USER MOD reduce.3.24.130724 H: found=0, std=0, add=1184, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1180 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: B 1 ARG N :NH3+ -129:sc= 1.76 (180deg=-1.11) USER MOD Set 1.2: B 5 GLN : amide:sc= 1.34 K(o=3.1,f=-4.4) USER MOD Set 2.1: A 105 MET CE :methyl -112:sc=-0.00927 (180deg=-0.152) USER MOD Set 2.2: B 7 THR OG1 : rot 98:sc= 1.1 USER MOD Set 3.1: A 56 ASN : amide:sc= 0.242 K(o=0.12,f=-2.8!) USER MOD Set 3.2: A 58 THR OG1 : rot 29:sc= -0.126 USER MOD Set 4.1: A 25 THR OG1 : rot -165:sc= 1.27 USER MOD Set 4.2: A 45 GLN : amide:sc= 1.85 K(o=3.7,f=-2.9) USER MOD Set 4.3: A 49 ASN : amide:sc= 0.604 K(o=3.7,f=-4.1!) USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 9 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0104) USER MOD Single : A 13 SER OG : rot -83:sc= 0.408 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 39:sc= 0.0549 USER MOD Single : A 24 THR OG1 : rot 180:sc=0.000524 USER MOD Single : A 26 LYS NZ :NH3+ 145:sc= 0.846 (180deg=0.391) USER MOD Single : A 30 THR OG1 : rot 79:sc= 1.24 USER MOD Single : A 32 MET CE :methyl -123:sc= 0 (180deg=-0.103) USER MOD Single : A 34 SER OG : rot 68:sc= 0.769 USER MOD Single : A 37 GLN : amide:sc=-0.000925 K(o=-0.00092,f=-1.3) USER MOD Single : A 38 ASN : amide:sc= -0.0347 X(o=-0.035,f=-0.14) USER MOD Single : A 40 THR OG1 : rot 125:sc= 0.357 USER MOD Single : A 47 MET CE :methyl 167:sc= -0.0796 (180deg=-0.347) USER MOD Single : A 66 THR OG1 : rot 76:sc= 1.2 USER MOD Single : A 67 MET CE :methyl 163:sc= -0.0786 (180deg=-0.469) USER MOD Single : A 68 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 175:sc= 1.25 (180deg=1.08) USER MOD Single : A 75 THR OG1 : rot 180:sc= -0.0026 USER MOD Single : A 77 SER OG : rot 180:sc= 0.132 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 ASN : amide:sc= 0.124 K(o=0.12,f=-1.3) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot -66:sc= 1.07 USER MOD Single : A 103 HIS : no HE2:sc= 0.496 K(o=0.5,f=-1.6!) USER MOD Single : A 106 THR OG1 : rot 69:sc= 1.29 USER MOD Single : A 107 ASN : amide:sc= -0.0497 K(o=-0.05,f=-1.6!) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 THR OG1 : rot -56:sc= 1.17 USER MOD Single : A 120 MET CE :methyl 148:sc= 0 (180deg=-1.31) USER MOD Single : A 131 GLN :FLIP amide:sc= -0.0131 F(o=-0.56,f=-0.013) USER MOD Single : A 133 ASN : amide:sc= -0.0426 K(o=-0.043,f=-2.4!) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 139 GLN : amide:sc= 0 K(o=0,f=-0.63) USER MOD Single : A 140 MET CE :methyl 162:sc= -0.0385 (180deg=-0.251) USER MOD Single : A 141 MET CE :methyl -161:sc= -0.616 (180deg=-1.54) USER MOD Single : A 142 THR OG1 : rot -77:sc= 0.756 USER MOD Single : B 3 LYS NZ :NH3+ -154:sc= 1.31 (180deg=1.12) USER MOD Single : B 6 LYS NZ :NH3+ 169:sc= 1.25 (180deg=1.2) USER MOD Single : B 9 HIS :FLIP no HD1:sc= -0.2 F(o=-0.91,f=-0.2) USER MOD ----------------------------------------------------------------- ATOM 29 N GLU A 3 -1.658 3.139 14.603 1.00 0.00 N ATOM 30 CA GLU A 3 -1.823 3.050 13.185 1.00 0.00 C ATOM 31 C GLU A 3 -0.496 3.013 12.509 1.00 0.00 C ATOM 32 O GLU A 3 -0.254 2.170 11.646 1.00 0.00 O ATOM 33 CB GLU A 3 -2.554 4.248 12.556 1.00 0.00 C ATOM 34 CG GLU A 3 -3.860 4.486 13.317 1.00 0.00 C ATOM 35 CD GLU A 3 -3.914 5.426 14.513 1.00 0.00 C ATOM 36 OE1 GLU A 3 -2.936 6.193 14.718 1.00 0.00 O ATOM 37 OE2 GLU A 3 -4.945 5.404 15.238 1.00 0.00 O ATOM 0 HA GLU A 3 -2.412 2.144 13.042 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -1.926 5.138 12.598 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -2.761 4.053 11.504 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -4.589 4.850 12.593 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -4.210 3.513 13.661 1.00 0.00 H new ATOM 44 N GLN A 4 0.488 3.820 12.944 1.00 0.00 N ATOM 45 CA GLN A 4 1.801 3.926 12.387 1.00 0.00 C ATOM 46 C GLN A 4 2.637 2.705 12.552 1.00 0.00 C ATOM 47 O GLN A 4 3.076 2.202 11.518 1.00 0.00 O ATOM 48 CB GLN A 4 2.485 5.036 13.202 1.00 0.00 C ATOM 49 CG GLN A 4 3.778 5.607 12.616 1.00 0.00 C ATOM 50 CD GLN A 4 4.535 6.606 13.478 1.00 0.00 C ATOM 51 OE1 GLN A 4 5.351 6.304 14.347 1.00 0.00 O ATOM 52 NE2 GLN A 4 4.293 7.927 13.262 1.00 0.00 N ATOM 0 H GLN A 4 0.356 4.442 13.741 1.00 0.00 H new ATOM 0 HA GLN A 4 1.709 4.105 11.316 1.00 0.00 H new ATOM 0 HB2 GLN A 4 1.776 5.854 13.329 1.00 0.00 H new ATOM 0 HB3 GLN A 4 2.703 4.646 14.196 1.00 0.00 H new ATOM 0 HG2 GLN A 4 4.446 4.776 12.392 1.00 0.00 H new ATOM 0 HG3 GLN A 4 3.539 6.088 11.668 1.00 0.00 H new ATOM 0 HE21 GLN A 4 3.622 8.213 12.549 1.00 0.00 H new ATOM 0 HE22 GLN A 4 4.782 8.632 13.813 1.00 0.00 H new ATOM 61 N ILE A 5 2.838 2.144 13.758 1.00 0.00 N ATOM 62 CA ILE A 5 3.565 0.918 13.876 1.00 0.00 C ATOM 63 C ILE A 5 3.006 -0.211 13.080 1.00 0.00 C ATOM 64 O ILE A 5 3.752 -0.873 12.361 1.00 0.00 O ATOM 65 CB ILE A 5 3.835 0.522 15.297 1.00 0.00 C ATOM 66 CG1 ILE A 5 4.974 -0.511 15.324 1.00 0.00 C ATOM 67 CG2 ILE A 5 2.590 -0.005 16.029 1.00 0.00 C ATOM 68 CD1 ILE A 5 5.213 -1.136 16.698 1.00 0.00 C ATOM 0 H ILE A 5 2.503 2.532 14.640 1.00 0.00 H new ATOM 0 HA ILE A 5 4.530 1.144 13.422 1.00 0.00 H new ATOM 0 HB ILE A 5 4.133 1.419 15.840 1.00 0.00 H new ATOM 0 HG12 ILE A 5 4.749 -1.303 14.610 1.00 0.00 H new ATOM 0 HG13 ILE A 5 5.894 -0.031 14.989 1.00 0.00 H new ATOM 0 HG21 ILE A 5 2.856 -0.273 17.052 1.00 0.00 H new ATOM 0 HG22 ILE A 5 1.822 0.769 16.045 1.00 0.00 H new ATOM 0 HG23 ILE A 5 2.208 -0.885 15.511 1.00 0.00 H new ATOM 0 HD11 ILE A 5 6.031 -1.853 16.634 1.00 0.00 H new ATOM 0 HD12 ILE A 5 5.470 -0.355 17.413 1.00 0.00 H new ATOM 0 HD13 ILE A 5 4.308 -1.646 17.028 1.00 0.00 H new ATOM 80 N ALA A 6 1.674 -0.380 13.000 1.00 0.00 N ATOM 81 CA ALA A 6 0.940 -1.333 12.226 1.00 0.00 C ATOM 82 C ALA A 6 1.200 -1.399 10.760 1.00 0.00 C ATOM 83 O ALA A 6 1.037 -2.466 10.172 1.00 0.00 O ATOM 84 CB ALA A 6 -0.560 -1.301 12.566 1.00 0.00 C ATOM 0 H ALA A 6 1.046 0.218 13.537 1.00 0.00 H new ATOM 0 HA ALA A 6 1.364 -2.282 12.553 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -1.086 -2.038 11.959 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -0.699 -1.534 13.622 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -0.959 -0.308 12.358 1.00 0.00 H new ATOM 90 N GLU A 7 1.651 -0.326 10.087 1.00 0.00 N ATOM 91 CA GLU A 7 2.074 -0.306 8.721 1.00 0.00 C ATOM 92 C GLU A 7 3.276 -1.139 8.437 1.00 0.00 C ATOM 93 O GLU A 7 3.200 -2.108 7.684 1.00 0.00 O ATOM 94 CB GLU A 7 2.311 1.129 8.221 1.00 0.00 C ATOM 95 CG GLU A 7 1.331 2.167 8.772 1.00 0.00 C ATOM 96 CD GLU A 7 1.485 3.528 8.107 1.00 0.00 C ATOM 97 OE1 GLU A 7 2.638 3.993 7.906 1.00 0.00 O ATOM 98 OE2 GLU A 7 0.442 4.155 7.782 1.00 0.00 O ATOM 0 H GLU A 7 1.725 0.591 10.528 1.00 0.00 H new ATOM 0 HA GLU A 7 1.245 -0.754 8.173 1.00 0.00 H new ATOM 0 HB2 GLU A 7 3.325 1.429 8.486 1.00 0.00 H new ATOM 0 HB3 GLU A 7 2.252 1.135 7.133 1.00 0.00 H new ATOM 0 HG2 GLU A 7 0.311 1.810 8.629 1.00 0.00 H new ATOM 0 HG3 GLU A 7 1.484 2.272 9.846 1.00 0.00 H new ATOM 105 N PHE A 8 4.451 -0.922 9.056 1.00 0.00 N ATOM 106 CA PHE A 8 5.666 -1.663 8.914 1.00 0.00 C ATOM 107 C PHE A 8 5.582 -3.011 9.543 1.00 0.00 C ATOM 108 O PHE A 8 6.079 -3.941 8.910 1.00 0.00 O ATOM 109 CB PHE A 8 6.863 -0.720 9.124 1.00 0.00 C ATOM 110 CG PHE A 8 6.959 -0.071 10.462 1.00 0.00 C ATOM 111 CD1 PHE A 8 7.508 -0.631 11.592 1.00 0.00 C ATOM 112 CD2 PHE A 8 6.517 1.230 10.487 1.00 0.00 C ATOM 113 CE1 PHE A 8 7.629 0.128 12.732 1.00 0.00 C ATOM 114 CE2 PHE A 8 6.525 1.940 11.664 1.00 0.00 C ATOM 115 CZ PHE A 8 7.006 1.351 12.809 1.00 0.00 C ATOM 0 H PHE A 8 4.558 -0.154 9.719 1.00 0.00 H new ATOM 0 HA PHE A 8 5.863 -2.012 7.900 1.00 0.00 H new ATOM 0 HB2 PHE A 8 7.779 -1.284 8.950 1.00 0.00 H new ATOM 0 HB3 PHE A 8 6.821 0.062 8.366 1.00 0.00 H new ATOM 0 HD1 PHE A 8 7.841 -1.658 11.584 1.00 0.00 H new ATOM 0 HD2 PHE A 8 6.162 1.696 9.579 1.00 0.00 H new ATOM 0 HE1 PHE A 8 8.212 -0.236 13.565 1.00 0.00 H new ATOM 0 HE2 PHE A 8 6.156 2.955 11.689 1.00 0.00 H new ATOM 0 HZ PHE A 8 6.895 1.846 13.763 1.00 0.00 H new ATOM 125 N LYS A 9 5.050 -3.185 10.766 1.00 0.00 N ATOM 126 CA LYS A 9 5.016 -4.382 11.547 1.00 0.00 C ATOM 127 C LYS A 9 4.219 -5.498 10.963 1.00 0.00 C ATOM 128 O LYS A 9 4.588 -6.671 10.954 1.00 0.00 O ATOM 129 CB LYS A 9 4.578 -4.129 12.999 1.00 0.00 C ATOM 130 CG LYS A 9 4.516 -5.301 13.982 1.00 0.00 C ATOM 131 CD LYS A 9 4.553 -4.814 15.432 1.00 0.00 C ATOM 132 CE LYS A 9 4.234 -5.884 16.477 1.00 0.00 C ATOM 133 NZ LYS A 9 5.166 -7.028 16.361 1.00 0.00 N ATOM 0 H LYS A 9 4.600 -2.410 11.253 1.00 0.00 H new ATOM 0 HA LYS A 9 6.055 -4.712 11.539 1.00 0.00 H new ATOM 0 HB2 LYS A 9 5.255 -3.385 13.420 1.00 0.00 H new ATOM 0 HB3 LYS A 9 3.587 -3.676 12.967 1.00 0.00 H new ATOM 0 HG2 LYS A 9 3.604 -5.873 13.812 1.00 0.00 H new ATOM 0 HG3 LYS A 9 5.354 -5.975 13.801 1.00 0.00 H new ATOM 0 HD2 LYS A 9 5.543 -4.408 15.639 1.00 0.00 H new ATOM 0 HD3 LYS A 9 3.843 -3.994 15.543 1.00 0.00 H new ATOM 0 HE2 LYS A 9 4.302 -5.454 17.476 1.00 0.00 H new ATOM 0 HE3 LYS A 9 3.209 -6.230 16.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 4.974 -7.710 17.122 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 5.034 -7.491 15.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 6.145 -6.687 16.440 1.00 0.00 H new ATOM 147 N GLU A 10 3.026 -5.141 10.453 1.00 0.00 N ATOM 148 CA GLU A 10 2.236 -6.113 9.763 1.00 0.00 C ATOM 149 C GLU A 10 2.736 -6.484 8.409 1.00 0.00 C ATOM 150 O GLU A 10 2.693 -7.639 7.989 1.00 0.00 O ATOM 151 CB GLU A 10 0.762 -5.685 9.661 1.00 0.00 C ATOM 152 CG GLU A 10 0.029 -5.803 10.999 1.00 0.00 C ATOM 153 CD GLU A 10 -0.117 -7.217 11.543 1.00 0.00 C ATOM 154 OE1 GLU A 10 -1.070 -7.981 11.234 1.00 0.00 O ATOM 155 OE2 GLU A 10 0.795 -7.587 12.330 1.00 0.00 O ATOM 0 H GLU A 10 2.618 -4.208 10.515 1.00 0.00 H new ATOM 0 HA GLU A 10 2.324 -7.005 10.383 1.00 0.00 H new ATOM 0 HB2 GLU A 10 0.709 -4.655 9.310 1.00 0.00 H new ATOM 0 HB3 GLU A 10 0.258 -6.302 8.917 1.00 0.00 H new ATOM 0 HG2 GLU A 10 0.558 -5.201 11.738 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -0.965 -5.370 10.888 1.00 0.00 H new ATOM 162 N ALA A 11 3.405 -5.572 7.681 1.00 0.00 N ATOM 163 CA ALA A 11 3.944 -5.893 6.396 1.00 0.00 C ATOM 164 C ALA A 11 5.267 -6.575 6.322 1.00 0.00 C ATOM 165 O ALA A 11 5.589 -7.432 5.501 1.00 0.00 O ATOM 166 CB ALA A 11 4.025 -4.598 5.571 1.00 0.00 C ATOM 0 H ALA A 11 3.573 -4.612 7.982 1.00 0.00 H new ATOM 0 HA ALA A 11 3.251 -6.642 6.012 1.00 0.00 H new ATOM 0 HB1 ALA A 11 4.434 -4.820 4.585 1.00 0.00 H new ATOM 0 HB2 ALA A 11 3.027 -4.173 5.463 1.00 0.00 H new ATOM 0 HB3 ALA A 11 4.671 -3.882 6.080 1.00 0.00 H new ATOM 172 N PHE A 12 6.130 -6.340 7.326 1.00 0.00 N ATOM 173 CA PHE A 12 7.386 -6.992 7.534 1.00 0.00 C ATOM 174 C PHE A 12 7.235 -8.436 7.868 1.00 0.00 C ATOM 175 O PHE A 12 8.092 -9.237 7.499 1.00 0.00 O ATOM 176 CB PHE A 12 8.174 -6.228 8.611 1.00 0.00 C ATOM 177 CG PHE A 12 9.638 -6.507 8.645 1.00 0.00 C ATOM 178 CD1 PHE A 12 10.431 -5.972 7.658 1.00 0.00 C ATOM 179 CD2 PHE A 12 10.173 -7.155 9.733 1.00 0.00 C ATOM 180 CE1 PHE A 12 11.791 -6.159 7.747 1.00 0.00 C ATOM 181 CE2 PHE A 12 11.525 -7.407 9.746 1.00 0.00 C ATOM 182 CZ PHE A 12 12.343 -6.906 8.760 1.00 0.00 C ATOM 0 H PHE A 12 5.935 -5.643 8.045 1.00 0.00 H new ATOM 0 HA PHE A 12 7.946 -6.972 6.599 1.00 0.00 H new ATOM 0 HB2 PHE A 12 8.028 -5.159 8.456 1.00 0.00 H new ATOM 0 HB3 PHE A 12 7.752 -6.469 9.587 1.00 0.00 H new ATOM 0 HD1 PHE A 12 9.999 -5.421 6.836 1.00 0.00 H new ATOM 0 HD2 PHE A 12 9.546 -7.459 10.558 1.00 0.00 H new ATOM 0 HE1 PHE A 12 12.437 -5.710 7.007 1.00 0.00 H new ATOM 0 HE2 PHE A 12 11.949 -8.005 10.539 1.00 0.00 H new ATOM 0 HZ PHE A 12 13.406 -7.097 8.782 1.00 0.00 H new ATOM 192 N SER A 13 6.118 -8.804 8.522 1.00 0.00 N ATOM 193 CA SER A 13 5.901 -10.166 8.897 1.00 0.00 C ATOM 194 C SER A 13 5.275 -10.885 7.752 1.00 0.00 C ATOM 195 O SER A 13 5.470 -12.092 7.613 1.00 0.00 O ATOM 196 CB SER A 13 4.894 -10.234 10.058 1.00 0.00 C ATOM 197 OG SER A 13 3.741 -9.410 9.970 1.00 0.00 O ATOM 0 H SER A 13 5.371 -8.163 8.789 1.00 0.00 H new ATOM 0 HA SER A 13 6.856 -10.607 9.183 1.00 0.00 H new ATOM 0 HB2 SER A 13 4.563 -11.268 10.157 1.00 0.00 H new ATOM 0 HB3 SER A 13 5.421 -9.979 10.977 1.00 0.00 H new ATOM 0 HG SER A 13 3.960 -8.506 10.280 1.00 0.00 H new ATOM 203 N LEU A 14 4.416 -10.147 7.027 1.00 0.00 N ATOM 204 CA LEU A 14 3.769 -10.557 5.820 1.00 0.00 C ATOM 205 C LEU A 14 4.684 -10.974 4.721 1.00 0.00 C ATOM 206 O LEU A 14 4.576 -12.048 4.131 1.00 0.00 O ATOM 207 CB LEU A 14 2.637 -9.579 5.462 1.00 0.00 C ATOM 208 CG LEU A 14 1.724 -10.024 4.307 1.00 0.00 C ATOM 209 CD1 LEU A 14 1.017 -11.350 4.635 1.00 0.00 C ATOM 210 CD2 LEU A 14 0.607 -8.977 4.160 1.00 0.00 C ATOM 0 H LEU A 14 4.157 -9.200 7.304 1.00 0.00 H new ATOM 0 HA LEU A 14 3.277 -11.512 6.007 1.00 0.00 H new ATOM 0 HB2 LEU A 14 2.023 -9.420 6.348 1.00 0.00 H new ATOM 0 HB3 LEU A 14 3.079 -8.617 5.204 1.00 0.00 H new ATOM 0 HG LEU A 14 2.335 -10.135 3.411 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.379 -11.638 3.800 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.762 -12.127 4.808 1.00 0.00 H new ATOM 0 HD13 LEU A 14 0.408 -11.226 5.531 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.058 -9.266 3.346 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.040 -8.917 5.089 1.00 0.00 H new ATOM 0 HD23 LEU A 14 1.047 -8.004 3.941 1.00 0.00 H new ATOM 222 N PHE A 15 5.670 -10.144 4.335 1.00 0.00 N ATOM 223 CA PHE A 15 6.601 -10.476 3.302 1.00 0.00 C ATOM 224 C PHE A 15 7.567 -11.579 3.569 1.00 0.00 C ATOM 225 O PHE A 15 7.933 -12.371 2.702 1.00 0.00 O ATOM 226 CB PHE A 15 7.436 -9.254 2.883 1.00 0.00 C ATOM 227 CG PHE A 15 6.681 -8.400 1.923 1.00 0.00 C ATOM 228 CD1 PHE A 15 6.079 -8.992 0.838 1.00 0.00 C ATOM 229 CD2 PHE A 15 6.597 -7.040 2.101 1.00 0.00 C ATOM 230 CE1 PHE A 15 5.318 -8.293 -0.068 1.00 0.00 C ATOM 231 CE2 PHE A 15 5.842 -6.338 1.191 1.00 0.00 C ATOM 232 CZ PHE A 15 5.177 -6.943 0.151 1.00 0.00 C ATOM 0 H PHE A 15 5.823 -9.224 4.749 1.00 0.00 H new ATOM 0 HA PHE A 15 5.930 -10.832 2.520 1.00 0.00 H new ATOM 0 HB2 PHE A 15 7.702 -8.670 3.764 1.00 0.00 H new ATOM 0 HB3 PHE A 15 8.369 -9.585 2.426 1.00 0.00 H new ATOM 0 HD1 PHE A 15 6.210 -10.054 0.691 1.00 0.00 H new ATOM 0 HD2 PHE A 15 7.101 -6.545 2.918 1.00 0.00 H new ATOM 0 HE1 PHE A 15 4.853 -8.781 -0.912 1.00 0.00 H new ATOM 0 HE2 PHE A 15 5.768 -5.266 1.298 1.00 0.00 H new ATOM 0 HZ PHE A 15 4.542 -6.356 -0.496 1.00 0.00 H new ATOM 242 N ASP A 16 8.210 -11.632 4.749 1.00 0.00 N ATOM 243 CA ASP A 16 9.085 -12.699 5.123 1.00 0.00 C ATOM 244 C ASP A 16 8.467 -14.041 5.314 1.00 0.00 C ATOM 245 O ASP A 16 7.485 -14.238 6.028 1.00 0.00 O ATOM 246 CB ASP A 16 9.715 -12.255 6.454 1.00 0.00 C ATOM 247 CG ASP A 16 11.128 -12.804 6.589 1.00 0.00 C ATOM 248 OD1 ASP A 16 11.300 -14.040 6.765 1.00 0.00 O ATOM 249 OD2 ASP A 16 12.129 -12.070 6.375 1.00 0.00 O ATOM 0 H ASP A 16 8.118 -10.911 5.464 1.00 0.00 H new ATOM 0 HA ASP A 16 9.781 -12.850 4.298 1.00 0.00 H new ATOM 0 HB2 ASP A 16 9.736 -11.166 6.507 1.00 0.00 H new ATOM 0 HB3 ASP A 16 9.103 -12.603 7.286 1.00 0.00 H new ATOM 254 N LYS A 17 8.994 -15.085 4.650 1.00 0.00 N ATOM 255 CA LYS A 17 8.548 -16.443 4.616 1.00 0.00 C ATOM 256 C LYS A 17 8.783 -17.015 5.972 1.00 0.00 C ATOM 257 O LYS A 17 7.885 -17.620 6.557 1.00 0.00 O ATOM 258 CB LYS A 17 9.265 -17.261 3.529 1.00 0.00 C ATOM 259 CG LYS A 17 8.670 -18.651 3.293 1.00 0.00 C ATOM 260 CD LYS A 17 7.182 -18.529 2.959 1.00 0.00 C ATOM 261 CE LYS A 17 6.418 -19.852 2.885 1.00 0.00 C ATOM 262 NZ LYS A 17 6.351 -20.603 4.159 1.00 0.00 N ATOM 0 H LYS A 17 9.826 -14.960 4.073 1.00 0.00 H new ATOM 0 HA LYS A 17 7.489 -16.482 4.359 1.00 0.00 H new ATOM 0 HB2 LYS A 17 9.237 -16.703 2.593 1.00 0.00 H new ATOM 0 HB3 LYS A 17 10.314 -17.369 3.805 1.00 0.00 H new ATOM 0 HG2 LYS A 17 9.195 -19.148 2.477 1.00 0.00 H new ATOM 0 HG3 LYS A 17 8.803 -19.269 4.181 1.00 0.00 H new ATOM 0 HD2 LYS A 17 6.709 -17.897 3.710 1.00 0.00 H new ATOM 0 HD3 LYS A 17 7.082 -18.017 2.002 1.00 0.00 H new ATOM 0 HE2 LYS A 17 5.402 -19.650 2.545 1.00 0.00 H new ATOM 0 HE3 LYS A 17 6.887 -20.484 2.131 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 5.816 -21.483 4.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 7.314 -20.831 4.