00 O ATOM 0 H GLY A 41 -2.567 2.238 11.996 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -2.889 0.110 12.741 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -3.839 0.694 14.092 1.00 0.00 H new ATOM 620 N GLU A 42 -5.797 1.380 11.978 1.00 0.00 N ATOM 621 CA GLU A 42 -7.054 1.122 11.285 1.00 0.00 C ATOM 622 C GLU A 42 -6.837 1.039 9.777 1.00 0.00 C ATOM 623 O GLU A 42 -5.905 1.626 9.225 1.00 0.00 O ATOM 624 CB GLU A 42 -8.072 2.219 11.605 1.00 0.00 C ATOM 625 CG GLU A 42 -7.699 3.579 11.041 1.00 0.00 C ATOM 626 CD GLU A 42 -8.713 4.652 11.387 1.00 0.00 C ATOM 627 OE1 GLU A 42 -8.595 5.250 12.477 1.00 0.00 O ATOM 628 OE2 GLU A 42 -9.625 4.893 10.568 1.00 0.00 O ATOM 0 H GLU A 42 -5.625 2.363 12.189 1.00 0.00 H new ATOM 0 HA GLU A 42 -7.441 0.164 11.632 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -9.045 1.926 11.211 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -8.178 2.300 12.687 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -6.721 3.871 11.424 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -7.608 3.506 9.957 1.00 0.00 H new ATOM 635 N PRO A 43 -7.716 0.292 9.093 1.00 0.00 N ATOM 636 CA PRO A 43 -7.642 0.114 7.640 1.00 0.00 C ATOM 637 C PRO A 43 -7.988 1.391 6.881 1.00 0.00 C ATOM 638 O PRO A 43 -9.123 1.574 6.438 1.00 0.00 O ATOM 639 CB PRO A 43 -8.685 -0.972 7.363 1.00 0.00 C ATOM 640 CG PRO A 43 -9.654 -0.864 8.489 1.00 0.00 C ATOM 641 CD PRO A 43 -8.851 -0.435 9.686 1.00 0.00 C ATOM 0 HA PRO A 43 -6.636 -0.148 7.312 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -9.175 -0.814 6.402 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -8.227 -1.961 7.328 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -10.436 -0.139 8.263 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -10.148 -1.818 8.672 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -9.432 0.202 10.352 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -8.517 -1.290 10.274 1.00 0.00 H new ATOM 649 N LEU A 44 -7.004 2.271 6.734 1.00 0.00 N ATOM 650 CA LEU A 44 -7.204 3.531 6.028 1.00 0.00 C ATOM 651 C LEU A 44 -8.225 3.371 4.906 1.00 0.00 C ATOM 652 O LEU A 44 -9.134 4.190 4.759 1.00 0.00 O ATOM 653 CB LEU A 44 -5.877 4.035 5.457 1.00 0.00 C ATOM 654 CG LEU A 44 -5.899 5.435 4.843 1.00 0.00 C ATOM 655 CD1 LEU A 44 -6.577 6.420 5.782 1.00 0.00 C ATOM 656 CD2 LEU A 44 -4.486 5.895 4.514 1.00 0.00 C ATOM 0 H LEU A 44 -6.060 2.135 7.094 1.00 0.00 H new ATOM 0 HA LEU A 44 -7.587 4.261 6.741 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -5.133 4.021 6.254 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -5.542 3.331 4.695 1.00 0.00 H new ATOM 0 HG LEU A 44 -6.472 5.395 3.917 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -6.583 7.411 5.328 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -7.602 6.100 5.967 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -6.033 6.457 6.726 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -4.521 6.893 4.078 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -3.889 5.918 5.426 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -4.035 5.204 3.802 1.00 0.00 H new ATOM 668 N CYS A 45 -8.071 2.311 4.120 1.00 0.00 N ATOM 669 CA CYS A 45 -8.981 2.042 3.013 1.00 0.00 C ATOM 670 C CYS A 45 -9.052 0.547 2.718 1.00 0.00 C ATOM 671 O CYS A 45 -8.357 -0.253 3.345 1.00 0.00 O ATOM 672 CB CYS A 45 -8.533 2.800 1.762 1.00 0.00 C ATOM 673 SG CYS A 45 -8.853 4.579 1.822 1.00 0.00 S ATOM 0 H CYS A 45 -7.325 1.624 4.229 1.00 0.00 H new ATOM 0 HA CYS A 45 -9.975 2.385 3.301 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -7.465 2.639 1.616 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -9.041 2.379 0.894 1.00 0.00 H new ATOM 0 HG CYS A 45 -9.086 4.937 3.050 1.00 0.00 H new ATOM 679 N ASP A 46 -9.897 0.178 1.762 1.00 0.00 N ATOM 680 CA ASP A 46 -10.060 -1.221 1.384 1.00 0.00 C ATOM 681 C ASP A 46 -8.716 -1.846 1.022 1.00 0.00 C ATOM 682 O ASP A 46 -7.807 -1.161 0.556 1.00 0.00 O ATOM 683 CB ASP A 46 -11.027 -1.345 0.206 1.00 0.00 C ATOM 684 CG ASP A 46 -10.733 -2.553 -0.661 1.00 0.00 C ATOM 685 OD1 ASP A 46 -11.095 -3.678 -0.254 1.00 0.00 O ATOM 686 OD2 ASP A 46 -10.143 -2.375 -1.746 1.00 0.00 O ATOM 0 H ASP A 46 -10.480 0.828 1.235 1.00 0.00 H new ATOM 0 HA ASP A 46 -10.472 -1.757 2.239 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -12.047 -1.412 0.583 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -10.971 -0.443 -0.403 1.00 0.00 H new ATOM 691 N ASN A 47 -8.598 -3.152 1.241 1.00 0.00 N ATOM 692 CA ASN A 47 -7.365 -3.869 0.939 1.00 0.00 C ATOM 693 C ASN A 47 -7.368 -4.376 -0.500 1.00 0.00 C ATOM 694 O ASN A 47 -8.413 -4.742 -1.038 1.00 0.00 O ATOM 695 CB ASN A 47 -7.183 -5.043 1.904 1.00 0.00 C ATOM 696 CG ASN A 47 -6.406 -4.654 3.147 1.00 0.00 C ATOM 697 OD1 ASN A 47 -5.716 -5.480 3.745 1.00 0.00 O ATOM 698 ND2 ASN A 47 -6.515 -3.391 3.542 1.00 0.00 N ATOM 0 H ASN A 47 -9.341 -3.735 1.626 1.00 0.00 H new ATOM 0 HA ASN A 47 -6.533 -3.175 1.060 1.00 0.00 H new ATOM 0 HB2 ASN A 47 -8.161 -5.426 2.195 1.00 0.00 H new ATOM 0 HB3 ASN A 47 -6.663 -5.853 1.393 1.00 0.00 H new ATOM 0 HD21 ASN A 47 -6.015 -3.071 4.372 1.00 0.00 H new ATOM 0 HD22 ASN A 47 -7.098 -2.741 3.016 1.00 0.00 H new ATOM 705 N VAL A 48 -6.191 -4.395 -1.118 1.00 0.00 N ATOM 706 CA VAL A 48 -6.058 -4.858 -2.494 1.00 0.00 C ATOM 707 C VAL A 48 -5.417 -6.241 -2.548 1.00 0.00 C ATOM 708 O VAL A 48 -4.432 -6.507 -1.862 1.00 0.00 O ATOM 709 CB VAL A 48 -5.216 -3.881 -3.336 1.00 0.00 C ATOM 710 CG1 VAL A 48 -5.106 -4.371 -4.771 1.00 0.00 C ATOM 711 CG2 VAL A 48 -5.815 -2.483 -3.285 1.00 0.00 C ATOM 0 H VAL A 48 -5.316 -4.095 -0.687 1.00 0.00 H new ATOM 0 HA VAL A 48 -7.064 -4.910 -2.910 1.00 0.00 H new ATOM 0 HB VAL A 48 -4.212 -3.837 -2.915 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -4.508 -3.668 -5.351 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -4.629 -5.351 -4.785 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -6.102 -4.446 -5.207 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -5.208 -1.805 -3.885 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -6.830 -2.508 -3.681 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -5.836 -2.134 -2.253 1.00 0.00 H new ATOM 721 N ASN A 49 -5.985 -7.118 -3.370 1.00 0.00 N ATOM 722 CA ASN A 49 -5.469 -8.474 -3.515 1.00 0.00 C ATOM 723 C ASN A 49 -4.896 -8.692 -4.912 1.00 0.00 C ATOM 724 O ASN A 49 -5.382 -8.124 -5.891 1.00 0.00 O ATOM 725 CB ASN A 49 -6.576 -9.495 -3.240 1.00 0.00 C ATOM 726 CG ASN A 49 -7.777 -9.302 -4.145 1.00 0.00 C ATOM 727 OD1 ASN A 49 -8.188 -8.175 -4.418 1.00 0.00 O ATOM 728 ND2 ASN A 49 -8.346 -10.406 -4.615 1.00 0.00 N ATOM 0 H ASN A 49 -6.802 -6.914 -3.945 1.00 0.00 H new ATOM 0 HA ASN A 49 -4.668 -8.611 -2.788 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -6.180 -10.502 -3.376 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -6.891 -9.414 -2.200 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -9.158 -10.340 -5.229 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -7.971 -11.320 -4.362 1.00 0.00 H new ATOM 735 N THR A 50 -3.860 -9.520 -4.998 1.00 0.00 N ATOM 736 CA THR A 50 -3.220 -9.814 -6.274 1.00 0.00 C ATOM 737 C THR A 50 -3.699 -11.147 -6.836 1.00 0.00 C ATOM 738 O THR A 50 -4.338 -11.932 -6.136 1.00 0.00 O ATOM 739 CB THR A 50 -1.686 -9.848 -6.139 1.00 0.00 C ATOM 740 OG1 THR A 50 -1.298 -10.879 -5.223 1.00 0.00 O ATOM 741 CG2 THR A 50 -1.155 -8.507 -5.654 1.00 0.00 C ATOM 0 H THR A 50 -3.446 -9.999 -4.198 1.00 0.00 H new ATOM 0 HA THR A 50 -3.499 -9.013 -6.959 1.00 0.00 H new ATOM 0 HB THR A 50 -1.262 -10.055 -7.121 1.00 0.00 H new ATOM 0 HG1 THR A 50 -0.738 -11.536 -5.688 1.00 0.00 H new ATOM 0 HG21 THR A 50 -0.070 -8.556 -5.566 1.00 0.00 H new ATOM 0 HG22 THR A 50 -1.427 -7.729 -6.367 1.00 0.00 H new ATOM 0 HG23 THR A 50 -1.587 -8.275 -4.681 1.00 0.00 H new ATOM 749 N GLN A 51 -3.385 -11.398 -8.103 1.00 0.00 N ATOM 750 CA GLN A 51 -3.784 -12.638 -8.758 1.00 0.00 C ATOM 751 C GLN A 51 -3.329 -13.850 -7.952 1.00 0.00 C ATOM 752 O GLN A 51 -2.493 -13.733 -7.056 1.00 0.00 O ATOM 753 CB GLN A 51 -3.203 -12.703 -10.171 1.00 0.00 C ATOM 754 CG GLN A 51 -1.701 -12.929 -10.202 1.00 0.00 C ATOM 755 CD GLN A 51 -1.157 -13.051 -11.612 1.00 0.00 C ATOM 756 OE1 GLN A 51 -0.389 -12.204 -12.068 1.00 0.00 O ATOM 757 NE2 GLN A 51 -1.554 -14.108 -12.310 1.00 0.00 N ATOM 0 H GLN A 51 -2.856 -10.759 -8.696 1.00 0.00 H new ATOM 0 HA GLN A 51 -4.872 -12.653 -8.819 1.00 0.00 H new ATOM 0 HB2 GLN A 51 -3.694 -13.506 -10.720 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -3.433 -11.774 -10.692 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -1.203 -12.103 -9.695 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -1.462 -13.835 -9.645 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -2.192 -14.785 -11.892 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -1.221 -14.243 -13.265 1.00 0.00 H new ATOM 766 N ARG A 52 -3.885 -15.013 -8.277 1.00 0.00 N ATOM 767 CA ARG A 52 -3.537 -16.246 -7.582 1.00 0.00 C ATOM 768 C ARG A 52 -2.550 -17.073 -8.402 1.00 0.00 C ATOM 769 O ARG A 52 -2.868 -17.527 -9.501 1.00 0.00 O ATOM 770 CB ARG A 52 -4.795 -17.069 -7.298 1.00 0.00 C ATOM 771 CG ARG A 52 -5.448 -16.743 -5.964 1.00 0.00 C ATOM 772 CD ARG A 52 -6.151 -15.395 -6.003 1.00 0.00 C ATOM 773 NE ARG A 52 -7.182 -15.346 -7.036 1.00 0.00 N ATOM 774 CZ ARG A 52 -7.658 -14.215 -7.546 1.00 0.00 C ATOM 775 NH1 ARG A 52 -7.196 -13.047 -7.121 1.00 0.00 N ATOM 776 NH2 ARG A 52 -8.596 -14.251 -8.483 1.00 0.00 N ATOM 0 H ARG A 52 -4.578 -15.127 -9.017 1.00 0.00 H new ATOM 0 HA ARG A 52 -3.064 -15.979 -6.637 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -5.517 -16.901 -8.097 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -4.538 -18.128 -7.318 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -6.166 -17.522 -5.709 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -4.692 -16.738 -5.179 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -6.601 -15.193 -5.031 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -5.418 -14.609 -6.185 1.00 0.00 H new ATOM 0 HE ARG A 52 -7.557 -16.228 -7.385 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -6.474 -13.016 -6.401 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -7.563 -12.180 -7.514 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -8.953 -15.148 -8.813 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -8.960 -13.382 -8.873 1.00 0.00 H new ATOM 790 N VAL A 53 -1.351 -17.262 -7.860 1.00 0.00 N ATOM 791 CA VAL A 53 -0.318 -18.034 -8.540 1.00 0.00 C ATOM 792 C VAL A 53 0.041 -19.287 -7.750 1.00 0.00 C ATOM 793 O VAL A 53 -0.085 -19.338 -6.527 1.00 0.00 O ATOM 794 CB VAL A 53 0.955 -17.196 -8.760 1.00 0.00 C ATOM 795 CG1 VAL A 53 0.596 -15.754 -9.085 1.00 0.00 C ATOM 796 CG2 VAL A 53 1.857 -17.267 -7.537 1.00 0.00 C ATOM 0 H VAL A 53 -1.071 -16.891 -6.952 1.00 0.00 H new ATOM 0 HA VAL A 53 -0.725 -18.324 -9.509 1.00 0.00 H new ATOM 0 HB VAL A 53 1.499 -17.610 -9.609 1.00 0.00 H new ATOM 0 HG11 VAL A 53 1.508 -15.177 -9.237 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -0.007 -15.725 -9.992 1.00 0.00 H new ATOM 0 HG13 VAL A 53 0.029 -15.325 -8.259 1.00 0.00 H new ATOM 0 HG21 VAL A 53 2.752 -16.669 -7.710 1.00 0.00 H new ATOM 0 HG22 VAL A 53 1.324 -16.880 -6.669 1.00 0.00 H new ATOM 0 HG23 VAL A 53 2.142 -18.303 -7.355 1.00 0.00 H new ATOM 806 N PRO A 54 0.502 -20.325 -8.465 1.00 0.00 N ATOM 807 CA PRO A 54 0.891 -21.598 -7.851 1.00 0.00 C ATOM 808 C PRO A 54 2.165 -21.477 -7.022 1.00 0.00 C ATOM 809 O PRO A 54 3.117 -20.806 -7.425 1.00 0.00 O ATOM 810 CB PRO A 54 1.120 -22.517 -9.054 1.00 0.00 C ATOM 811 CG PRO A 54 1.461 -21.595 -10.174 1.00 0.00 C ATOM 812 CD PRO A 54 0.678 -20.335 -9.926 1.00 0.00 C ATOM 0 HA PRO A 54 0.135 -21.963 -7.156 1.00 0.00 H new ATOM 0 HB2 PRO A 54 1.927 -23.225 -8.864 1.00 0.00 H new ATOM 0 HB3 PRO A 54 0.229 -23.103 -9.280 1.00 0.00 H new ATOM 0 HG2 PRO A 54 2.531 -21.391 -10.199 