USER MOD reduce.3.24.130724 H: found=0, std=0, add=764, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 766 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 77 THR OG1 : rot 126:sc= 0.441 USER MOD Set 1.2: A 81 THR OG1 : rot 85:sc= 1.02 USER MOD Set 2.1: A 71 ASN : amide:sc= -3.37! K(o=-3.4!,f=-0.67) USER MOD Set 2.2: A 73 THR OG1 : rot 180:sc=4.26e-05 USER MOD Single : A 6 TYR OH : rot 54:sc= 0.0726 USER MOD Single : A 7 ASN : amide:sc= -2.53! K(o=-2.5!,f=-3.5) USER MOD Single : A 11 MET CE :methyl 152:sc= -2.33! (180deg=-4.8!) USER MOD Single : A 17 GLN : amide:sc= -1.14 K(o=-1.1,f=-0.013) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 MET CE :methyl -172:sc= -0.731 (180deg=-1.06) USER MOD Single : A 64 MET CE :methyl 163:sc= -4.04! (180deg=-4.36!) USER MOD Single : A 67 THR OG1 : rot 95:sc= 0.81 USER MOD Single : A 69 SER OG : rot 145:sc= 1.19 USER MOD Single : A 75 LYS NZ :NH3+ -161:sc= -0.102 (180deg=-0.453) USER MOD Single : A 82 SER OG : rot 83:sc= 1.22 USER MOD Single : A 85 GLN : amide:sc= -3.65! K(o=-3.7!,f=-0.84) USER MOD Single : A 87 SER OG : rot 70:sc= 1.25 USER MOD Single : A 90 ASN : amide:sc= 0 K(o=0,f=-0.5) USER MOD Single : A 92 ASN : amide:sc= -0.302 X(o=-0.3,f=-0.68) USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 GLN : amide:sc= -2.42! C(o=-2.4!,f=-8.2!) USER MOD Single : A 102 SER OG : rot 147:sc= 0.17 USER MOD Single : A 108 MET CE :methyl -176:sc= -0.998 (180deg=-1.16) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 114 TYR OH : rot 30:sc= -0.0118 USER MOD Single : A 119 LYS NZ :NH3+ -144:sc= 0.00777 (180deg=0) USER MOD Single : A 124 SER OG : rot -33:sc= 0.699 USER MOD Single : A 125 GLN : amide:sc= -3.17 K(o=-3.2,f=-1.2) USER MOD Single : A 128 CYS SG : rot 180:sc= 0 USER MOD Single : A 132 THR OG1 : rot -38:sc= -0.404 USER MOD ----------------------------------------------------------------- ATOM 22 N ILE A 3 3.823 -15.611 6.823 1.00 0.00 N ATOM 23 CA ILE A 3 4.775 -14.507 6.721 1.00 0.00 C ATOM 24 C ILE A 3 4.287 -13.305 7.545 1.00 0.00 C ATOM 25 O ILE A 3 4.694 -12.159 7.321 1.00 0.00 O ATOM 26 CB ILE A 3 4.981 -14.114 5.227 1.00 0.00 C ATOM 27 CG1 ILE A 3 6.175 -13.152 5.066 1.00 0.00 C ATOM 28 CG2 ILE A 3 3.707 -13.504 4.645 1.00 0.00 C ATOM 29 CD1 ILE A 3 6.466 -12.769 3.627 1.00 0.00 C ATOM 0 HA ILE A 3 5.735 -14.827 7.126 1.00 0.00 H new ATOM 0 HB ILE A 3 5.207 -15.023 4.669 1.00 0.00 H new ATOM 0 HG12 ILE A 3 5.979 -12.246 5.640 1.00 0.00 H new ATOM 0 HG13 ILE A 3 7.063 -13.616 5.495 1.00 0.00 H new ATOM 0 HG21 ILE A 3 3.875 -13.238 3.601 1.00 0.00 H new ATOM 0 HG22 ILE A 3 2.895 -14.228 4.708 1.00 0.00 H new ATOM 0 HG23 ILE A 3 3.441 -12.610 5.209 1.00 0.00 H new ATOM 0 HD11 ILE A 3 7.319 -12.091 3.596 1.00 0.00 H new ATOM 0 HD12 ILE A 3 6.695 -13.666 3.051 1.00 0.00 H new ATOM 0 HD13 ILE A 3 5.594 -12.275 3.199 1.00 0.00 H new ATOM 41 N ARG A 4 3.436 -13.578 8.536 1.00 0.00 N ATOM 42 CA ARG A 4 2.855 -12.522 9.367 1.00 0.00 C ATOM 43 C ARG A 4 3.939 -11.666 10.020 1.00 0.00 C ATOM 44 O ARG A 4 3.768 -10.457 10.180 1.00 0.00 O ATOM 45 CB ARG A 4 1.939 -13.094 10.461 1.00 0.00 C ATOM 46 CG ARG A 4 1.416 -12.009 11.399 1.00 0.00 C ATOM 47 CD ARG A 4 0.593 -12.553 12.557 1.00 0.00 C ATOM 48 NE ARG A 4 0.353 -11.501 13.548 1.00 0.00 N ATOM 49 CZ ARG A 4 -0.670 -11.463 14.396 1.00 0.00 C ATOM 50 NH1 ARG A 4 -1.617 -12.395 14.362 1.00 0.00 N ATOM 51 NH2 ARG A 4 -0.752 -10.468 15.270 1.00 0.00 N ATOM 0 H ARG A 4 3.134 -14.521 8.782 1.00 0.00 H new ATOM 0 HA ARG A 4 2.259 -11.899 8.700 1.00 0.00 H new ATOM 0 HB2 ARG A 4 