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 5.876 -20.023 4.879 1.00 0.00 H new ATOM 276 N ASP A 18 9.947 -16.686 6.559 1.00 0.00 N ATOM 277 CA ASP A 18 10.541 -17.370 7.666 1.00 0.00 C ATOM 278 C ASP A 18 10.102 -16.733 8.940 1.00 0.00 C ATOM 279 O ASP A 18 9.632 -17.409 9.854 1.00 0.00 O ATOM 280 CB ASP A 18 12.076 -17.333 7.752 1.00 0.00 C ATOM 281 CG ASP A 18 12.729 -17.460 6.383 1.00 0.00 C ATOM 282 OD1 ASP A 18 12.608 -18.550 5.764 1.00 0.00 O ATOM 283 OD2 ASP A 18 13.386 -16.471 5.961 1.00 0.00 O ATOM 0 H ASP A 18 10.507 -15.895 6.242 1.00 0.00 H new ATOM 0 HA ASP A 18 10.221 -18.401 7.514 1.00 0.00 H new ATOM 0 HB2 ASP A 18 12.390 -16.399 8.218 1.00 0.00 H new ATOM 0 HB3 ASP A 18 12.422 -18.142 8.395 1.00 0.00 H new ATOM 288 N GLY A 19 10.333 -15.422 9.126 1.00 0.00 N ATOM 289 CA GLY A 19 10.166 -14.656 10.323 1.00 0.00 C ATOM 290 C GLY A 19 11.500 -14.596 10.983 1.00 0.00 C ATOM 291 O GLY A 19 11.681 -14.778 12.186 1.00 0.00 O ATOM 0 H GLY A 19 10.671 -14.841 8.359 1.00 0.00 H new ATOM 0 HA2 GLY A 19 9.802 -13.654 10.094 1.00 0.00 H new ATOM 0 HA3 GLY A 19 9.430 -15.120 10.980 1.00 0.00 H new ATOM 295 N ASP A 20 12.577 -14.402 10.201 1.00 0.00 N ATOM 296 CA ASP A 20 13.939 -14.384 10.636 1.00 0.00 C ATOM 297 C ASP A 20 14.462 -13.020 10.934 1.00 0.00 C ATOM 298 O ASP A 20 14.946 -12.706 12.020 1.00 0.00 O ATOM 299 CB ASP A 20 14.855 -15.209 9.718 1.00 0.00 C ATOM 300 CG ASP A 20 15.237 -14.632 8.362 1.00 0.00 C ATOM 301 OD1 ASP A 20 14.423 -13.908 7.729 1.00 0.00 O ATOM 302 OD2 ASP A 20 16.367 -14.956 7.908 1.00 0.00 O ATOM 0 H ASP A 20 12.489 -14.247 9.197 1.00 0.00 H new ATOM 0 HA ASP A 20 13.947 -14.888 11.603 1.00 0.00 H new ATOM 0 HB2 ASP A 20 15.777 -15.410 10.264 1.00 0.00 H new ATOM 0 HB3 ASP A 20 14.371 -16.170 9.545 1.00 0.00 H new ATOM 307 N GLY A 21 14.444 -12.104 9.949 1.00 0.00 N ATOM 308 CA GLY A 21 15.071 -10.829 10.113 1.00 0.00 C ATOM 309 C GLY A 21 15.155 -10.176 8.776 1.00 0.00 C ATOM 310 O GLY A 21 15.246 -8.956 8.648 1.00 0.00 O ATOM 0 H GLY A 21 13.997 -12.245 9.043 1.00 0.00 H new ATOM 0 HA2 GLY A 21 14.498 -10.210 10.803 1.00 0.00 H new ATOM 0 HA3 GLY A 21 16.066 -10.947 10.542 1.00 0.00 H new ATOM 314 N THR A 22 15.278 -10.901 7.650 1.00 0.00 N ATOM 315 CA THR A 22 15.757 -10.371 6.412 1.00 0.00 C ATOM 316 C THR A 22 14.931 -10.729 5.225 1.00 0.00 C ATOM 317 O THR A 22 14.677 -11.904 4.963 1.00 0.00 O ATOM 318 CB THR A 22 17.202 -10.654 6.125 1.00 0.00 C ATOM 319 OG1 THR A 22 17.421 -12.055 6.198 1.00 0.00 O ATOM 320 CG2 THR A 22 18.057 -9.923 7.174 1.00 0.00 C ATOM 0 H THR A 22 15.035 -11.890 7.600 1.00 0.00 H new ATOM 0 HA THR A 22 15.658 -9.298 6.576 1.00 0.00 H new ATOM 0 HB THR A 22 17.475 -10.306 5.129 1.00 0.00 H new ATOM 0 HG1 THR A 22 16.654 -12.527 5.810 1.00 0.00 H new ATOM 0 HG21 THR A 22 19.112 -10.117 6.982 1.00 0.00 H new ATOM 0 HG22 THR A 22 17.868 -8.851 7.115 1.00 0.00 H new ATOM 0 HG23 THR A 22 17.797 -10.283 8.170 1.00 0.00 H new ATOM 328 N ILE A 23 14.454 -9.747 4.439 1.00 0.00 N ATOM 329 CA ILE A 23 13.606 -9.950 3.306 1.00 0.00 C ATOM 330 C ILE A 23 14.383 -10.056 2.039 1.00 0.00 C ATOM 331 O ILE A 23 15.086 -9.109 1.689 1.00 0.00 O ATOM 332 CB ILE A 23 12.545 -8.902 3.148 1.00 0.00 C ATOM 333 CG1 ILE A 23 11.904 -8.448 4.470 1.00 0.00 C ATOM 334 CG2 ILE A 23 11.437 -9.489 2.256 1.00 0.00 C ATOM 335 CD1 ILE A 23 10.650 -7.576 4.422 1.00 0.00 C ATOM 0 H ILE A 23 14.671 -8.764 4.602 1.00 0.00 H new ATOM 0 HA ILE A 23 13.105 -10.897 3.507 1.00 0.00 H new ATOM 0 HB ILE A 23 13.025 -8.024 2.717 1.00 0.00 H new ATOM 0 HG12 ILE A 23 11.661 -9.343 5.043 1.00 0.00 H new ATOM 0 HG13 ILE A 23 12.662 -7.904 5.034 1.00 0.00 H new ATOM 0 HG21 ILE A 23 10.648 -8.749 2.121 1.00 0.00 H new ATOM 0 HG22 ILE A 23 11.854 -9.755 1.285 1.00 0.00 H new ATOM 0 HG23 ILE A 23 11.023 -10.379 2.729 1.00 0.00 H new ATOM 0 HD11 ILE A 23 10.328 -7.346 5.438 1.00 0.00 H new ATOM 0 HD12 ILE A 23 10.871 -6.649 3.893 1.00 0.00 H new ATOM 0 HD13 ILE A 23 9.855 -8.110 3.902 1.00 0.00 H new ATOM 347 N THR A 24 14.407 -11.193 1.321 1.00 0.00 N ATOM 348 CA THR A 24 15.247 -11.545 0.219 1.00 0.00 C ATOM 349 C THR A 24 14.433 -11.341 -1.012 1.00 0.00 C ATOM 350 O THR A 24 13.204 -11.324 -1.037 1.00 0.00 O ATOM 351 CB THR A 24 15.886 -12.900 0.134 1.00 0.00 C ATOM 352 OG1 THR A 24 14.968 -13.978 0.025 1.00 0.00 O ATOM 353 CG2 THR A 24 16.615 -13.092 1.474 1.00 0.00 C ATOM 0 H THR A 24 13.761 -11.951 1.542 1.00 0.00 H new ATOM 0 HA THR A 24 16.119 -10.905 0.357 1.00 0.00 H new ATOM 0 HB THR A 24 16.512 -12.920 -0.758 1.00 0.00 H new ATOM 0 HG1 THR A 24 15.461 -14.823 -0.027 1.00 0.00 H new ATOM 0 HG21 THR A 24 17.107 -14.064 1.484 1.00 0.00 H new ATOM 0 HG22 THR A 24 17.360 -12.307 1.598 1.00 0.00 H new ATOM 0 HG23 THR A 24 15.895 -13.041 2.291 1.00 0.00 H new ATOM 361 N THR A 25 15.194 -11.229 -2.116 1.00 0.00 N ATOM 362 CA THR A 25 14.801 -11.143 -3.488 1.00 0.00 C ATOM 363 C THR A 25 13.833 -12.219 -3.843 1.00 0.00 C ATOM 364 O THR A 25 12.793 -12.059 -4.479 1.00 0.00 O ATOM 365 CB THR A 25 15.984 -11.014 -4.401 1.00 0.00 C ATOM 366 OG1 THR A 25 16.731 -9.871 -4.009 1.00 0.00 O ATOM 367 CG2 THR A 25 15.527 -10.806 -5.854 1.00 0.00 C ATOM 0 H THR A 25 16.210 -11.195 -2.031 1.00 0.00 H new ATOM 0 HA THR A 25 14.249 -10.215 -3.638 1.00 0.00 H new ATOM 0 HB THR A 25 16.581 -11.924 -4.337 1.00 0.00 H new ATOM 0 HG1 THR A 25 17.362 -9.633 -4.720 1.00 0.00 H new ATOM 0 HG21 THR A 25 16.400 -10.715 -6.500 1.00 0.00 H new ATOM 0 HG22 THR A 25 14.927 -11.659 -6.172 1.00 0.00 H new ATOM 0 HG23 THR A 25 14.929 -9.897 -5.921 1.00 0.00 H new ATOM 375 N LYS A 26 14.220 -13.447 -3.454 1.00 0.00 N ATOM 376 CA LYS A 26 13.458 -14.646 -3.616 1.00 0.00 C ATOM 377 C LYS A 26 12.172 -14.718 -2.866 1.00 0.00 C ATOM 378 O LYS A 26 11.155 -15.157 -3.400 1.00 0.00 O ATOM 379 CB LYS A 26 14.365 -15.875 -3.438 1.00 0.00 C ATOM 380 CG LYS A 26 15.335 -16.260 -4.557 1.00 0.00 C ATOM 381 CD LYS A 26 14.722 -16.584 -5.922 1.00 0.00 C ATOM 382 CE LYS A 26 15.829 -17.179 -6.795 1.00 0.00 C ATOM 383 NZ LYS A 26 16.767 -16.145 -7.287 1.00 0.00 N ATOM 0 H LYS A 26 15.118 -13.612 -3.000 1.00 0.00 H new ATOM 0 HA LYS A 26 13.093 -14.633 -4.643 1.00 0.00 H new ATOM 0 HB2 LYS A 26 14.954 -15.719 -2.534 1.00 0.00 H new ATOM 0 HB3 LYS A 26 13.720 -16.734 -3.254 1.00 0.00 H new ATOM 0 HG2 LYS A 26 16.044 -15.442 -4.688 1.00 0.00 H new ATOM 0 HG3 LYS A 26 15.907 -17.127 -4.227 1.00 0.00 H new ATOM 0 HD2 LYS A 26 13.898 -17.289 -5.814 1.00 0.00 H new ATOM 0 HD3 LYS A 26 14.313 -15.684 -6.382 1.00 0.00 H new ATOM 0 HE2 LYS A 26 16.380 -17.925 -6.222 1.00 0.00 H new ATOM 0 HE3 LYS A 26 15.382 -17.696 -7.644 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 17.728 -16.541 -7.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 16.475 -15.835 -8.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 16.758 -15.332 -6.639 1.00 0.00 H new ATOM 397 N GLU A 27 12.116 -14.165 -1.642 1.00 0.00 N ATOM 398 CA GLU A 27 10.925 -14.107 -0.851 1.00 0.00 C ATOM 399 C GLU A 27 9.842 -13.321 -1.506 1.00 0.00 C ATOM 400 O GLU A 27 8.702 -13.764 -1.643 1.00 0.00 O ATOM 401 CB GLU A 27 11.232 -13.523 0.538 1.00 0.00 C ATOM 402 CG GLU A 27 11.842 -14.609 1.427 1.00 0.00 C ATOM 403 CD GLU A 27 12.299 -14.160 2.808 1.00 0.00 C ATOM 404 OE1 GLU A 27 13.139 -13.230 2.937 1.00 0.00 O ATOM 405 OE2 GLU A 27 11.748 -14.706 3.802 1.00 0.00 O ATOM 0 H GLU A 27 12.926 -13.744 -1.187 1.00 0.00 H new ATOM 0 HA GLU A 27 10.565 -15.130 -0.746 1.00 0.00 H new ATOM 0 HB2 GLU A 27 11.921 -12.684 0.447 1.00 0.00 H new ATOM 0 HB3 GLU A 27 10.319 -13.138 0.992 1.00 0.00 H new ATOM 0 HG2 GLU A 27 11.108 -15.405 1.550 1.00 0.00 H new ATOM 0 HG3 GLU A 27 12.696 -15.041 0.906 1.00 0.00 H new ATOM 412 N LEU A 28 10.155 -12.079 -1.915 1.00 0.00 N ATOM 413 CA LEU A 28 9.282 -11.129 -2.532 1.00 0.00 C ATOM 414 C LEU A 28 8.797 -11.543 -3.879 1.00 0.00 C ATOM 415 O LEU A 28 7.619 -11.472 -4.225 1.00 0.00 O ATOM 416 CB LEU A 28 10.033 -9.788 -2.508 1.00 0.00 C ATOM 417 CG LEU A 28 9.265 -8.534 -2.960 1.00 0.00 C ATOM 418 CD1 LEU A 28 7.998 -8.295 -2.122 1.00 0.00 C ATOM 419 CD2 LEU A 28 10.095 -7.242 -3.040 1.00 0.00 C ATOM 0 H LEU A 28 11.099 -11.710 -1.804 1.00 0.00 H new ATOM 0 HA LEU A 28 8.346 -11.045 -1.979 1.00 0.00 H new ATOM 0 HB2 LEU A 28 10.385 -9.618 -1.490 1.00 0.00 H new ATOM 0 HB3 LEU A 28 10.917 -9.886 -3.139 1.00 0.00 H new ATOM 0 HG LEU A 28 8.984 -8.770 -3.987 1.00 0.00 H new ATOM 0 HD11 LEU A 28 7.490 -7.399 -2.478 1.00 0.00 H new ATOM 0 HD12 LEU A 28 7.332 -9.152 -2.217 1.00 0.00 H new ATOM 0 HD13 LEU A 28 8.273 -8.164 -1.075 1.00 0.00 H new ATOM 0 HD21 LEU A 28 9.458 -6.420 -3.368 1.00 0.00 H new ATOM 0 HD22 LEU A 28 10.506 -7.012 -2.057 1.00 0.00 H new ATOM 0 HD23 LEU A 28 10.909 -7.376 -3.752 1.00 0.00 H new ATOM 431 N GLY A 29 9.768 -12.009 -4.684 1.00 0.00 N ATOM 432 CA GLY A 29 9.596 -12.385 -6.053 1.00 0.00 C ATOM 433 C GLY A 29 8.696 -13.565 -6.191 1.00 0.00 C ATOM 434 O GLY A 29 7.993 -13.633 -7.198 1.00 0.00 O ATOM 0 H GLY A 29 10.728 -12.130 -4.361 1.00 0.00 H new ATOM 0 HA2 GLY A 29 9.183 -11.545 -6.612 1.00 0.00 H new ATOM 0 HA3 GLY A 29 10.567 -12.614 -6.492 1.00 0.00 H new ATOM 438 N THR A 30 8.736 -14.530 -5.255 1.00 0.00 N ATOM 439 CA THR A 30 7.923 -15.703 -5.167 1.00 0.00 C ATOM 440 C THR A 30 6.548 -15.402 -4.676 1.00 0.00 C ATOM 441 O THR A 30 5.555 -15.885 -5.217 1.00 0.00 O ATOM 442 CB THR A 30 8.601 -16.821 -4.432 1.00 0.00 C ATOM 443 OG1 THR A 30 9.920 -17.057 -4.903 1.00 0.00 O ATOM 444 CG2 THR A 30 7.780 -18.116 -4.549 1.00 0.00 C ATOM 0 H THR A 30 9.404 -14.482 -4.486 1.00 0.00 H new ATOM 0 HA THR A 30 7.791 -16.074 -6.183 1.00 0.00 H new ATOM 0 HB THR A 30 8.668 -16.515 -3.388 1.00 0.00 H new ATOM 0 HG1 THR A 30 10.528 -16.390 -4.521 1.00 0.00 H new ATOM 0 HG21 THR A 30 8.286 -18.917 -4.010 1.00 0.00 H new ATOM 0 HG22 THR A 30 6.790 -17.959 -4.121 1.00 0.00 H new ATOM 0 HG23 THR A 30 7.681 -18.391 -5.599 1.00 0.00 H new ATOM 452 N VAL A 31 6.399 -14.437 -3.751 1.00 0.00 N ATOM 453 CA VAL A 31 5.094 -13.964 -3.407 1.00 0.00 C ATOM 454 C VAL A 31 4.357 -13.415 -4.580 1.00 0.00 C ATOM 455 O VAL A 31 3.172 -13.641 -4.818 1.00 0.00 O ATOM 456 CB VAL A 31 5.154 -13.021 -2.242 1.00 0.00 C ATOM 457 CG1 VAL A 31 3.798 -12.295 -2.218 1.00 0.00 C ATOM 458 CG2 VAL A 31 5.435 -13.684 -0.883 1.00 0.00 C ATOM 0 H VAL A 31 7.167 -13.991 -3.249 1.00 0.00 H new ATOM 0 HA VAL A 31 4.504 -14.822 -3.084 1.00 0.00 H new ATOM 0 HB VAL A 31 6.000 -12.348 -2.382 1.00 0.00 H new ATOM 0 HG11 VAL A 31 3.778 -11.590 -1.387 1.00 0.00 H new ATOM 0 HG12 VAL A 31 3.657 -11.756 -3.155 1.00 0.00 H new ATOM 0 HG13 VAL A 31 2.997 -13.024 -2.095 1.00 0.00 H new ATOM 0 HG21 VAL A 31 5.459 -12.922 -0.104 1.00 0.00 H new ATOM 0 HG22 VAL A 31 4.649 -14.405 -0.660 1.00 0.00 H new ATOM 0 HG23 VAL A 31 6.397 -14.196 -0.920 1.00 0.00 H new ATOM 468 N MET A 32 5.093 -12.645 -5.401 1.00 0.00 N ATOM 469 CA MET A 32 4.507 -12.022 -6.547 1.00 0.00 C ATOM 470 C MET A 32 4.103 -13.002 -7.594 1.00 0.00 C ATOM 471 O MET A 32 3.017 -12.875 -8.157 1.00 0.00 O ATOM 472 CB MET A 32 5.576 -11.144 -7.218 1.00 0.00 C ATOM 473 CG MET A 32 5.957 -9.850 -6.496 1.00 0.00 C ATOM 474 SD MET A 32 7.355 -8.976 -7.261 1.00 0.00 S ATOM 475 CE MET A 32 7.321 -7.452 -6.273 1.00 0.00 C ATOM 0 H MET A 32 6.087 -12.455 -5.273 1.00 0.00 H new ATOM 0 HA MET A 32 3.633 -11.475 -6.193 1.00 0.00 H new ATOM 0 HB2 MET A 32 6.479 -11.742 -7.342 1.00 0.00 H new ATOM 0 HB3 MET A 32 5.225 -10.885 -8.217 1.00 0.00 H new ATOM 0 HG2 MET A 32 5.092 -9.187 -6.475 1.00 0.00 H new ATOM 0 HG3 MET A 32 6.206 -10.081 -5.460 1.00 0.00 H new ATOM 0 HE1 MET A 32 7.215 -6.592 -6.934 1.00 0.00 H new ATOM 0 HE2 MET A 32 6.478 -7.485 -5.583 1.00 0.00 H new ATOM 0 HE3 MET A 32 8.249 -7.364 -5.708 1.00 0.00 H new ATOM 485 N ARG A 33 4.950 -13.993 -7.925 1.00 0.00 N ATOM 486 CA ARG A 33 4.608 -14.994 -8.887 1.00 0.00 C ATOM 487 C ARG A 33 3.528 -15.884 -8.377 1.00 0.00 C ATOM 488 O ARG A 33 2.712 -16.438 -9.111 1.00 0.00 O ATOM 489 CB ARG A 33 5.871 -15.834 -9.142 1.00 0.00 C ATOM 490 CG ARG A 33 5.746 -16.648 -10.431 1.00 0.00 C ATOM 491 CD ARG A 33 6.789 -17.764 -10.518 1.00 0.00 C ATOM 492 NE ARG A 33 6.596 -18.816 -9.481 1.00 0.00 N ATOM 493 CZ ARG A 33 7.544 -19.416 -8.702 1.00 0.00 C ATOM 494 NH1 ARG A 33 8.869 -19.391 -9.031 1.00 0.00 N ATOM 495 NH2 ARG A 33 7.273 -20.089 -7.546 1.00 0.00 N ATOM 0 H ARG A 33 5.881 -14.101 -7.522 1.00 0.00 H new ATOM 0 HA ARG A 33 4.248 -14.518 -9.799 1.00 0.00 H new ATOM 0 HB2 ARG A 33 6.740 -15.179 -9.206 1.00 0.00 H new ATOM 0 HB3 ARG A 33 6.040 -16.506 -8.300 1.00 0.00 H new ATOM 0 HG2 ARG A 33 4.748 -17.082 -10.488 1.00 0.00 H new ATOM 0 HG3 ARG A 33 5.855 -15.984 -11.289 1.00 0.00 H new ATOM 0 HD2 ARG A 33 6.743 -18.222 -11.506 1.00 0.00 H new ATOM 0 HD3 ARG A 33 7.785 -17.334 -10.412 1.00 0.00 H new ATOM 0 HE ARG A 33 5.636 -19.127 -9.334 1.00 0.00 H new ATOM 0 HH11 ARG A 33 9.175 -18.915 -9.879 1.00 0.00 H new ATOM 0 HH12 ARG A 33 9.553 -19.849 -8.428 1.00 0.00 H new ATOM 0 HH21 ARG A 33 6.311 -20.167 -7.215 1.00 0.00 H new ATOM 0 HH22 ARG A 33 8.032 -20.514 -7.013 1.00 0.00 H new ATOM 509 N SER A 34 3.368 -16.033 -7.049 1.00 0.00 N ATOM 510 CA SER A 34 2.211 -16.687 -6.521 1.00 0.00 C ATOM 511 C SER A 34 0.977 -15.872 -6.704 1.00 0.00 C ATOM 512 O SER A 34 -0.075 -16.468 -6.928 1.00 0.00 O ATOM 513 CB SER A 34 2.322 -16.930 -5.007 1.00 0.00 C ATOM 514 OG SER A 34 3.431 -17.713 -4.589 1.00 0.00 O ATOM 0 H SER A 34 4.032 -15.705 -6.348 1.00 0.00 H new ATOM 0 HA SER A 34 2.152 -17.628 -7.069 1.00 0.00 H new ATOM 0 HB2 SER A 34 2.373 -15.964 -4.505 1.00 0.00 H new ATOM 0 HB3 SER A 34 1.408 -17.417 -4.668 1.00 0.00 H new ATOM 0 HG SER A 34 4.260 -17.214 -4.744 1.00 0.00 H new ATOM 520 N LEU A 35 1.043 -14.529 -6.754 1.00 0.00 N ATOM 521 CA LEU A 35 -0.100 -13.682 -6.896 1.00 0.00 C ATOM 522 C LEU A 35 -0.513 -13.668 -8.328 1.00 0.00 C ATOM 523 O LEU A 35 -1.686 -13.752 -8.689 1.00 0.00 O ATOM 524 CB LEU A 35 0.214 -12.244 -6.448 1.00 0.00 C ATOM 525 CG LEU A 35 -1.017 -11.323 -6.454 1.00 0.00 C ATOM 526 CD1 LEU A 35 -1.969 -11.642 -5.290 1.00 0.00 C ATOM 527 CD2 LEU A 35 -0.478 -9.886 -6.346 1.00 0.00 C ATOM 0 H LEU A 35 1.922 -14.016 -6.693 1.00 0.00 H new ATOM 0 HA LEU A 35 -0.901 -14.070 -6.267 1.00 0.00 H new ATOM 0 HB2 LEU A 35 0.636 -12.268 -5.443 1.00 0.00 H new ATOM 0 HB3 LEU A 35 0.976 -11.824 -7.105 1.00 0.00 H new ATOM 0 HG LEU A 35 -1.599 -11.463 -7.365 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -2.827 -10.971 -5.327 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -2.311 -12.674 -5.372 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -1.445 -11.508 -4.344 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -1.312 -9.184 -6.346 1.00 0.00 H new ATOM 0 HD22 LEU A 35 0.088 -9.778 -5.421 1.00 0.00 H new ATOM 0 HD23 LEU A 35 0.172 -9.677 -7.195 1.00 0.00 H new ATOM 539 N GLY A 36 0.473 -13.438 -9.214 1.00 0.00 N ATOM 540 CA GLY A 36 0.384 -13.429 -10.641 1.00 0.00 C ATOM 541 C GLY A 36 1.255 -12.437 -11.333 1.00 0.00 C ATOM 542 O GLY A 36 0.754 -11.483 -11.924 1.00 0.00 O ATOM 0 H GLY A 36 1.422 -13.240 -8.898 1.00 0.00 H new ATOM 0 HA2 GLY A 36 0.633 -14.424 -11.009 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -0.651 -13.235 -10.922 1.00 0.00 H new ATOM 546 N GLN A 37 2.596 -12.540 -11.287 1.00 0.00 N ATOM 547 CA GLN A 37 3.485 -11.617 -11.920 1.00 0.00 C ATOM 548 C GLN A 37 4.839 -12.237 -11.881 1.00 0.00 C ATOM 549 O GLN A 37 5.322 -12.586 -10.804 1.00 0.00 O ATOM 550 CB GLN A 37 3.565 -10.275 -11.173 1.00 0.00 C ATOM 551 CG GLN A 37 4.774 -9.417 -11.550 1.00 0.00 C ATOM 552 CD GLN A 37 4.773 -9.039 -13.024 1.00 0.00 C ATOM 553 OE1 GLN A 37 5.681 -9.439 -13.751 1.00 0.00 O ATOM 554 NE2 GLN A 37 3.644 -8.512 -13.571 1.00 0.00 N ATOM 0 H GLN A 37 3.077 -13.291 -10.792 1.00 0.00 H new ATOM 0 HA GLN A 37 3.127 -11.417 -12.930 1.00 0.00 H new ATOM 0 HB2 GLN A 37 2.656 -9.708 -11.371 1.00 0.00 H new ATOM 0 HB3 GLN A 37 3.593 -10.470 -10.101 1.00 0.00 H new ATOM 0 HG2 GLN A 37 4.777 -8.511 -10.944 1.00 0.00 H new ATOM 0 HG3 GLN A 37 5.690 -9.960 -11.316 1.00 0.00 H new ATOM 0 HE21 GLN A 37 2.892 -8.181 -12.967 1.00 0.00 H new ATOM 0 HE22 GLN A 37 3.550 -8.448 -14.585 1.00 0.00 H new ATOM 563 N ASN A 38 5.535 -12.520 -12.997 1.00 0.00 N ATOM 564 CA ASN A 38 6.901 -12.930 -12.903 1.00 0.00 C ATOM 565 C ASN A 38 7.796 -11.763 -13.142 1.00 0.00 C ATOM 566 O ASN A 38 7.886 -11.365 -14.303 1.00 0.00 O ATOM 567 CB ASN A 38 7.148 -14.031 -13.949 1.00 0.00 C ATOM 568 CG ASN A 38 8.435 -14.784 -13.644 1.00 0.00 C ATOM 569 OD1 ASN A 38 8.551 -15.265 -12.518 1.00 0.00 O ATOM 570 ND2 ASN A 38 9.520 -14.770 -14.465 1.00 0.00 N ATOM 0 H ASN A 38 5.162 -12.467 -13.945 1.00 0.00 H new ATOM 0 HA ASN A 38 7.115 -13.319 -11.908 1.00 0.00 H new ATOM 0 HB2 ASN A 38 6.308 -14.726 -13.958 1.00 0.00 H new ATOM 0 HB3 ASN A 38 7.207 -13.588 -14.943 1.00 0.00 H new ATOM 0 HD21 ASN A 38 10.408 -15.154 -14.143 1.00 0.00 H new ATOM 0 HD22 ASN A 38 9.445 -14.376 -15.403 1.00 0.00 H new ATOM 577 N PRO A 39 8.375 -11.044 -12.227 1.00 0.00 N ATOM 578 CA PRO A 39 9.290 -10.001 -12.591 1.00 0.00 C ATOM 579 C PRO A 39 10.605 -10.471 -13.109 1.00 0.00 C ATOM 580 O PRO A 39 11.036 -11.599 -12.877 1.00 0.00 O ATOM 581 CB PRO A 39 9.572 -9.346 -11.241 1.00 0.00 C ATOM 582 CG PRO A 39 9.561 -10.481 -10.204 1.00 0.00 C ATOM 583 CD PRO A 39 8.507 -11.411 -10.825 1.00 0.00 C ATOM 0 HA PRO A 39 8.860 -9.387 -13.382 1.00 0.00 H new ATOM 0 HB2 PRO A 39 10.535 -8.836 -11.249 1.00 0.00 H new ATOM 0 HB3 PRO A 39 8.816 -8.597 -11.006 1.00 0.00 H new ATOM 0 HG2 PRO A 39 10.534 -10.963 -10.105 1.00 0.00 H new ATOM 0 HG3 PRO A 39 9.275 -10.134 -9.211 1.00 0.00 H new ATOM 0 HD2 PRO A 39 8.810 -12.454 -10.728 1.00 0.00 H new ATOM 0 HD3 PRO A 39 7.552 -11.307 -10.310 1.00 0.00 H new ATOM 591 N THR A 40 11.414 -9.527 -13.624 1.00 0.00 N ATOM 592 CA THR A 40 12.819 -9.680 -13.841 1.00 0.00 C ATOM 593 C THR A 40 13.533 -9.478 -12.549 1.00 0.00 C ATOM 594 O THR A 40 13.488 -8.395 -11.968 1.00 0.00 O ATOM 595 CB THR A 40 13.506 -8.766 -14.812 1.00 0.00 C ATOM 596 OG1 THR A 40 12.973 -8.585 -16.116 1.00 0.00 O ATOM 597 CG2 THR A 40 14.925 -9.245 -15.162 1.00 0.00 C ATOM 0 H THR A 40 11.069 -8.609 -13.903 1.00 0.00 H new ATOM 0 HA THR A 40 12.872 -10.678 -14.276 1.00 0.00 H new ATOM 0 HB THR A 40 13.402 -7.847 -14.235 1.00 0.00 H new ATOM 0 HG1 THR A 40 12.829 -7.630 -16.281 1.00 0.00 H new ATOM 0 HG21 THR A 40 15.380 -8.550 -15.868 1.00 0.00 H new ATOM 0 HG22 THR A 40 15.528 -9.288 -14.255 1.00 0.00 H new ATOM 0 HG23 THR A 40 14.874 -10.237 -15.611 1.00 0.00 H new ATOM 605 N GLU A 41 14.182 -10.550 -12.060 1.00 0.00 N ATOM 606 CA GLU A 41 14.942 -10.646 -10.852 1.00 0.00 C ATOM 607 C GLU A 41 16.087 -9.703 -10.715 1.00 0.00 C ATOM 608 O GLU A 41 16.198 -9.063 -9.671 1.00 0.00 O ATOM 609 CB GLU A 41 15.423 -12.090 -10.632 1.00 0.00 C ATOM 610 CG GLU A 41 16.243 -12.252 -9.350 1.00 0.00 C ATOM 611 CD GLU A 41 16.771 -13.671 -9.197 1.00 0.00 C ATOM 612 OE1 GLU A 41 15.922 -14.602 -9.199 1.00 0.00 O ATOM 613 OE2 GLU A 41 18.011 -13.873 -9.288 1.00 0.00 O ATOM 0 H GLU A 41 14.172 -11.437 -12.563 1.00 0.00 H new ATOM 0 HA GLU A 41 14.241 -10.342 -10.075 1.00 0.00 H new ATOM 0 HB2 GLU A 41 14.559 -12.754 -10.592 1.00 0.00 H new ATOM 0 HB3 GLU A 41 16.025 -12.402 -11.485 1.00 0.00 H new ATOM 0 HG2 GLU A 41 17.078 -11.552 -9.361 1.00 0.00 H new ATOM 0 HG3 GLU A 41 15.626 -11.998 -8.488 1.00 0.00 H new ATOM 620 N ALA A 42 16.798 -9.389 -11.813 1.00 0.00 N ATOM 621 CA ALA A 42 17.703 -8.282 -11.827 1.00 0.00 C ATOM 622 C ALA A 42 17.135 -6.970 -11.410 1.00 0.00 C ATOM 623 O ALA A 42 17.718 -6.248 -10.602 1.00 0.00 O ATOM 624 CB ALA A 42 18.336 -8.182 -13.225 1.00 0.00 C ATOM 0 H ALA A 42 16.746 -9.903 -12.693 1.00 0.00 H new ATOM 0 HA ALA A 42 18.449 -8.495 -11.061 1.00 0.00 H new ATOM 0 HB1 ALA A 42 19.029 -7.341 -13.251 1.00 0.00 H new ATOM 0 HB2 ALA A 42 18.874 -9.103 -13.447 1.00 0.00 H new ATOM 0 HB3 ALA A 42 17.554 -8.030 -13.969 1.00 0.00 H new ATOM 630 N GLU A 43 15.946 -6.609 -11.924 1.00 0.00 N ATOM 631 CA GLU A 43 15.243 -5.382 -11.712 1.00 0.00 C ATOM 632 C GLU A 43 14.601 -5.329 -10.368 1.00 0.00 C ATOM 633 O GLU A 43 14.560 -4.320 -9.666 1.00 0.00 O ATOM 634 CB GLU A 43 14.112 -5.129 -12.723 1.00 0.00 C ATOM 635 CG GLU A 43 14.596 -5.033 -14.171 1.00 0.00 C ATOM 636 CD GLU A 43 13.367 -4.746 -15.021 1.00 0.00 C ATOM 637 OE1 GLU A 43 12.888 -3.581 -14.984 1.00 0.00 O ATOM 638 OE2 GLU A 43 12.826 -5.623 -15.745 1.00 0.00 O ATOM 0 H GLU A 43 15.432 -7.234 -12.544 1.00 0.00 H new ATOM 0 HA GLU A 43 16.019 -4.625 -11.823 1.00 0.00 H new ATOM 0 HB2 GLU A 43 13.380 -5.933 -12.646 1.00 0.00 H new ATOM 0 HB3 GLU A 43 13.599 -4.205 -12.458 1.00 0.00 H new ATOM 0 HG2 GLU A 43 15.337 -4.241 -14.280 1.00 0.00 H new ATOM 0 HG3 GLU A 43 15.074 -5.962 -14.482 1.00 0.00 H new ATOM 645 N LEU A 44 14.166 -6.468 -9.800 1.00 0.00 N ATOM 646 CA LEU A 44 13.785 -6.535 -8.423 1.00 0.00 C ATOM 647 C LEU A 44 14.882 -6.272 -7.449 1.00 0.00 C ATOM 648 O LEU A 44 14.778 -5.501 -6.497 1.00 0.00 O ATOM 649 CB LEU A 44 13.039 -7.873 -8.286 1.00 0.00 C ATOM 650 CG LEU A 44 12.253 -7.957 -6.967 1.00 0.00 C ATOM 651 CD1 LEU A 44 11.135 -6.920 -6.769 1.00 0.00 C ATOM 652 CD2 LEU A 44 11.692 -9.373 -6.753 1.00 0.00 C ATOM 0 H LEU A 44 14.078 -7.352 -10.301 1.00 0.00 H new ATOM 0 HA LEU A 44 13.127 -5.712 -8.143 1.00 0.00 H new ATOM 0 HB2 LEU A 44 12.354 -7.995 -9.125 1.00 0.00 H new ATOM 0 HB3 LEU A 44 13.754 -8.694 -8.336 1.00 0.00 H new ATOM 0 HG LEU A 44 12.998 -7.711 -6.210 1.00 0.00 H new ATOM 0 HD11 LEU A 44 10.655 -7.082 -5.804 1.00 0.00 H new ATOM 0 HD12 LEU A 44 11.560 -5.917 -6.799 1.00 0.00 H new ATOM 0 HD13 LEU A 44 10.396 -7.025 -7.563 1.00 0.00 H new ATOM 0 HD21 LEU A 44 11.140 -9.408 -5.814 1.00 0.00 H new ATOM 0 HD22 LEU A 44 11.024 -9.628 -7.576 1.00 0.00 H new ATOM 0 HD23 LEU A 44 12.514 -10.088 -6.718 1.00 0.00 H new ATOM 664 N GLN A 45 16.043 -6.887 -7.741 1.00 0.00 N ATOM 665 CA GLN A 45 17.325 -6.692 -7.140 1.00 0.00 C ATOM 666 C GLN A 45 17.849 -5.298 -7.186 1.00 0.00 C ATOM 667 O GLN A 45 18.435 -4.737 -6.261 1.00 0.00 O ATOM 668 CB GLN A 45 18.356 -7.724 -7.626 1.00 0.00 C ATOM 669 CG GLN A 45 19.659 -7.742 -6.824 1.00 0.00 C ATOM 670 CD GLN A 45 19.630 -8.439 -5.472 1.00 0.00 C ATOM 671 OE1 GLN A 45 18.988 -9.452 -5.198 1.00 0.00 O ATOM 672 NE2 GLN A 45 20.294 -7.808 -4.467 1.00 0.00 N ATOM 0 H GLN A 45 16.084 -7.594 -8.475 1.00 0.00 H new ATOM 0 HA GLN A 45 17.152 -6.869 -6.079 1.00 0.00 H new ATOM 0 HB2 GLN A 45 17.906 -8.716 -7.586 1.00 0.00 H new ATOM 0 HB3 GLN A 45 18.590 -7.522 -8.671 1.00 0.00 H new ATOM 0 HG2 GLN A 45 20.426 -8.219 -7.434 1.00 0.00 H new ATOM 0 HG3 GLN A 45 19.974 -6.710 -6.666 1.00 0.00 H new ATOM 0 HE21 GLN A 45 20.835 -6.966 -4.663 1.00 0.00 H new ATOM 0 HE22 GLN A 45 20.251 -8.177 -3.517 1.00 0.00 H new ATOM 681 N ASP A 46 17.481 -4.608 -8.281 1.00 0.00 N ATOM 682 CA ASP A 46 17.823 -3.246 -8.547 1.00 0.00 C ATOM 683 C ASP A 46 17.139 -2.399 -7.529 1.00 0.00 C ATOM 684 O ASP A 46 17.856 -1.656 -6.861 1.00 0.00 O ATOM 685 CB ASP A 46 17.550 -2.743 -9.974 1.00 0.00 C ATOM 686 CG ASP A 46 17.919 -1.296 -10.268 1.00 0.00 C ATOM 687 OD1 ASP A 46 19.133 -1.016 -10.454 1.00 0.00 O ATOM 688 OD2 ASP A 46 17.016 -0.431 -10.425 1.00 0.00 O ATOM 0 H ASP A 46 16.914 -5.024 -9.020 1.00 0.00 H new ATOM 0 HA ASP A 46 18.908 -3.175 -8.474 1.00 0.00 H new ATOM 0 HB2 ASP A 46 18.094 -3.382 -10.670 1.00 0.00 H new ATOM 0 HB3 ASP A 46 16.488 -2.873 -10.184 1.00 0.00 H new ATOM 693 N MET A 47 15.831 -2.560 -7.262 1.00 0.00 N ATOM 694 CA MET A 47 15.061 -1.917 -6.244 1.00 0.00 C ATOM 695 C MET A 47 15.679 -2.229 -4.925 1.00 0.00 C ATOM 696 O MET A 47 15.951 -1.373 -4.084 1.00 0.00 O ATOM 697 CB MET A 47 13.606 -2.416 -6.211 1.00 0.00 C ATOM 698 CG MET A 47 12.768 -1.746 -5.120 1.00 0.00 C ATOM 699 SD MET A 47 12.501 -2.727 -3.614 1.00 0.00 S ATOM 700 CE MET A 47 11.323 -1.508 -2.962 1.00 0.00 C ATOM 0 H MET A 47 15.261 -3.202 -7.813 1.00 0.00 H new ATOM 0 HA MET A 47 15.052 -0.848 -6.456 1.00 0.00 H new ATOM 0 HB2 MET A 47 13.143 -2.233 -7.181 1.00 0.00 H new ATOM 0 HB3 MET A 47 13.601 -3.495 -6.054 1.00 0.00 H new ATOM 0 HG2 MET A 47 13.251 -0.810 -4.840 1.00 0.00 H new ATOM 0 HG3 MET A 47 11.796 -1.489 -5.541 1.00 0.00 H new ATOM 0 HE1 MET A 47 10.786 -1.937 -2.116 1.00 0.00 H new ATOM 0 HE2 MET A 47 11.863 -0.619 -2.636 1.00 0.00 H new ATOM 0 HE3 MET A 47 10.612 -1.235 -3.742 1.00 0.00 H new ATOM 710 N ILE A 48 16.026 -3.495 -4.629 1.00 0.00 N ATOM 711 CA ILE A 48 16.613 -3.823 -3.367 1.00 0.00 C ATOM 712 C ILE A 48 17.937 -3.218 -3.048 1.00 0.00 C ATOM 713 O ILE A 48 18.224 -2.769 -1.939 1.00 0.00 O ATOM 714 CB ILE A 48 16.505 -5.312 -3.219 1.00 0.00 C ATOM 715 CG1 ILE A 48 15.048 -5.804 -3.185 1.00 0.00 C ATOM 716 CG2 ILE A 48 17.119 -5.814 -1.902 1.00 0.00 C ATOM 717 CD1 ILE A 48 14.835 -7.305 -3.377 1.00 0.00 C ATOM 0 H ILE A 48 15.901 -4.287 -5.260 1.00 0.00 H new ATOM 0 HA ILE A 48 16.050 -3.327 -2.576 1.00 0.00 H new ATOM 0 HB ILE A 48 17.036 -5.698 -4.089 1.00 0.00 H new ATOM 0 HG12 ILE A 48 14.612 -5.516 -2.228 1.00 0.00 H new ATOM 0 HG13 ILE A 48 14.491 -5.278 -3.960 1.00 0.00 H new ATOM 0 HG21 ILE A 48 17.016 -6.897 -1.842 1.00 0.00 H new ATOM 0 HG22 ILE A 48 18.175 -5.548 -1.868 1.00 0.00 H new ATOM 0 HG23 ILE A 48 16.602 -5.353 -1.060 1.00 0.00 H new ATOM 0 HD11 ILE A 48 13.769 -7.530 -3.333 1.00 0.00 H new ATOM 0 HD12 ILE A 48 15.230 -7.607 -4.347 1.00 0.00 H new ATOM 0 HD13 ILE A 48 15.353 -7.850 -2.588 1.00 0.00 H new ATOM 729 N ASN A 49 18.820 -3.081 -4.053 1.00 0.00 N ATOM 730 CA ASN A 49 20.142 -2.560 -3.893 1.00 0.00 C ATOM 731 C ASN A 49 20.117 -1.071 -3.823 1.00 0.00 C ATOM 732 O ASN A 49 20.984 -0.363 -3.315 1.00 0.00 O ATOM 733 CB ASN A 49 21.012 -2.884 -5.118 1.00 0.00 C ATOM 734 CG ASN A 49 21.291 -4.379 -5.180 1.00 0.00 C ATOM 735 OD1 ASN A 49 21.025 -5.088 -4.210 1.00 0.00 O ATOM 736 ND2 ASN A 49 21.981 -4.761 -6.288 1.00 0.00 N ATOM 0 H ASN A 49 18.605 -3.343 -5.015 1.00 0.00 H new ATOM 0 HA ASN A 49 20.539 -3.008 -2.982 1.00 0.00 H new ATOM 0 HB2 ASN A 49 20.506 -2.562 -6.028 1.00 0.00 H new ATOM 0 HB3 ASN A 49 21.951 -2.333 -5.063 1.00 0.00 H new ATOM 0 HD21 ASN A 49 22.331 -5.716 -6.367 1.00 0.00 H new ATOM 0 HD22 ASN A 49 22.149 -4.093 -7.040 1.00 0.00 H new ATOM 743 N GLU A 50 18.991 -0.441 -4.202 1.00 0.00 N ATOM 744 CA GLU A 50 18.689 0.934 -3.953 1.00 0.00 C ATOM 745 C GLU A 50 18.294 1.212 -2.544 1.00 0.00 C ATOM 746 O GLU A 50 18.599 2.225 -1.916 1.00 0.00 O ATOM 747 CB GLU A 50 17.588 1.524 -4.850 1.00 0.00 C ATOM 748 CG GLU A 50 17.521 3.040 -4.649 1.00 0.00 C ATOM 749 CD GLU A 50 16.509 3.710 -5.568 1.00 0.00 C ATOM 750 OE1 GLU A 50 15.315 3.471 -5.245 1.00 0.00 O ATOM 751 OE2 GLU A 50 16.880 4.553 -6.427 1.00 0.00 O ATOM 0 H GLU A 50 18.249 -0.920 -4.712 1.00 0.00 H new ATOM 0 HA GLU A 50 19.638 1.417 -4.185 1.00 0.00 H new ATOM 0 HB2 GLU A 50 17.794 1.294 -5.895 1.00 0.00 H new ATOM 0 HB3 GLU A 50 16.626 1.072 -4.608 1.00 0.00 H new ATOM 0 HG2 GLU A 50 17.262 3.254 -3.612 1.00 0.00 H new ATOM 0 HG3 GLU A 50 18.507 3.470 -4.826 1.00 0.00 H new ATOM 758 N VAL A 51 17.557 0.274 -1.921 1.00 0.00 N ATOM 759 CA VAL A 51 17.009 0.413 -0.608 1.00 0.00 C ATOM 760 C VAL A 51 18.051 0.058 0.396 1.00 0.00 C ATOM 761 O VAL A 51 18.216 0.742 1.405 1.00 0.00 O ATOM 762 CB VAL A 51 15.761 -0.363 -0.306 1.00 0.00 C ATOM 763 CG1 VAL A 51 15.221 -0.154 1.119 1.00 0.00 C ATOM 764 CG2 VAL A 51 14.700 -0.013 -1.362 1.00 0.00 C ATOM 0 H VAL A 51 17.333 -0.622 -2.353 1.00 0.00 H new ATOM 0 HA VAL A 51 16.702 1.457 -0.555 1.00 0.00 H new ATOM 0 HB VAL A 51 16.013 -1.422 -0.352 1.00 0.00 H new ATOM 0 HG11 VAL A 51 14.318 -0.749 1.257 1.00 0.00 H new ATOM 0 HG12 VAL A 51 15.975 -0.465 1.843 1.00 0.00 H new ATOM 0 HG13 VAL A 51 14.987 0.900 1.268 1.00 0.00 H new ATOM 0 HG21 VAL A 51 13.785 -0.569 -1.157 1.00 0.00 H new ATOM 0 HG22 VAL A 51 14.490 1.056 -1.327 1.00 0.00 H new ATOM 0 HG23 VAL A 51 15.071 -0.277 -2.352 1.00 0.00 H new ATOM 774 N ASP A 52 18.821 -1.004 0.100 1.00 0.00 N ATOM 775 CA ASP A 52 19.823 -1.520 0.979 1.00 0.00 C ATOM 776 C ASP A 52 20.881 -0.537 1.346 1.00 0.00 C ATOM 777 O ASP A 52 21.556 0.035 0.491 1.00 0.00 O ATOM 778 CB ASP A 52 20.397 -2.721 0.209 1.00 0.00 C ATOM 779 CG ASP A 52 21.408 -3.448 1.085 1.00 0.00 C ATOM 780 OD1 ASP A 52 20.962 -4.150 2.032 1.00 0.00 O ATOM 781 OD2 ASP A 52 22.616 -3.349 0.741 1.00 0.00 O ATOM 0 H ASP A 52 18.744 -1.519 -0.777 1.00 0.00 H new ATOM 0 HA ASP A 52 19.398 -1.787 1.946 1.00 0.00 H new ATOM 0 HB2 ASP A 52 19.594 -3.400 -0.079 1.00 0.00 H new ATOM 0 HB3 ASP A 52 20.873 -2.383 -0.711 1.00 0.00 H new ATOM 786 N ALA A 53 21.051 -0.308 2.661 1.00 0.00 N ATOM 787 CA ALA A 53 21.920 0.618 3.318 1.00 0.00 C ATOM 788 C ALA A 53 23.157 -0.027 3.843 1.00 0.00 C ATOM 789 O ALA A 53 24.226 0.448 3.464 1.00 0.00 O ATOM 790 CB ALA A 53 20.988 1.323 4.318 1.00 0.00 C ATOM 0 H ALA A 53 20.511 -0.840 3.343 1.00 0.00 H new ATOM 0 HA ALA A 53 22.380 1.363 2.668 1.00 0.00 H new ATOM 0 HB1 ALA A 53 21.554 2.063 4.883 1.00 0.00 H new ATOM 0 HB2 ALA A 53 20.182 1.819 3.777 1.00 0.00 H new ATOM 0 HB3 ALA A 53 20.567 0.588 5.003 1.00 0.00 H new ATOM 796 N ASP A 54 22.997 -1.097 4.642 1.00 0.00 N ATOM 797 CA ASP A 54 24.022 -1.674 5.455 1.00 0.00 C ATOM 798 C ASP A 54 25.072 -2.138 4.505 1.00 0.00 C ATOM 799 O ASP A 54 26.116 -1.545 4.239 1.00 0.00 O ATOM 800 CB ASP A 54 23.546 -2.809 6.378 1.00 0.00 C ATOM 801 CG ASP A 54 22.334 -3.529 5.806 1.00 0.00 C ATOM 802 OD1 ASP A 54 22.375 -4.048 4.658 1.00 0.00 O ATOM 803 OD2 ASP A 54 21.234 -3.629 6.413 1.00 0.00 O ATOM 0 H ASP A 54 22.105 -1.585 4.725 1.00 0.00 H new ATOM 0 HA ASP A 54 24.394 -0.927 6.156 1.00 0.00 H new ATOM 0 HB2 ASP A 54 24.357 -3.522 6.525 1.00 0.00 H new ATOM 0 HB3 ASP A 54 23.298 -2.401 7.358 1.00 0.00 H new ATOM 808 N GLY A 55 24.725 -3.255 3.841 1.00 0.00 N ATOM 809 CA GLY A 55 25.436 -3.738 2.698 1.00 0.00 C ATOM 810 C GLY A 55 25.207 -5.146 2.266 1.00 0.00 C ATOM 811 O GLY A 55 26.160 -5.757 1.784 1.00 0.00 O ATOM 0 H GLY A 55 23.930 -3.837 4.105 1.00 0.00 H new ATOM 0 HA2 GLY A 55 25.193 -3.089 1.857 1.00 0.00 H new ATOM 0 HA3 GLY A 55 26.502 -3.620 2.895 1.00 0.00 H new ATOM 815 N ASN A 56 24.073 -5.760 2.648 1.00 0.00 N ATOM 816 CA ASN A 56 23.943 -7.159 2.384 1.00 0.00 C ATOM 817 C ASN A 56 23.110 -7.463 1.187 1.00 0.00 C ATOM 818 O ASN A 56 23.286 -8.547 0.632 1.00 0.00 O ATOM 819 CB ASN A 56 23.513 -7.848 3.690 1.00 0.00 C ATOM 820 CG ASN A 56 22.149 -7.451 4.239 1.00 0.00 C ATOM 821 OD1 ASN A 56 21.427 -6.564 3.786 1.00 0.00 O ATOM 822 ND2 ASN A 56 21.762 -8.154 5.336 1.00 0.00 N ATOM 0 H ASN A 56 23.283 -5.316 3.116 1.00 0.00 H new ATOM 0 HA ASN A 56 24.904 -7.579 2.088 1.00 0.00 H new ATOM 0 HB2 ASN A 56 23.517 -8.926 3.527 1.00 0.00 H new ATOM 0 HB3 ASN A 56 24.264 -7.638 4.452 1.00 0.00 H new ATOM 0 HD21 ASN A 56 20.870 -7.947 5.786 1.00 0.00 H new ATOM 0 HD22 ASN A 56 22.363 -8.889 5.709 1.00 0.00 H new ATOM 829 N GLY A 57 22.198 -6.584 0.736 1.00 0.00 N ATOM 830 CA GLY A 57 21.312 -6.787 -0.368 1.00 0.00 C ATOM 831 C GLY A 57 20.027 -7.426 0.032 1.00 0.00 C ATOM 832 O GLY A 57 19.288 -7.873 -0.843 1.00 0.00 O ATOM 0 H GLY A 57 22.072 -5.671 1.172 1.00 0.00 H new ATOM 0 HA2 GLY A 57 21.103 -5.828 -0.841 1.00 0.00 H new ATOM 0 HA3 GLY A 57 21.805 -7.410 -1.114 1.00 0.00 H new ATOM 836 N THR A 58 19.724 -7.507 1.340 1.00 0.00 N ATOM 837 CA THR A 58 18.399 -7.840 1.760 1.00 0.00 C ATOM 838 C THR A 58 17.793 -6.628 2.381 1.00 0.00 C ATOM 839 O THR A 58 18.513 -5.760 2.873 1.00 0.00 O ATOM 840 CB THR A 58 18.281 -8.947 2.765 1.00 0.00 C ATOM 841 OG1 THR A 58 19.101 -8.922 3.925 1.00 0.00 O ATOM 842 CG2 THR A 58 18.764 -10.212 2.035 1.00 0.00 C ATOM 0 H THR A 58 20.387 -7.344 2.098 1.00 0.00 H new ATOM 0 HA THR A 58 17.897 -8.190 0.858 1.00 0.00 H new ATOM 0 HB THR A 58 17.251 -8.876 3.114 1.00 0.00 H new ATOM 0 HG1 THR A 58 19.312 -7.993 4.157 1.00 0.00 H new ATOM 0 HG21 THR A 58 18.706 -11.066 2.710 1.00 0.00 H new ATOM 0 HG22 THR A 58 18.133 -10.393 1.165 1.00 0.00 H new ATOM 0 HG23 THR A 58 19.796 -10.074 1.712 1.00 0.00 H new ATOM 850 N ILE A 59 16.465 -6.424 2.337 1.00 0.00 N ATOM 851 CA ILE A 59 15.831 -5.385 3.087 1.00 0.00 C ATOM 852 C ILE A 59 15.758 -5.884 4.489 1.00 0.00 C ATOM 853 O ILE A 59 15.365 -6.990 4.858 1.00 0.00 O ATOM 854 CB ILE A 59 14.514 -4.824 2.638 1.00 0.00 C ATOM 855 CG1 ILE A 59 14.474 -4.405 1.159 1.00 0.00 C ATOM 856 CG2 ILE A 59 14.255 -3.542 3.447 1.00 0.00 C ATOM 857 CD1 ILE A 59 13.045 -4.628 0.666 1.00 0.00 C ATOM 0 H ILE A 59 15.824 -6.985 1.776 1.00 0.00 H new ATOM 0 HA ILE A 59 16.452 -4.502 2.937 1.00 0.00 H new ATOM 0 HB ILE A 59 13.777 -5.614 2.785 1.00 0.00 H new ATOM 0 HG12 ILE A 59 14.761 -3.359 1.047 1.00 0.00 H new ATOM 0 HG13 ILE A 59 15.180 -4.994 0.573 1.00 0.00 H new ATOM 0 HG21 ILE A 59 13.302 -3.107 3.144 1.00 0.00 H new ATOM 0 HG22 ILE A 59 14.223 -3.783 4.510 1.00 0.00 H new ATOM 0 HG23 ILE A 59 15.056 -2.826 3.261 1.00 0.00 H new ATOM 0 HD11 ILE A 59 12.973 -4.342 -0.383 1.00 0.00 H new ATOM 0 HD12 ILE A 59 12.783 -5.681 0.774 1.00 0.00 H new ATOM 0 HD13 ILE A 59 12.358 -4.021 1.255 1.00 0.00 H new ATOM 869 N ASP A 60 16.179 -5.073 5.475 1.00 0.00 N ATOM 870 CA ASP A 60 16.151 -5.305 6.886 1.00 0.00 C ATOM 871 C ASP A 60 15.109 -4.399 7.447 1.00 0.00 C ATOM 872 O ASP A 60 14.528 -3.509 6.828 1.00 0.00 O ATOM 873 CB ASP A 60 17.515 -4.943 7.497 1.00 0.00 C ATOM 874 CG ASP A 60 18.596 -5.852 6.930 1.00 0.00 C ATOM 875 OD1 ASP A 60 19.036 -5.675 5.762 1.00 0.00 O ATOM 876 OD2 ASP A 60 19.019 -6.752 7.704 1.00 0.00 O ATOM 0 H ASP A 60 16.580 -4.161 5.259 1.00 0.00 H new ATOM 0 HA ASP A 60 15.935 -6.350 7.107 1.00 0.00 H new ATOM 0 HB2 ASP A 60 17.754 -3.902 7.282 1.00 0.00 H new ATOM 0 HB3 ASP A 60 17.475 -5.044 8.582 1.00 0.00 H new ATOM 881 N PHE A 61 14.814 -4.494 8.755 1.00 0.00 N ATOM 882 CA PHE A 61 13.842 -3.742 9.486 1.00 0.00 C ATOM 883 C PHE A 61 14.087 -2.275 9.572 1.00 0.00 C ATOM 884 O PHE A 61 13.224 -1.524 9.121 1.00 0.00 O ATOM 885 CB PHE A 61 13.478 -4.416 10.819 1.00 0.00 C ATOM 886 CG PHE A 61 12.423 -3.745 11.630 1.00 0.00 C ATOM 887 CD1 PHE A 61 11.130 -3.652 11.170 1.00 0.00 C ATOM 888 CD2 PHE A 61 12.642 -3.308 12.915 1.00 0.00 C ATOM 889 CE1 PHE A 61 10.126 -3.111 11.939 1.00 0.00 C ATOM 890 CE2 PHE A 61 11.671 -2.741 13.706 1.00 0.00 C ATOM 891 CZ PHE A 61 10.405 -2.608 13.187 1.00 0.00 C ATOM 0 H PHE A 61 15.302 -5.159 9.355 1.00 0.00 H new ATOM 0 HA PHE A 61 12.941 -3.772 8.873 1.00 0.00 H new ATOM 0 HB2 PHE A 61 13.153 -5.435 10.610 1.00 0.00 H new ATOM 0 HB3 PHE A 61 14.382 -4.488 11.424 1.00 0.00 H new ATOM 0 HD1 PHE A 61 10.897 -4.013 10.179 1.00 0.00 H new ATOM 0 HD2 PHE A 61 13.634 -3.416 13.327 1.00 0.00 H new ATOM 0 HE1 PHE A 61 9.115 -3.081 11.561 1.00 0.00 H new ATOM 0 HE2 PHE A 61 11.897 -2.409 14.709 1.00 0.00 H new ATOM 0 HZ PHE A 61 9.634 -2.111 13.757 1.00 0.00 H new ATOM 901 N PRO A 62 15.097 -1.567 9.983 1.00 0.00 N ATOM 902 CA PRO A 62 15.124 -0.135 9.899 1.00 0.00 C ATOM 903 C PRO A 62 15.326 0.389 8.519 1.00 0.00 C ATOM 904 O PRO A 62 15.164 1.585 8.279 1.00 0.00 O ATOM 905 CB PRO A 62 16.261 0.309 10.816 1.00 0.00 C ATOM 906 CG PRO A 62 17.197 -0.901 10.968 1.00 0.00 C ATOM 907 CD PRO A 62 16.214 -2.066 10.771 1.00 0.00 C ATOM 0 HA PRO A 62 14.155 0.265 10.199 1.00 0.00 H new ATOM 0 HB2 PRO A 62 16.793 1.160 10.390 1.00 0.00 H new ATOM 0 HB3 PRO A 62 15.876 0.626 11.785 1.00 0.00 H new ATOM 0 HG2 PRO A 62 17.992 -0.903 10.222 1.00 0.00 H new ATOM 0 HG3 PRO A 62 17.678 -0.929 11.946 1.00 0.00 H new ATOM 0 HD2 PRO A 62 16.702 -2.897 10.262 1.00 0.00 H new ATOM 0 HD3 PRO A 62 15.867 -2.442 11.733 1.00 0.00 H new ATOM 915 N GLU A 63 15.505 -0.469 7.498 1.00 0.00 N ATOM 916 CA GLU A 63 15.477 -0.121 6.112 1.00 0.00 C ATOM 917 C GLU A 63 14.107 -0.094 5.527 1.00 0.00 C ATOM 918 O GLU A 63 13.864 0.882 4.819 1.00 0.00 O ATOM 919 CB GLU A 63 16.387 -1.065 5.307 1.00 0.00 C ATOM 920 CG GLU A 63 17.848 -1.209 5.739 1.00 0.00 C ATOM 921 CD GLU A 63 18.626 -2.098 4.780 1.00 0.00 C ATOM 922 OE1 GLU A 63 18.004 -3.155 4.491 1.00 0.00 O ATOM 923 OE2 GLU A 63 19.815 -1.822 4.466 1.00 0.00 O ATOM 0 H GLU A 63 15.679 -1.462 7.650 1.00 0.00 H new ATOM 0 HA GLU A 63 15.852 0.900 6.046 1.00 0.00 H new ATOM 0 HB2 GLU A 63 15.936 -2.057 5.325 1.00 0.00 H new ATOM 0 HB3 GLU A 63 16.379 -0.730 4.270 1.00 0.00 H new ATOM 0 HG2 GLU A 63 18.314 -0.225 5.784 1.00 0.00 H new ATOM 0 HG3 GLU A 63 17.892 -1.629 6.744 1.00 0.00 H new ATOM 930 N PHE A 64 13.283 -1.140 5.721 1.00 0.00 N ATOM 931 CA PHE A 64 11.871 -1.294 5.557 1.00 0.00 C ATOM 932 C PHE A 64 11.167 -0.101 6.105 1.00 0.00 C ATOM 933 O PHE A 64 10.428 0.570 5.385 1.00 0.00 O ATOM 934 CB PHE A 64 11.421 -2.626 6.182 1.00 0.00 C ATOM 935 CG PHE A 64 10.200 -3.037 5.433 1.00 0.00 C ATOM 936 CD1 PHE A 64 10.193 -3.428 4.115 1.00 0.00 C ATOM 937 CD2 PHE A 64 9.018 -3.038 6.136 1.00 0.00 C ATOM 938 CE1 PHE A 64 9.066 -3.975 3.548 1.00 0.00 C ATOM 939 CE2 PHE A 64 7.874 -3.481 5.516 1.00 0.00 C ATOM 940 CZ PHE A 64 7.861 -3.890 4.203 1.00 0.00 C ATOM 0 H PHE A 64 13.683 -2.020 6.047 1.00 0.00 H new ATOM 0 HA PHE A 64 11.607 -1.345 4.501 1.00 0.00 H new ATOM 0 HB2 PHE A 64 12.203 -3.381 6.098 1.00 0.00 H new ATOM 0 HB3 PHE A 64 11.206 -2.506 7.244 