1.00 0.00 H new ATOM 0 HG3 PRO A 54 1.198 -22.035 -11.136 1.00 0.00 H new ATOM 0 HD2 PRO A 54 1.216 -19.453 -10.272 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -0.280 -20.348 -10.446 1.00 0.00 H new ATOM 820 N CYS A 55 2.178 -22.130 -5.866 1.00 0.00 N ATOM 821 CA CYS A 55 3.336 -22.094 -4.980 1.00 0.00 C ATOM 822 C CYS A 55 4.631 -22.231 -5.774 1.00 0.00 C ATOM 823 O CYS A 55 5.590 -21.493 -5.549 1.00 0.00 O ATOM 824 CB CYS A 55 3.242 -23.210 -3.938 1.00 0.00 C ATOM 825 SG CYS A 55 3.060 -24.865 -4.644 1.00 0.00 S ATOM 0 H CYS A 55 1.400 -22.691 -5.520 1.00 0.00 H new ATOM 0 HA CYS A 55 3.343 -21.131 -4.470 1.00 0.00 H new ATOM 0 HB2 CYS A 55 4.137 -23.188 -3.316 1.00 0.00 H new ATOM 0 HB3 CYS A 55 2.394 -23.011 -3.283 1.00 0.00 H new ATOM 0 HG CYS A 55 2.991 -25.741 -3.685 1.00 0.00 H new ATOM 831 N SER A 56 4.653 -23.181 -6.703 1.00 0.00 N ATOM 832 CA SER A 56 5.832 -23.419 -7.527 1.00 0.00 C ATOM 833 C SER A 56 6.322 -22.121 -8.161 1.00 0.00 C ATOM 834 O SER A 56 7.525 -21.895 -8.289 1.00 0.00 O ATOM 835 CB SER A 56 5.521 -24.446 -8.617 1.00 0.00 C ATOM 836 OG SER A 56 4.878 -23.837 -9.723 1.00 0.00 O ATOM 0 H SER A 56 3.867 -23.799 -6.904 1.00 0.00 H new ATOM 0 HA SER A 56 6.621 -23.810 -6.884 1.00 0.00 H new ATOM 0 HB2 SER A 56 6.444 -24.922 -8.946 1.00 0.00 H new ATOM 0 HB3 SER A 56 4.885 -25.232 -8.210 1.00 0.00 H new ATOM 0 HG SER A 56 4.692 -24.514 -10.406 1.00 0.00 H new ATOM 842 N ASN A 57 5.381 -21.270 -8.556 1.00 0.00 N ATOM 843 CA ASN A 57 5.716 -19.994 -9.177 1.00 0.00 C ATOM 844 C ASN A 57 5.047 -18.837 -8.440 1.00 0.00 C ATOM 845 O ASN A 57 3.981 -18.356 -8.825 1.00 0.00 O ATOM 846 CB ASN A 57 5.289 -19.991 -10.646 1.00 0.00 C ATOM 847 CG ASN A 57 6.305 -20.670 -11.544 1.00 0.00 C ATOM 848 OD1 ASN A 57 6.077 -21.778 -12.031 1.00 0.00 O ATOM 849 ND2 ASN A 57 7.434 -20.008 -11.767 1.00 0.00 N ATOM 0 H ASN A 57 4.380 -21.441 -8.457 1.00 0.00 H new ATOM 0 HA ASN A 57 6.796 -19.863 -9.118 1.00 0.00 H new ATOM 0 HB2 ASN A 57 4.328 -20.495 -10.743 1.00 0.00 H new ATOM 0 HB3 ASN A 57 5.145 -18.963 -10.978 1.00 0.00 H new ATOM 0 HD21 ASN A 57 8.155 -20.415 -12.363 1.00 0.00 H new ATOM 0 HD22 ASN A 57 7.580 -19.092 -11.343 1.00 0.00 H new ATOM 856 N PRO A 58 5.686 -18.380 -7.353 1.00 0.00 N ATOM 857 CA PRO A 58 5.172 -17.274 -6.540 1.00 0.00 C ATOM 858 C PRO A 58 5.246 -15.936 -7.267 1.00 0.00 C ATOM 859 O PRO A 58 4.914 -14.893 -6.704 1.00 0.00 O ATOM 860 CB PRO A 58 6.098 -17.271 -5.320 1.00 0.00 C ATOM 861 CG PRO A 58 7.364 -17.889 -5.804 1.00 0.00 C ATOM 862 CD PRO A 58 6.960 -18.906 -6.836 1.00 0.00 C ATOM 0 HA PRO A 58 4.118 -17.405 -6.293 1.00 0.00 H new ATOM 0 HB2 PRO A 58 6.267 -16.258 -4.953 1.00 0.00 H new ATOM 0 HB3 PRO A 58 5.669 -17.841 -4.496 1.00 0.00 H new ATOM 0 HG2 PRO A 58 8.025 -17.137 -6.235 1.00 0.00 H new ATOM 0 HG3 PRO A 58 7.907 -18.359 -4.984 1.00 0.00 H new ATOM 0 HD2 PRO A 58 7.707 -18.997 -7.625 1.00 0.00 H new ATOM 0 HD3 PRO A 58 6.837 -19.896 -6.398 1.00 0.00 H new ATOM 870 N ARG A 59 5.683 -15.973 -8.522 1.00 0.00 N ATOM 871 CA ARG A 59 5.800 -14.763 -9.326 1.00 0.00 C ATOM 872 C ARG A 59 4.425 -14.176 -9.629 1.00 0.00 C ATOM 873 O ARG A 59 3.529 -14.878 -10.099 1.00 0.00 O ATOM 874 CB ARG A 59 6.538 -15.062 -10.633 1.00 0.00 C ATOM 875 CG ARG A 59 6.271 -16.456 -11.176 1.00 0.00 C ATOM 876 CD ARG A 59 6.484 -16.518 -12.681 1.00 0.00 C ATOM 877 NE ARG A 59 7.859 -16.870 -13.025 1.00 0.00 N ATOM 878 CZ ARG A 59 8.850 -15.987 -13.086 1.00 0.00 C ATOM 879 NH1 ARG A 59 8.620 -14.708 -12.826 1.00 0.00 N ATOM 880 NH2 ARG A 59 10.075 -16.385 -13.406 1.00 0.00 N ATOM 0 H ARG A 59 5.962 -16.828 -9.003 1.00 0.00 H new ATOM 0 HA ARG A 59 6.370 -14.031 -8.754 1.00 0.00 H new ATOM 0 HB2 ARG A 59 6.245 -14.327 -11.382 1.00 0.00 H new ATOM 0 HB3 ARG A 59 7.609 -14.943 -10.471 1.00 0.00 H new ATOM 0 HG2 ARG A 59 6.930 -17.172 -10.684 1.00 0.00 H new ATOM 0 HG3 ARG A 59 5.248 -16.750 -10.940 1.00 0.00 H new ATOM 0 HD2 ARG A 59 5.803 -17.251 -13.114 1.00 0.00 H new ATOM 0 HD3 ARG A 59 6.236 -15.553 -13.122 1.00 0.00 H new ATOM 0 HE ARG A 59 8.070 -17.847 -13.230 1.00 0.00 H new ATOM 0 HH11 ARG A 59 7.680 -14.399 -12.578 1.00 0.00 H new ATOM 0 HH12 ARG A 59 9.383 -14.033 -12.874 1.00 0.00 H new ATOM 0 HH21 ARG A 59 10.256 -17.369 -13.605 1.00 0.00 H new ATOM 0 HH22 ARG A 59 10.836 -15.707 -13.453 1.00 0.00 H new ATOM 894 N TRP A 60 4.265 -12.886 -9.357 1.00 0.00 N ATOM 895 CA TRP A 60 2.998 -12.205 -9.600 1.00 0.00 C ATOM 896 C TRP A 60 3.096 -11.293 -10.819 1.00 0.00 C ATOM 897 O TRP A 60 2.171 -11.221 -11.627 1.00 0.00 O ATOM 898 CB TRP A 60 2.589 -11.392 -8.371 1.00 0.00 C ATOM 899 CG TRP A 60 1.927 -12.215 -7.308 1.00 0.00 C ATOM 900 CD1 TRP A 60 0.612 -12.579 -7.253 1.00 0.00 C ATOM 901 CD2 TRP A 60 2.549 -12.776 -6.147 1.00 0.00 C ATOM 902 NE1 TRP A 60 0.379 -13.332 -6.127 1.00 0.00 N ATOM 903 CE2 TRP A 60 1.552 -13.467 -5.432 1.00 0.00 C ATOM 904 CE3 TRP A 60 3.852 -12.762 -5.642 1.00 0.00 C ATOM 905 CZ2 TRP A 60 1.818 -14.137 -4.241 1.00 0.00 C ATOM 906 CZ3 TRP A 60 4.115 -13.427 -4.459 1.00 0.00 C ATOM 907 CH2 TRP A 60 3.103 -14.107 -3.770 1.00 0.00 C ATOM 0 H TRP A 60 4.996 -12.291 -8.968 1.00 0.00 H new ATOM 0 HA TRP A 60 2.238 -12.962 -9.795 1.00 0.00 H new ATOM 0 HB2 TRP A 60 3.473 -10.912 -7.951 1.00 0.00 H new ATOM 0 HB3 TRP A 60 1.911 -10.597 -8.680 1.00 0.00 H new ATOM 0 HD1 TRP A 60 -0.135 -12.314 -7.986 1.00 0.00 H new ATOM 0 HE1 TRP A 60 -0.521 -13.726 -5.853 1.00 0.00 H new ATOM 0 HE3 TRP A 60 4.639 -12.241 -6.167 1.00 0.00 H new ATOM 0 HZ2 TRP A 60 1.039 -14.661 -3.708 1.00 0.00 H new ATOM 0 HZ3 TRP A 60 5.118 -13.422 -4.059 1.00 0.00 H new ATOM 0 HH2 TRP A 60 3.341 -14.618 -2.849 1.00 0.00 H new ATOM 918 N ASN A 61 4.222 -10.598 -10.944 1.00 0.00 N ATOM 919 CA ASN A 61 4.439 -9.690 -12.065 1.00 0.00 C ATOM 920 C ASN A 61 3.130 -9.033 -12.494 1.00 0.00 C ATOM 921 O ASN A 61 2.833 -8.939 -13.684 1.00 0.00 O ATOM 922 CB ASN A 61 5.055 -10.443 -13.246 1.00 0.00 C ATOM 923 CG ASN A 61 4.015 -11.176 -14.071 1.00 0.00 C ATOM 924 OD1 ASN A 61 3.583 -12.334 -13.585 1.00 0.00 O flip ATOM 925 ND2 ASN A 61 3.605 -10.706 -15.132 1.00 0.00 N flip ATOM 0 H ASN A 61 4.998 -10.646 -10.284 1.00 0.00 H new ATOM 0 HA ASN A 61 5.128 -8.910 -11.741 1.00 0.00 H new ATOM 0 HB2 ASN A 61 5.590 -9.739 -13.883 1.00 0.00 H new ATOM 0 HB3 ASN A 61 5.789 -11.158 -12.874 1.00 0.00 H new ATOM 0 HD21 ASN A 61 3.965 -9.813 -15.467 1.00 0.00 H new ATOM 0 HD22 ASN A 61 2.905 -11.210 -15.676 1.00 0.00 H new ATOM 932 N GLU A 62 2.353 -8.579 -11.515 1.00 0.00 N ATOM 933 CA GLU A 62 1.077 -7.931 -11.791 1.00 0.00 C ATOM 934 C GLU A 62 1.083 -6.486 -11.299 1.00 0.00 C ATOM 935 O GLU A 62 1.587 -6.191 -10.216 1.00 0.00 O ATOM 936 CB GLU A 62 -0.066 -8.702 -11.129 1.00 0.00 C ATOM 937 CG GLU A 62 -1.406 -7.989 -11.205 1.00 0.00 C ATOM 938 CD GLU A 62 -2.581 -8.946 -11.141 1.00 0.00 C ATOM 939 OE1 GLU A 62 -2.654 -9.730 -10.172 1.00 0.00 O ATOM 940 OE2 GLU A 62 -3.426 -8.910 -12.060 1.00 0.00 O ATOM 0 H GLU A 62 2.585 -8.648 -10.524 1.00 0.00 H new ATOM 0 HA GLU A 62 0.926 -7.929 -12.870 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -0.157 -9.679 -11.603 1.00 0.00 H new ATOM 0 HB3 GLU A 62 0.184 -8.878 -10.083 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -1.480 -7.274 -10.386 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -1.457 -7.418 -12.132 1.00 0.00 H new ATOM 947 N TRP A 63 0.519 -5.592 -12.103 1.00 0.00 N ATOM 948 CA TRP A 63 0.459 -4.178 -11.750 1.00 0.00 C ATOM 949 C TRP A 63 -0.708 -3.901 -10.809 1.00 0.00 C ATOM 950 O TRP A 63 -1.846 -3.729 -11.249 1.00 0.00 O ATOM 951 CB TRP A 63 0.329 -3.321 -13.010 1.00 0.00 C ATOM 952 CG TRP A 63 1.644 -3.025 -13.665 1.00 0.00 C ATOM 953 CD1 TRP A 63 2.167 -3.637 -14.769 1.00 0.00 C ATOM 954 CD2 TRP A 63 2.604 -2.044 -13.256 1.00 0.00 C ATOM 955 NE1 TRP A 63 3.393 -3.096 -15.070 1.00 0.00 N ATOM 956 CE2 TRP A 63 3.683 -2.116 -14.158 1.00 0.00 C ATOM 957 CE3 TRP A 63 2.655 -1.111 -12.218 1.00 0.00 C ATOM 958 CZ2 TRP A 63 4.800 -1.291 -14.049 1.00 0.00 C ATOM 959 CZ3 TRP A 63 3.763 -0.292 -12.111 1.00 0.00 C ATOM 960 CH2 TRP A 63 4.823 -0.386 -13.023 1.00 0.00 C ATOM 0 H TRP A 63 0.097 -5.821 -13.003 1.00 0.00 H new ATOM 0 HA TRP A 63 1.385 -3.918 -11.237 1.00 0.00 H new ATOM 0 HB2 TRP A 63 -0.317 -3.832 -13.723 1.00 0.00 H new ATOM 0 HB3 TRP A 63 -0.160 -2.382 -12.753 1.00 0.00 H new ATOM 0 HD1 TRP A 63 1.687 -4.430 -15.323 1.00 0.00 H new ATOM 0 HE1 TRP A 63 3.991 -3.378 -15.847 1.00 0.00 H new ATOM 0 HE3 TRP A 63 1.842 -1.031 -11.511 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 5.619 -1.363 -14.749 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 3.813 0.432 -11.311 1.00 0.00 H new ATOM 0 HH2 TRP A 63 5.675 0.269 -12.914 1.00 0.00 H new ATOM 971 N LEU A 64 -0.421 -3.858 -9.513 1.00 0.00 N ATOM 972 CA LEU A 64 -1.448 -3.601 -8.509 1.00 0.00 C ATOM 973 C LEU A 64 -1.660 -2.103 -8.319 1.00 0.00 C ATOM 974 O LEU A 64 -0.736 -1.376 -7.956 1.00 0.00 O ATOM 975 CB LEU A 64 -1.060 -4.246 -7.177 1.00 0.00 C ATOM 976 CG LEU A 64 -2.214 -4.573 -6.229 1.00 0.00 C ATOM 977 CD1 LEU A 64 -3.152 -5.590 -6.861 1.00 0.00 C ATOM 978 CD2 LEU A 64 -1.682 -5.090 -4.900 1.00 0.00 C ATOM 0 H LEU A 64 0.515 -3.998 -9.132 1.00 0.00 H new ATOM 0 HA LEU A 64 -2.382 -4.040 -8.859 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -0.516 -5.167 -7.387 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -0.370 -3.579 -6.661 1.00 0.00 H new ATOM 0 HG LEU A 64 -2.776 -3.658 -6.042 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -3.967 -5.811 -6.172 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -3.559 -5.183 -7.787 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -2.603 -6.506 -7.078 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -2.517 -5.318 -4.238 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -1.096 -5.994 -5.069 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -1.051 -4.329 -4.440 1.00 0.00 H new ATOM 990 N ASN A 65 -2.884 -1.648 -8.565 1.00 0.00 N ATOM 991 CA ASN A 65 -3.219 -0.236 -8.419 1.00 0.00 C ATOM 992 C ASN A 65 -3.895 0.027 -7.077 1.00 0.00 C ATOM 993 O ASN A 65 -4.815 -0.689 -6.682 1.00 0.00 O ATOM 994 CB ASN A 65 -4.134 0.214 -9.560 1.00 0.00 C ATOM 995 CG ASN A 65 -5.304 -0.728 -9.768 1.00 0.00 C ATOM 996 OD1 ASN A 65 -6.284 -0.693 -9.023 1.00 0.00 O ATOM 997 ND2 ASN A 65 -5.207 -1.578 -10.784 1.00 0.00 N ATOM 0 H ASN A 65 -3.661 -2.237 -8.866 1.00 0.00 H new ATOM 0 HA ASN A 65 -2.292 0.337 -8.458 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -4.510 1.215 -9.347 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -3.556 0.280 -10.482 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -5.963 -2.236 -10.972 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -4.376 -1.572 -11.376 1.00 0.00 H new ATOM 1004 N TYR A 66 -3.432 1.059 -6.381 1.00 0.00 N ATOM 1005 CA TYR A 66 -3.990 1.417 -5.082 1.00 0.00 C ATOM 1006 C TYR A 66 -4.960 2.588 -5.209 1.00 0.00 C ATOM 1007 O TYR A 66 -4.683 3.565 -5.904 1.00 0.00 O ATOM 1008 CB TYR A 66 -2.870 1.772 -4.102 1.00 0.00 C ATOM 1009 CG TYR A 66 -2.051 0.580 -3.660 1.00 0.00 C ATOM 1010 CD1 TYR A 66 -1.123 -0.005 -4.513 1.00 0.00 C ATOM 1011 CD2 TYR A 66 -2.206 0.039 -2.390 1.00 0.00 C ATOM 1012 CE1 TYR A 66 -0.374 -1.095 -4.113 1.00 0.00 C ATOM 1013 CE2 TYR A 66 -1.460 -1.050 -1.981 1.00 0.00 C ATOM 1014 CZ TYR A 66 -0.546 -1.613 -2.847 1.00 0.00 C ATOM 1015 OH TYR A 66 0.200 -2.698 -2.445 1.00 0.00 O ATOM 0 H TYR A 66 -2.672 1.663 -6.694 1.00 0.00 H new ATOM 0 HA TYR A 66 -4.538 0.555 -4.701 1.00 0.00 H new ATOM 0 HB2 TYR A 66 -2.209 2.503 -4.568 1.00 0.00 H new ATOM 0 HB3 TYR A 66 -3.305 2.249 -3.224 1.00 0.00 H new ATOM 0 HD1 TYR A 66 -0.985 0.399 -5.505 1.00 0.00 H new ATOM 0 HD2 TYR A 66 -2.922 0.477 -1.710 1.00 0.00 H new ATOM 0 HE1 TYR A 66 0.342 -1.539 -4.788 1.00 0.00 H new ATOM 0 HE2 TYR A 66 -1.592 -1.458 -0.990 1.00 0.00 H new ATOM 0 HH TYR