1.097 -13.607 9.996 1.00 0.00 H new ATOM 0 HB3 ARG A 4 2.487 -13.839 11.039 1.00 0.00 H new ATOM 0 HG2 ARG A 4 2.260 -11.446 11.797 1.00 0.00 H new ATOM 0 HG3 ARG A 4 0.806 -11.309 10.828 1.00 0.00 H new ATOM 0 HD2 ARG A 4 -0.358 -12.938 12.187 1.00 0.00 H new ATOM 0 HD3 ARG A 4 1.116 -13.389 13.023 1.00 0.00 H new ATOM 0 HE ARG A 4 1.026 -10.735 13.591 1.00 0.00 H new ATOM 0 HH11 ARG A 4 -1.564 -13.151 13.680 1.00 0.00 H new ATOM 0 HH12 ARG A 4 -2.397 -12.354 15.018 1.00 0.00 H new ATOM 0 HH21 ARG A 4 -0.035 -9.743 15.286 1.00 0.00 H new ATOM 0 HH22 ARG A 4 -1.532 -10.428 15.926 1.00 0.00 H new ATOM 65 N ASP A 5 5.051 -12.298 10.384 1.00 0.00 N ATOM 66 CA ASP A 5 6.149 -11.603 11.061 1.00 0.00 C ATOM 67 C ASP A 5 6.558 -10.344 10.304 1.00 0.00 C ATOM 68 O ASP A 5 6.757 -9.292 10.908 1.00 0.00 O ATOM 69 CB ASP A 5 7.357 -12.531 11.230 1.00 0.00 C ATOM 70 CG ASP A 5 7.081 -13.672 12.196 1.00 0.00 C ATOM 71 OD1 ASP A 5 6.528 -14.704 11.759 1.00 0.00 O ATOM 72 OD2 ASP A 5 7.415 -13.540 13.395 1.00 0.00 O ATOM 0 H ASP A 5 5.219 -13.291 10.223 1.00 0.00 H new ATOM 0 HA ASP A 5 5.792 -11.307 12.047 1.00 0.00 H new ATOM 0 HB2 ASP A 5 7.636 -12.940 10.259 1.00 0.00 H new ATOM 0 HB3 ASP A 5 8.208 -11.953 11.589 1.00 0.00 H new ATOM 77 N TYR A 6 6.664 -10.453 8.977 1.00 0.00 N ATOM 78 CA TYR A 6 7.005 -9.300 8.142 1.00 0.00 C ATOM 79 C TYR A 6 5.917 -8.234 8.274 1.00 0.00 C ATOM 80 O TYR A 6 6.208 -7.045 8.387 1.00 0.00 O ATOM 81 CB TYR A 6 7.189 -9.718 6.659 1.00 0.00 C ATOM 82 CG TYR A 6 6.244 -9.026 5.682 1.00 0.00 C ATOM 83 CD1 TYR A 6 6.492 -7.729 5.234 1.00 0.00 C ATOM 84 CD2 TYR A 6 5.096 -9.664 5.226 1.00 0.00 C ATOM 85 CE1 TYR A 6 5.624 -7.097 4.363 1.00 0.00 C ATOM 86 CE2 TYR A 6 4.225 -9.035 4.356 1.00 0.00 C ATOM 87 CZ TYR A 6 4.493 -7.753 3.930 1.00 0.00 C ATOM 88 OH TYR A 6 3.626 -7.125 3.063 1.00 0.00 O ATOM 0 H TYR A 6 6.520 -11.321 8.462 1.00 0.00 H new ATOM 0 HA TYR A 6 7.953 -8.887 8.485 1.00 0.00 H new ATOM 0 HB2 TYR A 6 8.216 -9.508 6.361 1.00 0.00 H new ATOM 0 HB3 TYR A 6 7.048 -10.796 6.579 1.00 0.00 H new ATOM 0 HD1 TYR A 6 7.376 -7.210 5.573 1.00 0.00 H new ATOM 0 HD2 TYR A 6 4.881 -10.669 5.557 1.00 0.00 H new ATOM 0 HE1 TYR A 6 5.832 -6.093 4.024 1.00 0.00 H new ATOM 0 HE2 TYR A 6 3.338 -9.547 4.012 1.00 0.00 H new ATOM 0 HH TYR A 6 4.120 -6.809 2.278 1.00 0.00 H new ATOM 98 N ASN A 7 4.664 -8.680 8.271 1.00 0.00 N ATOM 99 CA ASN A 7 3.527 -7.770 8.339 1.00 0.00 C ATOM 100 C ASN A 7 3.607 -6.938 9.607 1.00 0.00 C ATOM 101 O ASN A 7 3.824 -5.730 9.554 1.00 0.00 O ATOM 102 CB ASN A 7 2.196 -8.539 8.286 1.00 0.00 C ATOM 103 CG ASN A 7 1.939 -9.172 6.929 1.00 0.00 C ATOM 104 OD1 ASN A 7 1.368 -8.543 6.043 1.00 0.00 O ATOM 105 ND2 ASN A 7 2.359 -10.417 6.753 1.00 0.00 N ATOM 0 H ASN A 7 4.411 -9.667 8.222 1.00 0.00 H new ATOM 0 HA ASN A 7 3.565 -7.108 7.474 1.00 0.00 H new ATOM 0 HB2 ASN A 7 2.199 -9.316 9.050 1.00 0.00 H new ATOM 0 HB3 ASN A 7 1.378 -7.859 8.526 1.00 0.00 H new ATOM 0 HD21 ASN A 7 2.211 -10.883 5.858 1.00 0.00 H new ATOM 0 HD22 ASN A 7 2.830 -10.909 7.513 1.00 0.00 H new ATOM 112 N ASP A 8 3.467 -7.600 10.747 1.00 0.00 N ATOM 113 CA ASP A 8 3.531 -6.928 12.040 1.00 0.00 C ATOM 114 C ASP A 8 4.801 -6.081 12.140 1.00 0.00 C ATOM 115 O ASP A 8 4.732 -4.853 12.263 1.00 0.00 O ATOM 116 CB ASP A 8 3.488 -7.958 13.183 1.00 0.00 C ATOM 117 CG ASP A 8 2.157 -8.698 13.280 1.00 0.00 C ATOM 118 OD1 ASP A 8 1.510 -8.929 12.238 1.00 0.00 O ATOM 119 OD2 ASP A 8 1.766 -9.084 14.403 1.00 0.00 O ATOM 0 H ASP A 8 3.308 -8.606 10.804 1.00 0.00 H new ATOM 0 HA ASP A 8 