1.00 0.00 H new ATOM 0 HD1 PHE A 64 11.084 -3.304 3.517 1.00 0.00 H new ATOM 0 HD2 PHE A 64 8.989 -2.696 7.160 1.00 0.00 H new ATOM 0 HE1 PHE A 64 9.128 -4.470 2.590 1.00 0.00 H new ATOM 0 HE2 PHE A 64 6.953 -3.509 6.080 1.00 0.00 H new ATOM 0 HZ PHE A 64 6.935 -4.136 3.704 1.00 0.00 H new ATOM 950 N LEU A 65 11.456 0.278 7.363 1.00 0.00 N ATOM 951 CA LEU A 65 11.061 1.538 7.912 1.00 0.00 C ATOM 952 C LEU A 65 11.539 2.779 7.240 1.00 0.00 C ATOM 953 O LEU A 65 10.739 3.711 7.164 1.00 0.00 O ATOM 954 CB LEU A 65 11.730 1.647 9.293 1.00 0.00 C ATOM 955 CG LEU A 65 11.268 2.740 10.271 1.00 0.00 C ATOM 956 CD1 LEU A 65 9.857 2.416 10.791 1.00 0.00 C ATOM 957 CD2 LEU A 65 12.027 2.826 11.607 1.00 0.00 C ATOM 0 H LEU A 65 11.978 -0.307 8.015 1.00 0.00 H new ATOM 0 HA LEU A 65 9.973 1.514 7.846 1.00 0.00 H new ATOM 0 HB2 LEU A 65 11.606 0.687 9.793 1.00 0.00 H new ATOM 0 HB3 LEU A 65 12.799 1.785 9.129 1.00 0.00 H new ATOM 0 HG LEU A 65 11.397 3.644 9.676 1.00 0.00 H new ATOM 0 HD11 LEU A 65 9.537 3.195 11.483 1.00 0.00 H new ATOM 0 HD12 LEU A 65 9.162 2.368 9.952 1.00 0.00 H new ATOM 0 HD13 LEU A 65 9.871 1.456 11.306 1.00 0.00 H new ATOM 0 HD21 LEU A 65 11.611 3.633 12.210 1.00 0.00 H new ATOM 0 HD22 LEU A 65 11.927 1.883 12.144 1.00 0.00 H new ATOM 0 HD23 LEU A 65 13.081 3.024 11.414 1.00 0.00 H new ATOM 969 N THR A 66 12.792 2.832 6.755 1.00 0.00 N ATOM 970 CA THR A 66 13.299 3.944 6.013 1.00 0.00 C ATOM 971 C THR A 66 12.601 4.124 4.709 1.00 0.00 C ATOM 972 O THR A 66 12.247 5.229 4.300 1.00 0.00 O ATOM 973 CB THR A 66 14.791 3.932 5.854 1.00 0.00 C ATOM 974 OG1 THR A 66 15.346 3.973 7.160 1.00 0.00 O ATOM 975 CG2 THR A 66 15.218 5.182 5.067 1.00 0.00 C ATOM 0 H THR A 66 13.471 2.081 6.882 1.00 0.00 H new ATOM 0 HA THR A 66 13.073 4.820 6.622 1.00 0.00 H new ATOM 0 HB THR A 66 15.131 3.046 5.318 1.00 0.00 H new ATOM 0 HG1 THR A 66 15.261 3.091 7.579 1.00 0.00 H new ATOM 0 HG21 THR A 66 16.301 5.183 4.946 1.00 0.00 H new ATOM 0 HG22 THR A 66 14.743 5.174 4.086 1.00 0.00 H new ATOM 0 HG23 THR A 66 14.913 6.076 5.611 1.00 0.00 H new ATOM 983 N MET A 67 12.284 2.973 4.089 1.00 0.00 N ATOM 984 CA MET A 67 11.722 2.845 2.780 1.00 0.00 C ATOM 985 C MET A 67 10.291 3.259 2.780 1.00 0.00 C ATOM 986 O MET A 67 9.924 4.070 1.931 1.00 0.00 O ATOM 987 CB MET A 67 11.832 1.351 2.433 1.00 0.00 C ATOM 988 CG MET A 67 11.383 1.050 1.002 1.00 0.00 C ATOM 989 SD MET A 67 11.167 -0.695 0.538 1.00 0.00 S ATOM 990 CE MET A 67 9.621 -0.868 1.476 1.00 0.00 C ATOM 0 H MET A 67 12.431 2.068 4.535 1.00 0.00 H new ATOM 0 HA MET A 67 12.241 3.477 2.059 1.00 0.00 H new ATOM 0 HB2 MET A 67 12.864 1.026 2.563 1.00 0.00 H new ATOM 0 HB3 MET A 67 11.225 0.773 3.130 1.00 0.00 H new ATOM 0 HG2 MET A 67 10.436 1.563 0.832 1.00 0.00 H new ATOM 0 HG3 MET A 67 12.111 1.491 0.321 1.00 0.00 H new ATOM 0 HE1 MET A 67 9.089 -1.758 1.139 1.00 0.00 H new ATOM 0 HE2 MET A 67 9.848 -0.961 2.538 1.00 0.00 H new ATOM 0 HE3 MET A 67 8.997 0.011 1.314 1.00 0.00 H new ATOM 1000 N MET A 68 9.383 2.819 3.670 1.00 0.00 N ATOM 1001 CA MET A 68 7.999 3.168 3.757 1.00 0.00 C ATOM 1002 C MET A 68 7.716 4.504 4.351 1.00 0.00 C ATOM 1003 O MET A 68 6.648 5.102 4.225 1.00 0.00 O ATOM 1004 CB MET A 68 7.233 2.225 4.700 1.00 0.00 C ATOM 1005 CG MET A 68 7.064 0.885 3.981 1.00 0.00 C ATOM 1006 SD MET A 68 6.282 -0.440 4.950 1.00 0.00 S ATOM 1007 CE MET A 68 4.532 0.037 5.034 1.00 0.00 C ATOM 0 H MET A 68 9.646 2.155 4.398 1.00 0.00 H new ATOM 0 HA MET A 68 7.692 3.124 2.712 1.00 0.00 H new ATOM 0 HB2 MET A 68 7.779 2.092 5.634 1.00 0.00 H new ATOM 0 HB3 MET A 68 6.261 2.647 4.956 1.00 0.00 H new ATOM 0 HG2 MET A 68 6.471 1.049 3.081 1.00 0.00 H new ATOM 0 HG3 MET A 68 8.046 0.541 3.657 1.00 0.00 H new ATOM 0 HE1 MET A 68 3.978 -0.709 5.604 1.00 0.00 H new ATOM 0 HE2 MET A 68 4.442 1.007 5.523 1.00 0.00 H new ATOM 0 HE3 MET A 68 4.123 0.100 4.026 1.00 0.00 H new ATOM 1017 N ALA A 69 8.730 5.163 4.940 1.00 0.00 N ATOM 1018 CA ALA A 69 8.607 6.421 5.608 1.00 0.00 C ATOM 1019 C ALA A 69 8.781 7.518 4.615 1.00 0.00 C ATOM 1020 O ALA A 69 8.254 8.620 4.753 1.00 0.00 O ATOM 1021 CB ALA A 69 9.605 6.654 6.755 1.00 0.00 C ATOM 0 H ALA A 69 9.683 4.800 4.951 1.00 0.00 H new ATOM 0 HA ALA A 69 7.615 6.412 6.060 1.00 0.00 H new ATOM 0 HB1 ALA A 69 9.430 7.635 7.196 1.00 0.00 H new ATOM 0 HB2 ALA A 69 9.471 5.885 7.516 1.00 0.00 H new ATOM 0 HB3 ALA A 69 10.623 6.607 6.367 1.00 0.00 H new ATOM 1027 N ARG A 70 9.474 7.317 3.479 1.00 0.00 N ATOM 1028 CA ARG A 70 9.649 8.163 2.340 1.00 0.00 C ATOM 1029 C ARG A 70 8.361 8.540 1.693 1.00 0.00 C ATOM 1030 O ARG A 70 7.509 7.698 1.416 1.00 0.00 O ATOM 1031 CB ARG A 70 10.556 7.331 1.417 1.00 0.00 C ATOM 1032 CG ARG A 70 10.776 8.075 0.099 1.00 0.00 C ATOM 1033 CD ARG A 70 11.810 7.310 -0.729 1.00 0.00 C ATOM 1034 NE ARG A 70 12.207 8.027 -1.973 1.00 0.00 N ATOM 1035 CZ ARG A 70 13.078 7.480 -2.871 1.00 0.00 C ATOM 1036 NH1 ARG A 70 13.733 6.288 -2.762 1.00 0.00 N ATOM 1037 NH2 ARG A 70 13.159 8.173 -4.045 1.00 0.00 N ATOM 0 H ARG A 70 9.978 6.440 3.348 1.00 0.00 H new ATOM 0 HA ARG A 70 10.085 9.128 2.600 1.00 0.00 H new ATOM 0 HB2 ARG A 70 11.513 7.145 1.904 1.00 0.00 H new ATOM 0 HB3 ARG A 70 10.101 6.359 1.225 1.00 0.00 H new ATOM 0 HG2 ARG A 70 9.838 8.157 -0.450 1.00 0.00 H new ATOM 0 HG3 ARG A 70 11.122 9.090 0.291 1.00 0.00 H new ATOM 0 HD2 ARG A 70 12.696 7.133 -0.120 1.00 0.00 H new ATOM 0 HD3 ARG A 70 11.405 6.333 -0.993 1.00 0.00 H new ATOM 0 HE ARG A 70 11.818 8.951 -2.159 1.00 0.00 H new ATOM 0 HH11 ARG A 70 13.592 5.702 -1.939 1.00 0.00 H new ATOM 0 HH12 ARG A 70 14.364 5.983 -3.503 1.00 0.00 H new ATOM 0 HH21 ARG A 70 12.597 9.014 -4.181 1.00 0.00 H new ATOM 0 HH22 ARG A 70 13.781 7.850 -4.786 1.00 0.00 H new ATOM 1051 N LYS A 71 8.214 9.846 1.405 1.00 0.00 N ATOM 1052 CA LYS A 71 7.072 10.500 0.846 1.00 0.00 C ATOM 1053 C LYS A 71 7.290 10.580 -0.626 1.00 0.00 C ATOM 1054 O LYS A 71 8.381 10.847 -1.127 1.00 0.00 O ATOM 1055 CB LYS A 71 7.120 11.911 1.455 1.00 0.00 C ATOM 1056 CG LYS A 71 5.831 12.730 1.355 1.00 0.00 C ATOM 1057 CD LYS A 71 4.720 11.975 2.086 1.00 0.00 C ATOM 1058 CE LYS A 71 3.390 12.719 2.228 1.00 0.00 C ATOM 1059 NZ LYS A 71 2.342 11.826 2.771 1.00 0.00 N ATOM 0 H LYS A 71 8.971 10.506 1.582 1.00 0.00 H new ATOM 0 HA LYS A 71 6.123 10.000 1.041 1.00 0.00 H new ATOM 0 HB2 LYS A 71 7.389 11.822 2.507 1.00 0.00 H new ATOM 0 HB3 LYS A 71 7.920 12.468 0.967 1.00 0.00 H new ATOM 0 HG2 LYS A 71 5.973 13.716 1.797 1.00 0.00 H new ATOM 0 HG3 LYS A 71 5.560 12.885 0.311 1.00 0.00 H new ATOM 0 HD2 LYS A 71 4.536 11.038 1.560 1.00 0.00 H new ATOM 0 HD3 LYS A 71 5.078 11.716 3.082 1.00 0.00 H new ATOM 0 HE2 LYS A 71 3.518 13.579 2.886 1.00 0.00 H new ATOM 0 HE3 LYS A 71 3.078 13.104 1.257 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 1.449 12.352 2.859 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 2.207 11.019 2.129 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 2.633 11.479 3.707 1.00 0.00 H new ATOM 1073 N MET A 72 6.206 10.320 -1.379 1.00 0.00 N ATOM 1074 CA MET A 72 6.098 10.395 -2.803 1.00 0.00 C ATOM 1075 C MET A 72 5.429 11.687 -3.125 1.00 0.00 C ATOM 1076 O MET A 72 4.908 12.375 -2.249 1.00 0.00 O ATOM 1077 CB MET A 72 5.454 9.176 -3.485 1.00 0.00 C ATOM 1078 CG MET A 72 6.160 7.843 -3.234 1.00 0.00 C ATOM 1079 SD MET A 72 7.854 7.707 -3.879 1.00 0.00 S ATOM 1080 CE MET A 72 8.047 6.018 -3.239 1.00 0.00 C ATOM 0 H MET A 72 5.327 10.031 -0.950 1.00 0.00 H new ATOM 0 HA MET A 72 7.101 10.367 -3.229 1.00 0.00 H new ATOM 0 HB2 MET A 72 4.422 9.092 -3.145 1.00 0.00 H new ATOM 0 HB3 MET A 72 5.422 9.355 -4.560 1.00 0.00 H new ATOM 0 HG2 MET A 72 6.186 7.665 -2.159 1.00 0.00 H new ATOM 0 HG3 MET A 72 5.559 7.047 -3.675 1.00 0.00 H new ATOM 0 HE1 MET A 72 9.039 5.644 -3.492 1.00 0.00 H new ATOM 0 HE2 MET A 72 7.926 6.023 -2.156 1.00 0.00 H new ATOM 0 HE3 MET A 72 7.291 5.371 -3.685 1.00 0.00 H new ATOM 1090 N LYS A 73 5.373 12.098 -4.404 1.00 0.00 N ATOM 1091 CA LYS A 73 4.476 13.092 -4.908 1.00 0.00 C ATOM 1092 C LYS A 73 3.160 12.479 -5.244 1.00 0.00 C ATOM 1093 O LYS A 73 3.009 11.260 -5.311 1.00 0.00 O ATOM 1094 CB LYS A 73 4.937 13.819 -6.182 1.00 0.00 C ATOM 1095 CG LYS A 73 5.080 12.909 -7.403 1.00 0.00 C ATOM 1096 CD LYS A 73 5.565 13.727 -8.601 1.00 0.00 C ATOM 1097 CE LYS A 73 5.795 12.940 -9.893 1.00 0.00 C ATOM 1098 NZ LYS A 73 6.928 11.992 -9.806 1.00 0.00 N ATOM 0 H LYS A 73 5.986 11.717 -5.125 1.00 0.00 H new ATOM 0 HA LYS A 73 4.426 13.822 -4.100 1.00 0.00 H new ATOM 0 HB2 LYS A 73 4.224 14.611 -6.414 1.00 0.00 H new ATOM 0 HB3 LYS A 73 5.895 14.300 -5.986 1.00 0.00 H new ATOM 0 HG2 LYS A 73 5.785 12.106 -7.189 1.00 0.00 H new ATOM 0 HG3 LYS A 73 4.123 12.440 -7.634 1.00 0.00 H new ATOM 0 HD2 LYS A 73 4.836 14.512 -8.801 1.00 0.00 H new ATOM 0 HD3 LYS A 73 6.498 14.220 -8.327 1.00 0.00 H new ATOM 0 HE2 LYS A 73 4.888 12.389 -10.142 1.00 0.00 H new ATOM 0 HE3 LYS A 73 5.977 13.639 -10.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 6.979 11.431 -10.680 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 7.815 12.521 -9.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 6.788 11.357 -8.995 1.00 0.00 H new ATOM 1112 N ASP A 74 2.121 13.330 -5.330 1.00 0.00 N ATOM 1113 CA ASP A 74 0.760 12.897 -5.274 1.00 0.00 C ATOM 1114 C ASP A 74 0.255 12.040 -6.384 1.00 0.00 C ATOM 1115 O ASP A 74 -0.582 11.154 -6.219 1.00 0.00 O ATOM 1116 CB ASP A 74 -0.285 14.004 -5.057 1.00 0.00 C ATOM 1117 CG ASP A 74 0.154 14.824 -3.853 1.00 0.00 C ATOM 1118 OD1 ASP A 74 0.305 14.311 -2.712 1.00 0.00 O ATOM 1119 OD2 ASP A 74 0.436 16.033 -4.068 1.00 0.00 O ATOM 0 H ASP A 74 2.229 14.338 -5.441 1.00 0.00 H new ATOM 0 HA ASP A 74 0.852 12.276 -4.383 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -0.363 14.635 -5.942 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -1.271 13.571 -4.886 1.00 0.00 H new ATOM 1124 N THR A 75 0.813 12.259 -7.588 1.00 0.00 N ATOM 1125 CA THR A 75 0.430 11.598 -8.797 1.00 0.00 C ATOM 1126 C THR A 75 0.771 10.149 -8.853 1.00 0.00 C ATOM 1127 O THR A 75 -0.033 9.273 -9.166 1.00 0.00 O ATOM 1128 CB THR A 75 0.946 12.322 -10.006 1.00 0.00 C ATOM 1129 OG1 THR A 75 2.350 12.486 -9.881 1.00 0.00 O ATOM 1130 CG2 THR A 75 0.358 13.734 -10.169 1.00 0.00 C ATOM 0 H THR A 75 1.569 12.930 -7.725 1.00 0.00 H new ATOM 0 HA THR A 75 -0.659 11.634 -8.800 1.00 0.00 H new ATOM 0 HB THR A 75 0.658 11.719 -10.867 1.00 0.00 H new ATOM 0 HG1 THR A 75 2.696 12.957 -10.668 1.00 0.00 H new ATOM 0 HG21 THR A 75 0.774 14.200 -11.062 1.00 0.00 H new ATOM 0 HG22 THR A 75 -0.726 13.668 -10.265 1.00 0.00 H new ATOM 0 HG23 THR A 75 0.609 14.336 -9.295 1.00 0.00 H new ATOM 1138 N ASP A 76 2.010 9.956 -8.366 1.00 0.00 N ATOM 1139 CA ASP A 76 2.709 8.747 -8.057 1.00 0.00 C ATOM 1140 C ASP A 76 2.048 7.901 -7.024 1.00 0.00 C ATOM 1141 O ASP A 76 1.964 6.687 -7.205 1.00 0.00 O ATOM 1142 CB ASP A 76 4.162 8.980 -7.611 1.00 0.00 C ATOM 1143 CG ASP A 76 5.061 9.332 -8.787 1.00 0.00 C ATOM 1144 OD1 ASP A 76 4.819 9.191 -10.015 1.00 0.00 O ATOM 1145 OD2 ASP A 76 6.151 9.818 -8.381 1.00 0.00 O ATOM 0 H ASP A 76 2.598 10.764 -8.163 1.00 0.00 H new ATOM 0 HA ASP A 76 2.693 8.215 -9.008 1.00 0.00 H new ATOM 0 HB2 ASP A 76 4.193 9.784 -6.876 1.00 0.00 H new ATOM 0 HB3 ASP A 76 4.540 8.084 -7.119 1.00 0.00 H new ATOM 1150 N SER A 77 1.328 8.539 -6.085 1.00 0.00 N ATOM 1151 CA SER A 77 0.595 7.828 -5.085 1.00 0.00 C ATOM 1152 C SER A 77 -0.617 7.173 -5.653 1.00 0.00 C ATOM 1153 O SER A 77 -0.960 6.012 -5.434 1.00 0.00 O ATOM 1154 CB SER A 77 0.192 8.739 -3.912 1.00 0.00 C ATOM 1155 OG SER A 77 -0.138 7.954 -2.775 1.00 0.00 O ATOM 0 H SER A 77 1.253 9.554 -6.018 1.00 0.00 H new ATOM 0 HA SER A 77 1.264 7.055 -4.706 1.00 0.00 H new ATOM 0 HB2 SER A 77 1.010 9.417 -3.670 1.00 0.00 H new ATOM 0 HB3 SER A 77 -0.660 9.356 -4.197 1.00 0.00 H new ATOM 0 HG SER A 77 -0.392 8.543 -2.034 1.00 0.00 H new ATOM 1161 N GLU A 78 -1.447 8.040 -6.261 1.00 0.00 N ATOM 1162 CA GLU A 78 -2.738 7.660 -6.745 1.00 0.00 C ATOM 1163 C GLU A 78 -2.665 6.595 -7.785 1.00 0.00 C ATOM 1164 O GLU A 78 -3.574 5.783 -7.944 1.00 0.00 O ATOM 1165 CB GLU A 78 -3.447 8.939 -7.221 1.00 0.00 C ATOM 1166 CG GLU A 78 -4.082 9.848 -6.166 1.00 0.00 C ATOM 1167 CD GLU A 78 -5.107 10.803 -6.759 1.00 0.00 C ATOM 1168 OE1 GLU A 78 -4.818 11.352 -7.856 1.00 0.00 O ATOM 1169 OE2 GLU A 78 -6.066 11.183 -6.036 1.00 0.00 O ATOM 0 H GLU A 78 -1.218 9.021 -6.419 1.00 0.00 H new ATOM 0 HA GLU A 78 -3.323 7.203 -5.947 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -2.724 9.532 -7.780 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -4.228 8.646 -7.922 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -4.561 9.234 -5.403 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -3.301 10.422 -5.668 1.00 0.00 H new ATOM 1176 N GLU A 79 -1.618 6.694 -8.623 1.00 0.00 N ATOM 1177 CA GLU A 79 -1.461 5.793 -9.722 1.00 0.00 C ATOM 1178 C GLU A 79 -1.070 4.447 -9.215 1.00 0.00 C ATOM 1179 O GLU A 79 -1.371 3.398 -9.782 1.00 0.00 O ATOM 1180 CB GLU A 79 -0.472 6.457 -10.695 1.00 0.00 C ATOM 1181 CG GLU A 79 -0.138 5.651 -11.952 1.00 0.00 C ATOM 1182 CD GLU A 79 0.931 6.264 -12.846 1.00 0.00 C ATOM 1183 OE1 GLU A 79 2.081 6.521 -12.400 1.00 0.00 O ATOM 1184 OE2 GLU A 79 0.678 6.388 -14.074 1.00 0.00 O ATOM 0 H GLU A 79 -0.882 7.396 -8.540 1.00 0.00 H new ATOM 0 HA GLU A 79 -2.383 5.609 -10.274 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -0.882 7.420 -11.001 1.00 0.00 H new ATOM 0 HB3 GLU A 79 0.455 6.661 -10.159 1.00 0.00 H new ATOM 0 HG2 GLU A 79 0.189 4.656 -11.651 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -1.049 5.524 -12.536 1.00 0.00 H new ATOM 1191 N GLU A 80 -0.352 4.319 -8.084 1.00 0.00 N ATOM 1192 CA GLU A 80 0.071 3.157 -7.367 1.00 0.00 C ATOM 1193 C GLU A 80 -1.049 2.514 -6.623 1.00 0.00 C ATOM 1194 O GLU A 80 -1.164 1.306 -6.826 1.00 0.00 O ATOM 1195 CB GLU A 80 1.166 3.585 -6.376 1.00 0.00 C ATOM 1196 CG GLU A 80 2.088 2.472 -5.875 1.00 0.00 C ATOM 1197 CD GLU A 80 3.112 3.141 -4.969 1.00 0.00 C ATOM 1198 OE1 GLU A 80 2.736 3.605 -3.860 1.00 0.00 O ATOM 1199 OE2 GLU A 80 4.301 3.058 -5.379 1.00 0.00 O ATOM 0 H GLU A 80 -0.023 5.159 -7.608 1.00 0.00 H new ATOM 0 HA GLU A 80 0.444 2.423 -8.081 1.00 0.00 H new ATOM 0 HB2 GLU A 80 1.779 4.351 -6.851 1.00 0.00 H new ATOM 0 HB3 GLU A 80 0.687 4.049 -5.514 1.00 0.00 H new ATOM 0 HG2 GLU A 80 1.523 1.715 -5.331 1.00 0.00 H new ATOM 0 HG3 GLU A 80 2.577 1.968 -6.708 1.00 0.00 H new ATOM 1206 N ILE A 81 -1.946 3.263 -5.957 1.00 0.00 N ATOM 1207 CA ILE A 81 -3.243 2.798 -5.572 1.00 0.00 C ATOM 1208 C ILE A 81 -4.077 2.206 -6.656 1.00 0.00 C ATOM 1209 O ILE A 81 -4.650 1.127 -6.513 1.00 0.00 O ATOM 1210 CB ILE A 81 -4.006 3.841 -4.811 1.00 0.00 C ATOM 1211 CG1 ILE A 81 -3.162 4.430 -3.668 1.00 0.00 C ATOM 1212 CG2 ILE A 81 -5.380 3.292 -4.389 1.00 0.00 C ATOM 1213 CD1 ILE A 81 -2.922 3.435 -2.534 1.00 0.00 C ATOM 0 H ILE A 81 -1.762 4.226 -5.677 1.00 0.00 H new ATOM 0 HA ILE A 81 -3.025 1.958 -4.913 1.00 0.00 H new ATOM 0 HB ILE A 81 -4.215 4.692 -5.459 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -2.202 4.760 -4.065 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -3.663 5.313 -3.270 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -5.924 4.059 -3.837 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -5.948 3.011 -5.276 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -5.243 2.417 -3.754 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -2.321 3.907 -1.757 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -3.879 3.124 -2.114 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -2.395 2.563 -2.921 1.00 0.00 H new ATOM 1225 N ARG A 82 -4.132 2.823 -7.849 1.00 0.00 N ATOM 1226 CA ARG A 82 -4.872 2.511 -9.033 1.00 0.00 C ATOM 1227 C ARG A 82 -4.480 1.236 -9.697 1.00 0.00 C ATOM 1228 O ARG A 82 -5.339 0.397 -9.965 1.00 0.00 O ATOM 1229 CB ARG A 82 -4.886 3.618 -10.100 1.00 0.00 C ATOM 1230 CG ARG A 82 -5.926 3.423 -11.205 1.00 0.00 C ATOM 1231 CD ARG A 82 -5.785 4.316 -12.438 1.00 0.00 C ATOM 1232 NE ARG A 82 -4.706 3.749 -13.296 1.00 0.00 N ATOM 1233 CZ ARG A 82 -3.583 4.357 -13.776 1.00 0.00 C ATOM 1234 NH1 ARG A 82 -3.273 5.684 -13.699 1.00 0.00 N ATOM 1235 NH2 ARG A 82 -2.641 3.604 -14.416 1.00 0.00 N ATOM 0 H ARG A 82 -3.574 3.663 -7.999 1.00 0.00 H new ATOM 0 HA ARG A 82 -5.878 2.404 -8.626 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -5.070 4.574 -9.610 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -3.898 3.678 -10.556 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -5.888 2.383 -11.530 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -6.915 3.587 -10.776 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -6.726 4.359 -12.987 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -5.541 5.337 -12.143 1.00 0.00 H new ATOM 0 HE ARG A 82 -4.824 2.771 -13.561 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -3.916 6.332 -13.244 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -2.399 6.027 -14.096 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -2.782 2.600 -14.530 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -1.796 4.045 -14.780 1.00 0.00 H new ATOM 1249 N GLU A 83 -3.170 1.015 -9.909 1.00 0.00 N ATOM 1250 CA GLU A 83 -2.656 -0.272 -10.262 1.00 0.00 C ATOM 1251 C GLU A 83 -2.881 -1.372 -9.282 1.00 0.00 C ATOM 1252 O GLU A 83 -3.163 -2.509 -9.656 1.00 0.00 O ATOM 1253 CB GLU A 83 -1.168 -0.140 -10.624 1.00 0.00 C ATOM 1254 CG GLU A 83 -0.973 0.802 -11.815 1.00 0.00 C ATOM 1255 CD GLU A 83 -1.601 0.226 -13.076 1.00 0.00 C ATOM 1256 OE1 GLU A 83 -1.514 -1.015 -13.278 1.00 0.00 O ATOM 1257 OE2 GLU A 83 -2.142 1.066 -13.843 1.00 0.00 O ATOM 0 H GLU A 83 -2.457 1.741 -9.834 1.00 0.00 H new ATOM 0 HA GLU A 83 -3.245 -0.591 -11.122 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -0.613 0.236 -9.764 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -0.760 -1.122 -10.862 