A 66 1.135 -2.428 -2.330 1.00 0.00 H new ATOM 1025 N ASP A 67 -6.097 2.481 -4.531 1.00 0.00 N ATOM 1026 CA ASP A 67 -7.109 3.530 -4.565 1.00 0.00 C ATOM 1027 C ASP A 67 -6.841 4.579 -3.490 1.00 0.00 C ATOM 1028 O ASP A 67 -7.758 5.015 -2.793 1.00 0.00 O ATOM 1029 CB ASP A 67 -8.503 2.931 -4.375 1.00 0.00 C ATOM 1030 CG ASP A 67 -9.579 3.731 -5.082 1.00 0.00 C ATOM 1031 OD1 ASP A 67 -9.335 4.176 -6.223 1.00 0.00 O ATOM 1032 OD2 ASP A 67 -10.666 3.913 -4.494 1.00 0.00 O ATOM 0 H ASP A 67 -6.341 1.678 -3.951 1.00 0.00 H new ATOM 0 HA ASP A 67 -7.061 4.015 -5.540 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -8.510 1.908 -4.750 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -8.732 2.881 -3.310 1.00 0.00 H new ATOM 1037 N ILE A 68 -5.580 4.978 -3.361 1.00 0.00 N ATOM 1038 CA ILE A 68 -5.193 5.975 -2.371 1.00 0.00 C ATOM 1039 C ILE A 68 -4.740 7.267 -3.041 1.00 0.00 C ATOM 1040 O ILE A 68 -4.476 7.297 -4.243 1.00 0.00 O ATOM 1041 CB ILE A 68 -4.062 5.456 -1.463 1.00 0.00 C ATOM 1042 CG1 ILE A 68 -2.751 5.362 -2.248 1.00 0.00 C ATOM 1043 CG2 ILE A 68 -4.432 4.102 -0.876 1.00 0.00 C ATOM 1044 CD1 ILE A 68 -1.926 6.629 -2.200 1.00 0.00 C ATOM 0 H ILE A 68 -4.810 4.626 -3.929 1.00 0.00 H new ATOM 0 HA ILE A 68 -6.074 6.175 -1.762 1.00 0.00 H new ATOM 0 HB ILE A 68 -3.923 6.160 -0.642 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -2.158 4.537 -1.853 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -2.976 5.123 -3.288 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -3.623 3.749 -0.237 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -5.344 4.198 -0.287 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -4.595 3.388 -1.683 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -1.012 6.490 -2.777 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -2.500 7.453 -2.623 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -1.670 6.858 -1.165 1.00 0.00 H new ATOM 1056 N TYR A 69 -4.649 8.334 -2.254 1.00 0.00 N ATOM 1057 CA TYR A 69 -4.228 9.631 -2.771 1.00 0.00 C ATOM 1058 C TYR A 69 -2.919 10.075 -2.126 1.00 0.00 C ATOM 1059 O TYR A 69 -2.837 10.234 -0.907 1.00 0.00 O ATOM 1060 CB TYR A 69 -5.314 10.679 -2.522 1.00 0.00 C ATOM 1061 CG TYR A 69 -5.579 11.571 -3.715 1.00 0.00 C ATOM 1062 CD1 TYR A 69 -5.621 11.048 -5.002 1.00 0.00 C ATOM 1063 CD2 TYR A 69 -5.787 12.935 -3.555 1.00 0.00 C ATOM 1064 CE1 TYR A 69 -5.862 11.858 -6.094 1.00 0.00 C ATOM 1065 CE2 TYR A 69 -6.031 13.752 -4.641 1.00 0.00 C ATOM 1066 CZ TYR A 69 -6.067 13.210 -5.909 1.00 0.00 C ATOM 1067 OH TYR A 69 -6.308 14.021 -6.994 1.00 0.00 O ATOM 0 H TYR A 69 -4.861 8.326 -1.256 1.00 0.00 H new ATOM 0 HA TYR A 69 -4.068 9.532 -3.845 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -6.239 10.173 -2.244 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -5.022 11.298 -1.674 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -5.462 9.990 -5.151 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -5.757 13.364 -2.564 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -5.890 11.436 -7.088 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -6.193 14.810 -4.498 1.00 0.00 H new ATOM 0 HH TYR A 69 -6.432 14.945 -6.691 1.00 0.00 H new ATOM 1077 N ILE A 70 -1.898 10.275 -2.952 1.00 0.00 N ATOM 1078 CA ILE A 70 -0.593 10.703 -2.463 1.00 0.00 C ATOM 1079 C ILE A 70 -0.700 12.006 -1.678 1.00 0.00 C ATOM 1080 O ILE A 70 -0.225 12.119 -0.547 1.00 0.00 O ATOM 1081 CB ILE A 70 0.406 10.895 -3.620 1.00 0.00 C ATOM 1082 CG1 ILE A 70 0.871 9.537 -4.152 1.00 0.00 C ATOM 1083 CG2 ILE A 70 1.595 11.725 -3.160 1.00 0.00 C ATOM 1084 CD1 ILE A 70 0.002 8.995 -5.265 1.00 0.00 C ATOM 0 H ILE A 70 -1.949 10.148 -3.963 1.00 0.00 H new ATOM 0 HA ILE A 70 -0.228 9.914 -1.805 1.00 0.00 H new ATOM 0 HB ILE A 70 -0.094 11.429 -4.428 1.00 0.00 H new ATOM 0 HG12 ILE A 70 1.895 9.629 -4.513 1.00 0.00 H new ATOM 0 HG13 ILE A 70 0.886 8.820 -3.331 1.00 0.00 H new ATOM 0 HG21 ILE A 70 2.292 11.852 -3.988 1.00 0.00 H new ATOM 0 HG22 ILE A 70 1.248 12.702 -2.824 1.00 0.00 H new ATOM 0 HG23 ILE A 70 2.098 11.216 -2.338 1.00 0.00 H new ATOM 0 HD11 ILE A 70 0.390 8.031 -5.593 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -1.018 8.871 -4.902 1.00 0.00 H new ATOM 0 HD13 ILE A 70 0.007 9.692 -6.103 1.00 0.00 H new ATOM 1096 N PRO A 71 -1.340 13.014 -2.289 1.00 0.00 N ATOM 1097 CA PRO A 71 -1.527 14.327 -1.664 1.00 0.00 C ATOM 1098 C PRO A 71 -2.509 14.280 -0.498 1.00 0.00 C ATOM 1099 O PRO A 71 -2.804 15.303 0.119 1.00 0.00 O ATOM 1100 CB PRO A 71 -2.087 15.184 -2.801 1.00 0.00 C ATOM 1101 CG PRO A 71 -2.743 14.213 -3.721 1.00 0.00 C ATOM 1102 CD PRO A 71 -1.930 12.950 -3.636 1.00 0.00 C ATOM 0 HA PRO A 71 -0.600 14.712 -1.239 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -2.800 15.919 -2.428 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -1.295 15.736 -3.307 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -3.777 14.033 -3.426 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -2.765 14.595 -4.741 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -2.551 12.063 -3.761 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -1.163 12.913 -4.409 1.00 0.00 H new ATOM 1110 N ASP A 72 -3.012 13.086 -0.203 1.00 0.00 N ATOM 1111 CA ASP A 72 -3.960 12.905 0.890 1.00 0.00 C ATOM 1112 C ASP A 72 -3.470 11.838 1.864 1.00 0.00 C ATOM 1113 O ASP A 72 -4.069 11.623 2.919 1.00 0.00 O ATOM 1114 CB ASP A 72 -5.335 12.520 0.342 1.00 0.00 C ATOM 1115 CG ASP A 72 -6.467 12.986 1.238 1.00 0.00 C ATOM 1116 OD1 ASP A 72 -6.547 12.508 2.388 1.00 0.00 O ATOM 1117 OD2 ASP A 72 -7.272 13.827 0.788 1.00 0.00 O ATOM 0 H ASP A 72 -2.779 12.229 -0.705 1.00 0.00 H new ATOM 0 HA ASP A 72 -4.043 13.850 1.427 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -5.461 12.951 -0.651 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -5.388 11.437 0.229 1.00 0.00 H new ATOM 1122 N LEU A 73 -2.379 11.172 1.503 1.00 0.00 N ATOM 1123 CA LEU A 73 -1.808 10.126 2.345 1.00 0.00 C ATOM 1124 C LEU A 73 -1.088 10.727 3.547 1.00 0.00 C ATOM 1125 O LEU A 73 -0.092 11.439 3.414 1.00 0.00 O ATOM 1126 CB LEU A 73 -0.839 9.264 1.534 1.00 0.00 C ATOM 1127 CG LEU A 73 -0.735 7.797 1.953 1.00 0.00 C ATOM 1128 CD1 LEU A 73 -0.280 7.686 3.400 1.00 0.00 C ATOM 1129 CD2 LEU A 73 -2.067 7.089 1.754 1.00 0.00 C ATOM 0 H LEU A 73 -1.872 11.337 0.633 1.00 0.00 H new ATOM 0 HA LEU A 73 -2.623 9.501 2.709 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -1.140 9.302 0.487 1.00 0.00 H new ATOM 0 HB3 LEU A 73 0.153 9.711 1.597 1.00 0.00 H new ATOM 0 HG LEU A 73 0.009 7.311 1.322 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -0.212 6.635 3.680 1.00 0.00 H new ATOM 0 HD12 LEU A 73 0.697 8.155 3.511 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -0.999 8.188 4.047 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -1.974 6.046 2.057 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -2.832 7.576 2.359 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -2.351 7.137 0.703 1.00 0.00 H new ATOM 1141 N PRO A 74 -1.599 10.433 4.752 1.00 0.00 N ATOM 1142 CA PRO A 74 -1.019 10.932 6.002 1.00 0.00 C ATOM 1143 C PRO A 74 0.331 10.292 6.310 1.00 0.00 C ATOM 1144 O PRO A 74 0.518 9.091 6.114 1.00 0.00 O ATOM 1145 CB PRO A 74 -2.053 10.534 7.058 1.00 0.00 C ATOM 1146 CG PRO A 74 -2.759 9.360 6.472 1.00 0.00 C ATOM 1147 CD PRO A 74 -2.784 9.591 4.986 1.00 0.00 C ATOM 0 HA PRO A 74 -0.823 12.004 5.961 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -1.575 10.277 8.003 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -2.745 11.351 7.262 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -2.241 8.432 6.714 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -3.770 9.274 6.871 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -2.727 8.654 4.433 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -3.700 10.091 4.672 1.00 0.00 H new ATOM 1155 N ARG A 75 1.267 11.101 6.794 1.00 0.00 N ATOM 1156 CA ARG A 75 2.600 10.614 7.129 1.00 0.00 C ATOM 1157 C ARG A 75 2.519 9.414 8.069 1.00 0.00 C ATOM 1158 O ARG A 75 3.313 8.479 7.967 1.00 0.00 O ATOM 1159 CB ARG A 75 3.426 11.727 7.776 1.00 0.00 C ATOM 1160 CG ARG A 75 3.545 12.975 6.917 1.00 0.00 C ATOM 1161 CD ARG A 75 4.403 12.724 5.687 1.00 0.00 C ATOM 1162 NE ARG A 75 4.582 13.934 4.889 1.00 0.00 N ATOM 1163 CZ ARG A 75 5.349 14.953 5.261 1.00 0.00 C ATOM 1164 NH1 ARG A 75 6.005 14.908 6.413 1.00 0.00 N ATOM 1165 NH2 ARG A 75 5.462 16.020 4.481 1.00 0.00 N ATOM 0 H ARG A 75 1.127 12.097 6.963 1.00 0.00 H new ATOM 0 HA ARG A 75 3.087 10.300 6.206 1.00 0.00 H new ATOM 0 HB2 ARG A 75 2.974 11.995 8.731 1.00 0.00 H new ATOM 0 HB3 ARG A 75 4.425 11.348 7.992 1.00 0.00 H new ATOM 0 HG2 ARG A 75 2.552 13.302 6.609 1.00 0.00 H new ATOM 0 HG3 ARG A 75 3.978 13.783 7.506 1.00 0.00 H new ATOM 0 HD2 ARG A 75 5.378 12.346 5.996 1.00 0.00 H new ATOM 0 HD3 ARG A 75 3.941 11.950 5.074 1.00 0.00 H new ATOM 0 HE ARG A 75 4.091 14.000 3.997 1.00 0.00 H new ATOM 0 HH11 ARG A 75 5.921 14.090 7.016 1.00 0.00 H new ATOM 0 HH12 ARG A 75 6.593 15.692 6.696 1.00 0.00 H new ATOM 0 HH21 ARG A 75 4.960 16.059 3.594 1.00 0.00 H new ATOM 0 HH22 ARG A 75 6.051 16.802 4.768 1.00 0.00 H new ATOM 1179 N ALA A 76 1.555 9.448 8.983 1.00 0.00 N ATOM 1180 CA ALA A 76 1.370 8.363 9.939 1.00 0.00 C ATOM 1181 C ALA A 76 1.067 7.049 9.226 1.00 0.00 C ATOM 1182 O ALA A 76 1.462 5.978 9.686 1.00 0.00 O ATOM 1183 CB ALA A 76 0.255 8.706 10.916 1.00 0.00 C ATOM 0 H ALA A 76 0.890 10.215 9.082 1.00 0.00 H new ATOM 0 HA ALA A 76 2.299 8.238 10.495 1.00 0.00 H new ATOM 0 HB1 ALA A 76 0.127 7.887 11.624 1.00 0.00 H new ATOM 0 HB2 ALA A 76 0.512 9.617 11.457 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -0.675 8.860 10.368 1.00 0.00 H new ATOM 1189 N ALA A 77 0.363 7.140 8.103 1.00 0.00 N ATOM 1190 CA ALA A 77 0.009 5.958 7.327 1.00 0.00 C ATOM 1191 C ALA A 77 1.244 5.325 6.695 1.00 0.00 C ATOM 1192 O ALA A 77 2.307 5.942 6.634 1.00 0.00 O ATOM 1193 CB ALA A 77 -1.009 6.317 6.254 1.00 0.00 C ATOM 0 H ALA A 77 0.027 8.019 7.710 1.00 0.00 H new ATOM 0 HA ALA A 77 -0.434 5.229 8.005 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -1.265 5.425 5.682 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -1.908 6.716 6.724 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -0.585 7.067 5.586 1.00 0.00 H new ATOM 1199 N ARG A 78 1.096 4.090 6.227 1.00 0.00 N ATOM 1200 CA ARG A 78 2.201 3.372 5.602 1.00 0.00 C ATOM 1201 C ARG A 78 1.686 2.212 4.756 1.00 0.00 C ATOM 1202 O ARG A 78 0.496 1.896 4.774 1.00 0.00 O ATOM 1203 CB ARG A 78 3.167 2.852 6.668 1.00 0.00 C ATOM 1204 CG ARG A 78 2.533 1.864 7.634 1.00 0.00 C ATOM 1205 CD ARG A 78 3.259 1.847 8.970 1.00 0.00 C ATOM 1206 NE ARG A 78 2.378 1.451 10.066 1.00 0.00 N ATOM 1207 CZ ARG A 78 2.745 1.458 11.343 1.00 0.00 C ATOM 1208 NH1 ARG A 78 3.969 1.839 11.682 1.00 0.00 N ATOM 1209 NH2 ARG A 78 1.887 1.084 12.283 1.00 0.00 N ATOM 0 H ARG A 78 0.222 3.566 6.269 1.00 0.00 H new ATOM 0 HA ARG A 78 2.731 4.067 4.950 1.00 0.00 H new ATOM 0 HB2 ARG A 78 4.014 2.374 6.176 1.00 0.00 H new ATOM 0 HB3 ARG A 78 3.561 3.697 7.232 1.00 0.00 H new ATOM 0 HG2 ARG A 78 1.487 2.127 7.791 1.00 0.00 H new ATOM 0 HG3 ARG A 78 2.549 0.865 7.197 1.00 0.00 H new ATOM 0 HD2 ARG A 78 4.102 1.158 8.916 1.00 0.00 H new ATOM 0 HD3 ARG A 78 3.668 2.837 9.173 1.00 0.00 H new ATOM 0 HE ARG A 78 1.429 1.153 9.839 1.00 0.00 H new ATOM 0 HH11 ARG A 78 4.631 2.128 10.962 1.00 0.00 H new ATOM 0 HH12 ARG A 78 4.248 1.844 12.663 1.00 0.00 H new ATOM 0 HH21 ARG A 78 0.945 0.791 12.026 1.00 0.00 H new ATOM 0 HH22 ARG A 78 2.170 1.090 13.263 1.00 0.00 H new ATOM 1223 N LEU A 79 2.590 1.580 4.016 1.00 0.00 N ATOM 1224 CA LEU A 79 2.228 0.453 3.162 1.00 0.00 C ATOM 1225 C LEU A 79 2.436 -0.871 3.890 1.00 0.00 C ATOM 1226 O LEU A 79 3.370 -1.017 4.679 1.00 0.00 O ATOM 1227 CB LEU A 79 3.056 0.476 1.876 1.00 0.00 C ATOM 1228 CG LEU A 79 2.872 -0.718 0.938 1.00 0.00 C ATOM 1229 CD1 LEU