2.666 -6.271 12.130 1.00 0.00 H new ATOM 0 HB2 ASP A 8 4.289 -8.683 13.039 1.00 0.00 H new ATOM 0 HB3 ASP A 8 3.683 -7.450 14.128 1.00 0.00 H new ATOM 124 N ALA A 9 5.955 -6.740 12.040 1.00 0.00 N ATOM 125 CA ALA A 9 7.244 -6.074 12.198 1.00 0.00 C ATOM 126 C ALA A 9 7.396 -4.904 11.224 1.00 0.00 C ATOM 127 O ALA A 9 7.341 -3.737 11.631 1.00 0.00 O ATOM 128 CB ALA A 9 8.389 -7.068 12.024 1.00 0.00 C ATOM 0 H ALA A 9 6.021 -7.740 11.849 1.00 0.00 H new ATOM 0 HA ALA A 9 7.284 -5.670 13.210 1.00 0.00 H new ATOM 0 HB1 ALA A 9 9.341 -6.551 12.146 1.00 0.00 H new ATOM 0 HB2 ALA A 9 8.305 -7.855 12.774 1.00 0.00 H new ATOM 0 HB3 ALA A 9 8.340 -7.509 11.028 1.00 0.00 H new ATOM 134 N ASP A 10 7.553 -5.220 9.939 1.00 0.00 N ATOM 135 CA ASP A 10 7.823 -4.209 8.919 1.00 0.00 C ATOM 136 C ASP A 10 6.693 -3.192 8.830 1.00 0.00 C ATOM 137 O ASP A 10 6.922 -2.000 9.013 1.00 0.00 O ATOM 138 CB ASP A 10 8.060 -4.855 7.542 1.00 0.00 C ATOM 139 CG ASP A 10 9.390 -5.591 7.460 1.00 0.00 C ATOM 140 OD1 ASP A 10 9.506 -6.699 8.027 1.00 0.00 O ATOM 141 OD2 ASP A 10 10.339 -5.056 6.852 1.00 0.00 O ATOM 0 H ASP A 10 7.497 -6.173 9.579 1.00 0.00 H new ATOM 0 HA ASP A 10 8.732 -3.687 9.219 1.00 0.00 H new ATOM 0 HB2 ASP A 10 7.250 -5.552 7.328 1.00 0.00 H new ATOM 0 HB3 ASP A 10 8.028 -4.083 6.773 1.00 0.00 H new ATOM 146 N MET A 11 5.469 -3.660 8.587 1.00 0.00 N ATOM 147 CA MET A 11 4.354 -2.750 8.318 1.00 0.00 C ATOM 148 C MET A 11 4.102 -1.821 9.503 1.00 0.00 C ATOM 149 O MET A 11 4.028 -0.605 9.328 1.00 0.00 O ATOM 150 CB MET A 11 3.069 -3.512 7.954 1.00 0.00 C ATOM 151 CG MET A 11 3.170 -4.379 6.694 1.00 0.00 C ATOM 152 SD MET A 11 3.110 -3.434 5.149 1.00 0.00 S ATOM 153 CE MET A 11 4.755 -2.730 5.057 1.00 0.00 C ATOM 0 H MET A 11 5.225 -4.650 8.571 1.00 0.00 H new ATOM 0 HA MET A 11 4.639 -2.145 7.457 1.00 0.00 H new ATOM 0 HB2 MET A 11 2.790 -4.148 8.794 1.00 0.00 H new ATOM 0 HB3 MET A 11 2.262 -2.792 7.818 1.00 0.00 H new ATOM 0 HG2 MET A 11 4.101 -4.945 6.727 1.00 0.00 H new ATOM 0 HG3 MET A 11 2.356 -5.104 6.697 1.00 0.00 H new ATOM 0 HE1 MET A 11 5.024 -2.570 4.013 1.00 0.00 H new ATOM 0 HE2 MET A 11 4.773 -1.778 5.587 1.00 0.00 H new ATOM 0 HE3 MET A 11 5.470 -3.414 5.515 1.00 0.00 H new ATOM 163 N ALA A 12 4.002 -2.371 10.713 1.00 0.00 N ATOM 164 CA ALA A 12 3.722 -1.537 11.879 1.00 0.00 C ATOM 165 C ALA A 12 4.866 -0.555 12.124 1.00 0.00 C ATOM 166 O ALA A 12 4.643 0.630 12.339 1.00 0.00 O ATOM 167 CB ALA A 12 3.472 -2.391 13.119 1.00 0.00 C ATOM 0 H ALA A 12 4.108 -3.366 10.909 1.00 0.00 H new ATOM 0 HA ALA A 12 2.815 -0.968 11.675 1.00 0.00 H new ATOM 0 HB1 ALA A 12 3.266 -1.743 13.971 1.00 0.00 H new ATOM 0 HB2 ALA A 12 2.617 -3.044 12.945 1.00 0.00 H new ATOM 0 HB3 ALA A 12 4.354 -2.996 13.328 1.00 0.00 H new ATOM 173 N ARG A 13 6.094 -1.056 12.041 1.00 0.00 N ATOM 174 CA ARG A 13 7.277 -0.259 12.373 1.00 0.00 C ATOM 175 C ARG A 13 7.773 0.572 11.186 1.00 0.00 C ATOM 176 O ARG A 13 8.738 1.327 11.313 1.00 0.00 O ATOM 177 CB ARG A 13 8.373 -1.178 12.922 1.00 0.00 C ATOM 178 CG ARG A 13 7.949 -1.854 14.226 1.00 0.00 C ATOM 179 CD ARG A 13 8.787 -3.082 14.561 1.00 0.00 C ATOM 180 NE ARG A 13 8.248 -3.790 15.728 1.00 0.00 N ATOM 181 CZ ARG A 13 7.068 -4.426 15.749 1.00 0.00 C ATOM 182 NH1 ARG A 13 6.291 -4.448 14.669 1.00 0.00 N ATOM 183 NH2 ARG A 13 6.661 -5.033 16.854 1.00 0.00 N ATOM 0 H ARG A 13 6.300 -2.011 11.747 1.00 0.00 H new ATOM 0 HA ARG A 13 7.000 0.461 13.143 1.00 0.00 H new ATOM 0 HB2 ARG A 13 8.614 -1.939 12.180 1.00 0.00 H new ATOM 0 HB3 ARG A 13 9.281 -0.599 13.091 1.00 0.00 