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -1.419 1.772 -11.593 1.00 0.00 H new ATOM 0 HG3 GLU A 83 0.091 0.971 -11.979 1.00 0.00 H new ATOM 1264 N ALA A 84 -2.804 -1.052 -7.978 1.00 0.00 N ATOM 1265 CA ALA A 84 -2.969 -2.037 -6.954 1.00 0.00 C ATOM 1266 C ALA A 84 -4.341 -2.618 -6.935 1.00 0.00 C ATOM 1267 O ALA A 84 -4.505 -3.804 -6.656 1.00 0.00 O ATOM 1268 CB ALA A 84 -2.534 -1.435 -5.608 1.00 0.00 C ATOM 0 H ALA A 84 -2.627 -0.109 -7.632 1.00 0.00 H new ATOM 0 HA ALA A 84 -2.324 -2.889 -7.167 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -2.656 -2.179 -4.820 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -1.488 -1.135 -5.665 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -3.149 -0.564 -5.383 1.00 0.00 H new ATOM 1274 N PHE A 85 -5.323 -1.756 -7.254 1.00 0.00 N ATOM 1275 CA PHE A 85 -6.702 -2.045 -7.496 1.00 0.00 C ATOM 1276 C PHE A 85 -6.940 -2.911 -8.685 1.00 0.00 C ATOM 1277 O PHE A 85 -7.641 -3.922 -8.661 1.00 0.00 O ATOM 1278 CB PHE A 85 -7.504 -0.750 -7.708 1.00 0.00 C ATOM 1279 CG PHE A 85 -8.950 -0.858 -7.365 1.00 0.00 C ATOM 1280 CD1 PHE A 85 -9.456 -0.864 -6.086 1.00 0.00 C ATOM 1281 CD2 PHE A 85 -9.907 -0.949 -8.347 1.00 0.00 C ATOM 1282 CE1 PHE A 85 -10.779 -1.097 -5.793 1.00 0.00 C ATOM 1283 CE2 PHE A 85 -11.241 -1.196 -8.123 1.00 0.00 C ATOM 1284 CZ PHE A 85 -11.668 -1.310 -6.821 1.00 0.00 C ATOM 0 H PHE A 85 -5.129 -0.759 -7.351 1.00 0.00 H new ATOM 0 HA PHE A 85 -7.031 -2.582 -6.606 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -7.058 0.042 -7.106 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -7.412 -0.447 -8.751 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -8.777 -0.675 -5.267 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -9.588 -0.817 -9.370 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -11.117 -1.113 -4.767 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -11.933 -1.297 -8.946 1.00 0.00 H new ATOM 0 HZ PHE A 85 -12.695 -1.565 -6.607 1.00 0.00 H new ATOM 1294 N ARG A 86 -6.286 -2.644 -9.829 1.00 0.00 N ATOM 1295 CA ARG A 86 -6.321 -3.542 -10.942 1.00 0.00 C ATOM 1296 C ARG A 86 -5.774 -4.902 -10.674 1.00 0.00 C ATOM 1297 O ARG A 86 -6.146 -5.891 -11.304 1.00 0.00 O ATOM 1298 CB ARG A 86 -5.501 -2.815 -12.021 1.00 0.00 C ATOM 1299 CG ARG A 86 -5.762 -3.387 -13.416 1.00 0.00 C ATOM 1300 CD ARG A 86 -4.787 -2.913 -14.496 1.00 0.00 C ATOM 1301 NE ARG A 86 -3.375 -2.909 -14.021 1.00 0.00 N ATOM 1302 CZ ARG A 86 -2.584 -4.015 -13.901 1.00 0.00 C ATOM 1303 NH1 ARG A 86 -2.815 -5.229 -14.480 1.00 0.00 N ATOM 1304 NH2 ARG A 86 -1.466 -3.923 -13.123 1.00 0.00 N ATOM 0 H ARG A 86 -5.731 -1.803 -9.984 1.00 0.00 H new ATOM 0 HA ARG A 86 -7.352 -3.751 -11.228 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -5.748 -1.753 -12.012 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -4.439 -2.897 -11.787 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -5.721 -4.475 -13.361 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -6.775 -3.121 -13.719 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -4.872 -3.560 -15.369 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -5.063 -1.908 -14.816 1.00 0.00 H new ATOM 0 HE ARG A 86 -2.967 -2.010 -13.765 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -3.641 -5.367 -15.063 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -2.162 -5.998 -14.330 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -1.243 -3.046 -12.652 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -0.854 -4.731 -13.012 1.00 0.00 H new ATOM 1318 N VAL A 87 -4.831 -5.064 -9.728 1.00 0.00 N ATOM 1319 CA VAL A 87 -4.336 -6.337 -9.305 1.00 0.00 C ATOM 1320 C VAL A 87 -5.321 -7.100 -8.488 1.00 0.00 C ATOM 1321 O VAL A 87 -5.575 -8.288 -8.678 1.00 0.00 O ATOM 1322 CB VAL A 87 -3.055 -6.208 -8.536 1.00 0.00 C ATOM 1323 CG1 VAL A 87 -2.502 -7.581 -8.120 1.00 0.00 C ATOM 1324 CG2 VAL A 87 -2.046 -5.624 -9.539 1.00 0.00 C ATOM 0 H VAL A 87 -4.398 -4.280 -9.240 1.00 0.00 H new ATOM 0 HA VAL A 87 -4.152 -6.894 -10.224 1.00 0.00 H new ATOM 0 HB VAL A 87 -3.217 -5.608 -7.640 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -1.574 -7.446 -7.565 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -3.231 -8.091 -7.490 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -2.309 -8.180 -9.010 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -1.079 -5.499 -9.051 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -1.940 -6.302 -10.386 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -2.402 -4.656 -9.892 1.00 0.00 H new ATOM 1334 N PHE A 88 -5.898 -6.413 -7.485 1.00 0.00 N ATOM 1335 CA PHE A 88 -6.983 -6.796 -6.636 1.00 0.00 C ATOM 1336 C PHE A 88 -8.180 -7.288 -7.373 1.00 0.00 C ATOM 1337 O PHE A 88 -8.590 -8.435 -7.205 1.00 0.00 O ATOM 1338 CB PHE A 88 -7.296 -5.633 -5.680 1.00 0.00 C ATOM 1339 CG PHE A 88 -7.247 -6.080 -4.259 1.00 0.00 C ATOM 1340 CD1 PHE A 88 -8.105 -7.066 -3.833 1.00 0.00 C ATOM 1341 CD2 PHE A 88 -6.396 -5.467 -3.369 1.00 0.00 C ATOM 1342 CE1 PHE A 88 -8.069 -7.478 -2.521 1.00 0.00 C ATOM 1343 CE2 PHE A 88 -6.326 -5.870 -2.057 1.00 0.00 C ATOM 1344 CZ PHE A 88 -7.222 -6.832 -1.652 1.00 0.00 C ATOM 0 H PHE A 88 -5.561 -5.481 -7.245 1.00 0.00 H new ATOM 0 HA PHE A 88 -6.673 -7.663 -6.053 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -6.579 -4.827 -5.836 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -8.283 -5.229 -5.904 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -8.803 -7.514 -4.524 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -5.771 -4.654 -3.708 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -8.693 -8.291 -2.181 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -5.601 -5.451 -1.375 1.00 0.00 H new ATOM 0 HZ PHE A 88 -7.262 -7.091 -0.604 1.00 0.00 H new ATOM 1354 N ASP A 89 -8.667 -6.502 -8.350 1.00 0.00 N ATOM 1355 CA ASP A 89 -9.855 -6.837 -9.072 1.00 0.00 C ATOM 1356 C ASP A 89 -9.571 -7.726 -10.234 1.00 0.00 C ATOM 1357 O ASP A 89 -8.858 -7.307 -11.144 1.00 0.00 O ATOM 1358 CB ASP A 89 -10.467 -5.447 -9.316 1.00 0.00 C ATOM 1359 CG ASP A 89 -11.870 -5.400 -9.905 1.00 0.00 C ATOM 1360 OD1 ASP A 89 -12.697 -6.260 -9.500 1.00 0.00 O ATOM 1361 OD2 ASP A 89 -12.040 -4.429 -10.690 1.00 0.00 O ATOM 0 H ASP A 89 -8.233 -5.626 -8.642 1.00 0.00 H new ATOM 0 HA ASP A 89 -10.584 -7.470 -8.565 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -10.481 -4.912 -8.366 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -9.802 -4.897 -9.982 1.00 0.00 H new ATOM 1366 N LYS A 90 -9.986 -9.005 -10.227 1.00 0.00 N ATOM 1367 CA LYS A 90 -9.560 -10.010 -11.151 1.00 0.00 C ATOM 1368 C LYS A 90 -10.153 -9.955 -12.517 1.00 0.00 C ATOM 1369 O LYS A 90 -9.511 -10.101 -13.556 1.00 0.00 O ATOM 1370 CB LYS A 90 -9.758 -11.379 -10.479 1.00 0.00 C ATOM 1371 CG LYS A 90 -9.142 -12.496 -11.323 1.00 0.00 C ATOM 1372 CD LYS A 90 -7.628 -12.706 -11.241 1.00 0.00 C ATOM 1373 CE LYS A 90 -7.061 -13.552 -12.382 1.00 0.00 C ATOM 1374 NZ LYS A 90 -5.586 -13.597 -12.273 1.00 0.00 N ATOM 0 H LYS A 90 -10.654 -9.356 -9.541 1.00 0.00 H new ATOM 0 HA LYS A 90 -8.508 -9.818 -11.363 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -9.302 -11.372 -9.489 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -10.822 -11.569 -10.338 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -9.625 -13.432 -11.042 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -9.397 -12.306 -12.366 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -7.135 -11.734 -11.242 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -7.388 -13.185 -10.292 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -7.471 -14.561 -12.340 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -7.353 -13.129 -13.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -5.198 -14.172 -13.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -5.204 -12.632 -12.333 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -5.318 -14.019 -11.361 1.00 0.00 H new ATOM 1388 N ASP A 91 -11.491 -9.838 -12.574 1.00 0.00 N ATOM 1389 CA ASP A 91 -12.254 -9.541 -13.746 1.00 0.00 C ATOM 1390 C ASP A 91 -11.849 -8.243 -14.355 1.00 0.00 C ATOM 1391 O ASP A 91 -11.514 -8.190 -15.537 1.00 0.00 O ATOM 1392 CB ASP A 91 -13.756 -9.710 -13.458 1.00 0.00 C ATOM 1393 CG ASP A 91 -14.232 -9.188 -12.110 1.00 0.00 C ATOM 1394 OD1 ASP A 91 -13.904 -8.054 -11.669 1.00 0.00 O ATOM 1395 OD2 ASP A 91 -14.874 -9.964 -11.353 1.00 0.00 O ATOM 0 H ASP A 91 -12.077 -9.959 -11.748 1.00 0.00 H new ATOM 0 HA ASP A 91 -12.031 -10.266 -14.529 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -14.317 -9.202 -14.242 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -14.003 -10.770 -13.525 1.00 0.00 H new ATOM 1400 N GLY A 92 -11.925 -7.206 -13.501 1.00 0.00 N ATOM 1401 CA GLY A 92 -11.706 -5.817 -13.760 1.00 0.00 C ATOM 1402 C GLY A 92 -12.994 -5.068 -13.728 1.00 0.00 C ATOM 1403 O GLY A 92 -13.123 -4.067 -14.431 1.00 0.00 O ATOM 0 H GLY A 92 -12.167 -7.362 -12.522 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -11.022 -5.407 -13.017 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -11.231 -5.693 -14.733 1.00 0.00 H new ATOM 1407 N ASN A 93 -13.955 -5.555 -12.924 1.00 0.00 N ATOM 1408 CA ASN A 93 -15.282 -5.024 -12.950 1.00 0.00 C ATOM 1409 C ASN A 93 -15.391 -3.702 -12.270 1.00 0.00 C ATOM 1410 O ASN A 93 -16.248 -2.874 -12.573 1.00 0.00 O ATOM 1411 CB ASN A 93 -16.424 -5.958 -12.515 1.00 0.00 C ATOM 1412 CG ASN A 93 -16.660 -6.264 -11.043 1.00 0.00 C ATOM 1413 OD1 ASN A 93 -15.665 -6.287 -10.320 1.00 0.00 O ATOM 1414 ND2 ASN A 93 -17.924 -6.372 -10.553 1.00 0.00 N ATOM 0 H ASN A 93 -13.814 -6.314 -12.258 1.00 0.00 H new ATOM 0 HA ASN A 93 -15.441 -4.894 -14.020 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -17.350 -5.537 -12.907 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -16.268 -6.911 -13.020 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -18.075 -6.477 -9.550 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -18.721 -6.348 -11.189 1.00 0.00 H new ATOM 1421 N GLY A 94 -14.690 -3.433 -11.154 1.00 0.00 N ATOM 1422 CA GLY A 94 -14.687 -2.199 -10.431 1.00 0.00 C ATOM 1423 C GLY A 94 -15.062 -2.410 -9.005 1.00 0.00 C ATOM 1424 O GLY A 94 -15.195 -1.449 -8.249 1.00 0.00 O ATOM 0 H GLY A 94 -14.081 -4.130 -10.727 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -13.698 -1.744 -10.486 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -15.385 -1.501 -10.894 1.00 0.00 H new ATOM 1428 N TYR A 95 -15.149 -3.701 -8.636 1.00 0.00 N ATOM 1429 CA TYR A 95 -15.507 -4.109 -7.313 1.00 0.00 C ATOM 1430 C TYR A 95 -14.778 -5.283 -6.756 1.00 0.00 C ATOM 1431 O TYR A 95 -14.726 -6.359 -7.348 1.00 0.00 O ATOM 1432 CB TYR A 95 -17.019 -4.380 -7.235 1.00 0.00 C ATOM 1433 CG TYR A 95 -17.909 -3.217 -7.510 1.00 0.00 C ATOM 1434 CD1 TYR A 95 -18.346 -2.321 -6.563 1.00 0.00 C ATOM 1435 CD2 TYR A 95 -18.499 -3.170 -8.751 1.00 0.00 C ATOM 1436 CE1 TYR A 95 -19.462 -1.558 -6.814 1.00 0.00 C ATOM 1437 CE2 TYR A 95 -19.501 -2.282 -9.064 1.00 0.00 C ATOM 1438 CZ TYR A 95 -20.003 -1.468 -8.075 1.00 0.00 C ATOM 1439 OH TYR A 95 -21.187 -0.750 -8.343 1.00 0.00 O ATOM 0 H TYR A 95 -14.967 -4.478 -9.271 1.00 0.00 H new ATOM 0 HA TYR A 95 -15.205 -3.266 -6.691 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -17.262 -5.173 -7.942 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -17.248 -4.760 -6.239 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -17.816 -2.217 -5.628 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -18.162 -3.859 -9.511 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -19.924 -1.017 -6.002 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -19.888 -2.224 -10.071 1.00 0.00 H new ATOM 0 HH TYR A 95 -21.397 -0.811 -9.298 1.00 0.00 H new ATOM 1449 N ILE A 96 -14.086 -5.192 -5.605 1.00 0.00 N ATOM 1450 CA ILE A 96 -13.439 -6.306 -4.986 1.00 0.00 C ATOM 1451 C ILE A 96 -14.402 -7.262 -4.371 1.00 0.00 C ATOM 1452 O ILE A 96 -15.188 -6.811 -3.539 1.00 0.00 O ATOM 1453 CB ILE A 96 -12.387 -5.818 -4.035 1.00 0.00 C ATOM 1454 CG1 ILE A 96 -11.401 -4.870 -4.739 1.00 0.00 C ATOM 1455 CG2 ILE A 96 -11.541 -6.969 -3.464 1.00 0.00 C ATOM 1456 CD1 ILE A 96 -10.558 -3.984 -3.824 1.00 0.00 C ATOM 0 H ILE A 96 -13.974 -4.318 -5.091 1.00 0.00 H new ATOM 0 HA ILE A 96 -12.938 -6.889 -5.759 1.00 0.00 H new ATOM 0 HB ILE A 96 -12.929 -5.311 -3.237 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -10.728 -5.468 -5.354 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -11.965 -4.228 -5.416 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -10.793 -6.567 -2.781 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -12.187 -7.663 -2.927 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -11.043 -7.494 -4.279 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -9.901 -3.359 -4.428 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -11.213 -3.350 -3.226 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -9.958 -4.610 -3.164 1.00 0.00 H new ATOM 1468 N SER A 97 -14.472 -8.527 -4.825 1.00 0.00 N ATOM 1469 CA SER A 97 -15.367 -9.459 -4.212 1.00 0.00 C ATOM 1470 C SER A 97 -14.645 -10.372 -3.281 1.00 0.00 C ATOM 1471 O SER A 97 -13.427 -10.354 -3.112 1.00 0.00 O ATOM 1472 CB SER A 97 -16.028 -10.276 -5.335 1.00 0.00 C ATOM 1473 OG SER A 97 -15.122 -11.008 -6.148 1.00 0.00 O ATOM 0 H SER A 97 -13.922 -8.899 -5.599 1.00 0.00 H new ATOM 0 HA SER A 97 -16.112 -8.920 -3.627 1.00 0.00 H new ATOM 0 HB2 SER A 97 -16.739 -10.972 -4.889 1.00 0.00 H new ATOM 0 HB3 SER A 97 -16.600 -9.599 -5.970 1.00 0.00 H new ATOM 0 HG SER A 97 -14.554 -10.385 -6.648 1.00 0.00 H new ATOM 1479 N ALA A 98 -15.355 -11.264 -2.568 1.00 0.00 N ATOM 1480 CA ALA A 98 -14.820 -12.185 -1.615 1.00 0.00 C ATOM 1481 C ALA A 98 -13.869 -13.204 -2.142 1.00 0.00 C ATOM 1482 O ALA A 98 -12.854 -13.518 -1.522 1.00 0.00 O ATOM 1483 CB ALA A 98 -16.014 -12.791 -0.858 1.00 0.00 C ATOM 0 H ALA A 98 -16.367 -11.346 -2.664 1.00 0.00 H new ATOM 0 HA ALA A 98 -14.166 -11.632 -0.941 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -15.651 -13.503 -0.117 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -16.568 -11.997 -0.358 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -16.670 -13.303 -1.563 1.00 0.00 H new ATOM 1489 N ALA A 99 -14.184 -13.669 -3.364 1.00 0.00 N ATOM 1490 CA ALA A 99 -13.515 -14.703 -4.091 1.00 0.00 C ATOM 1491 C ALA A 99 -12.169 -14.204 -4.489 1.00 0.00 C ATOM 1492 O ALA A 99 -11.116 -14.766 -4.193 1.00 0.00 O ATOM 1493 CB ALA A 99 -14.364 -15.239 -5.255 1.00 0.00 C ATOM 0 H ALA A 99 -14.973 -13.288 -3.886 1.00 0.00 H new ATOM 0 HA ALA A 99 -13.371 -15.577 -3.455 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -13.813 -16.022 -5.777 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -15.297 -15.648 -4.867 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -14.585 -14.427 -5.948 1.00 0.00 H new ATOM 1499 N GLU A 100 -12.184 -12.975 -5.037 1.00 0.00 N ATOM 1500 CA GLU A 100 -11.019 -12.254 -5.446 1.00 0.00 C ATOM 1501 C GLU A 100 -10.105 -11.858 -4.339 1.00 0.00 C ATOM 1502 O GLU A 100 -8.884 -11.903 -4.478 1.00 0.00 O ATOM 1503 CB GLU A 100 -11.462 -10.964 -6.157 1.00 0.00 C ATOM 1504 CG GLU A 100 -12.164 -11.277 -7.480 1.00 0.00 C ATOM 1505 CD GLU A 100 -12.666 -9.999 -8.136 1.00 0.00 C ATOM 1506 OE1 GLU A 100 -13.418 -9.298 -7.406 1.00 0.00 O ATOM 1507 OE2 GLU A 100 -12.468 -9.745 -9.354 1.00 0.00 O ATOM 0 H GLU A 100 -13.049 -12.461 -5.202 1.00 0.00 H new ATOM 0 HA GLU A 100 -10.464 -12.936 -6.090 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -12.134 -10.401 -5.510 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -10.594 -10.331 -6.343 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -11.475 -11.790 -8.151 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -13.000 -11.954 -7.303 1.00 0.00 H new ATOM 1514 N LEU A 101 -10.610 -11.465 -3.155 1.00 0.00 N ATOM 1515 CA LEU A 101 -9.935 -11.147 -1.935 1.00 0.00 C ATOM 1516 C LEU A 101 -9.216 -12.312 -1.347 1.00 0.00 C ATOM 1517 O LEU A 101 -8.053 -12.190 -0.964 1.00 0.00 O ATOM 1518 CB LEU A 101 -11.008 -10.607 -0.975 1.00 0.00 C ATOM 1519 CG LEU A 101 -10.568 -10.340 0.474 1.00 0.00 C ATOM 1520 CD1 LEU A 101 -9.538 -9.220 0.700 1.00 0.00 C ATOM 1521 CD2 LEU A 101 -11.784 -10.119 1.389 1.00 0.00 C ATOM 0 H LEU A 101 -11.618 -11.358 -3.045 1.00 0.00 H new ATOM 0 HA LEU A 101 -9.157 -10.407 -2.123 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -11.398 -9.677 -1.389 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -11.834 -11.318 -0.954 1.00 0.00 H new ATOM 0 HG LEU A 101 -10.035 -11.254 0.736 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -9.317 -9.138 1.764 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -8.623 -9.452 0.156 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -9.944 -8.274 0.340 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -11.444 -9.932 2.408 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -12.355 -9.261 1.034 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -12.416 -11.007 1.375 1.00 0.00 H new ATOM 1533 N ARG A 102 -9.920 -13.457 -1.307 1.00 0.00 N ATOM 1534 CA ARG A 102 -9.502 -14.672 -0.679 1.00 0.00 C ATOM 1535 C ARG A 102 -8.324 -15.226 -1.405 1.00 0.00 C ATOM 1536 O ARG A 102 -7.416 -15.805 -0.811 1.00 0.00 O ATOM 1537 CB ARG A 102 -10.601 -15.746 -0.634 1.00 0.00 C ATOM 1538 CG ARG A 102 -10.368 -16.920 0.320 1.00 0.00 C ATOM 1539 CD ARG A 102 -11.672 -17.568 0.788 1.00 0.00 C ATOM 1540 NE ARG A 102 -11.385 -18.486 1.926 1.00 0.00 N ATOM 1541 CZ ARG A 102 -12.418 -19.094 2.580 1.00 0.00 C ATOM 1542 NH1 ARG A 102 -13.736 -18.909 2.274 1.00 0.00 N ATOM 1543 NH2 ARG A 102 -12.085 -19.982 3.561 1.00 0.00 N ATOM 0 H ARG A 102 -10.839 -13.539 -1.741 1.00 0.00 H new ATOM 0 HA ARG A 102 -9.253 -14.418 0.351 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -11.539 -15.263 -0.359 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -10.731 -16.144 -1.640 