A 79 1.458 -0.744 0.379 1.00 0.00 C ATOM 1230 CD2 LEU A 79 3.893 -0.672 -0.189 1.00 0.00 C ATOM 0 H LEU A 79 3.579 1.828 3.990 1.00 0.00 H new ATOM 0 HA LEU A 79 1.172 0.545 2.909 1.00 0.00 H new ATOM 0 HB2 LEU A 79 2.812 1.385 1.327 1.00 0.00 H new ATOM 0 HB3 LEU A 79 4.110 0.541 2.147 1.00 0.00 H new ATOM 0 HG LEU A 79 3.032 -1.633 1.509 1.00 0.00 H new ATOM 0 HD11 LEU A 79 1.345 -1.600 -0.286 1.00 0.00 H new ATOM 0 HD12 LEU A 79 0.744 -0.825 1.199 1.00 0.00 H new ATOM 0 HD13 LEU A 79 1.270 0.175 -0.177 1.00 0.00 H new ATOM 0 HD21 LEU A 79 3.748 -1.529 -0.847 1.00 0.00 H new ATOM 0 HD22 LEU A 79 3.765 0.249 -0.759 1.00 0.00 H new ATOM 0 HD23 LEU A 79 4.899 -0.703 0.230 1.00 0.00 H new ATOM 1242 N CYS A 80 1.560 -1.832 3.619 1.00 0.00 N ATOM 1243 CA CYS A 80 1.648 -3.146 4.247 1.00 0.00 C ATOM 1244 C CYS A 80 1.428 -4.254 3.223 1.00 0.00 C ATOM 1245 O CYS A 80 0.704 -4.074 2.243 1.00 0.00 O ATOM 1246 CB CYS A 80 0.621 -3.265 5.374 1.00 0.00 C ATOM 1247 SG CYS A 80 0.843 -2.062 6.706 1.00 0.00 S ATOM 0 H CYS A 80 0.781 -1.726 2.969 1.00 0.00 H new ATOM 0 HA CYS A 80 2.649 -3.256 4.664 1.00 0.00 H new ATOM 0 HB2 CYS A 80 -0.378 -3.146 4.955 1.00 0.00 H new ATOM 0 HB3 CYS A 80 0.673 -4.270 5.794 1.00 0.00 H new ATOM 0 HG CYS A 80 -0.318 -1.626 7.095 1.00 0.00 H new ATOM 1253 N LEU A 81 2.058 -5.400 3.455 1.00 0.00 N ATOM 1254 CA LEU A 81 1.933 -6.539 2.552 1.00 0.00 C ATOM 1255 C LEU A 81 2.220 -7.847 3.282 1.00 0.00 C ATOM 1256 O LEU A 81 3.138 -7.926 4.098 1.00 0.00 O ATOM 1257 CB LEU A 81 2.888 -6.382 1.367 1.00 0.00 C ATOM 1258 CG LEU A 81 4.155 -5.569 1.630 1.00 0.00 C ATOM 1259 CD1 LEU A 81 5.311 -6.095 0.793 1.00 0.00 C ATOM 1260 CD2 LEU A 81 3.913 -4.095 1.339 1.00 0.00 C ATOM 0 H LEU A 81 2.661 -5.565 4.261 1.00 0.00 H new ATOM 0 HA LEU A 81 0.908 -6.568 2.183 1.00 0.00 H new ATOM 0 HB2 LEU A 81 3.182 -7.376 1.029 1.00 0.00 H new ATOM 0 HB3 LEU A 81 2.344 -5.914 0.547 1.00 0.00 H new ATOM 0 HG LEU A 81 4.418 -5.674 2.683 1.00 0.00 H new ATOM 0 HD11 LEU A 81 6.204 -5.504 0.994 1.00 0.00 H new ATOM 0 HD12 LEU A 81 5.501 -7.137 1.049 1.00 0.00 H new ATOM 0 HD13 LEU A 81 5.057 -6.022 -0.265 1.00 0.00 H new ATOM 0 HD21 LEU A 81 4.826 -3.531 1.532 1.00 0.00 H new ATOM 0 HD22 LEU A 81 3.625 -3.973 0.295 1.00 0.00 H new ATOM 0 HD23 LEU A 81 3.115 -3.724 1.982 1.00 0.00 H new ATOM 1272 N SER A 82 1.431 -8.873 2.980 1.00 0.00 N ATOM 1273 CA SER A 82 1.599 -10.178 3.608 1.00 0.00 C ATOM 1274 C SER A 82 1.188 -11.297 2.655 1.00 0.00 C ATOM 1275 O SER A 82 0.191 -11.184 1.942 1.00 0.00 O ATOM 1276 CB SER A 82 0.773 -10.259 4.893 1.00 0.00 C ATOM 1277 OG SER A 82 -0.613 -10.159 4.616 1.00 0.00 O ATOM 0 H SER A 82 0.669 -8.826 2.304 1.00 0.00 H new ATOM 0 HA SER A 82 2.654 -10.302 3.853 1.00 0.00 H new ATOM 0 HB2 SER A 82 0.978 -11.201 5.402 1.00 0.00 H new ATOM 0 HB3 SER A 82 1.070 -9.459 5.571 1.00 0.00 H new ATOM 0 HG SER A 82 -1.125 -10.463 5.395 1.00 0.00 H new ATOM 1283 N ILE A 83 1.965 -12.375 2.650 1.00 0.00 N ATOM 1284 CA ILE A 83 1.682 -13.515 1.786 1.00 0.00 C ATOM 1285 C ILE A 83 0.711 -14.482 2.453 1.00 0.00 C ATOM 1286 O ILE A 83 0.819 -14.762 3.648 1.00 0.00 O ATOM 1287 CB ILE A 83 2.970 -14.273 1.415 1.00 0.00 C ATOM 1288 CG1 ILE A 83 3.995 -13.314 0.805 1.00 0.00 C ATOM 1289 CG2 ILE A 83 2.658 -15.407 0.450 1.00 0.00 C ATOM 1290 CD1 ILE A 83 5.388 -13.896 0.714 1.00 0.00 C ATOM 0 H ILE A 83 2.794 -12.483 3.234 1.00 0.00 H new ATOM 0 HA ILE A 83 1.229 -13.118 0.878 1.00 0.00 H new ATOM 0 HB ILE A 83 3.396 -14.701 2.322 1.00 0.00 H new ATOM 0 HG12 ILE A 83 3.664 -13.028 -0.193 1.00 0.00 H new ATOM 0 HG13 ILE A 83 4.029 -12.403 1.403 1.00 0.00 H new ATOM 0 HG21 ILE A 83 3.578 -15.933 0.197 1.00 0.00 H new ATOM 0 HG22 ILE A 83 1.960 -16.101 0.918 1.00 0.00 H new ATOM 0 HG23 ILE A 83 2.212 -15.000 -0.457 1.00 0.00 H new ATOM 0 HD11 ILE A 83 6.061 -13.161 0.272 1.00 0.00 H new ATOM 0 HD12 ILE A 83 5.740 -14.156 1.712 1.00 0.00 H new ATOM 0 HD13 ILE A 83 5.369 -14.791 0.092 1.00 0.00 H new ATOM 1302 N CYS A 84 -0.237 -14.992 1.674 1.00 0.00 N ATOM 1303 CA CYS A 84 -1.228 -15.930 2.189 1.00 0.00 C ATOM 1304 C CYS A 84 -1.497 -17.044 1.182 1.00 0.00 C ATOM 1305 O CYS A 84 -1.475 -16.819 -0.028 1.00 0.00 O ATOM 1306 CB CYS A 84 -2.530 -15.199 2.519 1.00 0.00 C ATOM 1307 SG CYS A 84 -2.368 -13.956 3.822 1.00 0.00 S ATOM 0 H CYS A 84 -0.340 -14.772 0.683 1.00 0.00 H new ATOM 0 HA CYS A 84 -0.830 -16.377 3.100 1.00 0.00 H new ATOM 0 HB2 CYS A 84 -2.902 -14.716 1.615 1.00 0.00 H new ATOM 0 HB3 CYS A 84 -3.279 -15.931 2.821 1.00 0.00 H new ATOM 0 HG CYS A 84 -1.124 -13.875 4.192 1.00 0.00 H new ATOM 1313 N SER A 85 -1.749 -18.246 1.690 1.00 0.00 N ATOM 1314 CA SER A 85 -2.017 -19.396 0.835 1.00 0.00 C ATOM 1315 C SER A 85 -3.495 -19.772 0.878 1.00 0.00 C ATOM 1316 O SER A 85 -4.037 -20.085 1.938 1.00 0.00 O ATOM 1317 CB SER A 85 -1.162 -20.589 1.267 1.00 0.00 C ATOM 1318 OG SER A 85 -1.472 -20.985 2.592 1.00 0.00 O ATOM 0 H SER A 85 -1.773 -18.449 2.689 1.00 0.00 H new ATOM 0 HA SER A 85 -1.759 -19.125 -0.189 1.00 0.00 H new ATOM 0 HB2 SER A 85 -1.327 -21.424 0.586 1.00 0.00 H new ATOM 0 HB3 SER A 85 -0.106 -20.327 1.200 1.00 0.00 H new ATOM 0 HG SER A 85 -2.405 -20.760 2.791 1.00 0.00 H new ATOM 1324 N VAL A 86 -4.141 -19.740 -0.284 1.00 0.00 N ATOM 1325 CA VAL A 86 -5.556 -20.078 -0.381 1.00 0.00 C ATOM 1326 C VAL A 86 -5.747 -21.487 -0.931 1.00 0.00 C ATOM 1327 O VAL A 86 -5.163 -21.852 -1.952 1.00 0.00 O ATOM 1328 CB VAL A 86 -6.311 -19.081 -1.279 1.00 0.00 C ATOM 1329 CG1 VAL A 86 -6.019 -19.357 -2.746 1.00 0.00 C ATOM 1330 CG2 VAL A 86 -7.805 -19.142 -1.004 1.00 0.00 C ATOM 0 H VAL A 86 -3.707 -19.484 -1.171 1.00 0.00 H new ATOM 0 HA VAL A 86 -5.964 -20.026 0.628 1.00 0.00 H new ATOM 0 HB VAL A 86 -5.963 -18.074 -1.047 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -6.561 -18.643 -3.366 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -4.949 -19.257 -2.929 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -6.337 -20.369 -2.996 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -8.323 -18.431 -1.648 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -8.171 -20.148 -1.207 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -7.993 -18.891 0.040 1.00 0.00 H new ATOM 1340 N LYS A 87 -6.570 -22.276 -0.248 1.00 0.00 N ATOM 1341 CA LYS A 87 -6.842 -23.645 -0.669 1.00 0.00 C ATOM 1342 C LYS A 87 -8.325 -23.974 -0.527 1.00 0.00 C ATOM 1343 O LYS A 87 -8.866 -23.985 0.578 1.00 0.00 O ATOM 1344 CB LYS A 87 -6.010 -24.629 0.158 1.00 0.00 C ATOM 1345 CG LYS A 87 -6.428 -26.078 -0.020 1.00 0.00 C ATOM 1346 CD LYS A 87 -5.975 -26.629 -1.361 1.00 0.00 C ATOM 1347 CE LYS A 87 -6.341 -28.097 -1.513 1.00 0.00 C ATOM 1348 NZ LYS A 87 -5.521 -28.968 -0.627 1.00 0.00 N ATOM 0 H LYS A 87 -7.060 -21.990 0.600 1.00 0.00 H new ATOM 0 HA LYS A 87 -6.566 -23.737 -1.720 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -4.961 -24.526 -0.118 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -6.090 -24.363 1.212 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -6.005 -26.681 0.784 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -7.512 -26.157 0.059 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -6.433 -26.054 -2.165 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -4.896 -26.510 -1.459 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -7.397 -28.234 -1.280 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -6.201 -28.400 -2.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -5.716 -29.966 -0.845 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -4.512 -28.770 -0.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -5.761 -28.777 0.367 1.00 0.00 H new ATOM 1454 N GLU A 94 -12.883 -21.578 0.179 1.00 0.00 N ATOM 1455 CA GLU A 94 -11.430 -21.465 0.215 1.00 0.00 C ATOM 1456 C GLU A 94 -10.946 -21.104 1.616 1.00 0.00 C ATOM 1457 O GLU A 94 -11.691 -20.532 2.412 1.00 0.00 O ATOM 1458 CB GLU A 94 -10.954 -20.412 -0.788 1.00 0.00 C ATOM 1459 CG GLU A 94 -10.693 -20.969 -2.178 1.00 0.00 C ATOM 1460 CD GLU A 94 -10.486 -19.880 -3.213 1.00 0.00 C ATOM 1461 OE1 GLU A 94 -10.990 -18.757 -3.001 1.00 0.00 O ATOM 1462 OE2 GLU A 94 -9.819 -20.151 -4.234 1.00 0.00 O ATOM 0 HA GLU A 94 -11.009 -22.433 -0.057 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -11.703 -19.623 -0.857 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -10.040 -19.952 -0.413 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -9.812 -21.610 -2.149 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -11.533 -21.595 -2.478 1.00 0.00 H new ATOM 1469 N GLU A 95 -9.695 -21.443 1.910 1.00 0.00 N ATOM 1470 CA GLU A 95 -9.113 -21.156 3.215 1.00 0.00 C ATOM 1471 C GLU A 95 -7.847 -20.316 3.074 1.00 0.00 C ATOM 1472 O GLU A 95 -6.856 -20.759 2.491 1.00 0.00 O ATOM 1473 CB GLU A 95 -8.794 -22.457 3.954 1.00 0.00 C ATOM 1474 CG GLU A 95 -8.319 -22.247 5.382 1.00 0.00 C ATOM 1475 CD GLU A 95 -8.028 -23.551 6.098 1.00 0.00 C ATOM 1476 OE1 GLU A 95 -6.969 -24.153 5.826 1.00 0.00 O ATOM 1477 OE2 GLU A 95 -8.860 -23.969 6.931 1.00 0.00 O ATOM 0 H GLU A 95 -9.065 -21.917 1.262 1.00 0.00 H new ATOM 0 HA GLU A 95 -9.843 -20.588 3.792 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -9.684 -23.086 3.965 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -8.027 -23.000 3.401 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -7.419 -21.632 5.375 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -9.078 -21.694 5.936 1.00 0.00 H new ATOM 1484 N HIS A 96 -7.887 -19.100 3.610 1.00 0.00 N ATOM 1485 CA HIS A 96 -6.743 -18.197 3.544 1.00 0.00 C ATOM 1486 C HIS A 96 -5.883 -18.317 4.798 1.00 0.00 C ATOM 1487 O HIS A 96 -6.383 -18.201 5.918 1.00 0.00 O ATOM 1488 CB HIS A 96 -7.216 -16.753 3.371 1.00 0.00 C ATOM 1489 CG HIS A 96 -8.085 -16.547 2.169 1.00 0.00 C ATOM 1490 ND1 HIS A 96 -9.006 -17.354 1.593 1.00 0.00 N flip ATOM 1491 CD2 HIS A 96 -8.059 -15.395 1.411 1.00 0.00 C flip ATOM 1492 CE1 HIS A 96 -9.516 -16.682 0.509 1.00 0.00 C flip ATOM 1493 NE2 HIS A 96 -8.928 -15.503 0.421 1.00 0.00 N flip ATOM 0 H HIS A 96 -8.699 -18.717 4.095 1.00 0.00 H new ATOM 0 HA HIS A 96 -6.138 -18.479 2.682 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -7.765 -16.450 4.262 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -6.346 -16.101 3.296 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -7.428 -14.539 1.597 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -10.275 -17.057 -0.162 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -9.113 -14.796 -0.290 1.00 0.00 H new ATOM 1502 N CYS A 97 -4.590 -18.549 4.603 1.00 0.00 N ATOM 1503 CA CYS A 97 -3.661 -18.686 5.719 1.00 0.00 C ATOM 1504 C CYS A 97 -2.420 -17.826 5.502 1.00 0.00 C ATOM 1505 O CYS A 97 -1.721 -17.945 4.496 1.00 0.00 O ATOM 1506 CB CYS A 97 -3.257 -20.150 5.896 1.00 0.00 C ATOM 1507 SG CYS A 97 -2.367 -20.490 7.434 1.00 0.00 S ATOM 0 H CYS A 97 -4.161 -18.646 3.683 1.00 0.00 H new ATOM 0 HA CYS A 97 -4.164 -18.344 6.623 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -4.153 -20.770 5.863 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -2.632 -20.448 5.054 1.00 0.00 H new ATOM 0 HG CYS A 97 -2.070 -21.754 7.493 1.00 0.00 H new ATOM 1513 N PRO A 98 -2.140 -16.937 6.467 1.00 0.00 N ATOM 1514 CA PRO A 98 -0.983 -16.039 6.403 1.00 0.00 C ATOM 1515 C PRO A 98 0.338 -16.782 6.569 1.00 0.00 C ATOM 1516 O PRO A 98 0.412 -17.788 7.275 1.00 0.00 O ATOM 1517 CB PRO A 98 -1.211 -15.084 7.578 1.00 0.00 C ATOM 1518 CG PRO A 98 -2.054 -15.855 8.535 1.00 0.00 C ATOM 1519 CD PRO A 98 -2.930 -16.741 7.693 1.00 0.00 C ATOM 0 HA PRO A 98 -0.908 -15.539 5.437 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -0.267 -14.785 8.034 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -1.712 -14.172 7.255 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -1.436 -16.446 9.211 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -2.654 -15.187 9.153 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -3.141 -17.688 8.191 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -3.891 -16.272 7.481 1.00 0.00 H new ATOM 1527 N LEU A 99 1.379 -16.280 5.914 1.00 0.00 N ATOM 1528 CA LEU A 99 2.699 -16.897 5.989 1.00 0.00 C ATOM 1529 C LEU A 99 3.737 -15.900 6.494 1.00 0.00 C ATOM 1530 O LEU A 99 4.518 -16.206 7.395 1.00 0.00 O ATOM 1531 CB LEU A 99 3.113 -17.430 4.616 1.00 0.00 C ATOM 1532 CG LEU A 99 2.064 -18.258 3.873 1.00 0.00 C ATOM 1533 CD1 LEU A 99 2.547 -18.598 2.471 1.00 0.00 C ATOM 1534 CD2 LEU A 99 1.739 -19.526 4.649 1.00 0.00 C ATOM 0 H LEU A 99 1.335 -15.448 5.325 1.00 0.00 H new ATOM 0 HA LEU A 99 2.646 -17.727 6.693 1.00 0.00 H new ATOM 0 HB2 LEU A 99 3.390 -16.583 3.988 1.00 0.00 H new ATOM 0 HB3 LEU A 99 4.007 -18.040 4.740 1.00 0.00 H new ATOM 0 HG LEU A 99 1.154 -17.664 3.787 1.00 0.00 H new ATOM 0 HD11 LEU A 99 1.787 -19.187 1.957 1.00 0.00 H new ATOM 0 HD12 LEU A 99 2.729 -17.678 1.916 1.00 0.00 H new ATOM 0 HD13 LEU A 99 3.471 -19.173 2.534 1.00 0.00 H new ATOM 0 HD21 LEU A 99 0.991 -20.103 4.106 1.00 0.00 H new ATOM 0 HD22 LEU A 99 2.643 -20.123 4.766 1.00 0.00 H new ATOM 0 HD23 LEU A 99 1.350 -19.261 5.632 1.00 0.00 H new ATOM 1546 N ALA A 100 3.739 -14.707 5.910 1.00 0.00 N ATOM 1547 CA ALA A 100 4.678 -13.664 6.304 1.00 0.00 C ATOM 1548 C ALA A 100 4.038 -12.284 6.207 1.00 0.00 C ATOM 1549 O ALA A 100 3.006 -12.112 5.558 1.00 0.00 O ATOM 1550 CB ALA A 100 5.930 -13.729 5.443 1.00 0.00 C ATOM 0 H ALA A 100 3.100 -14.438 5.162 1.00 0.00 H new ATOM 0 HA ALA A 100 4.956 -13.834 7.344 1.00 0.00 H new ATOM 0 HB1 ALA A 100 6.623 -12.945 5.748 1.00 0.00 H new ATOM 0 HB2 ALA A 100 6.406 -14.702 5.566 1.00 0.00 H new ATOM 0 HB3 ALA A 100 5.660 -13.588 4.397 1.00 0.00 H new ATOM 1556 N TRP A 101 4.655 -11.303 6.856 1.00 0.00 N ATOM 1557 CA TRP A 101 4.145 -9.937 6.843 1.00 0.00 C ATOM 1558 C TRP A 101 5.287 -8.929 6.789 1.00 0.00 C ATOM 1559 O TRP A 101 6.304 -9.093 7.462 1.00 0.00 O ATOM 1560 CB TRP A 101 3.281 -9.682 8.079 1.00 0.00 C ATOM 1561 CG TRP A 101 4.003 -9.928 9.369 1.00 0.00 C ATOM 1562 CD1 TRP A 101 4.146 -11.123 10.013 1.00 0.00 C ATOM 1563 CD2 TRP A 101 4.678 -8.953 10.172 1.00 0.00 C ATOM 1564 NE1 TRP A 101 4.870 -10.950 11.169 1.00 0.00 N ATOM 1565 CE2 TRP A 101 5.209 -9.629 11.288 1.00 0.00 C ATOM 1566 CE3 TRP A 101 4.888 -7.576 10.055 1.00 0.00 C ATOM 1567 CZ2 TRP A 101 5.933 -8.972 12.280 1.00 0.00 C ATOM 1568 CZ3 TRP A 101 5.607 -6.927 11.040 1.00 0.00 C ATOM 1569 CH2 TRP A 101 6.123 -7.624 12.140 1.00 0.00 C ATOM 0 H TRP A 101 5.510 -11.428 7.398 1.00 0.00 H new ATOM 0 HA TRP A 101 3.534 -9.813 5.949 1.00 0.00 H new ATOM 0 HB2 TRP A 101 2.927 -8.651 8.060 1.00 0.00 H new ATOM 0 HB3 TRP A 101 2.400 -10.322 8.036 1.00 0.00 H new ATOM 0 HD1 TRP A 101 3.749 -12.065 9.666 1.00 0.00 H new ATOM 0 HE1 TRP A 101 5.115 -11.687 11.831 1.00 0.00 H new ATOM 0 HE3 TRP A 101 4.495 -7.030 9.210 1.00 0.00 H new ATOM 0 HZ2 TRP A 101 6.330 -9.507 13.130 1.00 0.00 H new ATOM 0 HZ3 TRP A 101 5.774 -5.863 10.961 1.00 0.00 H new ATOM 0 HH2 TRP A 101 6.682 -7.087 12.892 1.00 0.00 H new ATOM 1580 N GLY A 102 5.113 -7.886 5.984 1.00 0.00 N ATOM 1581 CA GLY A 102 6.138 -6.866 5.858 1.00 0.00 C ATOM 1582 C GLY A 102 5.557 -5.474 5.716 1.00 0.00 C ATOM 1583 O GLY A 102 4.797 -5.202 4.788 1.00 0.00 O ATOM 0 H GLY A 102 4.280 -7.729 5.416 1.00 0.00 H new ATOM 0 HA2 GLY A 102 6.787 -6.898 6.733 1.00 0.00 H new ATOM 0 HA3 GLY A 102 6.761 -7.086 4.991 1.00 0.00 H new ATOM 1587 N ASN A 103 5.914 -4.589 6.642 1.00 0.00 N ATOM 1588 CA ASN A 103 5.420 -3.217 6.618 1.00 0.00 C ATOM 1589 C ASN A 103 6.476 -2.269 6.057 1.00 0.00 C ATOM 1590 O ASN A 103 7.635 -2.300 6.472 1.00 0.00 O ATOM 1591 CB ASN A 103 5.016 -2.773 8.025 1.00 0.00 C ATOM 1592 CG ASN A 103 3.932 -3.652 8.619 1.00 0.00 C ATOM 1593 OD1 ASN A 103 3.429 -4.564 7.964 1.00 0.00 O ATOM 1594 ND2 ASN A 103 3.567 -3.379 9.867 1.00 0.00 N ATOM 0 H ASN A 103 6.543 -4.798 7.417 1.00 0.00 H new ATOM 0 HA ASN A 103 4.545 -3.184 5.969 1.00 0.00 H new ATOM 0 HB2 ASN A 103 5.891 -2.791 8.674 1.00 0.00 H new ATOM 0 HB3 ASN A 103 4.666 -1.741 7.991 1.00 0.00 H new ATOM 0 HD21 ASN A 103 2.842 -3.936 10.320 1.00 0.00 H new ATOM 0 HD22 ASN A 103 4.012 -2.613 10.372 1.00 0.00 H new ATOM 1601 N ILE A 104 6.067 -1.427 5.114 1.00 0.00 N ATOM 1602 CA ILE A 104 6.977 -0.470 4.498 1.00 0.00 C ATOM 1603 C ILE A 104 6.447 0.954 4.628 1.00 0.00 C ATOM 1604 O ILE A 104 5.349 1.263 4.166 1.00 0.00 O ATOM 1605 CB ILE A 104 7.204 -0.787 3.008 1.00 0.00 C ATOM 1606 CG1 ILE A 104 7.707 -2.222 2.840 1.00 0.00 C ATOM 1607 CG2 ILE A 104 8.190 0.200 2.401 1.00 0.00 C ATOM 1608 CD1 ILE A 104 7.619 -2.731 1.419 1.00 0.00 C ATOM 0 H ILE A 104 5.111 -1.388 4.760 1.00 0.00 H new ATOM 0 HA ILE A 104 7.926 -0.552 5.027 1.00 0.00 H new ATOM 0 HB ILE A 104 6.254 -0.691 2.483 1.00 0.00 H new ATOM 0 HG12 ILE A 104 8.743 -2.276 3.173 1.00 0.00 H new ATOM 0 HG13 ILE A 104 7.129 -2.879 3.489 1.00 0.00 H new ATOM 0 HG21 ILE A 104 8.340 -0.037 1.348 1.00 0.00 H new ATOM 0 HG22 ILE A 104 7.795 1.212 2.493 1.00 0.00 H new ATOM 0 HG23 ILE A 104 9.142 0.133 2.927 1.00 0.00 H new ATOM 0 HD11 ILE A 104 7.993 -3.754 1.375 1.00 0.00 H new ATOM 0 HD12 ILE A 104 6.581 -2.709 1.088 1.00 0.00 H new ATOM 0 HD13 ILE A 104 8.220 -2.097 0.768 1.00 0.00 H new ATOM 1620 N ASN A 105 7.236 1.818 5.259 1.00 0.00 N ATOM 1621 CA ASN A 105 6.846 3.211 5.449 1.00 0.00 C ATOM 1622 C ASN A 105 6.783 3.945 4.113 1.00 0.00 C ATOM 1623 O ASN A 105 7.799 4.424 3.606 1.00 0.00 O ATOM 1624 CB ASN A 105 7.832 3.915 6.384 1.00 0.00 C ATOM 1625 CG ASN A 105 7.481 3.720 7.846 1.00 0.00 C ATOM 1626 OD1 ASN A 105 8.283 3.205 8.626 1.00 0.00 O ATOM 1627 ND2 ASN A 105 6.276 4.132 8.225 1.00 0.00 N ATOM 0 H ASN A 105 8.148 1.579 5.647 1.00 0.00 H new ATOM 0 HA ASN A 105 5.854 3.227 5.899 1.00 0.00 H new ATOM 0 HB2 ASN A 105 8.837 3.535 6.201 1.00 0.00 H new ATOM 0 HB3 ASN A 105 7.847 4.981 6.156 1.00 0.00 H new ATOM 0 HD21 ASN A 105 5.983 4.027 9.196 1.00 0.00 H new ATOM 0 HD22 ASN A 105 5.644 4.553 7.545 1.00 0.00 H new ATOM 1634 N LEU A 106 5.584 4.030 3.547 1.00 0.00 N ATOM 1635 CA LEU A 106 5.387 4.706 2.269 1.00 0.00 C ATOM 1636 C LEU A 106 6.319 5.908 2.140 1.00 0.00 C ATOM 1637 O LEU A 106 6.865 6.171 1.068 1.00 0.00 O ATOM 1638 CB LEU A 106 3.932 5.157 2.128 1.00 0.00 C ATOM 1639 CG LEU A 106 2.923 4.064 1.776 1.00 0.00 C ATOM 1640 CD1 LEU A 106 1.523 4.472 2.209 1.00 0.00 C ATOM 1641 CD2 LEU A 106 2.956 3.766 0.284 1.00 0.00 C ATOM 0 H LEU A 106 4.734 3.639 3.953 1.00 0.00 H new ATOM 0 HA LEU A 106 5.621 4.000 1.472 1.00 0.00 H new ATOM 0 HB2 LEU A 106 3.624 5.620 3.065 1.00 0.00 H new ATOM 0 HB3 LEU A 106 3.884 5.929 1.360 1.00 0.00 H new ATOM 0 HG LEU A 106 3.198 3.156 2.313 1.00 0.00 H new ATOM 0 HD11 LEU A 106 0.818 3.682 1.951 1.00 0.00 H new ATOM 0 HD12 LEU A 106 1.508 4.633 3.287 1.00 0.00 H new ATOM 0 HD13 LEU A 106 1.239 5.393 1.700 1.00 0.00 H new ATOM 0 HD21 LEU A 106 2.231 2.986 0.053 1.00 0.00 H new ATOM 0 HD22 LEU A 106 2.707 4.669 -0.273 1.00 0.00 H new ATOM 0 HD23 LEU A 106 3.954 3.430 0.002 1.00 0.00 H new ATOM 1653 N PHE A 107 6.497 6.632 3.240 1.00 0.00 N ATOM 1654 CA PHE A 107 7.364 7.805 3.250 1.00 0.00 C ATOM 1655 C PHE A 107 8.705 7.485 3.904 1.00 0.00 C ATOM 1656 O PHE A 107 8.772 7.197 5.099 1.00 0.00 O ATOM 1657 CB PHE A 107 6.686 8.960 3.990 1.00 0.00 C ATOM 1658 CG PHE A 107 5.381 9.382 3.375 1.00 0.00 C ATOM 1659 CD1 PHE A 107 5.352 10.002 2.136 1.00 0.00 C ATOM 1660 CD2 PHE A 107 4.185 9.159 4.037 1.00 0.00 C ATOM 1661 CE1 PHE A 107 4.154 10.391 1.568 1.00 0.00 C ATOM 1662 CE2 PHE A 107 2.983 9.546 3.474 1.00 0.00 C ATOM 1663 CZ PHE A 107 2.968 10.163 2.239 1.00 0.00 C ATOM 0 H PHE A 107 6.053 6.428 4.135 1.00 0.00 H new ATOM 0 HA PHE A 107 7.545 8.101 2.217 1.00 0.00 H new ATOM 0 HB2 PHE A 107 6.512 8.666 5.025 1.00 0.00 H new ATOM 0 HB3 PHE A 107 7.362 9.815 4.011 1.00 0.00 H new ATOM 0 HD1 PHE A 107 6.277 10.183 1.608 1.00 0.00 H new ATOM 0 HD2 PHE A 107 4.191 8.677 5.004 1.00 0.00 H new ATOM 0 HE1 PHE A 107 4.145 10.872 0.601 1.00 0.00 H new ATOM 0 HE2 PHE A 107 2.057 9.366 4.000 1.00 0.00 H new ATOM 0 HZ PHE A 107 2.030 10.467 1.798 1.00 0.00 H new ATOM 1673 N ASP A 108 9.770 7.538 3.112 1.00 0.00 N ATOM 1674 CA ASP A 108 11.110 7.254 3.612 1.00 0.00 C ATOM 1675 C ASP A 108 11.466 8.182 4.769 1.00 0.00 C ATOM 1676 O ASP A 108 10.715 9.104 5.092 1.00 0.00 O ATOM 1677 CB ASP A 108 12.138 7.400 2.490 1.00 0.00 C ATOM 1678 CG ASP A 108 12.366 6.102 1.741 1.00 0.00 C ATOM 1679 OD1 ASP A 108 11.886 5.051 2.214 1.00 0.00 O ATOM 1680 OD2 ASP A 108 13.025 6.137 0.681 1.00 0.00 O ATOM 0 H ASP A 108 9.731 7.775 2.121 1.00 0.00 H new ATOM 0 HA ASP A 108 11.125 6.227 3.976 1.00 0.00 H new ATOM 0 HB2 ASP A 108 11.802 8.165 1.791 1.00 0.00 H new ATOM 0 HB3 ASP A 108 13.083 7.745 2.910 1.00 0.00 H new ATOM 1685 N TYR A 109 12.613 7.933 5.389 1.00 0.00 N ATOM 1686 CA TYR A 109 13.067 8.745 6.513 1.00 0.00 C ATOM 1687 C TYR A 109 13.190 10.211 6.111 1.00 0.00 C ATOM 1688 O TYR A 109 13.288 11.096 6.962 1.00 0.00 O ATOM 1689 CB TYR A 109 14.412 8.231 7.029 1.00 0.00 C ATOM 1690 CG TYR A 109 15.590 8.662 6.184 1.00 0.00 C ATOM 1691 CD1 TYR A 109 15.628 8.390 4.822 1.00 0.00 C ATOM 1692 CD2 TYR A 109 16.664 9.338 6.747 1.00 0.00 C ATOM 1693 CE1 TYR A 109 16.702 8.781 4.045 1.00 0.00 C ATOM 1694 CE2 TYR A 109 17.742 9.734 5.979 1.00 0.00 C ATOM 1695 CZ TYR A 109 17.756 9.452 4.628 1.00 0.00 C ATOM 1696 OH TYR A 109 18.828 9.843 3.859 1.00 0.00 O ATOM 0 H TYR A 109 13.246 7.175 5.133 1.00 0.00 H new ATOM 0 HA TYR A 109 12.326 8.667 7.309 1.00 0.00 H new ATOM 0 HB2 TYR A 109 14.559 8.584 8.050 1.00 0.00 H new ATOM 0 HB3 TYR A 109 14.384 7.142 7.070 1.00 0.00 H new ATOM 0 HD1 TYR A 109 14.804 7.864 4.363 1.00 0.00 H new ATOM 0 HD2 TYR A 109 16.657 9.558 7.804 1.00 0.00 H new ATOM 0 HE1 TYR A 109 16.716 8.562 2.987 1.00 0.00 H new ATOM 0 HE2 TYR A 109 18.568 10.261 6.433 1.00 0.00 H new ATOM 0 HH TYR A 109 19.484 10.305 4.422 1.00 0.00 H new ATOM 1706 N THR A 110 13.184 10.463 4.805 1.00 0.00 N ATOM 1707 CA THR A 110 13.295 11.821 4.288 1.00 0.00 C ATOM 1708 C THR A 110 11.943 12.341 3.814 1.00 0.00 C ATOM 1709 O THR A 110 11.872 13.211 2.945 1.00 0.00 O ATOM 1710 CB THR A 110 14.300 11.898 3.123 1.00 0.00 C ATOM 1711 OG1 THR A 110 13.992 10.899 2.144 1.00 0.00 O ATOM 1712 CG2 THR A 110 15.723 11.705 3.622 1.00 0.00 C ATOM 0 H THR A 110 13.103 9.744 4.086 1.00 0.00 H new ATOM 0 HA THR A 110 13.653 12.443 5.108 1.00 0.00 H new ATOM 0 HB THR A 110 14.222 12.886 2.670 1.00 0.00 H new ATOM 0 HG1 THR A 110 14.634 10.955 1.406 1.00 0.00 H new ATOM 0 HG21 THR A 110 16.414 11.763 2.781 1.00 0.00 H new ATOM 0 HG22 THR A 110 15.964 12.484 4.345 1.00 0.00 H new ATOM 0 HG23 THR A 110 15.812 10.729 4.098 1.00 0.00 H new ATOM 1720 N ASP A 111 10.873 11.805 4.389 1.00 0.00 N ATOM 1721 CA ASP A 111 9.522 12.216 4.026 1.00 0.00 C ATOM 1722 C ASP A 111 9.365 12.289 2.511 1.00 0.00 C ATOM 1723 O ASP A 111 8.659 13.153 1.989 1.00 0.00 O ATOM 1724 CB ASP A 111 9.194 13.573 4.651 1.00 0.00 C ATOM 1725 CG ASP A 111 9.145 13.517 6.165 1.00 0.00 C ATOM 1726 OD1 ASP A 111 8.158 12.977 6.706 1.00 0.00 O ATOM 1727 OD2 ASP A 111 10.093 14.014 6.809 1.00 0.00 O ATOM 0 H ASP A 111 10.915 11.084 5.109 1.00 0.00 H new ATOM 0 HA ASP A 111 8.826 11.470 4.410 1.00 0.00 H new ATOM 0 HB2 ASP A 111 9.942 14.303 4.341 1.00 0.00 H new ATOM 0 HB3 ASP A 111 8.233 13.921 4.272 1.00 0.00 H new ATOM 1732 N THR A 112 10.029 11.377 1.807 1.00 0.00 N ATOM 1733 CA THR A 112 9.965 11.339 0.352 1.00 0.00 C ATOM 1734 C THR A 112 9.541 9.961 -0.144 1.00 0.00 C ATOM 1735 O THR A 112 10.301 8.996 -0.054 1.00 0.00 O ATOM 1736 CB THR A 112 11.322 11.703 -0.280 1.00 0.00 C ATOM 1737 OG1 THR A 112 11.710 13.023 0.120 1.00 0.00 O ATOM 1738 CG2 THR A 112 11.250 11.628 -1.797 1.00 0.00 C ATOM 0 H THR A 112 10.617 10.655 2.222 1.00 0.00 H new ATOM 0 HA THR A 112 9.222 12.076 