H new ATOM 0 HG2 ARG A 13 8.025 -1.136 15.042 1.00 0.00 H new ATOM 0 HG3 ARG A 13 6.901 -2.145 14.154 1.00 0.00 H new ATOM 0 HD2 ARG A 13 8.811 -3.754 13.703 1.00 0.00 H new ATOM 0 HD3 ARG A 13 9.816 -2.781 14.758 1.00 0.00 H new ATOM 0 HE ARG A 13 8.809 -3.799 16.580 1.00 0.00 H new ATOM 0 HH11 ARG A 13 6.591 -3.978 13.815 1.00 0.00 H new ATOM 0 HH12 ARG A 13 5.395 -4.935 14.695 1.00 0.00 H new ATOM 0 HH21 ARG A 13 7.246 -5.017 17.690 1.00 0.00 H new ATOM 0 HH22 ARG A 13 5.763 -5.517 16.869 1.00 0.00 H new ATOM 197 N LEU A 14 7.113 0.435 10.037 1.00 0.00 N ATOM 198 CA LEU A 14 7.374 1.303 8.885 1.00 0.00 C ATOM 199 C LEU A 14 6.373 2.454 8.870 1.00 0.00 C ATOM 200 O LEU A 14 6.744 3.616 8.701 1.00 0.00 O ATOM 201 CB LEU A 14 7.290 0.513 7.569 1.00 0.00 C ATOM 202 CG LEU A 14 7.440 1.344 6.278 1.00 0.00 C ATOM 203 CD1 LEU A 14 8.784 2.068 6.246 1.00 0.00 C ATOM 204 CD2 LEU A 14 7.271 0.455 5.045 1.00 0.00 C ATOM 0 H LEU A 14 6.392 -0.269 9.877 1.00 0.00 H new ATOM 0 HA LEU A 14 8.384 1.702 8.976 1.00 0.00 H new ATOM 0 HB2 LEU A 14 8.064 -0.254 7.577 1.00 0.00 H new ATOM 0 HB3 LEU A 14 6.330 -0.003 7.537 1.00 0.00 H new ATOM 0 HG LEU A 14 6.654 2.099 6.267 1.00 0.00 H new ATOM 0 HD11 LEU A 14 8.864 2.646 5.326 1.00 0.00 H new ATOM 0 HD12 LEU A 14 8.857 2.738 7.103 1.00 0.00 H new ATOM 0 HD13 LEU A 14 9.592 1.337 6.287 1.00 0.00 H new ATOM 0 HD21 LEU A 14 7.380 1.058 4.144 1.00 0.00 H new ATOM 0 HD22 LEU A 14 8.031 -0.326 5.053 1.00 0.00 H new ATOM 0 HD23 LEU A 14 6.281 -0.002 5.058 1.00 0.00 H new ATOM 216 N LEU A 15 5.099 2.122 9.063 1.00 0.00 N ATOM 217 CA LEU A 15 4.040 3.125 9.080 1.00 0.00 C ATOM 218 C LEU A 15 4.056 3.891 10.397 1.00 0.00 C ATOM 219 O LEU A 15 3.539 5.005 10.477 1.00 0.00 O ATOM 220 CB LEU A 15 2.667 2.484 8.828 1.00 0.00 C ATOM 221 CG LEU A 15 2.397 2.058 7.372 1.00 0.00 C ATOM 222 CD1 LEU A 15 2.474 3.261 6.432 1.00 0.00 C ATOM 223 CD2 LEU A 15 3.370 0.966 6.932 1.00 0.00 C ATOM 0 H LEU A 15 4.776 1.166 9.210 1.00 0.00 H new ATOM 0 HA LEU A 15 4.225 3.832 8.271 1.00 0.00 H new ATOM 0 HB2 LEU A 15 2.570 1.608 9.469 1.00 0.00 H new ATOM 0 HB3 LEU A 15 1.894 3.189 9.132 1.00 0.00 H new ATOM 0 HG LEU A 15 1.387 1.650 7.323 1.00 0.00 H new ATOM 0 HD11 LEU A 15 2.280 2.937 5.410 1.00 0.00 H new ATOM 0 HD12 LEU A 15 1.729 4.000 6.726 1.00 0.00 H new ATOM 0 HD13 LEU A 15 3.468 3.705 6.490 1.00 0.00 H new ATOM 0 HD21 LEU A 15 3.158 0.683 5.901 1.00 0.00 H new ATOM 0 HD22 LEU A 15 4.392 1.339 7.003 1.00 0.00 H new ATOM 0 HD23 LEU A 15 3.256 0.095 7.578 1.00 0.00 H new ATOM 235 N GLU A 16 4.665 3.284 11.418 1.00 0.00 N ATOM 236 CA GLU A 16 4.942 3.965 12.685 1.00 0.00 C ATOM 237 C GLU A 16 5.597 5.316 12.392 1.00 0.00 C ATOM 238 O GLU A 16 5.288 6.338 13.015 1.00 0.00 O ATOM 239 CB GLU A 16 5.890 3.097 13.534 1.00 0.00 C ATOM 240 CG GLU A 16 6.047 3.541 14.988 1.00 0.00 C ATOM 241 CD GLU A 16 4.866 3.168 15.877 1.00 0.00 C ATOM 242 OE1 GLU A 16 3.933 2.493 15.400 1.00 0.00 O ATOM 243 OE2 GLU A 16 4.869 3.557 17.066 1.00 0.00 O ATOM 0 H GLU A 16 4.978 2.314 11.391 1.00 0.00 H new ATOM 0 HA GLU A 16 4.014 4.123 13.234 1.00 0.00 H new ATOM 0 HB2 GLU A 16 5.526 2.070 13.521 1.00 0.00 H new ATOM 0 HB3 GLU A 16 6.873 3.093 13.063 1.00 0.00 H new ATOM 0 HG2 GLU A 16 6.953 3.095 15.398 1.00 0.00 H new ATOM 0 HG3 GLU A 16 6.183 4.622 15.015 1.00 0.00 H new ATOM 250 N GLN A 17 6.496 5.288 11.408 1.00 0.00 N ATOM 251 CA GLN A 17 7.163 6.482 10.910 1.00 0.00 C ATOM 252 C GLN A 17 6.139 7.472 10.362 1.00 0.00 C ATOM 253 O GLN A 17 6.027 8.587 10.856 1.00 0.00 O ATOM 254 CB