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -9.752 -17.670 -0.177 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -9.808 -16.572 1.188 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -12.383 -16.801 1.095 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -12.132 -18.119 -0.032 1.00 0.00 H new ATOM 0 HE ARG A 102 -10.422 -18.659 2.215 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -14.000 -18.283 1.513 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -14.456 -19.397 2.806 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -11.104 -20.163 3.774 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -12.817 -20.465 4.082 1.00 0.00 H new ATOM 1557 N HIS A 103 -8.300 -15.195 -2.749 1.00 0.00 N ATOM 1558 CA HIS A 103 -7.233 -15.691 -3.563 1.00 0.00 C ATOM 1559 C HIS A 103 -6.023 -14.833 -3.430 1.00 0.00 C ATOM 1560 O HIS A 103 -4.920 -15.344 -3.241 1.00 0.00 O ATOM 1561 CB HIS A 103 -7.527 -15.978 -5.045 1.00 0.00 C ATOM 1562 CG HIS A 103 -8.414 -17.163 -5.287 1.00 0.00 C ATOM 1563 ND1 HIS A 103 -9.677 -17.267 -4.741 1.00 0.00 N ATOM 1564 CD2 HIS A 103 -8.134 -18.376 -5.833 1.00 0.00 C ATOM 1565 CE1 HIS A 103 -10.166 -18.501 -5.038 1.00 0.00 C ATOM 1566 NE2 HIS A 103 -9.248 -19.180 -5.700 1.00 0.00 N ATOM 0 H HIS A 103 -9.066 -14.803 -3.297 1.00 0.00 H new ATOM 0 HA HIS A 103 -7.065 -16.686 -3.150 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -7.992 -15.097 -5.487 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -6.582 -16.135 -5.565 1.00 0.00 H new ATOM 0 HD1 HIS A 103 -10.160 -16.544 -4.207 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -7.199 -18.662 -6.292 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -11.148 -18.866 -4.775 1.00 0.00 H new ATOM 1574 N VAL A 104 -6.237 -13.507 -3.361 1.00 0.00 N ATOM 1575 CA VAL A 104 -5.171 -12.562 -3.234 1.00 0.00 C ATOM 1576 C VAL A 104 -4.309 -12.692 -2.025 1.00 0.00 C ATOM 1577 O VAL A 104 -3.113 -12.959 -2.130 1.00 0.00 O ATOM 1578 CB VAL A 104 -5.703 -11.166 -3.371 1.00 0.00 C ATOM 1579 CG1 VAL A 104 -4.766 -10.021 -2.953 1.00 0.00 C ATOM 1580 CG2 VAL A 104 -6.107 -10.894 -4.830 1.00 0.00 C ATOM 0 H VAL A 104 -7.165 -13.084 -3.394 1.00 0.00 H new ATOM 0 HA VAL A 104 -4.493 -12.799 -4.054 1.00 0.00 H new ATOM 0 HB VAL A 104 -6.540 -11.155 -2.673 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -5.270 -9.066 -3.101 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -4.502 -10.133 -1.901 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -3.861 -10.051 -3.560 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -6.492 -9.878 -4.918 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -5.237 -11.010 -5.476 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -6.879 -11.602 -5.132 1.00 0.00 H new ATOM 1590 N MET A 105 -4.941 -12.681 -0.838 1.00 0.00 N ATOM 1591 CA MET A 105 -4.358 -12.781 0.464 1.00 0.00 C ATOM 1592 C MET A 105 -3.792 -14.146 0.654 1.00 0.00 C ATOM 1593 O MET A 105 -2.735 -14.357 1.247 1.00 0.00 O ATOM 1594 CB MET A 105 -5.274 -12.438 1.651 1.00 0.00 C ATOM 1595 CG MET A 105 -5.727 -10.980 1.748 1.00 0.00 C ATOM 1596 SD MET A 105 -7.066 -10.675 2.939 1.00 0.00 S ATOM 1597 CE MET A 105 -6.091 -10.939 4.449 1.00 0.00 C ATOM 0 H MET A 105 -5.956 -12.594 -0.787 1.00 0.00 H new ATOM 0 HA MET A 105 -3.587 -12.010 0.478 1.00 0.00 H new ATOM 0 HB2 MET A 105 -6.160 -13.070 1.595 1.00 0.00 H new ATOM 0 HB3 MET A 105 -4.754 -12.698 2.573 1.00 0.00 H new ATOM 0 HG2 MET A 105 -4.869 -10.365 2.022 1.00 0.00 H new ATOM 0 HG3 MET A 105 -6.054 -10.650 0.762 1.00 0.00 H new ATOM 0 HE1 MET A 105 -6.433 -11.845 4.949 1.00 0.00 H new ATOM 0 HE2 MET A 105 -5.038 -11.043 4.188 1.00 0.00 H new ATOM 0 HE3 MET A 105 -6.217 -10.087 5.117 1.00 0.00 H new ATOM 1607 N THR A 106 -4.418 -15.244 0.192 1.00 0.00 N ATOM 1608 CA THR A 106 -3.909 -16.580 0.195 1.00 0.00 C ATOM 1609 C THR A 106 -2.621 -16.784 -0.526 1.00 0.00 C ATOM 1610 O THR A 106 -1.670 -17.312 0.048 1.00 0.00 O ATOM 1611 CB THR A 106 -4.910 -17.655 -0.106 1.00 0.00 C ATOM 1612 OG1 THR A 106 -6.110 -17.566 0.647 1.00 0.00 O ATOM 1613 CG2 THR A 106 -4.360 -19.078 0.093 1.00 0.00 C ATOM 0 H THR A 106 -5.352 -15.191 -0.215 1.00 0.00 H new ATOM 0 HA THR A 106 -3.664 -16.704 1.250 1.00 0.00 H new ATOM 0 HB THR A 106 -5.130 -17.477 -1.159 1.00 0.00 H new ATOM 0 HG1 THR A 106 -6.620 -16.780 0.359 1.00 0.00 H new ATOM 0 HG21 THR A 106 -5.137 -19.805 -0.143 1.00 0.00 H new ATOM 0 HG22 THR A 106 -3.506 -19.234 -0.566 1.00 0.00 H new ATOM 0 HG23 THR A 106 -4.046 -19.205 1.129 1.00 0.00 H new ATOM 1621 N ASN A 107 -2.554 -16.187 -1.729 1.00 0.00 N ATOM 1622 CA ASN A 107 -1.385 -16.054 -2.541 1.00 0.00 C ATOM 1623 C ASN A 107 -0.229 -15.235 -2.077 1.00 0.00 C ATOM 1624 O ASN A 107 0.939 -15.532 -2.322 1.00 0.00 O ATOM 1625 CB ASN A 107 -1.684 -15.599 -3.980 1.00 0.00 C ATOM 1626 CG ASN A 107 -2.480 -16.694 -4.675 1.00 0.00 C ATOM 1627 OD1 ASN A 107 -2.323 -17.877 -4.375 1.00 0.00 O ATOM 1628 ND2 ASN A 107 -3.294 -16.269 -5.678 1.00 0.00 N ATOM 0 H ASN A 107 -3.376 -15.768 -2.164 1.00 0.00 H new ATOM 0 HA ASN A 107 -1.059 -17.091 -2.464 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -2.248 -14.666 -3.973 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -0.755 -15.406 -4.517 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -3.818 -16.947 -6.231 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -3.381 -15.272 -5.877 1.00 0.00 H new ATOM 1635 N LEU A 108 -0.482 -14.181 -1.282 1.00 0.00 N ATOM 1636 CA LEU A 108 0.437 -13.404 -0.509 1.00 0.00 C ATOM 1637 C LEU A 108 0.930 -14.130 0.695 1.00 0.00 C ATOM 1638 O LEU A 108 2.141 -14.143 0.908 1.00 0.00 O ATOM 1639 CB LEU A 108 -0.402 -12.182 -0.097 1.00 0.00 C ATOM 1640 CG LEU A 108 0.320 -10.968 0.510 1.00 0.00 C ATOM 1641 CD1 LEU A 108 1.491 -10.377 -0.294 1.00 0.00 C ATOM 1642 CD2 LEU A 108 -0.722 -9.872 0.790 1.00 0.00 C ATOM 0 H LEU A 108 -1.436 -13.838 -1.170 1.00 0.00 H new ATOM 0 HA LEU A 108 1.337 -13.156 -1.071 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -0.943 -11.839 -0.979 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -1.147 -12.519 0.624 1.00 0.00 H new ATOM 0 HG LEU A 108 0.795 -11.346 1.415 1.00 0.00 H new ATOM 0 HD11 LEU A 108 1.911 -9.528 0.245 1.00 0.00 H new ATOM 0 HD12 LEU A 108 2.260 -11.137 -0.429 1.00 0.00 H new ATOM 0 HD13 LEU A 108 1.133 -10.047 -1.269 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -0.228 -9.002 1.222 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -1.210 -9.587 -0.142 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -1.468 -10.249 1.489 1.00 0.00 H new ATOM 1654 N GLY A 109 0.100 -14.809 1.506 1.00 0.00 N ATOM 1655 CA GLY A 109 0.519 -15.563 2.647 1.00 0.00 C ATOM 1656 C GLY A 109 -0.455 -15.876 3.730 1.00 0.00 C ATOM 1657 O GLY A 109 -0.010 -16.637 4.588 1.00 0.00 O ATOM 0 H GLY A 109 -0.909 -14.834 1.360 1.00 0.00 H new ATOM 0 HA2 GLY A 109 0.914 -16.511 2.282 1.00 0.00 H new ATOM 0 HA3 GLY A 109 1.350 -15.026 3.104 1.00 0.00 H new ATOM 1661 N GLU A 110 -1.672 -15.304 3.770 1.00 0.00 N ATOM 1662 CA GLU A 110 -2.424 -15.377 4.985 1.00 0.00 C ATOM 1663 C GLU A 110 -3.444 -16.462 5.039 1.00 0.00 C ATOM 1664 O GLU A 110 -3.825 -16.984 3.993 1.00 0.00 O ATOM 1665 CB GLU A 110 -3.171 -14.044 5.157 1.00 0.00 C ATOM 1666 CG GLU A 110 -2.461 -12.768 5.612 1.00 0.00 C ATOM 1667 CD GLU A 110 -1.856 -12.921 7.000 1.00 0.00 C ATOM 1668 OE1 GLU A 110 -1.007 -13.825 7.222 1.00 0.00 O ATOM 1669 OE2 GLU A 110 -2.345 -12.253 7.951 1.00 0.00 O ATOM 0 H GLU A 110 -2.121 -14.811 2.998 1.00 0.00 H new ATOM 0 HA GLU A 110 -1.700 -15.590 5.772 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -3.637 -13.819 4.198 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -3.977 -14.225 5.868 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -1.676 -12.515 4.899 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -3.169 -11.939 5.614 1.00 0.00 H new ATOM 1676 N LYS A 111 -3.985 -16.816 6.218 1.00 0.00 N ATOM 1677 CA LYS A 111 -4.942 -17.871 6.349 1.00 0.00 C ATOM 1678 C LYS A 111 -6.321 -17.373 6.610 1.00 0.00 C ATOM 1679 O LYS A 111 -6.686 -17.000 7.724 1.00 0.00 O ATOM 1680 CB LYS A 111 -4.543 -18.740 7.554 1.00 0.00 C ATOM 1681 CG LYS A 111 -3.257 -19.558 7.423 1.00 0.00 C ATOM 1682 CD LYS A 111 -2.917 -20.409 8.648 1.00 0.00 C ATOM 1683 CE LYS A 111 -1.756 -21.388 8.465 1.00 0.00 C ATOM 1684 NZ LYS A 111 -0.413 -20.788 8.628 1.00 0.00 N ATOM 0 H LYS A 111 -3.753 -16.359 7.100 1.00 0.00 H new ATOM 0 HA LYS A 111 -4.945 -18.421 5.408 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -4.444 -18.090 8.423 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -5.363 -19.428 7.762 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -3.345 -20.212 6.555 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -2.428 -18.878 7.227 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -2.681 -19.743 9.478 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -3.804 -20.973 8.935 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -1.866 -22.200 9.183 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -1.824 -21.830 7.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 0.313 -21.519 8.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -0.283 -20.032 7.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -0.324 -20.391 9.585 1.00 0.00 H new ATOM 1698 N LEU A 112 -7.212 -17.375 5.602 1.00 0.00 N ATOM 1699 CA LEU A 112 -8.576 -16.957 5.709 1.00 0.00 C ATOM 1700 C LEU A 112 -9.557 -18.057 5.932 1.00 0.00 C ATOM 1701 O LEU A 112 -9.750 -18.908 5.066 1.00 0.00 O ATOM 1702 CB LEU A 112 -8.893 -16.194 4.412 1.00 0.00 C ATOM 1703 CG LEU A 112 -8.480 -14.713 4.408 1.00 0.00 C ATOM 1704 CD1 LEU A 112 -8.532 -14.124 2.988 1.00 0.00 C ATOM 1705 CD2 LEU A 112 -9.244 -13.813 5.393 1.00 0.00 C ATOM 0 H LEU A 112 -6.967 -17.685 4.662 1.00 0.00 H new ATOM 0 HA LEU A 112 -8.679 -16.338 6.600 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -8.395 -16.696 3.583 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -9.965 -16.257 4.225 1.00 0.00 H new ATOM 0 HG LEU A 112 -7.451 -14.719 4.768 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -8.235 -13.076 3.018 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -7.851 -14.676 2.340 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -9.547 -14.202 2.599 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -8.877 -12.790 5.311 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -10.308 -13.837 5.157 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -9.089 -14.173 6.410 1.00 0.00 H new ATOM 1717 N THR A 113 -10.227 -18.100 7.097 1.00 0.00 N ATOM 1718 CA THR A 113 -11.485 -18.729 7.355 1.00 0.00 C ATOM 1719 C THR A 113 -12.633 -18.029 6.713 1.00 0.00 C ATOM 1720 O THR A 113 -12.606 -16.826 6.457 1.00 0.00 O ATOM 1721 CB THR A 113 -11.799 -19.329 8.693 1.00 0.00 C ATOM 1722 OG1 THR A 113 -11.764 -18.460 9.815 1.00 0.00 O ATOM 1723 CG2 THR A 113 -10.714 -20.396 8.913 1.00 0.00 C ATOM 0 H THR A 113 -9.852 -17.653 7.934 1.00 0.00 H new ATOM 0 HA THR A 113 -11.300 -19.670 6.836 1.00 0.00 H new ATOM 0 HB THR A 113 -12.830 -19.678 8.648 1.00 0.00 H new ATOM 0 HG1 THR A 113 -10.886 -18.027 9.866 1.00 0.00 H new ATOM 0 HG21 THR A 113 -10.873 -20.884 9.875 1.00 0.00 H new ATOM 0 HG22 THR A 113 -10.767 -21.138 8.116 1.00 0.00 H new ATOM 0 HG23 THR A 113 -9.732 -19.923 8.904 1.00 0.00 H new ATOM 1731 N ASP A 114 -13.737 -18.753 6.455 1.00 0.00 N ATOM 1732 CA ASP A 114 -14.861 -18.214 5.755 1.00 0.00 C ATOM 1733 C ASP A 114 -15.582 -17.242 6.625 1.00 0.00 C ATOM 1734 O ASP A 114 -16.174 -16.323 6.061 1.00 0.00 O ATOM 1735 CB ASP A 114 -15.849 -19.366 5.505 1.00 0.00 C ATOM 1736 CG ASP A 114 -15.363 -20.236 4.355 1.00 0.00 C ATOM 1737 OD1 ASP A 114 -14.386 -20.972 4.656 1.00 0.00 O ATOM 1738 OD2 ASP A 114 -15.951 -20.261 3.240 1.00 0.00 O ATOM 0 H ASP A 114 -13.851 -19.727 6.736 1.00 0.00 H new ATOM 0 HA ASP A 114 -14.518 -17.736 4.837 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -15.952 -19.968 6.408 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -16.836 -18.965 5.275 1.00 0.00 H new ATOM 1743 N GLU A 115 -15.395 -17.412 7.946 1.00 0.00 N ATOM 1744 CA GLU A 115 -15.823 -16.524 8.981 1.00 0.00 C ATOM 1745 C GLU A 115 -15.299 -15.139 8.812 1.00 0.00 C ATOM 1746 O GLU A 115 -16.095 -14.202 8.773 1.00 0.00 O ATOM 1747 CB GLU A 115 -15.389 -17.160 10.313 1.00 0.00 C ATOM 1748 CG GLU A 115 -15.775 -16.394 11.580 1.00 0.00 C ATOM 1749 CD GLU A 115 -15.026 -16.951 12.783 1.00 0.00 C ATOM 1750 OE1 GLU A 115 -15.055 -18.171 13.098 1.00 0.00 O ATOM 1751 OE2 GLU A 115 -14.439 -16.138 13.546 1.00 0.00 O ATOM 0 H GLU A 115 -14.910 -18.229 8.316 1.00 0.00 H new ATOM 0 HA GLU A 115 -16.906 -16.402 8.948 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -15.818 -18.160 10.372 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -14.306 -17.279 10.300 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -15.545 -15.336 11.458 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -16.850 -16.469 11.745 1.00 0.00 H new ATOM 1758 N GLU A 116 -13.965 -15.155 8.645 1.00 0.00 N ATOM 1759 CA GLU A 116 -13.147 -14.002 8.427 1.00 0.00 C ATOM 1760 C GLU A 116 -13.478 -13.230 7.196 1.00 0.00 C ATOM 1761 O GLU A 116 -13.700 -12.025 7.296 1.00 0.00 O ATOM 1762 CB GLU A 116 -11.676 -14.449 8.471 1.00 0.00 C ATOM 1763 CG GLU A 116 -11.276 -15.137 9.778 1.00 0.00 C ATOM 1764 CD GLU A 116 -9.832 -15.557 9.539 1.00 0.00 C ATOM 1765 OE1 GLU A 116 -8.951 -14.656 9.529 1.00 0.00 O ATOM 1766 OE2 GLU A 116 -9.654 -16.803 9.586 1.00 0.00 O ATOM 0 H GLU A 116 -13.427 -16.021 8.663 1.00 0.00 H new ATOM 0 HA GLU A 116 -13.348 -13.287 9.224 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -11.489 -15.130 7.641 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -11.037 -13.579 8.320 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -11.360 -14.461 10.629 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -11.913 -15.996 9.989 1.00 0.00 H new ATOM 1773 N VAL A 117 -13.439 -13.910 6.037 1.00 0.00 N ATOM 1774 CA VAL A 117 -13.775 -13.381 4.751 1.00 0.00 C ATOM 1775 C VAL A 117 -14.988 -12.526 4.892 1.00 0.00 C ATOM 1776 O VAL A 117 -14.874 -11.310 4.745 1.00 0.00 O ATOM 1777 CB VAL A 117 -14.074 -14.424 3.716 1.00 0.00 C ATOM 1778 CG1 VAL A 117 -14.458 -13.775 2.375 1.00 0.00 C ATOM 1779 CG2 VAL A 117 -12.805 -15.260 3.483 1.00 0.00 C ATOM 0 H VAL A 117 -13.156 -14.889 5.995 1.00 0.00 H new ATOM 0 HA VAL A 117 -12.900 -12.828 4.410 1.00 0.00 H new ATOM 0 HB VAL A 117 -14.902 -15.037 4.072 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -14.670 -14.553 1.642 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -15.343 -13.154 2.512 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -13.633 -13.157 2.020 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -13.006 -16.024 2.732 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -12.001 -14.612 3.135 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -12.508 -15.738 4.416 1.00 0.00 H new ATOM 1789 N ASP A 118 -16.171 -12.997 5.325 1.00 0.00 N ATOM 1790 CA ASP A 118 -17.407 -12.315 5.553 1.00 0.00 C ATOM 1791 C ASP A 118 -17.260 -11.195 6.525 1.00 0.00 C ATOM 1792 O ASP A 118 -17.847 -10.150 6.251 1.00 0.00 O ATOM 1793 CB ASP A 118 -18.389 -13.470 5.815 1.00 0.00 C ATOM 1794 CG ASP A 118 -19.820 -13.028 6.084 1.00 0.00 C ATOM 1795 OD1 ASP A 118 -20.557 -12.465 5.232 1.00 0.00 O ATOM 1796 OD2 ASP A 118 -20.172 -13.295 7.264 1.00 0.00 O ATOM 0 H ASP A 118 -16.268 -13.989 5.543 1.00 0.00 H new ATOM 0 HA ASP A 118 -17.810 -11.724 4.730 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -18.384 -14.138 4.954 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -18.033 -14.047 6.668 1.00 0.00 H new ATOM 1801 N GLU A 119 -16.511 -11.374 7.628 1.00 0.00 N ATOM 1802 CA GLU A 119 -16.419 -10.394 8.665 1.00 0.00 C ATOM 1803 C GLU A 119 -15.633 -9.189 8.279 1.00 0.00 C ATOM 1804 O GLU A 119 -15.765 -8.127 8.885 1.00 0.00 O ATOM 1805 CB GLU A 119 -15.637 -10.946 9.869 1.00 0.00 C ATOM 1806 CG GLU A 119 -16.143 -10.272 11.145 1.00 0.00 C ATOM 1807 CD GLU A 119 -15.526 -10.703 12.468 1.00 0.00 C ATOM 1808 OE1 GLU A 119 -15.613 -11.911 12.814 1.00 0.00 O ATOM 1809 OE2 GLU A 119 -14.869 -9.888 13.170 1.00 0.00 O ATOM 0 H GLU A 119 -15.960 -12.214 7.803 1.00 0.00 H new ATOM 0 HA GLU A 119 -17.457 -10.142 8.881 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -15.766 -12.026 9.938 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -14.571 -10.759 9.742 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -15.991 -9.198 11.039 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -17.219 -10.438 11.207 1.00 0.00 H new ATOM 1816 N MET A 120 -14.867 -9.351 7.185 1.00 0.00 N ATOM 1817 CA MET A 120 -14.001 -8.429 6.519 1.00 0.00 C ATOM 1818 C MET A 120 -14.804 -7.753 5.462 1.00 0.00 C ATOM 1819 O MET A 120 -14.567 -6.561 5.275 1.00 0.00 O ATOM 1820 CB MET A 120 -12.759 -9.141 5.957 1.00 0.00 C ATOM 1821 CG MET A 120 -11.578 -9.430 6.886 1.00 0.00 C ATOM 1822 SD MET A 120 -10.104 -10.225 6.179 1.00 0.00 S ATOM 1823 CE MET A 120 -9.540 -8.945 5.021 1.00 0.00 C ATOM 0 H MET A 120 -14.858 -10.252 6.708 1.00 0.00 H new ATOM 0 HA MET A 120 -13.616 -7.683 7.214 1.00 0.00 H new ATOM 0 HB2 MET A 120 -13.088 -10.093 5.539 1.00 0.00 H new ATOM 0 HB3 MET A 120 -12.384 -8.541 5.128 1.00 0.00 H new ATOM 0 HG2 MET A 120 -11.266 -8.485 7.331 1.00 0.00 H new ATOM 0 HG3 MET A 120 -11.940 -10.061 7.698 1.00 0.00 H new ATOM 0 HE1 MET A 120 -8.453 -8.977 4.945 1.00 0.00 H new ATOM 0 HE2 MET A 120 -9.978 -9.124 4.039 1.00 0.00 H new ATOM 0 HE3 MET A 120 -9.850 -7.965 5.383 1.00 0.00 H new ATOM 1833 N ILE A 121 -15.766 -8.389 4.770 1.00 0.00 N ATOM 1834 CA ILE A 121 -16.771 -7.742 3.985 1.00 0.00 C ATOM 1835 C ILE A 121 -17.715 -6.923 4.796 1.00 0.00 C ATOM 1836 O ILE A 121 -18.052 -5.794 4.442 1.00 0.00 O ATOM 1837 CB ILE A 121 -17.567 -8.678 3.124 1.00 0.00 C ATOM 1838 CG1 ILE A 121 -16.615 -9.495 2.234 