0.049 1.00 0.00 H new ATOM 0 HB THR A 112 12.065 10.985 0.068 1.00 0.00 H new ATOM 0 HG1 THR A 112 11.790 13.059 1.096 1.00 0.00 H new ATOM 0 HG21 THR A 112 12.220 11.889 -2.221 1.00 0.00 H new ATOM 0 HG22 THR A 112 10.983 10.615 -2.099 1.00 0.00 H new ATOM 0 HG23 THR A 112 10.496 12.326 -2.160 1.00 0.00 H new ATOM 1746 N LEU A 113 8.323 9.876 -0.668 1.00 0.00 N ATOM 1747 CA LEU A 113 7.797 8.615 -1.180 1.00 0.00 C ATOM 1748 C LEU A 113 8.907 7.775 -1.804 1.00 0.00 C ATOM 1749 O LEU A 113 9.784 8.299 -2.491 1.00 0.00 O ATOM 1750 CB LEU A 113 6.699 8.879 -2.212 1.00 0.00 C ATOM 1751 CG LEU A 113 5.323 9.240 -1.651 1.00 0.00 C ATOM 1752 CD1 LEU A 113 4.426 9.788 -2.750 1.00 0.00 C ATOM 1753 CD2 LEU A 113 4.682 8.028 -0.992 1.00 0.00 C ATOM 0 H LEU A 113 7.681 10.665 -0.750 1.00 0.00 H new ATOM 0 HA LEU A 113 7.374 8.060 -0.343 1.00 0.00 H new ATOM 0 HB2 LEU A 113 7.028 9.689 -2.863 1.00 0.00 H new ATOM 0 HB3 LEU A 113 6.593 7.991 -2.836 1.00 0.00 H new ATOM 0 HG LEU A 113 5.451 10.015 -0.895 1.00 0.00 H new ATOM 0 HD11 LEU A 113 3.451 10.039 -2.332 1.00 0.00 H new ATOM 0 HD12 LEU A 113 4.879 10.682 -3.177 1.00 0.00 H new ATOM 0 HD13 LEU A 113 4.304 9.035 -3.529 1.00 0.00 H new ATOM 0 HD21 LEU A 113 3.703 8.303 -0.598 1.00 0.00 H new ATOM 0 HD22 LEU A 113 4.567 7.232 -1.728 1.00 0.00 H new ATOM 0 HD23 LEU A 113 5.316 7.679 -0.177 1.00 0.00 H new ATOM 1765 N VAL A 114 8.861 6.469 -1.563 1.00 0.00 N ATOM 1766 CA VAL A 114 9.860 5.555 -2.104 1.00 0.00 C ATOM 1767 C VAL A 114 9.667 5.355 -3.603 1.00 0.00 C ATOM 1768 O VAL A 114 8.633 5.722 -4.161 1.00 0.00 O ATOM 1769 CB VAL A 114 9.806 4.185 -1.403 1.00 0.00 C ATOM 1770 CG1 VAL A 114 10.253 4.308 0.046 1.00 0.00 C ATOM 1771 CG2 VAL A 114 8.405 3.598 -1.489 1.00 0.00 C ATOM 0 H VAL A 114 8.142 6.020 -0.996 1.00 0.00 H new ATOM 0 HA VAL A 114 10.835 6.008 -1.923 1.00 0.00 H new ATOM 0 HB VAL A 114 10.491 3.508 -1.913 1.00 0.00 H new ATOM 0 HG11 VAL A 114 10.208 3.330 0.525 1.00 0.00 H new ATOM 0 HG12 VAL A 114 11.276 4.682 0.081 1.00 0.00 H new ATOM 0 HG13 VAL A 114 9.595 5.000 0.572 1.00 0.00 H new ATOM 0 HG21 VAL A 114 8.385 2.630 -0.989 1.00 0.00 H new ATOM 0 HG22 VAL A 114 7.698 4.272 -1.005 1.00 0.00 H new ATOM 0 HG23 VAL A 114 8.127 3.471 -2.535 1.00 0.00 H new ATOM 1781 N SER A 115 10.670 4.770 -4.250 1.00 0.00 N ATOM 1782 CA SER A 115 10.613 4.524 -5.686 1.00 0.00 C ATOM 1783 C SER A 115 11.628 3.461 -6.096 1.00 0.00 C ATOM 1784 O SER A 115 12.457 3.037 -5.293 1.00 0.00 O ATOM 1785 CB SER A 115 10.874 5.819 -6.458 1.00 0.00 C ATOM 1786 OG SER A 115 9.666 6.516 -6.707 1.00 0.00 O ATOM 0 H SER A 115 11.532 4.458 -3.802 1.00 0.00 H new ATOM 0 HA SER A 115 9.614 4.160 -5.928 1.00 0.00 H new ATOM 0 HB2 SER A 115 11.554 6.454 -5.890 1.00 0.00 H new ATOM 0 HB3 SER A 115 11.367 5.590 -7.403 1.00 0.00 H new ATOM 0 HG SER A 115 9.132 6.548 -5.886 1.00 0.00 H new ATOM 1792 N GLY A 116 11.554 3.035 -7.353 1.00 0.00 N ATOM 1793 CA GLY A 116 12.471 2.025 -7.849 1.00 0.00 C ATOM 1794 C GLY A 116 12.218 0.662 -7.237 1.00 0.00 C ATOM 1795 O GLY A 116 11.593 0.552 -6.182 1.00 0.00 O ATOM 0 H GLY A 116 10.876 3.371 -8.037 1.00 0.00 H new ATOM 0 HA2 GLY A 116 12.379 1.956 -8.933 1.00 0.00 H new ATOM 0 HA3 GLY A 116 13.495 2.332 -7.635 1.00 0.00 H new ATOM 1799 N LYS A 117 12.704 -0.382 -7.899 1.00 0.00 N ATOM 1800 CA LYS A 117 12.528 -1.746 -7.415 1.00 0.00 C ATOM 1801 C LYS A 117 13.245 -1.948 -6.084 1.00 0.00 C ATOM 1802 O LYS A 117 14.325 -1.401 -5.861 1.00 0.00 O ATOM 1803 CB LYS A 117 13.054 -2.747 -8.446 1.00 0.00 C ATOM 1804 CG LYS A 117 12.382 -4.107 -8.372 1.00 0.00 C ATOM 1805 CD LYS A 117 13.026 -5.101 -9.325 1.00 0.00 C ATOM 1806 CE LYS A 117 14.232 -5.778 -8.692 1.00 0.00 C ATOM 1807 NZ LYS A 117 15.482 -4.997 -8.906 1.00 0.00 N ATOM 0 H LYS A 117 13.224 -0.309 -8.774 1.00 0.00 H new ATOM 0 HA LYS A 117 11.462 -1.916 -7.263 1.00 0.00 H new ATOM 0 HB2 LYS A 117 12.912 -2.335 -9.445 1.00 0.00 H new ATOM 0 HB3 LYS A 117 14.127 -2.873 -8.303 1.00 0.00 H new ATOM 0 HG2 LYS A 117 12.442 -4.488 -7.353 1.00 0.00 H new ATOM 0 HG3 LYS A 117 11.324 -4.004 -8.613 1.00 0.00 H new ATOM 0 HD2 LYS A 117 12.294 -5.855 -9.615 1.00 0.00 H new ATOM 0 HD3 LYS A 117 13.332 -4.587 -10.236 1.00 0.00 H new ATOM 0 HE2 LYS A 117 14.060 -5.902 -7.623 1.00 0.00 H new ATOM 0 HE3 LYS A 117 14.351 -6.776 -9.113 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 16.277 -5.650 -9.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 15.370 -4.383 -9.738 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 15.674 -4.412 -8.068 1.00 0.00 H new ATOM 1821 N MET A 118 12.638 -2.737 -5.204 1.00 0.00 N ATOM 1822 CA MET A 118 13.220 -3.012 -3.895 1.00 0.00 C ATOM 1823 C MET A 118 12.753 -4.364 -3.366 1.00 0.00 C ATOM 1824 O MET A 118 11.640 -4.803 -3.654 1.00 0.00 O ATOM 1825 CB MET A 118 12.848 -1.907 -2.905 1.00 0.00 C ATOM 1826 CG MET A 118 13.248 -2.216 -1.471 1.00 0.00 C ATOM 1827 SD MET A 118 13.351 -0.737 -0.445 1.00 0.00 S ATOM 1828 CE MET A 118 11.655 -0.165 -0.505 1.00 0.00 C ATOM 0 H MET A 118 11.744 -3.197 -5.373 1.00 0.00 H new ATOM 0 HA MET A 118 14.304 -3.040 -4.006 1.00 0.00 H new ATOM 0 HB2 MET A 118 13.326 -0.977 -3.214 1.00 0.00 H new ATOM 0 HB3 MET A 118 11.771 -1.741 -2.946 1.00 0.00 H new ATOM 0 HG2 MET A 118 12.524 -2.905 -1.036 1.00 0.00 H new ATOM 0 HG3 MET A 118 14.213 -2.723 -1.468 1.00 0.00 H new ATOM 0 HE1 MET A 118 11.524 0.660 0.195 1.00 0.00 H new ATOM 0 HE2 MET A 118 11.421 0.174 -1.514 1.00 0.00 H new ATOM 0 HE3 MET A 118 10.986 -0.981 -0.232 1.00 0.00 H new ATOM 1838 N ALA A 119 13.611 -5.020 -2.591 1.00 0.00 N ATOM 1839 CA ALA A 119 13.285 -6.321 -2.021 1.00 0.00 C ATOM 1840 C ALA A 119 13.782 -6.430 -0.583 1.00 0.00 C ATOM 1841 O ALA A 119 14.976 -6.291 -0.316 1.00 0.00 O ATOM 1842 CB ALA A 119 13.878 -7.434 -2.872 1.00 0.00 C ATOM 0 H ALA A 119 14.537 -4.671 -2.344 1.00 0.00 H new ATOM 0 HA ALA A 119 12.200 -6.425 -2.012 1.00 0.00 H new ATOM 0 HB1 ALA A 119 13.627 -8.400 -2.434 1.00 0.00 H new ATOM 0 HB2 ALA A 119 13.471 -7.376 -3.882 1.00 0.00 H new ATOM 0 HB3 ALA A 119 14.962 -7.324 -2.911 1.00 0.00 H new ATOM 1848 N LEU A 120 12.859 -6.679 0.339 1.00 0.00 N ATOM 1849 CA LEU A 120 13.203 -6.807 1.751 1.00 0.00 C ATOM 1850 C LEU A 120 12.630 -8.093 2.338 1.00 0.00 C ATOM 1851 O LEU A 120 11.646 -8.632 1.833 1.00 0.00 O ATOM 1852 CB LEU A 120 12.684 -5.600 2.534 1.00 0.00 C ATOM 1853 CG LEU A 120 11.252 -5.163 2.221 1.00 0.00 C ATOM 1854 CD1 LEU A 120 10.264 -5.889 3.121 1.00 0.00 C ATOM 1855 CD2 LEU A 120 11.109 -3.656 2.376 1.00 0.00 C ATOM 0 H LEU A 120 11.867 -6.796 0.135 1.00 0.00 H new ATOM 0 HA LEU A 120 14.289 -6.846 1.832 1.00 0.00 H new ATOM 0 HB2 LEU A 120 12.749 -5.827 3.598 1.00 0.00 H new ATOM 0 HB3 LEU A 120 13.349 -4.757 2.347 1.00 0.00 H new ATOM 0 HG LEU A 120 11.030 -5.425 1.186 1.00 0.00 H new ATOM 0 HD11 LEU A 120 9.250 -5.566 2.884 1.00 0.00 H new ATOM 0 HD12 LEU A 120 10.348 -6.964 2.961 1.00 0.00 H new ATOM 0 HD13 LEU A 120 10.484 -5.659 4.163 1.00 0.00 H new ATOM 0 HD21 LEU A 120 10.084 -3.363 2.149 1.00 0.00 H new ATOM 0 HD22 LEU A 120 11.350 -3.371 3.400 1.00 0.00 H new ATOM 0 HD23 LEU A 120 11.790 -3.153 1.690 1.00 0.00 H new ATOM 1867 N ASN A 121 13.251 -8.577 3.408 1.00 0.00 N ATOM 1868 CA ASN A 121 12.802 -9.799 4.065 1.00 0.00 C ATOM 1869 C ASN A 121 11.554 -9.539 4.903 1.00 0.00 C ATOM 1870 O ASN A 121 11.332 -8.424 5.376 1.00 0.00 O ATOM 1871 CB ASN A 121 13.914 -10.367 4.949 1.00 0.00 C ATOM 1872 CG ASN A 121 15.080 -10.901 4.140 1.00 0.00 C ATOM 1873 OD1 ASN A 121 16.112 -10.243 4.009 1.00 0.00 O ATOM 1874 ND2 ASN A 121 14.920 -12.100 3.592 1.00 0.00 N ATOM 0 H ASN A 121 14.067 -8.142 3.839 1.00 0.00 H new ATOM 0 HA ASN A 121 12.555 -10.527 3.292 1.00 0.00 H new ATOM 0 HB2 ASN A 121 14.270 -9.589 5.625 1.00 0.00 H new ATOM 0 HB3 ASN A 121 13.509 -11.167 5.569 1.00 0.00 H new ATOM 0 HD21 ASN A 121 15.670 -12.511 3.036 1.00 0.00 H new ATOM 0 HD22 ASN A 121 14.047 -12.610 3.727 1.00 0.00 H new ATOM 1881 N LEU A 122 10.742 -10.575 5.082 1.00 0.00 N ATOM 1882 CA LEU A 122 9.515 -10.460 5.864 1.00 0.00 C ATOM 1883 C LEU A 122 9.649 -11.188 7.197 1.00 0.00 C ATOM 1884 O LEU A 122 10.469 -12.095 7.341 1.00 0.00 O ATOM 1885 CB LEU A 122 8.331 -11.024 5.078 1.00 0.00 C ATOM 1886 CG LEU A 122 8.339 -10.761 3.571 1.00 0.00 C ATOM 1887 CD1 LEU A 122 7.539 -11.827 2.839 1.00 0.00 C ATOM 1888 CD2 LEU A 122 7.787 -9.376 3.269 1.00 0.00 C ATOM 0 H LEU A 122 10.911 -11.504 4.697 1.00 0.00 H new ATOM 0 HA LEU A 122 9.339 -9.403 6.065 1.00 0.00 H new ATOM 0 HB2 LEU A 122 8.294 -12.102 5.238 1.00 0.00 H new ATOM 0 HB3 LEU A 122 7.413 -10.608 5.494 1.00 0.00 H new ATOM 0 HG LEU A 122 9.370 -10.804 3.219 1.00 0.00 H new ATOM 0 HD11 LEU A 122 7.556 -11.623 1.768 1.00 0.00 H new ATOM 0 HD12 LEU A 122 7.978 -12.806 3.029 1.00 0.00 H new ATOM 0 HD13 LEU A 122 6.509 -11.816 3.194 1.00 0.00 H new ATOM 0 HD21 LEU A 122 7.800 -9.206 2.192 1.00 0.00 H new ATOM 0 HD22 LEU A 122 6.763 -9.305 3.635 1.00 0.00 H new ATOM 0 HD23 LEU A 122 8.402 -8.624 3.763 1.00 0.00 H new ATOM 1900 N TRP A 123 8.837 -10.787 8.169 1.00 0.00 N ATOM 1901 CA TRP A 123 8.863 -11.404 9.490 1.00 0.00 C ATOM 1902 C TRP A 123 7.889 -12.575 9.564 1.00 0.00 C ATOM 1903 O TRP A 123 6.880 -12.619 8.860 1.00 0.00 O ATOM 1904 CB TRP A 123 8.520 -10.371 10.564 1.00 0.00 C ATOM 1905 CG TRP A 123 9.302 -9.099 10.437 1.00 0.00 C ATOM 1906 CD1 TRP A 123 9.157 -8.140 9.475 1.00 0.00 C ATOM 1907 CD2 TRP A 123 10.353 -8.649 11.299 1.00 0.00 C ATOM 1908 NE1 TRP A 123 10.054 -7.121 9.688 1.00 0.00 N ATOM 1909 CE2 TRP A 123 10.798 -7.409 10.801 1.00 0.00 C ATOM 1910 CE3 TRP A 123 10.959 -9.171 12.445 1.00 0.00 C ATOM 1911 CZ2 TRP A 123 11.822 -6.687 11.409 1.00 0.00 C ATOM 1912 CZ3 TRP A 123 11.975 -8.454 13.047 1.00 0.00 C ATOM 1913 CH2 TRP A 123 12.398 -7.222 12.529 1.00 0.00 C ATOM 0 H TRP A 123 8.153 -10.037 8.067 1.00 0.00 H new ATOM 0 HA TRP A 123 9.870 -11.782 9.667 1.00 0.00 H new ATOM 0 HB2 TRP A 123 7.456 -10.142 10.510 1.00 0.00 H new ATOM 0 HB3 TRP A 123 8.703 -10.805 11.547 1.00 0.00 H new ATOM 0 HD1 TRP A 123 8.442 -8.177 8.666 1.00 0.00 H new ATOM 0 HE1 TRP A 123 10.150 -6.286 9.111 1.00 0.00 H new ATOM 0 HE3 TRP A 123 10.639 -10.118 12.853 1.00 0.00 H new ATOM 0 HZ2 TRP A 123 12.150 -5.738 11.011 1.00 0.00 H new ATOM 0 HZ3 TRP A 123 12.452 -8.849 13.932 1.00 0.00 H new ATOM 0 HH2 TRP A 123 13.194 -6.685 13.023 1.00 0.00 H new ATOM 1924 N PRO A 124 8.196 -13.547 10.435 1.00 0.00 N ATOM 1925 CA PRO A 124 7.359 -14.736 10.621 1.00 0.00 C ATOM 1926 C PRO A 124 6.033 -14.411 11.300 1.00 0.00 C ATOM 1927 O PRO A 124 5.938 -13.462 12.079 1.00 0.00 O ATOM 1928 CB PRO A 124 8.213 -15.634 11.520 1.00 0.00 C ATOM 1929 CG PRO A 124 9.107 -14.695 12.254 1.00 0.00 C ATOM 1930 CD PRO A 124 9.383 -13.560 11.307 1.00 0.00 C ATOM 0 HA PRO A 124 7.087 -15.195 9.671 1.00 0.00 H new ATOM 0 HB2 PRO A 124 7.593 -16.210 12.208 1.00 0.00 H new ATOM 0 HB3 PRO A 124 8.788 -16.350 10.933 1.00 0.00 H new ATOM 0 HG2 PRO A 124 8.631 -14.335 13.166 1.00 0.00 H new ATOM 0 HG3 PRO A 124 10.032 -15.189 12.551 1.00 0.00 H new ATOM 0 HD2 PRO A 124 9.503 -12.615 11.837 1.00 0.00 H new ATOM 0 HD3 PRO A 124 10.298 -13.725 10.738 1.00 0.00 H new ATOM 1938 N VAL A 125 5.010 -15.205 11.001 1.00 0.00 N ATOM 1939 CA VAL A 125 3.689 -15.002 11.584 1.00 0.00 C ATOM 1940 C VAL A 125 3.652 -15.465 13.036 1.00 0.00 C ATOM 1941 O VAL A 125 3.832 -16.644 13.342 1.00 0.00 O ATOM 1942 CB VAL A 125 2.603 -15.753 10.789 1.00 0.00 C ATOM 1943 CG1 VAL A 125 1.251 -15.617 11.472 1.00 0.00 C ATOM 1944 CG2 VAL A 125 2.541 -15.241 9.358 1.00 0.00 C ATOM 0 H VAL A 125 5.071 -15.995 10.358 1.00 0.00 H new ATOM 0 HA VAL A 125 3.485 -13.932 11.542 1.00 0.00 H new ATOM 0 HB VAL A 125 2.864 -16.811 10.761 1.00 0.00 H new ATOM 0 HG11 VAL A 125 0.497 -16.154 10.896 1.00 0.00 H new ATOM 0 HG12 VAL A 125 1.307 -16.036 12.477 1.00 0.00 H new ATOM 0 HG13 VAL A 125 0.979 -14.563 11.533 1.00 0.00 H new ATOM 0 HG21 VAL A 125 1.769 -15.782 8.811 1.00 0.00 H new ATOM 0 HG22 VAL A 125 2.304 -14.177 9.362 1.00 0.00 H new ATOM 0 HG23 VAL A 125 3.505 -15.396 8.874 1.00 0.00 H new ATOM 2039 N LEU A 132 -4.676 -11.700 8.689 1.00 0.00 N ATOM 2040 CA LEU A 132 -3.829 -11.967 7.531 1.00 0.00 C ATOM 2041 C LEU A 132 -2.798 -10.858 7.344 1.00 0.00 C ATOM 2042 O LEU A 132 -1.617 -11.126 7.118 1.00 0.00 O ATOM 2043 CB LEU A 132 -4.683 -12.103 6.270 1.00 0.00 C ATOM 2044 CG LEU A 132 -5.815 -13.130 6.333 1.00 0.00 C ATOM 2045 CD1 LEU A 132 -6.722 -12.999 5.120 1.00 0.00 C ATOM 2046 CD2 LEU A 132 -5.251 -14.540 6.431 1.00 0.00 C ATOM 0 HA LEU A 132 -3.300 -12.904 7.706 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -5.115 -11.129 6.042 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -4.028 -12.364 5.438 1.00 0.00 H new ATOM 0 HG LEU A 132 -6.408 -12.935 7.227 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -7.521 -13.737 5.182 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -7.154 -11.998 5.095 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -6.142 -13.167 4.212 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -6.070 -15.257 6.475 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -4.634 -14.747 5.556 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -4.644 -14.627 7.332 1.00 0.00 H new ATOM 2058 N LEU A 133 -3.252 -9.613 7.441 1.00 0.00 N ATOM 2059 CA LEU A 133 -2.368 -8.463 7.284 1.00 0.00 C ATOM 2060 C LEU A 133 -2.050 -7.832 8.636 1.00 0.00 C ATOM 2061 O LEU A 133 -2.945 -7.593 9.446 1.00 0.00 O ATOM 2062 CB LEU A 133 -3.009 -7.424 6.362 1.00 0.00 C ATOM 2063 CG LEU A 133 -2.046 -6.487 5.634 1.00 0.00 C ATOM 2064 CD1 LEU A 133 -1.263 -7.246 4.573 1.00 0.00 C ATOM 2065 CD2 LEU A 133 -2.802 -5.323 5.010 1.00 0.00 C ATOM 0 H LEU A 133 -4.226 -9.374 7.627 1.00 0.00 H new ATOM 0 HA LEU A 133 -1.436 -8.811 6.838 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -3.607 -7.949 5.617 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -3.696 -6.818 6.953 1.00 0.00 H new ATOM 0 HG LEU A 133 -1.340 -6.087 6.362 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -0.582 -6.563 4.065 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -0.690 -8.044 5.045 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -1.955 -7.675 3.848 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -2.100 -4.667 4.496 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -3.532 -5.704 4.296 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -3.317 -4.763 5.791 1.00 0.00 H new ATOM 2077 N ASN A 134 -0.770 -7.565 8.872 1.00 0.00 N ATOM 2078 CA ASN A 134 -0.334 -6.960 10.125 1.00 0.00 C ATOM 2079 C ASN A 134 0.031 -5.492 9.923 1.00 0.00 C ATOM 2080 O ASN A 134 1.171 -5.148 9.609 1.00 0.00 O ATOM 2081 CB ASN A 134 0.865 -7.722 10.694 1.00 0.00 C ATOM 2082 CG ASN A 134 1.053 -7.480 12.179 1.00 0.00 C ATOM 2083 OD1 ASN A 134 0.331 -6.689 12.786 1.00 0.00 O ATOM 2084 ND2 ASN A 134 2.026 -8.163 12.771 1.00 0.00 N ATOM 0 H ASN A 134 -0.017 -7.758 8.212 1.00 0.00 H new ATOM 0 HA ASN A 134 -1.161 -7.016 10.833 1.00 0.00 H new ATOM 0 HB2 ASN A 134 0.731 -8.789 10.517 1.00 0.00 H new ATOM 0 HB3 ASN A 134 1.768 -7.422 10.163 1.00 0.00 H new ATOM 0 HD21 ASN A 134 2.200 -8.042 13.769 1.00 0.00 H new ATOM 0 HD22 ASN A 134 2.600 -8.808 12.228 1.00 0.00 H new ATOM 2091 N PRO A 135 -0.958 -4.605 10.109 1.00 0.00 N ATOM 2092 CA PRO A 135 -0.764 -3.161 9.954 1.00 0.00 C ATOM 2093 C PRO A 135 0.105 -2.570 11.058 1.00 0.00 C ATOM 2094 O PRO A 135 1.010 -1.779 10.792 1.00 0.00 O ATOM 2095 CB PRO A 135 -2.187 -2.602 10.036 1.00 0.00 C ATOM 2096 CG PRO A 135 -2.945 -3.611 10.827 1.00 0.00 C ATOM 2097 CD PRO A 135 -2.340 -4.945 10.485 1.00 0.00 C ATOM 0 HA PRO A 135 -0.247 -2.917 9.026 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -2.202 -1.626 10.521 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -2.619 -2.471 9.044 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -2.866 -3.409 11.895 1.00 0.00 H new ATOM 0 HG3 PRO A 135 -4.005 -3.587 10.576 1.00 0.00 H new ATOM 0 HD2 PRO A 135 -2.369 -5.629 11.333 1.00 0.00 H new ATOM 0 HD3 PRO A 135 -2.872 -5.430 9.666 1.00 0.00 H new ATOM 2105 N ILE A 136 -0.175 -2.959 12.297 1.00 0.00 N ATOM 2106 CA ILE A 136 0.583 -2.469 13.441 1.00 0.00 C ATOM 2107 C ILE A 136 1.962 -3.117 13.506 1.00 0.00 C ATOM 2108 O ILE A 136 2.893 -2.563 14.089 1.00 0.00 O ATOM 2109 CB ILE A 136 -0.159 -2.735 14.764 1.00 0.00 C ATOM 2110 CG1 ILE A 136 -1.629 -2.330 14.640 1.00 0.00 C ATOM 2111 CG2 ILE A 136 0.508 -1.984 15.907 1.00 0.00 C ATOM 2112 CD1 ILE A 136 -2.503 -2.880 15.745 1.00 0.00 C ATOM 0 H ILE A 136 -0.922 -3.612 12.534 1.00 0.00 H new ATOM 0 HA ILE A 136 0.696 -1.393 13.307 1.00 0.00 H new ATOM 0 HB ILE A 136 -0.112 -3.802 14.981 1.00 0.00 H new ATOM 0 HG12 ILE A 136 -1.699 -1.242 14.640 1.00 0.00 H new ATOM 0 HG13 ILE A 136 -2.012 -2.674 13.679 1.00 0.00 H new ATOM 0 HG21 ILE A 136 -0.028 -2.183 16.835 1.00 0.00 H new ATOM 0 HG22 ILE A 136 1.541 -2.317 16.007 1.00 0.00 H new ATOM 0 HG23 ILE A 136 0.490 -0.914 15.699 1.00 0.00 H new ATOM 0 HD11 ILE A 136 -3.531 -2.553 15.593 1.00 0.00 H new ATOM 0 HD12 ILE A 136 -2.463 -3.969 15.732 1.00 0.00 H new ATOM 0 HD13 ILE A 136 -2.145 -2.515 16.708 1.00 0.00 H new ATOM 2124 N GLY A 137 2.086 -4.294 12.900 1.00 0.00 N ATOM 2125 CA GLY A 137 3.355 -4.998 12.898 1.00 0.00 C ATOM 2126 C GLY A 137 4.534 -4.066 12.706 1.00 0.00 C ATOM 2127 O GLY A 137 4.382 -2.957 12.192 1.00 0.00 O ATOM 0 H GLY A 137 1.330 -4.773 12.410 1.00 0.00 H new ATOM 0 HA2 GLY A 137 3.470 -5.536 13.839 1.00 0.00 H new ATOM 0 HA3 GLY A 137 3.352 -5.744 12.103 1.00 0.00 H new ATOM 2131 N VAL A 138 5.715 -4.514 13.120 1.00 0.00 N ATOM 2132 CA VAL A 138 6.926 -3.712 12.991 1.00 0.00 C ATOM 2133 C VAL A 138 7.113 -3.227 11.558 1.00 0.00 C ATOM 2134 O VAL A 138 6.377 -3.624 10.654 1.00 0.00 O ATOM 2135 CB VAL A 138 8.174 -4.506 13.420 1.00 0.00 C ATOM 2136 CG1 VAL A 138 7.957 -5.148 14.782 1.00 0.00 C ATOM 2137 CG2 VAL A 138 8.521 -5.557 12.376 1.00 0.00 C ATOM 0 H VAL A 138 5.859 -5.429 13.548 1.00 0.00 H new ATOM 0 HA VAL A 138 6.808 -2.852 13.650 1.00 0.00 H new ATOM 0 HB VAL A 138 9.013 -3.815 13.500 1.00 0.00 H new ATOM 0 HG11 VAL A 138 8.849 -5.705 15.068 1.00 0.00 H new ATOM 0 HG12 VAL A 138 7.760 -4.373 15.522 1.00 0.00 H new ATOM 0 HG13 VAL A 138 7.106 -5.827 14.733 1.00 0.00 H new ATOM 0 HG21 VAL A 138 9.405 -6.109 12.695 1.00 0.00 H new ATOM 0 HG22 VAL A 138 7.685 -6.247 12.262 1.00 0.00 H new ATOM 0 HG23 VAL A 138 8.722 -5.070 11.422 1.00 0.00 H new ATOM 2147 N THR A 139 8.104 -2.364 11.356 1.00 0.00 N ATOM 2148 CA THR A 139 8.389 -1.823 10.033 1.00 0.00 C ATOM 2149 C THR A 139 9.876 -1.913 9.710 1.00 0.00 C ATOM 2150 O THR A 139 10.707 -2.074 10.604 1.00 0.00 O ATOM 2151 CB THR A 139 7.939 -0.355 9.918 1.00 0.00 C ATOM 2152 OG1 THR A 139 8.511 0.418 10.979 1.00 0.00 O ATOM 2153 CG2 THR A 139 6.422 -0.248 9.968 1.00 0.00 C ATOM 0 H THR A 139 8.723 -2.025 12.092 1.00 0.00 H new ATOM 0 HA THR A 139 7.828 -2.425 9.318 1.00 0.00 H new ATOM 0 HB THR A 139 8.284 0.033 8.959 1.00 0.00 H new ATOM 0 HG1 THR A 139 8.221 1.351 10.897 1.00 0.00 H new ATOM 0 HG21 THR A 139 6.128 0.798 9.885 1.00 0.00 H new ATOM 0 HG22 THR A 139 5.990 -0.813 9.142 1.00 0.00 H new ATOM 0 HG23 THR A 139 6.060 -0.653 10.913 1.00 0.00 H new ATOM 2161 N GLY A 140 10.206 -1.808 8.427 1.00 0.00 N ATOM 2162 CA GLY A 140 11.594 -1.880 8.009 1.00 0.00 C ATOM 2163 C GLY A 140 11.945 -3.219 7.391 1.00 0.00 C ATOM 2164 O GLY A 140 11.094 -4.102 7.281 1.00 0.00 O ATOM 0 H GLY A 140 9.537 -1.674 7.669 1.00 0.00 H new ATOM 0 HA2 GLY A 140 11.795 -1.087 7.289 1.00 0.00 H new ATOM 0 HA3 GLY A 140 12.239 -1.700 8.869 1.00 0.00 H new ATOM 2168 N SER A 141 13.202 -3.370 6.985 1.00 0.00 N ATOM 2169 CA SER A 141 13.662 -4.609 6.369 1.00 0.00 C ATOM 2170 C SER A 141 14.195 -5.575 7.423 1.00 0.00 C ATOM 2171 O SER A 141 15.128 -5.255 8.159 1.00 0.00 O ATOM 2172 CB SER A 141 14.750 -4.316 5.334 1.00 0.00 C ATOM 2173 OG SER A 141 15.700 -3.394 5.840 1.00 0.00 O ATOM 0 H SER A 141 13.919 -2.650 7.072 1.00 0.00 H new ATOM 0 HA SER A 141 12.812 -5.075 5.871 1.00 0.00 H new ATOM 0 HB2 SER A 141 15.251 -5.243 5.056 1.00 0.00 H new ATOM 0 HB3 SER A 141 14.296 -3.915 4.428 1.00 0.00 H new ATOM 0 HG SER A 141 15.888 -3.600 6.780 1.00 0.00 H new ATOM 2179 N ASN A 142 13.594 -6.758 7.490 1.00 0.00 N ATOM 2180 CA ASN A 142 14.006 -7.772 8.454 1.00 0.00 C ATOM 2181 C ASN A 142 15.440 -8.223 8.190 1.00 0.00 C ATOM 2182 O ASN A 142 15.795 -8.625 7.082 1.00 0.00 O ATOM 2183 CB ASN A 142 13.062 -8.974 8.397 1.00 0.00 C ATOM 2184 CG ASN A 142 12.948 -9.684 9.733 1.00 0.00 C ATOM 2185 OD1 ASN A 142 13.034 -9.059 10.790 1.00 0.00 O ATOM 2186 ND2 ASN A 142 12.754 -10.997 9.690 1.00 0.00 N ATOM 0 H ASN A 142 12.820 -7.038 6.888 1.00 0.00 H new ATOM 0 HA ASN A 142 13.960 -7.331 9.450 1.00 0.00 H new ATOM 0 HB2 ASN A 142 12.074 -8.641 8.080 1.00 0.00 H new ATOM 0 HB3 ASN A 142 13.419 -9.677 7.644 1.00 0.00 H new ATOM 0 HD21 ASN A 142 12.670 -11.529 10.556 1.00 0.00 H new ATOM 0 HD22 ASN A 142 12.689 -11.474 8.791 1.00 0.00 H new ATOM 2193 N PRO A 143 16.283 -8.157 9.231 1.00 0.00 N ATOM 2194 CA PRO A 143 17.690 -8.556 9.136 1.00 0.00 C ATOM 2195 C PRO A 143 17.856 -10.063 8.972 1.00 0.00 C ATOM 2196 O PRO A 143 18.975 -10.570 8.904 1.00 0.00 O ATOM 2197 CB PRO A 143 18.280 -8.095 10.471 1.00 0.00 C ATOM 2198 CG PRO A 143 17.122 -8.071 11.409 1.00 0.00 C ATOM 2199 CD PRO A 143 15.927 -7.688 10.580 1.00 0.00 C ATOM 0 HA PRO A 143 18.179 -8.120 8.265 1.00 0.00 H new ATOM 0 HB2 PRO A 143 19.056 -8.777 10.818 1.00 0.00 H new ATOM 0 HB3 PRO A 143 18.738 -7.110 10.382 1.00 0.00 H new ATOM 0 HG2 PRO A 143 16.977 -9.045 11.876 1.00 0.00 H new ATOM 0 HG3 PRO A 143 17.286 -7.353 12.213 1.00 0.00 H new ATOM 0 HD2 PRO A 143 15.016 -8.164 10.944 1.00 0.00 H new ATOM 0 HD3 PRO A 143 15.753 -6.612 10.599 1.00 0.00 H new ATOM 2207 N ASN A 144 16.735 -10.773 8.909 1.00 0.00 N ATOM 2208 CA ASN A 144 16.756 -12.223 8.753 1.00 0.00 C ATOM 2209 C ASN A 144 16.702 -12.612 7.278 1.00 0.00 C ATOM 2210 O ASN A 144 15.698 -12.389 6.602 1.00 0.00 O ATOM 2211 CB ASN A 144 15.582 -12.855 9.502 1.00 0.00 C ATOM 2212 CG ASN A 144 15.416 -12.290 10.899 1.00 0.00 C ATOM 2213 OD1 ASN A 144 15.298 -11.078 11.081 1.00 0.00 O ATOM 2214 ND2 ASN A 144 15.407 -13.168 11.896 1.00 0.00 N ATOM 0 H ASN A 144 15.800 -10.368 8.964 1.00 0.00 H new ATOM 0 HA ASN A 144 17.689 -12.595 9.175 1.00 0.00 H new ATOM 0 HB2 ASN A 144 14.664 -12.693 8.936 1.00 0.00 H new ATOM 0 HB3 ASN A 144 15.732 -13.933 9.564 1.00 0.00 H new ATOM 0 HD21 ASN A 144 15.299 -12.846 12.858 1.00 0.00 H new ATOM 0 HD22 ASN A 144 15.508 -14.164 11.700 1.00 0.00 H new ATOM 2221 N LYS A 145 17.789 -13.197 6.786 1.00 0.00 N ATOM 2222 CA LYS A 145 17.867 -13.620 5.393 1.00 0.00 C ATOM 2223 C LYS A 145 17.035 -14.877 5.159 1.00 0.00 C ATOM 2224 O LYS A 145 16.364 -15.006 4.136 1.00 0.00 O ATOM 2225 CB LYS A 145 19.322 -13.877 4.997 1.00 0.00 C ATOM 2226 CG LYS A 145 20.267 -12.754 5.388 1.00 0.00 C ATOM 2227 CD LYS A 145 19.980 -11.485 4.602 1.00 0.00 C ATOM 2228 CE LYS A 145 20.320 -10.241 5.409 1.00 0.00 C ATOM 2229 NZ LYS A 145 19.159 -9.766 6.212 1.00 0.00 N ATOM 0 H LYS A 145 18.629 -13.389 7.332 1.00 0.00 H new ATOM 0 HA LYS A 145 17.465 -12.819 4.773 1.00 0.00 H new ATOM 0 HB2 LYS A 145 19.659 -14.803 5.464 1.00 0.00 H new ATOM 0 HB3 LYS A 145 19.375 -14.026 3.919 1.00 0.00 H new ATOM 0 HG2 LYS A 145 20.172 -12.552 6.455 1.00 0.00 H new ATOM 0 HG3 LYS A 145 21.297 -13.066 5.214 1.00 0.00 H new ATOM 0 HD2 LYS A 145 20.558 -11.490 3.678 1.00 0.00 H new ATOM 0 HD3 LYS A 145 18.927 -11.461 4.320 1.00 0.00 H new ATOM 0 HE2 LYS A 145 21.157 -10.457 6.073 1.00 0.00 H new ATOM 0 HE3 LYS A 145 20.644 -9.448 4.735 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 19.007 -8.752 6.