GLN A 17 8.167 6.083 9.818 1.00 0.00 C ATOM 255 CG GLN A 17 8.822 7.256 9.098 1.00 0.00 C ATOM 256 CD GLN A 17 9.762 6.816 7.984 1.00 0.00 C ATOM 257 OE1 GLN A 17 10.736 7.503 7.672 1.00 0.00 O ATOM 258 NE2 GLN A 17 9.475 5.675 7.369 1.00 0.00 N ATOM 0 H GLN A 17 6.780 4.430 10.935 1.00 0.00 H new ATOM 0 HA GLN A 17 7.697 6.966 11.727 1.00 0.00 H new ATOM 0 HB2 GLN A 17 8.947 5.468 10.267 1.00 0.00 H new ATOM 0 HB3 GLN A 17 7.656 5.462 9.082 1.00 0.00 H new ATOM 0 HG2 GLN A 17 8.047 7.898 8.680 1.00 0.00 H new ATOM 0 HG3 GLN A 17 9.377 7.855 9.820 1.00 0.00 H new ATOM 0 HE21 GLN A 17 8.660 5.133 7.655 1.00 0.00 H new ATOM 0 HE22 GLN A 17 10.070 5.341 6.611 1.00 0.00 H new ATOM 267 N TRP A 18 5.368 7.030 9.369 1.00 0.00 N ATOM 268 CA TRP A 18 4.375 7.880 8.707 1.00 0.00 C ATOM 269 C TRP A 18 3.427 8.530 9.714 1.00 0.00 C ATOM 270 O TRP A 18 3.042 9.694 9.556 1.00 0.00 O ATOM 271 CB TRP A 18 3.577 7.061 7.682 1.00 0.00 C ATOM 272 CG TRP A 18 4.347 6.768 6.429 1.00 0.00 C ATOM 273 CD1 TRP A 18 5.345 5.847 6.265 1.00 0.00 C ATOM 274 CD2 TRP A 18 4.178 7.407 5.161 1.00 0.00 C ATOM 275 NE1 TRP A 18 5.807 5.885 4.972 1.00 0.00 N ATOM 276 CE2 TRP A 18 5.104 6.833 4.274 1.00 0.00 C ATOM 277 CE3 TRP A 18 3.329 8.414 4.690 1.00 0.00 C ATOM 278 CZ2 TRP A 18 5.210 7.229 2.946 1.00 0.00 C ATOM 279 CZ3 TRP A 18 3.432 8.809 3.370 1.00 0.00 C ATOM 280 CH2 TRP A 18 4.367 8.217 2.512 1.00 0.00 C ATOM 0 H TRP A 18 5.412 6.079 9.002 1.00 0.00 H new ATOM 0 HA TRP A 18 4.911 8.678 8.193 1.00 0.00 H new ATOM 0 HB2 TRP A 18 3.269 6.121 8.139 1.00 0.00 H new ATOM 0 HB3 TRP A 18 2.667 7.603 7.423 1.00 0.00 H new ATOM 0 HD1 TRP A 18 5.715 5.188 7.037 1.00 0.00 H new ATOM 0 HE1 TRP A 18 6.553 5.302 4.592 1.00 0.00 H new ATOM 0 HE3 TRP A 18 2.606 8.875 5.347 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 5.930 6.775 2.281 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 2.782 9.586 2.995 1.00 0.00 H new ATOM 0 HH2 TRP A 18 4.425 8.547 1.485 1.00 0.00 H new ATOM 291 N GLU A 19 3.054 7.775 10.744 1.00 0.00 N ATOM 292 CA GLU A 19 2.178 8.284 11.790 1.00 0.00 C ATOM 293 C GLU A 19 2.894 9.363 12.596 1.00 0.00 C ATOM 294 O GLU A 19 2.326 10.419 12.882 1.00 0.00 O ATOM 295 CB GLU A 19 1.713 7.147 12.708 1.00 0.00 C ATOM 296 CG GLU A 19 0.952 6.046 11.980 1.00 0.00 C ATOM 297 CD GLU A 19 0.388 4.999 12.925 1.00 0.00 C ATOM 298 OE1 GLU A 19 1.119 4.052 13.282 1.00 0.00 O ATOM 299 OE2 GLU A 19 -0.790 5.127 13.318 1.00 0.00 O ATOM 0 H GLU A 19 3.347 6.807 10.875 1.00 0.00 H new ATOM 0 HA GLU A 19 1.298 8.724 11.321 1.00 0.00 H new ATOM 0 HB2 GLU A 19 2.582 6.711 13.201 1.00 0.00 H new ATOM 0 HB3 GLU A 19 1.077 7.560 13.490 1.00 0.00 H new ATOM 0 HG2 GLU A 19 0.137 6.490 11.409 1.00 0.00 H new ATOM 0 HG3 GLU A 19 1.617 5.563 11.264 1.00 0.00 H new ATOM 306 N LYS A 20 4.153 9.097 12.941 1.00 0.00 N ATOM 307 CA LYS A 20 4.970 10.062 13.672 1.00 0.00 C ATOM 308 C LYS A 20 5.115 11.350 12.862 1.00 0.00 C ATOM 309 O LYS A 20 4.870 12.443 13.375 1.00 0.00 O ATOM 310 CB LYS A 20 6.352 9.465 13.991 1.00 0.00 C ATOM 311 CG LYS A 20 7.270 10.408 14.766 1.00 0.00 C ATOM 312 CD LYS A 20 8.588 9.737 15.151 1.00 0.00 C ATOM 313 CE LYS A 20 9.493 10.682 15.938 1.00 0.00 C ATOM 314 NZ LYS A 20 10.705 9.991 16.453 1.00 0.00 N ATOM 0 H LYS A 20 4.629 8.221 12.726 1.00 0.00 H new ATOM 0 HA LYS A 20 4.474 10.298 14.614 1.00 0.00 H new ATOM 0 HB2 LYS A 20 6.217 8.550 14.568 1.00 0.00 H new ATOM 0 HB3 LYS A 20 6.840 9.185 13.058 1.00 0.00 H new ATOM 0 HG2 LYS A 20 7.476 11.291 14.161 1.00 0.00 H new ATOM 0 HG3 LYS A 20 6.761 10.750 