1.00 0.00 C ATOM 1839 CG2 ILE A 121 -18.549 -7.881 2.249 1.00 0.00 C ATOM 1840 CD1 ILE A 121 -15.765 -8.742 1.210 1.00 0.00 C ATOM 0 H ILE A 121 -15.847 -9.406 4.758 1.00 0.00 H new ATOM 0 HA ILE A 121 -16.194 -7.084 3.336 1.00 0.00 H new ATOM 0 HB ILE A 121 -18.134 -9.356 3.761 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -15.939 -10.047 2.887 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -17.211 -10.232 1.696 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -19.123 -8.568 1.627 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -19.228 -7.316 2.887 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -17.993 -7.193 1.612 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -15.146 -9.451 0.659 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -16.417 -8.213 0.515 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -15.125 -8.025 1.725 1.00 0.00 H new ATOM 1852 N ARG A 122 -18.070 -7.482 5.966 1.00 0.00 N ATOM 1853 CA ARG A 122 -18.662 -6.729 7.028 1.00 0.00 C ATOM 1854 C ARG A 122 -18.133 -5.376 7.359 1.00 0.00 C ATOM 1855 O ARG A 122 -18.771 -4.377 7.029 1.00 0.00 O ATOM 1856 CB ARG A 122 -18.914 -7.538 8.311 1.00 0.00 C ATOM 1857 CG ARG A 122 -20.076 -6.978 9.134 1.00 0.00 C ATOM 1858 CD ARG A 122 -21.371 -7.776 8.971 1.00 0.00 C ATOM 1859 NE ARG A 122 -21.134 -9.172 9.433 1.00 0.00 N ATOM 1860 CZ ARG A 122 -20.869 -10.244 8.631 1.00 0.00 C ATOM 1861 NH1 ARG A 122 -20.959 -10.267 7.269 1.00 0.00 N ATOM 1862 NH2 ARG A 122 -20.542 -11.479 9.113 1.00 0.00 N ATOM 0 H ARG A 122 -17.944 -8.472 6.179 1.00 0.00 H new ATOM 0 HA ARG A 122 -19.608 -6.503 6.537 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -19.125 -8.575 8.048 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -18.009 -7.541 8.919 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -19.794 -6.966 10.187 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -20.255 -5.944 8.841 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -22.173 -7.317 9.550 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -21.688 -7.772 7.928 1.00 0.00 H new ATOM 0 HE ARG A 122 -21.173 -9.342 10.438 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -21.247 -9.430 6.763 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -20.739 -11.122 6.758 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -20.486 -11.635 10.119 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -20.354 -12.245 8.467 1.00 0.00 H new ATOM 1876 N GLU A 123 -16.924 -5.342 7.948 1.00 0.00 N ATOM 1877 CA GLU A 123 -16.057 -4.292 8.385 1.00 0.00 C ATOM 1878 C GLU A 123 -15.969 -3.267 7.306 1.00 0.00 C ATOM 1879 O GLU A 123 -16.034 -2.081 7.625 1.00 0.00 O ATOM 1880 CB GLU A 123 -14.674 -4.901 8.671 1.00 0.00 C ATOM 1881 CG GLU A 123 -13.645 -3.881 9.163 1.00 0.00 C ATOM 1882 CD GLU A 123 -12.404 -4.621 9.641 1.00 0.00 C ATOM 1883 OE1 GLU A 123 -12.571 -5.617 10.395 1.00 0.00 O ATOM 1884 OE2 GLU A 123 -11.286 -4.133 9.323 1.00 0.00 O ATOM 0 H GLU A 123 -16.476 -6.235 8.153 1.00 0.00 H new ATOM 0 HA GLU A 123 -16.435 -3.817 9.290 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -14.780 -5.687 9.419 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -14.299 -5.373 7.763 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -13.386 -3.190 8.360 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -14.064 -3.285 9.974 1.00 0.00 H new ATOM 1891 N ALA A 124 -15.844 -3.609 6.011 1.00 0.00 N ATOM 1892 CA ALA A 124 -15.589 -2.612 5.019 1.00 0.00 C ATOM 1893 C ALA A 124 -16.887 -2.028 4.578 1.00 0.00 C ATOM 1894 O ALA A 124 -17.126 -0.823 4.533 1.00 0.00 O ATOM 1895 CB ALA A 124 -15.049 -3.450 3.848 1.00 0.00 C ATOM 0 H ALA A 124 -15.918 -4.562 5.655 1.00 0.00 H new ATOM 0 HA ALA A 124 -14.932 -1.812 5.361 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -14.812 -2.794 3.010 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -14.148 -3.977 4.163 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -15.804 -4.173 3.540 1.00 0.00 H new ATOM 1901 N ASP A 125 -17.822 -2.890 4.138 1.00 0.00 N ATOM 1902 CA ASP A 125 -19.008 -2.561 3.410 1.00 0.00 C ATOM 1903 C ASP A 125 -20.251 -2.294 4.187 1.00 0.00 C ATOM 1904 O ASP A 125 -21.069 -3.171 4.461 1.00 0.00 O ATOM 1905 CB ASP A 125 -19.160 -3.527 2.223 1.00 0.00 C ATOM 1906 CG ASP A 125 -19.513 -2.817 0.924 1.00 0.00 C ATOM 1907 OD1 ASP A 125 -20.680 -2.494 0.578 1.00 0.00 O ATOM 1908 OD2 ASP A 125 -18.543 -2.424 0.222 1.00 0.00 O ATOM 0 H ASP A 125 -17.741 -3.893 4.305 1.00 0.00 H new ATOM 0 HA ASP A 125 -18.854 -1.553 3.026 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -18.230 -4.079 2.089 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -19.934 -4.259 2.453 1.00 0.00 H new ATOM 1913 N ILE A 126 -20.453 -1.008 4.525 1.00 0.00 N ATOM 1914 CA ILE A 126 -21.579 -0.592 5.302 1.00 0.00 C ATOM 1915 C ILE A 126 -22.704 -0.079 4.471 1.00 0.00 C ATOM 1916 O ILE A 126 -23.826 0.017 4.967 1.00 0.00 O ATOM 1917 CB ILE A 126 -21.085 0.353 6.358 1.00 0.00 C ATOM 1918 CG1 ILE A 126 -22.090 0.411 7.520 1.00 0.00 C ATOM 1919 CG2 ILE A 126 -20.687 1.726 5.792 1.00 0.00 C ATOM 1920 CD1 ILE A 126 -21.462 0.816 8.853 1.00 0.00 C ATOM 0 H ILE A 126 -19.828 -0.248 4.256 1.00 0.00 H new ATOM 0 HA ILE A 126 -22.032 -1.449 5.801 1.00 0.00 H new ATOM 0 HB ILE A 126 -20.151 -0.035 6.765 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -22.881 1.119 7.271 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -22.560 -0.566 7.632 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -20.338 2.366 6.602 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -19.890 1.600 5.060 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -21.551 2.186 5.312 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -22.230 0.836 9.626 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -20.691 0.095 9.126 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -21.016 1.806 8.759 1.00 0.00 H new ATOM 1932 N ASP A 127 -22.484 0.275 3.193 1.00 0.00 N ATOM 1933 CA ASP A 127 -23.379 0.984 2.332 1.00 0.00 C ATOM 1934 C ASP A 127 -24.525 0.189 1.808 1.00 0.00 C ATOM 1935 O ASP A 127 -25.698 0.555 1.866 1.00 0.00 O ATOM 1936 CB ASP A 127 -22.517 1.662 1.254 1.00 0.00 C ATOM 1937 CG ASP A 127 -21.572 0.702 0.546 1.00 0.00 C ATOM 1938 OD1 ASP A 127 -20.519 0.210 1.033 1.00 0.00 O ATOM 1939 OD2 ASP A 127 -21.884 0.393 -0.636 1.00 0.00 O ATOM 0 H ASP A 127 -21.607 0.046 2.724 1.00 0.00 H new ATOM 0 HA ASP A 127 -23.914 1.738 2.909 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -23.170 2.128 0.516 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -21.935 2.461 1.714 1.00 0.00 H new ATOM 1944 N GLY A 128 -24.292 -1.015 1.257 1.00 0.00 N ATOM 1945 CA GLY A 128 -25.402 -1.867 0.963 1.00 0.00 C ATOM 1946 C GLY A 128 -25.117 -3.117 0.203 1.00 0.00 C ATOM 1947 O GLY A 128 -25.687 -4.188 0.405 1.00 0.00 O ATOM 0 H GLY A 128 -23.373 -1.389 1.022 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -25.874 -2.145 1.905 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -26.133 -1.288 0.399 1.00 0.00 H new ATOM 1951 N ASP A 129 -24.365 -2.941 -0.898 1.00 0.00 N ATOM 1952 CA ASP A 129 -24.059 -3.957 -1.857 1.00 0.00 C ATOM 1953 C ASP A 129 -23.168 -5.070 -1.425 1.00 0.00 C ATOM 1954 O ASP A 129 -23.307 -6.212 -1.861 1.00 0.00 O ATOM 1955 CB ASP A 129 -23.591 -3.327 -3.180 1.00 0.00 C ATOM 1956 CG ASP A 129 -22.480 -2.295 -3.046 1.00 0.00 C ATOM 1957 OD1 ASP A 129 -21.567 -2.389 -2.183 1.00 0.00 O ATOM 1958 OD2 ASP A 129 -22.576 -1.289 -3.798 1.00 0.00 O ATOM 0 H ASP A 129 -23.948 -2.040 -1.132 1.00 0.00 H new ATOM 0 HA ASP A 129 -25.010 -4.472 -1.996 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -23.249 -4.122 -3.842 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -24.447 -2.856 -3.663 1.00 0.00 H new ATOM 1963 N GLY A 130 -22.122 -4.821 -0.618 1.00 0.00 N ATOM 1964 CA GLY A 130 -21.195 -5.817 -0.177 1.00 0.00 C ATOM 1965 C GLY A 130 -19.914 -5.742 -0.934 1.00 0.00 C ATOM 1966 O GLY A 130 -18.946 -6.452 -0.667 1.00 0.00 O ATOM 0 H GLY A 130 -21.913 -3.890 -0.258 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -20.998 -5.687 0.887 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -21.635 -6.806 -0.301 1.00 0.00 H new ATOM 1970 N GLN A 131 -19.991 -4.885 -1.969 1.00 0.00 N ATOM 1971 CA GLN A 131 -19.023 -4.801 -3.018 1.00 0.00 C ATOM 1972 C GLN A 131 -18.141 -3.611 -2.856 1.00 0.00 C ATOM 1973 O GLN A 131 -18.637 -2.491 -2.741 1.00 0.00 O ATOM 1974 CB GLN A 131 -19.647 -4.705 -4.420 1.00 0.00 C ATOM 1975 CG GLN A 131 -20.649 -5.835 -4.662 1.00 0.00 C ATOM 1976 CD GLN A 131 -21.492 -5.608 -5.910 1.00 0.00 C ATOM 1977 OE1 GLN A 131 -21.706 -4.361 -6.410 1.00 0.00 O flip ATOM 1978 NE2 GLN A 131 -21.760 -6.634 -6.533 1.00 0.00 N flip ATOM 0 H GLN A 131 -20.760 -4.224 -2.079 1.00 0.00 H new ATOM 0 HA GLN A 131 -18.456 -5.728 -2.938 1.00 0.00 H new ATOM 0 HB2 GLN A 131 -20.147 -3.743 -4.533 1.00 0.00 H new ATOM 0 HB3 GLN A 131 -18.861 -4.746 -5.174 1.00 0.00 H new ATOM 0 HG2 GLN A 131 -20.112 -6.779 -4.757 1.00 0.00 H new ATOM 0 HG3 GLN A 131 -21.305 -5.927 -3.796 1.00 0.00 H new ATOM 0 HE21 GLN A 131 -21.581 -7.547 -6.114 1.00 0.00 H new ATOM 0 HE22 GLN A 131 -22.162 -6.572 -7.469 1.00 0.00 H new ATOM 1987 N VAL A 132 -16.815 -3.834 -2.833 1.00 0.00 N ATOM 1988 CA VAL A 132 -15.871 -2.816 -2.491 1.00 0.00 C ATOM 1989 C VAL A 132 -15.439 -2.040 -3.688 1.00 0.00 C ATOM 1990 O VAL A 132 -14.697 -2.662 -4.446 1.00 0.00 O ATOM 1991 CB VAL A 132 -14.635 -3.214 -1.741 1.00 0.00 C ATOM 1992 CG1 VAL A 132 -13.889 -1.961 -1.252 1.00 0.00 C ATOM 1993 CG2 VAL A 132 -15.138 -3.942 -0.482 1.00 0.00 C ATOM 0 H VAL A 132 -16.392 -4.735 -3.055 1.00 0.00 H new ATOM 0 HA VAL A 132 -16.459 -2.225 -1.789 1.00 0.00 H new ATOM 0 HB VAL A 132 -13.977 -3.814 -2.369 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -12.993 -2.260 -0.708 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -13.607 -1.348 -2.108 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -14.538 -1.385 -0.592 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -14.286 -4.263 0.117 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -15.760 -3.266 0.105 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -15.724 -4.813 -0.775 1.00 0.00 H new ATOM 2003 N ASN A 133 -15.947 -0.824 -3.955 1.00 0.00 N ATOM 2004 CA ASN A 133 -15.407 -0.021 -5.008 1.00 0.00 C ATOM 2005 C ASN A 133 -14.153 0.757 -4.799 1.00 0.00 C ATOM 2006 O ASN A 133 -13.442 0.565 -3.814 1.00 0.00 O ATOM 2007 CB ASN A 133 -16.559 0.809 -5.598 1.00 0.00 C ATOM 2008 CG ASN A 133 -16.962 2.042 -4.802 1.00 0.00 C ATOM 2009 OD1 ASN A 133 -16.206 2.938 -4.430 1.00 0.00 O ATOM 2010 ND2 ASN A 133 -18.254 2.096 -4.380 1.00 0.00 N ATOM 0 H ASN A 133 -16.724 -0.400 -3.448 1.00 0.00 H new ATOM 0 HA ASN A 133 -14.997 -0.740 -5.717 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -16.277 1.124 -6.603 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -17.432 0.164 -5.699 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -18.562 2.860 -3.778 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -18.914 1.373 -4.665 1.00 0.00 H new ATOM 2017 N TYR A 134 -13.794 1.715 -5.672 1.00 0.00 N ATOM 2018 CA TYR A 134 -12.506 2.334 -5.642 1.00 0.00 C ATOM 2019 C TYR A 134 -12.297 3.153 -4.414 1.00 0.00 C ATOM 2020 O TYR A 134 -11.392 2.936 -3.610 1.00 0.00 O ATOM 2021 CB TYR A 134 -12.291 3.086 -6.966 1.00 0.00 C ATOM 2022 CG TYR A 134 -10.910 3.626 -7.113 1.00 0.00 C ATOM 2023 CD1 TYR A 134 -9.923 2.858 -7.684 1.00 0.00 C ATOM 2024 CD2 TYR A 134 -10.604 4.895 -6.683 1.00 0.00 C ATOM 2025 CE1 TYR A 134 -8.655 3.379 -7.796 1.00 0.00 C ATOM 2026 CE2 TYR A 134 -9.339 5.430 -6.734 1.00 0.00 C ATOM 2027 CZ TYR A 134 -8.371 4.622 -7.282 1.00 0.00 C ATOM 2028 OH TYR A 134 -7.046 5.095 -7.396 1.00 0.00 O ATOM 0 H TYR A 134 -14.406 2.065 -6.409 1.00 0.00 H new ATOM 0 HA TYR A 134 -11.727 1.575 -5.569 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -12.502 2.414 -7.797 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -13.005 3.907 -7.031 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -10.140 1.861 -8.039 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -11.401 5.505 -6.283 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -7.881 2.810 -8.289 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -9.119 6.422 -6.367 1.00 0.00 H new ATOM 0 HH TYR A 134 -6.981 5.986 -6.994 1.00 0.00 H new ATOM 2038 N GLU A 135 -13.111 4.208 -4.237 1.00 0.00 N ATOM 2039 CA GLU A 135 -13.070 5.195 -3.203 1.00 0.00 C ATOM 2040 C GLU A 135 -13.335 4.544 -1.889 1.00 0.00 C ATOM 2041 O GLU A 135 -12.778 4.928 -0.862 1.00 0.00 O ATOM 2042 CB GLU A 135 -14.179 6.221 -3.487 1.00 0.00 C ATOM 2043 CG GLU A 135 -13.793 7.248 -4.554 1.00 0.00 C ATOM 2044 CD GLU A 135 -14.934 8.213 -4.839 1.00 0.00 C ATOM 2045 OE1 GLU A 135 -15.969 7.801 -5.428 1.00 0.00 O ATOM 2046 OE2 GLU A 135 -14.978 9.387 -4.383 1.00 0.00 O ATOM 0 H GLU A 135 -13.877 4.386 -4.887 1.00 0.00 H new ATOM 0 HA GLU A 135 -12.094 5.679 -3.176 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -15.078 5.695 -3.807 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -14.427 6.743 -2.563 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -12.917 7.806 -4.223 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -13.514 6.732 -5.473 1.00 0.00 H new ATOM 2053 N GLU A 136 -14.137 3.473 -1.755 1.00 0.00 N ATOM 2054 CA GLU A 136 -14.240 2.654 -0.587 1.00 0.00 C ATOM 2055 C GLU A 136 -13.014 1.941 -0.130 1.00 0.00 C ATOM 2056 O GLU A 136 -12.746 1.778 1.059 1.00 0.00 O ATOM 2057 CB GLU A 136 -15.362 1.614 -0.740 1.00 0.00 C ATOM 2058 CG GLU A 136 -16.778 2.178 -0.880 1.00 0.00 C ATOM 2059 CD GLU A 136 -17.806 1.121 -1.259 1.00 0.00 C ATOM 2060 OE1 GLU A 136 -17.410 -0.049 -1.508 1.00 0.00 O ATOM 2061 OE2 GLU A 136 -19.035 1.391 -1.312 1.00 0.00 O ATOM 0 H GLU A 136 -14.750 3.160 -2.508 1.00 0.00 H new ATOM 0 HA GLU A 136 -14.449 3.393 0.186 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -15.147 1.001 -1.616 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -15.339 0.952 0.126 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -17.073 2.642 0.061 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -16.777 2.963 -1.636 1.00 0.00 H new ATOM 2068 N PHE A 137 -12.268 1.396 -1.108 1.00 0.00 N ATOM 2069 CA PHE A 137 -11.009 0.741 -0.934 1.00 0.00 C ATOM 2070 C PHE A 137 -10.075 1.804 -0.466 1.00 0.00 C ATOM 2071 O PHE A 137 -9.250 1.613 0.426 1.00 0.00 O ATOM 2072 CB PHE A 137 -10.597 0.092 -2.266 1.00 0.00 C ATOM 2073 CG PHE A 137 -9.460 -0.846 -2.049 1.00 0.00 C ATOM 2074 CD1 PHE A 137 -9.624 -1.962 -1.262 1.00 0.00 C ATOM 2075 CD2 PHE A 137 -8.235 -0.550 -2.599 1.00 0.00 C ATOM 2076 CE1 PHE A 137 -8.587 -2.850 -1.105 1.00 0.00 C ATOM 2077 CE2 PHE A 137 -7.172 -1.400 -2.404 1.00 0.00 C ATOM 2078 CZ PHE A 137 -7.373 -2.550 -1.677 1.00 0.00 C ATOM 0 H PHE A 137 -12.565 1.415 -2.084 1.00 0.00 H new ATOM 0 HA PHE A 137 -11.024 -0.069 -0.205 1.00 0.00 H new ATOM 0 HB2 PHE A 137 -11.444 -0.444 -2.695 1.00 0.00 H new ATOM 0 HB3 PHE A 137 -10.311 0.863 -2.982 1.00 0.00 H new ATOM 0 HD1 PHE A 137 -10.567 -2.140 -0.768 1.00 0.00 H new ATOM 0 HD2 PHE A 137 -8.108 0.349 -3.184 1.00 0.00 H new ATOM 0 HE1 PHE A 137 -8.723 -3.763 -0.545 1.00 0.00 H new ATOM 0 HE2 PHE A 137 -6.199 -1.169 -2.813 1.00 0.00 H new ATOM 0 HZ PHE A 137 -6.551 -3.239 -1.551 1.00 0.00 H new ATOM 2088 N VAL A 138 -10.066 3.046 -0.982 1.00 0.00 N ATOM 2089 CA VAL A 138 -9.254 4.164 -0.613 1.00 0.00 C ATOM 2090 C VAL A 138 -9.603 4.640 0.755 1.00 0.00 C ATOM 2091 O VAL A 138 -8.675 4.837 1.538 1.00 0.00 O ATOM 2092 CB VAL A 138 -9.320 5.260 -1.635 1.00 0.00 C ATOM 2093 CG1 VAL A 138 -8.539 6.523 -1.235 1.00 0.00 C ATOM 2094 CG2 VAL A 138 -8.776 4.798 -2.997 1.00 0.00 C ATOM 0 H VAL A 138 -10.700 3.291 -1.743 1.00 0.00 H new ATOM 0 HA VAL A 138 -8.215 3.834 -0.587 1.00 0.00 H new ATOM 0 HB VAL A 138 -10.380 5.506 -1.700 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -8.632 7.272 -2.021 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -8.943 6.921 -0.305 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -7.488 6.272 -1.095 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -8.840 5.619 -3.712 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -7.736 4.492 -2.888 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -9.366 3.956 -3.358 1.00 0.00 H new ATOM 2104 N GLN A 139 -10.854 4.839 1.209 1.00 0.00 N ATOM 2105 CA GLN A 139 -11.185 5.164 2.562 1.00 0.00 C ATOM 2106 C GLN A 139 -10.784 4.163 3.590 1.00 0.00 C ATOM 2107 O GLN A 139 -10.509 4.515 4.736 1.00 0.00 O ATOM 2108 CB GLN A 139 -12.704 5.386 2.468 1.00 0.00 C ATOM 2109 CG GLN A 139 -13.363 6.148 3.620 1.00 0.00 C ATOM 2110 CD GLN A 139 -13.130 7.651 3.586 1.00 0.00 C ATOM 2111 OE1 GLN A 139 -12.250 8.216 2.939 1.00 0.00 O ATOM 2112 NE2 GLN A 139 -14.039 8.409 4.257 1.00 0.00 N ATOM 0 H GLN A 139 -11.672 4.770 0.604 1.00 0.00 H new ATOM 0 HA GLN A 139 -10.628 6.028 2.925 1.00 0.00 H new ATOM 0 HB2 GLN A 139 -12.912 5.923 1.543 1.00 0.00 H new ATOM 0 HB3 GLN A 139 -13.185 4.411 2.386 1.00 0.00 H new ATOM 0 HG2 GLN A 139 -14.436 5.957 3.600 1.00 0.00 H new ATOM 0 HG3 GLN A 139 -12.986 5.754 4.564 1.00 0.00 H new ATOM 0 HE21 GLN A 139 -14.777 7.960 4.799 1.00 0.00 H new ATOM 0 HE22 GLN A 139 -13.983 9.427 4.218 1.00 0.00 H new ATOM 2121 N MET A 140 -10.809 2.860 3.257 1.00 0.00 N ATOM 2122 CA MET A 140 -10.260 1.800 4.044 1.00 0.00 C ATOM 2123 C MET A 140 -8.801 1.943 4.312 1.00 0.00 C ATOM 2124 O MET A 140 -8.264 1.742 5.400 1.00 0.00 O ATOM 2125 CB MET A 140 -10.687 0.455 3.434 1.00 0.00 C ATOM 2126 CG MET A 140 -10.290 -0.752 4.287 1.00 0.00 C ATOM 2127 SD MET A 140 -11.091 -2.290 3.742 1.00 0.00 S ATOM 2128 CE MET A 140 -11.090 -2.186 1.929 1.00 0.00 C ATOM 0 H MET A 140 -11.236 2.529 2.392 1.00 0.00 H new ATOM 0 HA MET A 140 -10.676 1.849 5.050 1.00 0.00 H new ATOM 0 HB2 MET A 140 -11.768 0.454 3.297 1.00 0.00 H new ATOM 