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 18.307 -10.296 5.938 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 19.351 -9.917 7.223 1.00 0.00 H new ATOM 2243 N GLU A 146 17.085 -15.800 6.115 1.00 0.00 N ATOM 2244 CA GLU A 146 16.335 -17.046 6.011 1.00 0.00 C ATOM 2245 C GLU A 146 14.877 -16.776 5.650 1.00 0.00 C ATOM 2246 O GLU A 146 14.314 -17.424 4.767 1.00 0.00 O ATOM 2247 CB GLU A 146 16.410 -17.823 7.328 1.00 0.00 C ATOM 2248 CG GLU A 146 15.741 -17.113 8.492 1.00 0.00 C ATOM 2249 CD GLU A 146 16.184 -17.654 9.838 1.00 0.00 C ATOM 2250 OE1 GLU A 146 17.287 -17.285 10.291 1.00 0.00 O ATOM 2251 OE2 GLU A 146 15.427 -18.446 10.437 1.00 0.00 O ATOM 0 H GLU A 146 17.636 -15.708 6.968 1.00 0.00 H new ATOM 0 HA GLU A 146 16.783 -17.644 5.217 1.00 0.00 H new ATOM 0 HB2 GLU A 146 15.943 -18.799 7.192 1.00 0.00 H new ATOM 0 HB3 GLU A 146 17.456 -18.002 7.575 1.00 0.00 H new ATOM 0 HG2 GLU A 146 15.966 -16.048 8.441 1.00 0.00 H new ATOM 0 HG3 GLU A 146 14.660 -17.215 8.402 1.00 0.00 H new ATOM 2258 N THR A 147 14.271 -15.814 6.339 1.00 0.00 N ATOM 2259 CA THR A 147 12.880 -15.458 6.093 1.00 0.00 C ATOM 2260 C THR A 147 12.653 -15.108 4.626 1.00 0.00 C ATOM 2261 O THR A 147 13.558 -14.658 3.923 1.00 0.00 O ATOM 2262 CB THR A 147 12.441 -14.268 6.967 1.00 0.00 C ATOM 2263 OG1 THR A 147 13.251 -13.123 6.678 1.00 0.00 O ATOM 2264 CG2 THR A 147 12.550 -14.613 8.444 1.00 0.00 C ATOM 0 H THR A 147 14.723 -15.267 7.072 1.00 0.00 H new ATOM 0 HA THR A 147 12.280 -16.330 6.353 1.00 0.00 H new ATOM 0 HB THR A 147 11.399 -14.042 6.739 1.00 0.00 H new ATOM 0 HG1 THR A 147 14.184 -13.316 6.906 1.00 0.00 H new ATOM 0 HG21 THR A 147 12.235 -13.758 9.042 1.00 0.00 H new ATOM 0 HG22 THR A 147 11.910 -15.467 8.666 1.00 0.00 H new ATOM 0 HG23 THR A 147 13.584 -14.862 8.684 1.00 0.00 H new ATOM 2272 N PRO A 148 11.416 -15.317 4.152 1.00 0.00 N ATOM 2273 CA PRO A 148 11.041 -15.029 2.764 1.00 0.00 C ATOM 2274 C PRO A 148 11.006 -13.533 2.472 1.00 0.00 C ATOM 2275 O PRO A 148 10.460 -12.751 3.253 1.00 0.00 O ATOM 2276 CB PRO A 148 9.638 -15.630 2.643 1.00 0.00 C ATOM 2277 CG PRO A 148 9.104 -15.627 4.034 1.00 0.00 C ATOM 2278 CD PRO A 148 10.288 -15.851 4.933 1.00 0.00 C ATOM 0 HA PRO A 148 11.759 -15.441 2.054 1.00 0.00 H new ATOM 0 HB2 PRO A 148 9.010 -15.039 1.977 1.00 0.00 H new ATOM 0 HB3 PRO A 148 9.674 -16.640 2.235 1.00 0.00 H new ATOM 0 HG2 PRO A 148 8.615 -14.680 4.262 1.00 0.00 H new ATOM 0 HG3 PRO A 148 8.359 -16.411 4.168 1.00 0.00 H new ATOM 0 HD2 PRO A 148 10.175 -15.330 5.884 1.00 0.00 H new ATOM 0 HD3 PRO A 148 10.423 -16.908 5.163 1.00 0.00 H new ATOM 2286 N CYS A 149 11.589 -13.141 1.346 1.00 0.00 N ATOM 2287 CA CYS A 149 11.625 -11.737 0.951 1.00 0.00 C ATOM 2288 C CYS A 149 10.799 -11.506 -0.310 1.00 0.00 C ATOM 2289 O CYS A 149 10.780 -12.341 -1.215 1.00 0.00 O ATOM 2290 CB CYS A 149 13.068 -11.287 0.719 1.00 0.00 C ATOM 2291 SG CYS A 149 13.220 -9.742 -0.208 1.00 0.00 S ATOM 0 H CYS A 149 12.044 -13.775 0.689 1.00 0.00 H new ATOM 0 HA CYS A 149 11.194 -11.147 1.760 1.00 0.00 H new ATOM 0 HB2 CYS A 149 13.560 -11.169 1.684 1.00 0.00 H new ATOM 0 HB3 CYS A 149 13.601 -12.073 0.184 1.00 0.00 H new ATOM 0 HG CYS A 149 12.294 -8.913 0.175 1.00 0.00 H new ATOM 2297 N LEU A 150 10.116 -10.367 -0.363 1.00 0.00 N ATOM 2298 CA LEU A 150 9.285 -10.026 -1.513 1.00 0.00 C ATOM 2299 C LEU A 150 9.896 -8.873 -2.303 1.00 0.00 C ATOM 2300 O LEU A 150 10.519 -7.979 -1.731 1.00 0.00 O ATOM 2301 CB LEU A 150 7.874 -9.654 -1.055 1.00 0.00 C ATOM 2302 CG LEU A 150 6.856 -10.795 -1.023 1.00 0.00 C ATOM 2303 CD1 LEU A 150 5.736 -10.483 -0.043 1.00 0.00 C ATOM 2304 CD2 LEU A 150 6.295 -11.048 -2.415 1.00 0.00 C ATOM 0 H LEU A 150 10.121 -9.665 0.377 1.00 0.00 H new ATOM 0 HA LEU A 150 9.231 -10.899 -2.163 1.00 0.00 H new ATOM 0 HB2 LEU A 150 7.940 -9.224 -0.055 1.00 0.00 H new ATOM 0 HB3 LEU A 150 7.494 -8.873 -1.714 1.00 0.00 H new ATOM 0 HG LEU A 150 7.363 -11.700 -0.688 1.00 0.00 H new ATOM 0 HD11 LEU A 150 5.021 -11.306 -0.034 1.00 0.00 H new ATOM 0 HD12 LEU A 150 6.152 -10.353 0.956 1.00 0.00 H new ATOM 0 HD13 LEU A 150 5.231 -9.567 -0.348 1.00 0.00 H new ATOM 0 HD21 LEU A 150 5.572 -11.863 -2.373 1.00 0.00 H new ATOM 0 HD22 LEU A 150 5.804 -10.146 -2.779 1.00 0.00 H new ATOM 0 HD23 LEU A 150 7.107 -11.317 -3.091 1.00 0.00 H new ATOM 2316 N GLU A 151 9.712 -8.901 -3.619 1.00 0.00 N ATOM 2317 CA GLU A 151 10.244 -7.856 -4.486 1.00 0.00 C ATOM 2318 C GLU A 151 9.116 -7.098 -5.180 1.00 0.00 C ATOM 2319 O GLU A 151 8.289 -7.691 -5.874 1.00 0.00 O ATOM 2320 CB GLU A 151 11.185 -8.461 -5.531 1.00 0.00 C ATOM 2321 CG GLU A 151 11.945 -7.422 -6.339 1.00 0.00 C ATOM 2322 CD GLU A 151 12.857 -8.045 -7.377 1.00 0.00 C ATOM 2323 OE1 GLU A 151 12.384 -8.304 -8.504 1.00 0.00 O ATOM 2324 OE2 GLU A 151 14.045 -8.272 -7.065 1.00 0.00 O ATOM 0 H GLU A 151 9.199 -9.635 -4.108 1.00 0.00 H new ATOM 0 HA GLU A 151 10.802 -7.154 -3.866 1.00 0.00 H new ATOM 0 HB2 GLU A 151 11.900 -9.113 -5.030 1.00 0.00 H new ATOM 0 HB3 GLU A 151 10.606 -9.086 -6.211 1.00 0.00 H new ATOM 0 HG2 GLU A 151 11.234 -6.761 -6.835 1.00 0.00 H new ATOM 0 HG3 GLU A 151 12.537 -6.804 -5.664 1.00 0.00 H new ATOM 2331 N LEU A 152 9.089 -5.784 -4.988 1.00 0.00 N ATOM 2332 CA LEU A 152 8.063 -4.943 -5.595 1.00 0.00 C ATOM 2333 C LEU A 152 8.688 -3.739 -6.292 1.00 0.00 C ATOM 2334 O LEU A 152 9.862 -3.432 -6.088 1.00 0.00 O ATOM 2335 CB LEU A 152 7.069 -4.471 -4.533 1.00 0.00 C ATOM 2336 CG LEU A 152 7.594 -3.441 -3.532 1.00 0.00 C ATOM 2337 CD1 LEU A 152 8.846 -3.958 -2.842 1.00 0.00 C ATOM 2338 CD2 LEU A 152 7.873 -2.117 -4.227 1.00 0.00 C ATOM 0 H LEU A 152 9.766 -5.278 -4.417 1.00 0.00 H new ATOM 0 HA LEU A 152 7.535 -5.538 -6.340 1.00 0.00 H new ATOM 0 HB2 LEU A 152 6.202 -4.047 -5.039 1.00 0.00 H new ATOM 0 HB3 LEU A 152 6.720 -5.342 -3.978 1.00 0.00 H new ATOM 0 HG LEU A 152 6.829 -3.276 -2.774 1.00 0.00 H new ATOM 0 HD11 LEU A 152 9.205 -3.212 -2.133 1.00 0.00 H new ATOM 0 HD12 LEU A 152 8.614 -4.881 -2.311 1.00 0.00 H new ATOM 0 HD13 LEU A 152 9.618 -4.152 -3.587 1.00 0.00 H new ATOM 0 HD21 LEU A 152 8.246 -1.396 -3.500 1.00 0.00 H new ATOM 0 HD22 LEU A 152 8.620 -2.266 -5.007 1.00 0.00 H new ATOM 0 HD23 LEU A 152 6.953 -1.739 -4.673 1.00 0.00 H new ATOM 2350 N GLU A 153 7.895 -3.060 -7.114 1.00 0.00 N ATOM 2351 CA GLU A 153 8.371 -1.888 -7.841 1.00 0.00 C ATOM 2352 C GLU A 153 7.550 -0.653 -7.479 1.00 0.00 C ATOM 2353 O GLU A 153 6.340 -0.611 -7.701 1.00 0.00 O ATOM 2354 CB GLU A 153 8.304 -2.134 -9.349 1.00 0.00 C ATOM 2355 CG GLU A 153 9.379 -3.080 -9.860 1.00 0.00 C ATOM 2356 CD GLU A 153 9.116 -3.551 -11.277 1.00 0.00 C ATOM 2357 OE1 GLU A 153 7.966 -3.417 -11.744 1.00 0.00 O ATOM 2358 OE2 GLU A 153 10.062 -4.053 -11.919 1.00 0.00 O ATOM 0 H GLU A 153 6.920 -3.301 -7.294 1.00 0.00 H new ATOM 0 HA GLU A 153 9.408 -1.711 -7.555 1.00 0.00 H new ATOM 0 HB2 GLU A 153 7.324 -2.542 -9.599 1.00 0.00 H new ATOM 0 HB3 GLU A 153 8.394 -1.180 -9.869 1.00 0.00 H new ATOM 0 HG2 GLU A 153 10.346 -2.579 -9.821 1.00 0.00 H new ATOM 0 HG3 GLU A 153 9.441 -3.945 -9.199 1.00 0.00 H new ATOM 2365 N PHE A 154 8.218 0.350 -6.920 1.00 0.00 N ATOM 2366 CA PHE A 154 7.552 1.586 -6.526 1.00 0.00 C ATOM 2367 C PHE A 154 7.536 2.587 -7.677 1.00 0.00 C ATOM 2368 O PHE A 154 8.534 3.257 -7.945 1.00 0.00 O ATOM 2369 CB PHE A 154 8.248 2.201 -5.310 1.00 0.00 C ATOM 2370 CG PHE A 154 7.879 1.544 -4.011 1.00 0.00 C ATOM 2371 CD1 PHE A 154 6.562 1.525 -3.579 1.00 0.00 C ATOM 2372 CD2 PHE A 154 8.848 0.945 -3.222 1.00 0.00 C ATOM 2373 CE1 PHE A 154 6.219 0.920 -2.384 1.00 0.00 C ATOM 2374 CE2 PHE A 154 8.510 0.339 -2.027 1.00 0.00 C ATOM 2375 CZ PHE A 154 7.194 0.328 -1.607 1.00 0.00 C ATOM 0 H PHE A 154 9.220 0.331 -6.730 1.00 0.00 H new ATOM 0 HA PHE A 154 6.522 1.345 -6.263 1.00 0.00 H new ATOM 0 HB2 PHE A 154 9.327 2.135 -5.447 1.00 0.00 H new ATOM 0 HB3 PHE A 154 7.998 3.261 -5.256 1.00 0.00 H new ATOM 0 HD1 PHE A 154 5.795 1.988 -4.183 1.00 0.00 H new ATOM 0 HD2 PHE A 154 9.879 0.952 -3.545 1.00 0.00 H new ATOM 0 HE1 PHE A 154 5.189 0.911 -2.059 1.00 0.00 H new ATOM 0 HE2 PHE A 154 9.274 -0.126 -1.422 1.00 0.00 H new ATOM 0 HZ PHE A 154 6.929 -0.143 -0.672 1.00 0.00 H new ATOM 2385 N ASP A 155 6.397 2.682 -8.355 1.00 0.00 N ATOM 2386 CA ASP A 155 6.250 3.601 -9.477 1.00 0.00 C ATOM 2387 C ASP A 155 5.107 4.581 -9.232 1.00 0.00 C ATOM 2388 O ASP A 155 4.175 4.287 -8.483 1.00 0.00 O ATOM 2389 CB ASP A 155 6.003 2.824 -10.771 1.00 0.00 C ATOM 2390 CG ASP A 155 7.292 2.388 -11.440 1.00 0.00 C ATOM 2391 OD1 ASP A 155 7.913 3.222 -12.131 1.00 0.00 O ATOM 2392 OD2 ASP A 155 7.678 1.212 -11.273 1.00 0.00 O ATOM 0 H ASP A 155 5.562 2.134 -8.147 1.00 0.00 H new ATOM 0 HA ASP A 155 7.176 4.168 -9.573 1.00 0.00 H new ATOM 0 HB2 ASP A 155 5.395 1.946 -10.554 1.00 0.00 H new ATOM 0 HB3 ASP A 155 5.431 3.445 -11.461 1.00 0.00 H new ATOM 2397 N TRP A 156 5.187 5.746 -9.865 1.00 0.00 N ATOM 2398 CA TRP A 156 4.159 6.770 -9.714 1.00 0.00 C ATOM 2399 C TRP A 156 3.847 7.429 -11.053 1.00 0.00 C ATOM 2400 O TRP A 156 4.628 8.237 -11.556 1.00 0.00 O ATOM 2401 CB TRP A 156 4.608 7.826 -8.704 1.00 0.00 C ATOM 2402 CG TRP A 156 5.169 7.242 -7.443 1.00 0.00 C ATOM 2403 CD1 TRP A 156 6.448 6.808 -7.239 1.00 0.00 C ATOM 2404 CD2 TRP A 156 4.469 7.027 -6.212 1.00 0.00 C ATOM 2405 NE1 TRP A 156 6.585 6.335 -5.956 1.00 0.00 N ATOM 2406 CE2 TRP A 156 5.386 6.460 -5.305 1.00 0.00 C ATOM 2407 CE3 TRP A 156 3.158 7.261 -5.788 1.00 0.00 C ATOM 2408 CZ2 TRP A 156 5.030 6.123 -4.002 1.00 0.00 C ATOM 2409 CZ3 TRP A 156 2.807 6.925 -4.494 1.00 0.00 C ATOM 2410 CH2 TRP A 156 3.740 6.362 -3.613 1.00 0.00 C ATOM 0 H TRP A 156 5.952 6.005 -10.487 1.00 0.00 H new ATOM 0 HA TRP A 156 3.252 6.289 -9.347 1.00 0.00 H new ATOM 0 HB2 TRP A 156 5.361 8.464 -9.167 1.00 0.00 H new ATOM 0 HB3 TRP A 156 3.760 8.464 -8.455 1.00 0.00 H new ATOM 0 HD1 TRP A 156 7.236 6.833 -7.977 1.00 0.00 H new ATOM 0 HE1 TRP A 156 7.441 5.953 -5.554 1.00 0.00 H new ATOM 0 HE3 TRP A 156 2.432 7.696 -6.459 1.00 0.00 H new ATOM 0 HZ2 TRP A 156 5.747 5.688 -3.322 1.00 0.00 H new ATOM 0 HZ3 TRP A 156 1.796 7.099 -4.156 1.00 0.00 H new ATOM 0 HH2 TRP A 156 3.435 6.112 -2.608 1.00 0.00 H new ATOM 2421 N PHE A 157 2.700 7.079 -11.626 1.00 0.00 N ATOM 2422 CA PHE A 157 2.285 7.637 -12.908 1.00 0.00 C ATOM 2423 C PHE A 157 1.457 8.903 -12.707 1.00 0.00 C ATOM 2424 O PHE A 157 1.711 9.930 -13.336 1.00 0.00 O ATOM 2425 CB PHE A 157 1.477 6.606 -13.699 1.00 0.00 C ATOM 2426 CG PHE A 157 0.052 6.481 -13.241 1.00 0.00 C ATOM 2427 CD1 PHE A 157 -0.260 5.768 -12.095 1.00 0.00 C ATOM 2428 CD2 PHE A 157 -0.975 7.076 -13.956 1.00 0.00 C ATOM 2429 CE1 PHE A 157 -1.570 5.650 -11.670 1.00 0.00 C ATOM 2430 CE2 PHE A 157 -2.286 6.962 -13.536 1.00 0.00 C ATOM 2431 CZ PHE A 157 -2.585 6.248 -12.392 1.00 0.00 C ATOM 0 H PHE A 157 2.042 6.412 -11.223 1.00 0.00 H new ATOM 0 HA PHE A 157 3.182 7.896 -13.471 1.00 0.00 H new ATOM 0 HB2 PHE A 157 1.488 6.879 -14.754 1.00 0.00 H new ATOM 0 HB3 PHE A 157 1.963 5.634 -13.616 1.00 0.00 H new ATOM 0 HD1 PHE A 157 0.530 5.299 -11.527 1.00 0.00 H new ATOM 0 HD2 PHE A 157 -0.748 7.635 -14.852 1.00 0.00 H new ATOM 0 HE1 PHE A 157 -1.800 5.091 -10.775 1.00 0.00 H new ATOM 0 HE2 PHE A 157 -3.077 7.431 -14.102 1.00 0.00 H new ATOM 0 HZ PHE A 157 -3.610 6.157 -12.063 1.00 0.00 H new ATOM 2441 N SER A 158 0.464 8.821 -11.827 1.00 0.00 N ATOM 2442 CA SER A 158 -0.404 9.958 -11.546 1.00 0.00 C ATOM 2443 C SER A 158 -0.860 10.626 -12.840 1.00 0.00 C ATOM 2444 O SER A 158 -0.808 11.848 -12.971 1.00 0.00 O ATOM 2445 CB SER A 158 0.321 10.975 -10.662 1.00 0.00 C ATOM 2446 OG SER A 158 1.273 11.713 -11.408 1.00 0.00 O ATOM 0 H SER A 158 0.241 7.979 -11.297 1.00 0.00 H new ATOM 0 HA SER A 158 -1.283 9.590 -11.017 1.00 0.00 H new ATOM 0 HB2 SER A 158 -0.404 11.656 -10.217 1.00 0.00 H new ATOM 0 HB3 SER A 158 0.819 10.458 -9.841 1.00 0.00 H new ATOM 0 HG SER A 158 1.332 11.347 -12.315 1.00 0.00 H new