15.667 1.00 0.00 H new ATOM 0 HD2 LYS A 20 8.383 8.848 15.748 1.00 0.00 H new ATOM 0 HD3 LYS A 20 9.104 9.405 14.250 1.00 0.00 H new ATOM 0 HE2 LYS A 20 9.793 11.513 15.299 1.00 0.00 H new ATOM 0 HE3 LYS A 20 8.935 11.107 16.773 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 11.292 10.668 16.981 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 10.420 9.214 17.083 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 11.251 9.607 15.655 1.00 0.00 H new ATOM 328 N ASP A 21 5.493 11.205 11.592 1.00 0.00 N ATOM 329 CA ASP A 21 5.637 12.342 10.679 1.00 0.00 C ATOM 330 C ASP A 21 4.330 13.109 10.566 1.00 0.00 C ATOM 331 O ASP A 21 4.324 14.337 10.462 1.00 0.00 O ATOM 332 CB ASP A 21 6.075 11.872 9.283 1.00 0.00 C ATOM 333 CG ASP A 21 7.519 11.390 9.250 1.00 0.00 C ATOM 334 OD1 ASP A 21 8.434 12.229 9.129 1.00 0.00 O ATOM 335 OD2 ASP A 21 7.748 10.171 9.356 1.00 0.00 O ATOM 0 H ASP A 21 5.707 10.302 11.168 1.00 0.00 H new ATOM 0 HA ASP A 21 6.404 12.999 11.089 1.00 0.00 H new ATOM 0 HB2 ASP A 21 5.420 11.066 8.954 1.00 0.00 H new ATOM 0 HB3 ASP A 21 5.954 12.691 8.574 1.00 0.00 H new ATOM 340 N ASP A 22 3.221 12.376 10.583 1.00 0.00 N ATOM 341 CA ASP A 22 1.896 12.981 10.497 1.00 0.00 C ATOM 342 C ASP A 22 1.656 13.909 11.686 1.00 0.00 C ATOM 343 O ASP A 22 1.275 15.069 11.514 1.00 0.00 O ATOM 344 CB ASP A 22 0.815 11.894 10.435 1.00 0.00 C ATOM 345 CG ASP A 22 -0.574 12.467 10.216 1.00 0.00 C ATOM 346 OD1 ASP A 22 -0.816 13.017 9.121 1.00 0.00 O ATOM 347 OD2 ASP A 22 -1.433 12.342 11.115 1.00 0.00 O ATOM 0 H ASP A 22 3.214 11.359 10.656 1.00 0.00 H new ATOM 0 HA ASP A 22 1.843 13.572 9.583 1.00 0.00 H new ATOM 0 HB2 ASP A 22 1.049 11.199 9.629 1.00 0.00 H new ATOM 0 HB3 ASP A 22 0.826 11.322 11.363 1.00 0.00 H new ATOM 352 N ASP A 23 1.904 13.395 12.890 1.00 0.00 N ATOM 353 CA ASP A 23 1.765 14.190 14.114 1.00 0.00 C ATOM 354 C ASP A 23 2.743 15.364 14.120 1.00 0.00 C ATOM 355 O ASP A 23 2.406 16.464 14.564 1.00 0.00 O ATOM 356 CB ASP A 23 1.981 13.320 15.365 1.00 0.00 C ATOM 357 CG ASP A 23 0.764 12.481 15.728 1.00 0.00 C ATOM 358 OD1 ASP A 23 0.644 11.339 15.240 1.00 0.00 O ATOM 359 OD2 ASP A 23 -0.075 12.956 16.523 1.00 0.00 O ATOM 0 H ASP A 23 2.202 12.432 13.046 1.00 0.00 H new ATOM 0 HA ASP A 23 0.749 14.584 14.135 1.00 0.00 H new ATOM 0 HB2 ASP A 23 2.833 12.660 15.199 1.00 0.00 H new ATOM 0 HB3 ASP A 23 2.236 13.963 16.208 1.00 0.00 H new ATOM 364 N ILE A 24 3.954 15.131 13.620 1.00 0.00 N ATOM 365 CA ILE A 24 4.969 16.182 13.544 1.00 0.00 C ATOM 366 C ILE A 24 4.506 17.310 12.619 1.00 0.00 C ATOM 367 O ILE A 24 4.680 18.492 12.927 1.00 0.00 O ATOM 368 CB ILE A 24 6.335 15.626 13.056 1.00 0.00 C ATOM 369 CG1 ILE A 24 6.897 14.619 14.078 1.00 0.00 C ATOM 370 CG2 ILE A 24 7.334 16.760 12.811 1.00 0.00 C ATOM 371 CD1 ILE A 24 8.200 13.971 13.653 1.00 0.00 C ATOM 0 H ILE A 24 4.257 14.226 13.262 1.00 0.00 H new ATOM 0 HA ILE A 24 5.105 16.576 14.551 1.00 0.00 H new ATOM 0 HB ILE A 24 6.175 15.110 12.109 1.00 0.00 H new ATOM 0 HG12 ILE A 24 7.050 15.129 15.029 1.00 0.00 H new ATOM 0 HG13 ILE A 24 6.155 13.840 14.250 1.00 0.00 H new ATOM 0 HG21 ILE A 24 8.282 16.343 12.470 1.00 0.00 H new ATOM 0 HG22 ILE A 24 6.940 17.434 12.051 1.00 0.00 H new ATOM 0 HG23 ILE A 24 7.493 17.312 13.738 1.00 0.00 H new ATOM 0 HD11 ILE A 24 8.530 13.276 14.425 1.00 0.00 H new ATOM 0 HD12 ILE A 24 8.050 13.430 12.719 1.00 0.00 H new ATOM 0 HD13 ILE A 24 8.959 14.740 13.509 1.00 0.00 H new ATOM 383 N GLU A 25 3.892 16.940 11.499 1.00 0.00 N ATOM 384 CA GLU A 25 3.371 17.921 10.548 1.00 