0 HB3 MET A 140 -10.240 0.355 2.445 1.00 0.00 H new ATOM 0 HG2 MET A 140 -9.208 -0.878 4.250 1.00 0.00 H new ATOM 0 HG3 MET A 140 -10.553 -0.559 5.327 1.00 0.00 H new ATOM 0 HE1 MET A 140 -11.252 -3.178 1.508 1.00 0.00 H new ATOM 0 HE2 MET A 140 -11.887 -1.518 1.602 1.00 0.00 H new ATOM 0 HE3 MET A 140 -10.130 -1.799 1.587 1.00 0.00 H new ATOM 2138 N MET A 141 -7.978 2.375 3.340 1.00 0.00 N ATOM 2139 CA MET A 141 -6.564 2.564 3.435 1.00 0.00 C ATOM 2140 C MET A 141 -6.122 3.827 4.089 1.00 0.00 C ATOM 2141 O MET A 141 -5.155 3.824 4.850 1.00 0.00 O ATOM 2142 CB MET A 141 -5.933 2.540 2.033 1.00 0.00 C ATOM 2143 CG MET A 141 -5.844 1.092 1.545 1.00 0.00 C ATOM 2144 SD MET A 141 -5.028 0.541 0.017 1.00 0.00 S ATOM 2145 CE MET A 141 -6.075 1.666 -0.950 1.00 0.00 C ATOM 0 H MET A 141 -8.332 2.611 2.413 1.00 0.00 H new ATOM 0 HA MET A 141 -6.233 1.741 4.069 1.00 0.00 H new ATOM 0 HB2 MET A 141 -6.532 3.133 1.342 1.00 0.00 H new ATOM 0 HB3 MET A 141 -4.940 2.989 2.060 1.00 0.00 H new ATOM 0 HG2 MET A 141 -5.369 0.535 2.353 1.00 0.00 H new ATOM 0 HG3 MET A 141 -6.873 0.738 1.476 1.00 0.00 H new ATOM 0 HE1 MET A 141 -6.076 1.354 -1.994 1.00 0.00 H new ATOM 0 HE2 MET A 141 -7.093 1.639 -0.562 1.00 0.00 H new ATOM 0 HE3 MET A 141 -5.685 2.681 -0.875 1.00 0.00 H new ATOM 2155 N THR A 142 -6.815 4.967 3.918 1.00 0.00 N ATOM 2156 CA THR A 142 -6.465 6.265 4.408 1.00 0.00 C ATOM 2157 C THR A 142 -7.145 6.745 5.682 1.00 0.00 C ATOM 2158 O THR A 142 -8.051 6.083 6.256 1.00 0.00 O ATOM 2159 CB THR A 142 -6.777 7.307 3.376 1.00 0.00 C ATOM 2160 OG1 THR A 142 -8.144 7.258 2.993 1.00 0.00 O ATOM 2161 CG2 THR A 142 -5.987 7.129 2.069 1.00 0.00 C ATOM 0 H THR A 142 -7.690 4.981 3.395 1.00 0.00 H new ATOM 0 HA THR A 142 -5.406 6.143 4.636 1.00 0.00 H new ATOM 0 HB THR A 142 -6.509 8.248 3.856 1.00 0.00 H new ATOM 0 HG1 THR A 142 -8.285 6.508 2.378 1.00 0.00 H new ATOM 0 HG21 THR A 142 -6.262 7.917 1.368 1.00 0.00 H new ATOM 0 HG22 THR A 142 -4.919 7.186 2.279 1.00 0.00 H new ATOM 0 HG23 THR A 142 -6.219 6.157 1.633 1.00 0.00 H new ATOM 2170 N ARG B 1 -9.125 -2.816 10.364 1.00 0.00 N ATOM 2171 CA ARG B 1 -8.237 -3.342 11.425 1.00 0.00 C ATOM 2172 C ARG B 1 -6.867 -3.687 10.952 1.00 0.00 C ATOM 2173 O ARG B 1 -6.042 -2.821 10.666 1.00 0.00 O ATOM 2174 CB ARG B 1 -8.965 -4.520 12.094 1.00 0.00 C ATOM 2175 CG ARG B 1 -10.189 -4.034 12.873 1.00 0.00 C ATOM 2176 CD ARG B 1 -11.059 -5.165 13.425 1.00 0.00 C ATOM 2177 NE ARG B 1 -12.203 -4.544 14.150 1.00 0.00 N ATOM 2178 CZ ARG B 1 -13.504 -4.614 13.742 1.00 0.00 C ATOM 2179 NH1 ARG B 1 -13.883 -5.242 12.591 1.00 0.00 N ATOM 2180 NH2 ARG B 1 -14.448 -4.096 14.581 1.00 0.00 N ATOM 0 H1 ARG B 1 -9.557 -1.925 10.683 1.00 0.00 H new ATOM 0 H2 ARG B 1 -8.570 -2.643 9.501 1.00 0.00 H new ATOM 0 H3 ARG B 1 -9.872 -3.510 10.161 1.00 0.00 H new ATOM 0 HA ARG B 1 -8.049 -2.557 12.158 1.00 0.00 H new ATOM 0 HB2 ARG B 1 -9.274 -5.240 11.336 1.00 0.00 H new ATOM 0 HB3 ARG B 1 -8.283 -5.039 12.767 1.00 0.00 H new ATOM 0 HG2 ARG B 1 -9.856 -3.407 13.700 1.00 0.00 H new ATOM 0 HG3 ARG B 1 -10.797 -3.406 12.222 1.00 0.00 H new ATOM 0 HD2 ARG B 1 -11.419 -5.801 12.616 1.00 0.00 H new ATOM 0 HD3 ARG B 1 -10.480 -5.800 14.096 1.00 0.00 H new ATOM 0 HE ARG B 1 -12.001 -4.032 15.009 1.00 0.00 H new ATOM 0 HH11 ARG B 1 -13.182 -5.684 11.996 1.00 0.00 H new ATOM 0 HH12 ARG B 1 -14.867 -5.270 12.325 1.00 0.00 H new ATOM 0 HH21 ARG B 1 -14.168 -3.680 15.469 1.00 0.00 H new ATOM 0 HH22 ARG B 1 -15.434 -4.125 14.320 1.00 0.00 H new ATOM 2193 N ARG B 2 -6.451 -4.961 10.834 1.00 0.00 N ATOM 2194 CA ARG B 2 -5.133 -5.267 10.372 1.00 0.00 C ATOM 2195 C ARG B 2 -5.187 -5.883 9.016 1.00 0.00 C ATOM 2196 O ARG B 2 -4.456 -5.522 8.095 1.00 0.00 O ATOM 2197 CB ARG B 2 -4.534 -6.333 11.306 1.00 0.00 C ATOM 2198 CG ARG B 2 -4.291 -5.777 12.710 1.00 0.00 C ATOM 2199 CD ARG B 2 -4.005 -6.818 13.794 1.00 0.00 C ATOM 2200 NE ARG B 2 -2.866 -7.700 13.411 1.00 0.00 N ATOM 2201 CZ ARG B 2 -2.294 -8.645 14.213 1.00 0.00 C ATOM 2202 NH1 ARG B 2 -2.780 -9.014 15.434 1.00 0.00 N ATOM 2203 NH2 ARG B 2 -1.174 -9.285 13.768 1.00 0.00 N ATOM 0 H ARG B 2 -7.024 -5.775 11.057 1.00 0.00 H new ATOM 0 HA ARG B 2 -4.547 -4.348 10.351 1.00 0.00 H new ATOM 0 HB2 ARG B 2 -5.208 -7.188 11.364 1.00 0.00 H new ATOM 0 HB3 ARG B 2 -3.594 -6.696 10.890 1.00 0.00 H new ATOM 0 HG2 ARG B 2 -3.451 -5.084 12.666 1.00 0.00 H new ATOM 0 HG3 ARG B 2 -5.166 -5.199 13.009 1.00 0.00 H new ATOM 0 HD2 ARG B 2 -3.778 -6.315 14.734 1.00 0.00 H new ATOM 0 HD3 ARG B 2 -4.895 -7.423 13.964 1.00 0.00 H new ATOM 0 HE ARG B 2 -2.482 -7.588 12.472 1.00 0.00 H new ATOM 0 HH11 ARG B 2 -3.624 -8.575 15.801 1.00 0.00 H new ATOM 0 HH12 ARG B 2 -2.299 -9.729 15.979 1.00 0.00 H new ATOM 0 HH21 ARG B 2 -0.783 -9.053 12.855 1.00 0.00 H new ATOM 0 HH22 ARG B 2 -0.728 -9.995 14.349 1.00 0.00 H new ATOM 2217 N LYS B 3 -6.050 -6.896 8.824 1.00 0.00 N ATOM 2218 CA LYS B 3 -6.182 -7.783 7.710 1.00 0.00 C ATOM 2219 C LYS B 3 -6.388 -7.146 6.379 1.00 0.00 C ATOM 2220 O LYS B 3 -5.802 -7.574 5.386 1.00 0.00 O ATOM 2221 CB LYS B 3 -7.228 -8.883 7.958 1.00 0.00 C ATOM 2222 CG LYS B 3 -6.875 -9.843 9.096 1.00 0.00 C ATOM 2223 CD LYS B 3 -7.870 -10.976 9.357 1.00 0.00 C ATOM 2224 CE LYS B 3 -7.864 -11.609 10.750 1.00 0.00 C ATOM 2225 NZ LYS B 3 -9.066 -12.446 10.963 1.00 0.00 N ATOM 0 H LYS B 3 -6.740 -7.117 9.542 1.00 0.00 H new ATOM 0 HA LYS B 3 -5.193 -8.236 7.646 1.00 0.00 H new ATOM 0 HB2 LYS B 3 -8.187 -8.413 8.179 1.00 0.00 H new ATOM 0 HB3 LYS B 3 -7.358 -9.458 7.041 1.00 0.00 H new ATOM 0 HG2 LYS B 3 -5.902 -10.284 8.882 1.00 0.00 H new ATOM 0 HG3 LYS B 3 -6.768 -9.263 10.013 1.00 0.00 H new ATOM 0 HD2 LYS B 3 -8.873 -10.595 9.164 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -7.683 -11.764 8.628 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -6.968 -12.217 10.872 1.00 0.00 H new ATOM 0 HE3 LYS B 3 -7.824 -10.826 11.508 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -9.276 -12.499 11.980 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -9.875 -12.025 10.463 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -8.892 -13.403 10.595 1.00 0.00 H new ATOM 2239 N TRP B 4 -7.156 -6.043 6.325 1.00 0.00 N ATOM 2240 CA TRP B 4 -7.200 -5.347 5.077 1.00 0.00 C ATOM 2241 C TRP B 4 -6.031 -4.478 4.765 1.00 0.00 C ATOM 2242 O TRP B 4 -5.492 -4.516 3.659 1.00 0.00 O ATOM 2243 CB TRP B 4 -8.428 -4.421 5.095 1.00 0.00 C ATOM 2244 CG TRP B 4 -9.750 -5.101 4.830 1.00 0.00 C ATOM 2245 CD1 TRP B 4 -10.818 -5.182 5.676 1.00 0.00 C ATOM 2246 CD2 TRP B 4 -10.186 -5.660 3.577 1.00 0.00 C ATOM 2247 NE1 TRP B 4 -11.917 -5.612 4.981 1.00 0.00 N ATOM 2248 CE2 TRP B 4 -11.572 -5.833 3.669 1.00 0.00 C ATOM 2249 CE3 TRP B 4 -9.569 -5.828 2.367 1.00 0.00 C ATOM 2250 CZ2 TRP B 4 -12.284 -6.331 2.612 1.00 0.00 C ATOM 2251 CZ3 TRP B 4 -10.319 -6.133 1.256 1.00 0.00 C ATOM 2252 CH2 TRP B 4 -11.669 -6.363 1.383 1.00 0.00 C ATOM 0 H TRP B 4 -7.711 -5.653 7.087 1.00 0.00 H new ATOM 0 HA TRP B 4 -7.219 -6.131 4.320 1.00 0.00 H new ATOM 0 HB2 TRP B 4 -8.479 -3.930 6.067 1.00 0.00 H new ATOM 0 HB3 TRP B 4 -8.284 -3.639 4.350 1.00 0.00 H new ATOM 0 HD1 TRP B 4 -10.799 -4.944 6.729 1.00 0.00 H new ATOM 0 HE1 TRP B 4 -12.848 -5.747 5.376 1.00 0.00 H new ATOM 0 HE3 TRP B 4 -8.497 -5.721 2.285 1.00 0.00 H new ATOM 0 HZ2 TRP B 4 -13.296 -6.687 2.739 1.00 0.00 H new ATOM 0 HZ3 TRP B 4 -9.849 -6.192 0.285 1.00 0.00 H new ATOM 0 HH2 TRP B 4 -12.256 -6.573 0.501 1.00 0.00 H new ATOM 2263 N GLN B 5 -5.588 -3.704 5.771 1.00 0.00 N ATOM 2264 CA GLN B 5 -4.633 -2.640 5.753 1.00 0.00 C ATOM 2265 C GLN B 5 -3.282 -3.190 5.448 1.00 0.00 C ATOM 2266 O GLN B 5 -2.567 -2.725 4.562 1.00 0.00 O ATOM 2267 CB GLN B 5 -4.722 -1.689 6.959 1.00 0.00 C ATOM 2268 CG GLN B 5 -5.933 -0.756 6.889 1.00 0.00 C ATOM 2269 CD GLN B 5 -7.231 -1.312 7.456 1.00 0.00 C ATOM 2270 OE1 GLN B 5 -7.266 -2.405 8.020 1.00 0.00 O ATOM 2271 NE2 GLN B 5 -8.313 -0.543 7.157 1.00 0.00 N ATOM 0 H GLN B 5 -5.948 -3.846 6.715 1.00 0.00 H new ATOM 0 HA GLN B 5 -4.882 -1.959 4.939 1.00 0.00 H new ATOM 0 HB2 GLN B 5 -4.774 -2.276 7.876 1.00 0.00 H new ATOM 0 HB3 GLN B 5 -3.812 -1.092 7.013 1.00 0.00 H new ATOM 0 HG2 GLN B 5 -5.691 0.164 7.421 1.00 0.00 H new ATOM 0 HG3 GLN B 5 -6.100 -0.486 5.846 1.00 0.00 H new ATOM 0 HE21 GLN B 5 -8.187 0.353 6.686 1.00 0.00 H new ATOM 0 HE22 GLN B 5 -9.250 -0.863 7.404 1.00 0.00 H new ATOM 2280 N LYS B 6 -2.843 -4.270 6.118 1.00 0.00 N ATOM 2281 CA LYS B 6 -1.762 -5.156 5.818 1.00 0.00 C ATOM 2282 C LYS B 6 -1.586 -5.571 4.398 1.00 0.00 C ATOM 2283 O LYS B 6 -0.519 -5.632 3.789 1.00 0.00 O ATOM 2284 CB LYS B 6 -1.519 -6.340 6.768 1.00 0.00 C ATOM 2285 CG LYS B 6 -2.357 -7.583 6.462 1.00 0.00 C ATOM 2286 CD LYS B 6 -2.401 -8.505 7.683 1.00 0.00 C ATOM 2287 CE LYS B 6 -1.044 -9.034 8.152 1.00 0.00 C ATOM 2288 NZ LYS B 6 -1.462 -9.924 9.258 1.00 0.00 N ATOM 0 H LYS B 6 -3.309 -4.554 6.980 1.00 0.00 H new ATOM 0 HA LYS B 6 -0.964 -4.443 6.026 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -0.464 -6.610 6.728 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -1.728 -6.019 7.789 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -3.369 -7.289 6.183 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -1.933 -8.115 5.610 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -2.867 -7.966 8.508 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -3.044 -9.355 7.453 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -0.516 -9.572 7.365 1.00 0.00 H new ATOM 0 HE3 LYS B 6 -0.384 -8.236 8.491 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -0.654 -10.504 9.561 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -1.795 -9.350 10.058 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -2.231 -10.544 8.933 1.00 0.00 H new ATOM 2302 N THR B 7 -2.708 -6.022 3.808 1.00 0.00 N ATOM 2303 CA THR B 7 -2.880 -6.440 2.452 1.00 0.00 C ATOM 2304 C THR B 7 -2.851 -5.343 1.444 1.00 0.00 C ATOM 2305 O THR B 7 -2.249 -5.504 0.384 1.00 0.00 O ATOM 2306 CB THR B 7 -4.180 -7.181 2.345 1.00 0.00 C ATOM 2307 OG1 THR B 7 -4.280 -8.294 3.221 1.00 0.00 O ATOM 2308 CG2 THR B 7 -4.495 -7.588 0.896 1.00 0.00 C ATOM 0 H THR B 7 -3.578 -6.100 4.335 1.00 0.00 H new ATOM 0 HA THR B 7 -2.023 -7.071 2.215 1.00 0.00 H new ATOM 0 HB THR B 7 -4.939 -6.469 2.671 1.00 0.00 H new ATOM 0 HG1 THR B 7 -4.780 -8.035 4.023 1.00 0.00 H new ATOM 0 HG21 THR B 7 -5.445 -8.122 0.866 1.00 0.00 H new ATOM 0 HG22 THR B 7 -4.561 -6.696 0.273 1.00 0.00 H new ATOM 0 HG23 THR B 7 -3.703 -8.236 0.520 1.00 0.00 H new ATOM 2316 N GLY B 8 -3.520 -4.227 1.782 1.00 0.00 N ATOM 2317 CA GLY B 8 -3.459 -2.971 1.101 1.00 0.00 C ATOM 2318 C GLY B 8 -2.146 -2.270 1.039 1.00 0.00 C ATOM 2319 O GLY B 8 -1.829 -1.709 -0.009 1.00 0.00 O ATOM 0 H GLY B 8 -4.146 -4.201 2.587 1.00 0.00 H new ATOM 0 HA2 GLY B 8 -3.801 -3.129 0.078 1.00 0.00 H new ATOM 0 HA3 GLY B 8 -4.174 -2.299 1.576 1.00 0.00 H new ATOM 2323 N HIS B 9 -1.241 -2.407 2.024 1.00 0.00 N ATOM 2324 CA HIS B 9 0.127 -1.991 2.002 1.00 0.00 C ATOM 2325 C HIS B 9 0.987 -2.922 1.217 1.00 0.00 C ATOM 2326 O HIS B 9 1.794 -2.593 0.349 1.00 0.00 O ATOM 2327 CB HIS B 9 0.796 -2.026 3.386 1.00 0.00 C ATOM 2328 CG HIS B 9 0.104 -1.061 4.302 1.00 0.00 C ATOM 2329 ND1 HIS B 9 -0.473 -1.120 5.532 1.00 0.00 N flip ATOM 2330 CD2 HIS B 9 0.294 0.298 4.160 1.00 0.00 C flip ATOM 2331 CE1 HIS B 9 -0.666 0.101 6.145 1.00 0.00 C flip ATOM 2332 NE2 HIS B 9 -0.148 0.944 5.272 1.00 0.00 N flip ATOM 0 H HIS B 9 -1.489 -2.846 2.910 1.00 0.00 H new ATOM 0 HA HIS B 9 0.068 -0.986 1.585 1.00 0.00 H new ATOM 0 HB2 HIS B 9 0.748 -3.034 3.799 1.00 0.00 H new ATOM 0 HB3 HIS B 9 1.851 -1.767 3.298 1.00 0.00 H new ATOM 0 HD2 HIS B 9 0.729 0.777 3.295 1.00 0.00 H new ATOM 0 HE1 HIS B 9 -1.125 0.313 7.099 1.00 0.00 H new ATOM 0 HE2 HIS B 9 -0.087 1.952 5.413 1.00 0.00 H new ATOM 2340 N ALA B 10 0.810 -4.237 1.432 1.00 0.00 N ATOM 2341 CA ALA B 10 1.408 -5.275 0.651 1.00 0.00 C ATOM 2342 C ALA B 10 1.161 -5.395 -0.814 1.00 0.00 C ATOM 2343 O ALA B 10 2.133 -5.460 -1.566 1.00 0.00 O ATOM 2344 CB ALA B 10 1.115 -6.642 1.293 1.00 0.00 C ATOM 0 H ALA B 10 0.222 -4.594 2.186 1.00 0.00 H new ATOM 0 HA ALA B 10 2.448 -4.948 0.677 1.00 0.00 H new ATOM 0 HB1 ALA B 10 1.572 -7.430 0.695 1.00 0.00 H new ATOM 0 HB2 ALA B 10 1.527 -6.666 2.302 1.00 0.00 H new ATOM 0 HB3 ALA B 10 0.037 -6.799 1.338 1.00 0.00 H new ATOM 2350 N VAL B 11 -0.052 -5.388 -1.395 1.00 0.00 N ATOM 2351 CA VAL B 11 -0.355 -5.331 -2.791 1.00 0.00 C ATOM 2352 C VAL B 11 0.076 -4.053 -3.423 1.00 0.00 C ATOM 2353 O VAL B 11 0.419 -4.053 -4.605 1.00 0.00 O ATOM 2354 CB VAL B 11 -1.772 -5.666 -3.154 1.00 0.00 C ATOM 2355 CG1 VAL B 11 -2.642 -4.407 -3.001 1.00 0.00 C ATOM 2356 CG2 VAL B 11 -1.910 -6.195 -4.592 1.00 0.00 C ATOM 0 H VAL B 11 -0.901 -5.426 -0.830 1.00 0.00 H new ATOM 0 HA VAL B 11 0.246 -6.138 -3.212 1.00 0.00 H new ATOM 0 HB VAL B 11 -2.100 -6.458 -2.481 1.00 0.00 H new ATOM 0 HG11 VAL B 11 -3.673 -4.643 -3.263 1.00 0.00 H new ATOM 0 HG12 VAL B 11 -2.601 -4.059 -1.969 1.00 0.00 H new ATOM 0 HG13 VAL B 11 -2.270 -3.625 -3.662 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -2.956 -6.420 -4.798 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -1.557 -5.439 -5.293 1.00 0.00 H new ATOM 0 HG23 VAL B 11 -1.315 -7.101 -4.705 1.00 0.00 H new ATOM 2366 N ARG B 12 0.175 -2.975 -2.624 1.00 0.00 N ATOM 2367 CA ARG B 12 0.605 -1.718 -3.153 1.00 0.00 C ATOM 2368 C ARG B 12 2.012 -1.657 -3.640 1.00 0.00 C ATOM 2369 O ARG B 12 2.328 -1.024 -4.646 1.00 0.00 O ATOM 2370 CB ARG B 12 0.481 -0.707 -2.001 1.00 0.00 C ATOM 2371 CG ARG B 12 0.988 0.703 -2.313 1.00 0.00 C ATOM 2372 CD ARG B 12 0.693 1.736 -1.224 1.00 0.00 C ATOM 2373 NE ARG B 12 1.160 3.022 -1.816 1.00 0.00 N ATOM 2374 CZ ARG B 12 0.699 4.203 -1.310 1.00 0.00 C ATOM 2375 NH1 ARG B 12 0.027 4.289 -0.126 1.00 0.00 N ATOM 2376 NH2 ARG B 12 0.805 5.358 -2.030 1.00 0.00 N ATOM 0 H ARG B 12 -0.039 -2.972 -1.627 1.00 0.00 H new ATOM 0 HA ARG B 12 -0.016 -1.519 -4.027 1.00 0.00 H new ATOM 0 HB2 ARG B 12 -0.567 -0.642 -1.707 1.00 0.00 H new ATOM 0 HB3 ARG B 12 1.030 -1.091 -1.141 1.00 0.00 H new ATOM 0 HG2 ARG B 12 2.065 0.661 -2.475 1.00 0.00 H new ATOM 0 HG3 ARG B 12 0.538 1.039 -3.247 1.00 0.00 H new ATOM 0 HD2 ARG B 12 -0.369 1.770 -0.982 1.00 0.00 H new ATOM 0 HD3 ARG B 12 1.223 1.505 -0.300 1.00 0.00 H new ATOM 0 HE ARG B 12 1.820 3.019 -2.594 1.00 0.00 H new ATOM 0 HH11 ARG B 12 -0.150 3.447 0.422 1.00 0.00 H new ATOM 0 HH12 ARG B 12 -0.298 5.195 0.211 1.00 0.00 H new ATOM 0 HH21 ARG B 12 1.232 5.344 -2.956 1.00 0.00 H new ATOM 0 HH22 ARG B 12 0.457 6.235 -1.642 1.00 0.00 H new ATOM 2390 N ALA B 13 2.814 -2.515 -2.985 1.00 0.00 N ATOM 2391 CA ALA B 13 4.138 -2.842 -3.414 1.00 0.00 C ATOM 2392 C ALA B 13 4.234 -3.572 -4.710 1.00 0.00 C ATOM 2393 O ALA B 13 4.899 -3.169 -5.663 1.00 0.00 O ATOM 2394 CB ALA B 13 4.890 -3.625 -2.325 1.00 0.00 C ATOM 0 H ALA B 13 2.533 -2.996 -2.131 1.00 0.00 H new ATOM 0 HA ALA B 13 4.607 -1.873 -3.589 1.00 0.00 H new ATOM 0 HB1 ALA B 13 5.895 -3.862 -2.675 1.00 0.00 H new ATOM 0 HB2 ALA B 13 4.954 -3.020 -1.421 1.00 0.00 H new ATOM 0 HB3 ALA B 13 4.355 -4.549 -2.106 1.00 0.00 H new ATOM 2400 N ILE B 14 3.450 -4.657 -4.834 1.00 0.00 N ATOM 2401 CA ILE B 14 3.333 -5.502 -5.982 1.00 0.00 C ATOM 2402 C ILE B 14 2.840 -4.748 -7.168 1.00 0.00 C ATOM 2403 O ILE B 14 3.300 -4.817 -8.307 1.00 0.00 O ATOM 2404 CB ILE B 14 2.612 -6.770 -5.630 1.00 0.00 C ATOM 2405 CG1 ILE B 14 3.277 -7.525 -4.467 1.00 0.00 C ATOM 2406 CG2 ILE B 14 2.563 -7.652 -6.889 1.00 0.00 C ATOM 2407 CD1 ILE B 14 2.579 -8.801 -3.998 1.00 0.00 C ATOM 0 H ILE B 14 2.850 -4.967 -4.069 1.00 0.00 H new ATOM 0 HA ILE B 14 4.317 -5.842 -6.307 1.00 0.00 H new ATOM 0 HB ILE B 14 1.607 -6.520 -5.291 1.00 0.00 H new ATOM 0 HG12 ILE B 14 4.294 -7.781 -4.763 1.00 0.00 H new ATOM 0 HG13 ILE B 14 3.354 -6.846 -3.618 1.00 0.00 H new ATOM 0 HG21 ILE B 14 2.043 -8.583 -6.661 1.00 0.00 H new ATOM 0 HG22 ILE B 14 2.033 -7.125 -7.682 1.00 0.00 H new ATOM 0 HG23 ILE B 14 3.578 -7.875 -7.217 1.00 0.00 H new ATOM 0 HD11 ILE B 14 3.142 -9.242 -3.175 1.00 0.00 H new ATOM 0 HD12 ILE B 14 1.571 -8.561 -3.660 1.00 0.00 H new ATOM 0 HD13 ILE B 14 2.526 -9.511 -4.823 1.00 0.00 H new ATOM 2419 N GLY B 15 1.902 -3.824 -6.895 1.00 0.00 N ATOM 2420 CA GLY B 15 1.390 -2.827 -7.783 1.00 0.00 C ATOM 2421 C GLY B 15 2.325 -1.807 -8.335 1.00 0.00 C ATOM 2422 O GLY B 15 2.310 -1.417 -9.501 1.00 0.00 O ATOM 0 H GLY B 15 1.466 -3.771 -5.974 1.00 0.00 H new ATOM 0 HA2 GLY B 15 0.929 -3.342 -8.626 1.00 0.00 H new ATOM 0 HA3 GLY B 15 0.595 -2.296 -7.260 1.00 0.00 H new ATOM 2426 N ARG B 16 3.295 -1.369 -7.512 1.00 0.00 N ATOM 2427 CA ARG B 16 4.423 -0.614 -7.963 1.00 0.00 C ATOM 2428 C ARG B 16 5.366 -1.483 -8.722 1.00 0.00 C ATOM 2429 O ARG B 16 5.604 -1.285 -9.912 1.00 0.00 O ATOM 2430 CB ARG B 16 5.060 0.078 -6.747 1.00 0.00 C ATOM 2431 CG ARG B 16 6.299 0.926 -7.043 1.00 0.00 C ATOM 2432 CD ARG B 16 6.389 1.832 -8.273 1.00 0.00 C ATOM 2433 NE ARG B 16 5.342 2.850 -7.977 1.00 0.00 N ATOM 2434 CZ ARG B 16 4.801 3.707 -8.891 1.00 0.00 C ATOM 2435 NH1 ARG B 16 5.097 3.610 -10.220 1.00 0.00 N ATOM 2436 NH2 ARG B 16 3.992 4.738 -8.509 1.00 0.00 N ATOM 0 H ARG B 16 3.295 -1.544 -6.507 1.00 0.00 H new ATOM 0 HA ARG B 16 4.119 0.163 -8.665 1.00 0.00 H new ATOM 0 HB2 ARG B 16 4.309 0.715 -6.279 1.00 0.00 H new ATOM 0 HB3 ARG B 16 5.330 -0.685 -6.017 1.00 0.00 H new ATOM 0 HG2 ARG B 16 6.459 1.562 -6.172 1.00 0.00 H new ATOM 0 HG3 ARG B 16 7.144 0.239 -7.096 1.00 0.00 H new ATOM 0 HD2 ARG B 16 7.377 2.280 -8.380 1.00 0.00 H new ATOM 0 HD3 ARG B 16 6.183 1.290 -9.196 1.00 0.00 H new ATOM 0 HE ARG B 16 5.003 2.911 -7.017 1.00 0.00 H new ATOM 0 HH11 ARG B 16 5.735 2.885 -10.549 1.00 0.00 H new ATOM 0 HH12 ARG B 16 4.680 4.262 -10.884 1.00 0.00 H new ATOM 0 HH21 ARG B 16 3.780 4.881 -7.522 1.00 0.00 H new ATOM 0 HH22 ARG B 16 3.600 5.365 -9.211 1.00 0.00 H new