0.00 C ATOM 385 C GLU A 25 2.092 18.558 11.104 1.00 0.00 C ATOM 386 O GLU A 25 1.709 19.662 10.716 1.00 0.00 O ATOM 387 CB GLU A 25 3.115 17.260 9.183 1.00 0.00 C ATOM 388 CG GLU A 25 2.880 18.255 8.047 1.00 0.00 C ATOM 389 CD GLU A 25 4.056 19.202 7.839 1.00 0.00 C ATOM 390 OE1 GLU A 25 5.026 18.818 7.151 1.00 0.00 O ATOM 391 OE2 GLU A 25 4.016 20.337 8.359 1.00 0.00 O ATOM 0 H GLU A 25 3.742 15.969 11.226 1.00 0.00 H new ATOM 0 HA GLU A 25 4.111 18.708 10.404 1.00 0.00 H new ATOM 0 HB2 GLU A 25 3.968 16.630 8.930 1.00 0.00 H new ATOM 0 HB3 GLU A 25 2.247 16.605 9.264 1.00 0.00 H new ATOM 0 HG2 GLU A 25 2.693 17.707 7.123 1.00 0.00 H new ATOM 0 HG3 GLU A 25 1.984 18.837 8.260 1.00 0.00 H new ATOM 398 N GLU A 26 1.436 17.842 12.018 1.00 0.00 N ATOM 399 CA GLU A 26 0.307 18.384 12.775 1.00 0.00 C ATOM 400 C GLU A 26 0.823 19.405 13.797 1.00 0.00 C ATOM 401 O GLU A 26 0.068 20.224 14.330 1.00 0.00 O ATOM 402 CB GLU A 26 -0.457 17.242 13.473 1.00 0.00 C ATOM 403 CG GLU A 26 -1.662 17.686 14.299 1.00 0.00 C ATOM 404 CD GLU A 26 -2.720 18.405 13.475 1.00 0.00 C ATOM 405 OE1 GLU A 26 -3.484 17.734 12.751 1.00 0.00 O ATOM 406 OE2 GLU A 26 -2.801 19.650 13.550 1.00 0.00 O ATOM 0 H GLU A 26 1.670 16.877 12.253 1.00 0.00 H new ATOM 0 HA GLU A 26 -0.383 18.886 12.097 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -0.795 16.534 12.716 1.00 0.00 H new ATOM 0 HB3 GLU A 26 0.234 16.707 14.124 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -2.111 16.813 14.773 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -1.324 18.345 15.099 1.00 0.00 H new ATOM 413 N GLY A 27 2.126 19.346 14.056 1.00 0.00 N ATOM 414 CA GLY A 27 2.777 20.318 14.917 1.00 0.00 C ATOM 415 C GLY A 27 2.816 19.887 16.368 1.00 0.00 C ATOM 416 O GLY A 27 2.971 20.719 17.266 1.00 0.00 O ATOM 0 H GLY A 27 2.750 18.632 13.679 1.00 0.00 H new ATOM 0 HA2 GLY A 27 3.795 20.483 14.565 1.00 0.00 H new ATOM 0 HA3 GLY A 27 2.254 21.271 14.840 1.00 0.00 H new ATOM 420 N ASP A 28 2.684 18.587 16.602 1.00 0.00 N ATOM 421 CA ASP A 28 2.762 18.024 17.950 1.00 0.00 C ATOM 422 C ASP A 28 3.685 16.815 17.957 1.00 0.00 C ATOM 423 O ASP A 28 3.398 15.808 17.309 1.00 0.00 O ATOM 424 CB ASP A 28 1.373 17.616 18.467 1.00 0.00 C ATOM 425 CG ASP A 28 0.509 18.804 18.855 1.00 0.00 C ATOM 426 OD1 ASP A 28 0.762 19.398 19.927 1.00 0.00 O ATOM 427 OD2 ASP A 28 -0.434 19.138 18.103 1.00 0.00 O ATOM 0 H ASP A 28 2.521 17.895 15.870 1.00 0.00 H new ATOM 0 HA ASP A 28 3.161 18.793 18.611 1.00 0.00 H new ATOM 0 HB2 ASP A 28 0.861 17.038 17.698 1.00 0.00 H new ATOM 0 HB3 ASP A 28 1.491 16.963 19.331 1.00 0.00 H new ATOM 432 N LEU A 29 4.792 16.921 18.686 1.00 0.00 N ATOM 433 CA LEU A 29 5.741 15.820 18.802 1.00 0.00 C ATOM 434 C LEU A 29 5.110 14.679 19.603 1.00 0.00 C ATOM 435 O LEU A 29 4.812 14.837 20.790 1.00 0.00 O ATOM 436 CB LEU A 29 7.051 16.285 19.464 1.00 0.00 C ATOM 437 CG LEU A 29 7.968 17.171 18.594 1.00 0.00 C ATOM 438 CD1 LEU A 29 8.354 16.451 17.303 1.00 0.00 C ATOM 439 CD2 LEU A 29 7.308 18.514 18.281 1.00 0.00 C ATOM 0 H LEU A 29 5.054 17.759 19.205 1.00 0.00 H new ATOM 0 HA LEU A 29 5.984 15.463 17.801 1.00 0.00 H new ATOM 0 HB2 LEU A 29 6.802 16.835 20.372 1.00 0.00 H new ATOM 0 HB3 LEU A 29 7.614 15.403 19.770 1.00 0.00 H new ATOM 0 HG LEU A 29 8.876 17.367 19.165 1.00 0.00 H new ATOM 0 HD11 LEU A 29 9.000 17.095 16.706 1.00 0.00 H new ATOM 0 HD12 LEU A 29 8.883 15.529 17.545 1.00 0.00 H new ATOM 0 HD13 LEU A 29 7.454 16.214 16.735 1.00 0.00 H new ATOM 0 HD21 LEU A 29 7.979 19.115 17.667 1.00 0.00 H new ATOM 0 HD22 LEU A 29 6.376 18.345 17.741 1.00 0.00 H new ATOM 0 HD23 LEU A 29 7.098 19.042 19.211 1.00 0.00 H new ATOM 451 N LEU A 62 -5.477 7.925 4.546 1.00 0.00 N ATOM 452 CA LEU A 62 -5.595 6.682 3.789 1.00 0.00 C ATOM 453 C LEU A 62 -4.233 6.039 3.514 1.00 0.00 C ATOM 454 O LEU A 62 -3.357 6.637 2.881 1.00 0.00 O ATOM 455 CB LEU A 62 -6.351 6.951 2.471 1.00 0.00 C ATOM 456 CG LEU A 62 -6.802 5.711 1.662 1.00 0.00 C ATOM 457 CD1 LEU A 62 -5.639 5.079 0.892 1.00 0.00 C ATOM 458 CD2 LEU A 62 -7.469 4.681 2.578 1.00 0.00 C ATOM 0 HA LEU A 62 -6.159 5.971 4.394 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -7.234 7.547 2.701 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -5.713 7.561 1.831 1.00 0.00 H new ATOM 0 HG LEU A 62 -7.533 6.049 0.928 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -5.998 4.212 0.338 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -5.224 5.808 0.196 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -4.866 4.766 1.593 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -7.779 3.817 1.990 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -6.762 4.363 3.344 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -8.342 5.128 3.053 1.00 0.00 H new ATOM 470 N MET A 63 -4.072 4.815 4.015 1.00 0.00 N ATOM 471 CA MET A 63 -2.967 3.943 3.630 1.00 0.00 C ATOM 472 C MET A 63 -3.441 2.485 3.669 1.00 0.00 C ATOM 473 O MET A 63 -4.082 2.053 4.641 1.00 0.00 O ATOM 474 CB MET A 63 -1.728 4.177 4.513 1.00 0.00 C ATOM 475 CG MET A 63 -1.914 3.877 5.992 1.00 0.00 C ATOM 476 SD MET A 63 -0.517 4.470 6.973 1.00 0.00 S ATOM 477 CE MET A 63 -0.845 3.696 8.551 1.00 0.00 C ATOM 0 H MET A 63 -4.705 4.401 4.699 1.00 0.00 H new ATOM 0 HA MET A 63 -2.659 4.180 2.612 1.00 0.00 H new ATOM 0 HB2 MET A 63 -0.912 3.561 4.135 1.00 0.00 H new ATOM 0 HB3 MET A 63 -1.418 5.217 4.407 1.00 0.00 H new ATOM 0 HG2 MET A 63 -2.832 4.345 6.346 1.00 0.00 H new ATOM 0 HG3 MET A 63 -2.029 2.802 6.134 1.00 0.00 H new ATOM 0 HE1 MET A 63 -0.149 4.081 9.297 1.00 0.00 H new ATOM 0 HE2 MET A 63 -1.867 3.918 8.860 1.00 0.00 H new ATOM 0 HE3 MET A 63 -0.719 2.617 8.460 1.00 0.00 H new ATOM 487 N MET A 64 -3.152 1.746 2.595 1.00 0.00 N ATOM 488 CA MET A 64 -3.704 0.408 2.385 1.00 0.00 C ATOM 489 C MET A 64 -2.606 -0.653 2.324 1.00 0.00 C ATOM 490 O MET A 64 -1.560 -0.445 1.703 1.00 0.00 O ATOM 491 CB MET A 64 -4.493 0.354 1.066 1.00 0.00 C ATOM 492 CG MET A 64 -5.640 1.350 0.962 1.00 0.00 C ATOM 493 SD MET A 64 -6.559 1.172 -0.584 1.00 0.00 S ATOM 494 CE MET A 64 -7.829 2.422 -0.397 1.00 0.00 C ATOM 0 H MET A 64 -2.530 2.058 1.849 1.00 0.00 H new ATOM 0 HA MET A 64 -4.358 0.200 3.231 1.00 0.00 H new ATOM 0 HB2 MET A 64 -3.804 0.529 0.240 1.00 0.00 H new ATOM 0 HB3 MET A 64 -4.893 -0.652 0.940 1.00 0.00 H new ATOM 0 HG2 MET A 64 -6.318 1.210 1.804 1.00 0.00 H new ATOM 0 HG3 MET A 64 -5.246 2.364 1.034 1.00 0.00 H new ATOM 0 HE1 MET A 64 -8.273 2.638 -1.369 1.00 0.00 H new ATOM 0 HE2 MET A 64 -8.600 2.058 0.282 1.00 0.00 H new ATOM 0 HE3 MET A 64 -7.387 3.332 0.010 1.00 0.00 H new ATOM 504 N PHE A 65 -2.865 -1.790 2.963 1.00 0.00 N ATOM 505 CA PHE A 65 -2.040 -2.986 2.810 1.00 0.00 C ATOM 506 C PHE A 65 -2.789 -3.959 1.908 1.00 0.00 C ATOM 507 O PHE A 65 -3.862 -4.444 2.285 1.00 0.00 O ATOM 508 CB PHE A 65 -1.778 -3.651 4.171 1.00 0.00 C ATOM 509 CG PHE A 65 -1.295 -2.706 5.240 1.00 0.00 C ATOM 510 CD1 PHE A 65 0.039 -2.337 5.314 1.00 0.00 C ATOM 511 CD2 PHE A 65 -2.179 -2.194 6.179 1.00 0.00 C ATOM 512 CE1 PHE A 65 0.480 -1.477 6.301 1.00 0.00 C ATOM 513 CE2 PHE A 65 -1.741 -1.335 7.165 1.00 0.00 C ATOM 514 CZ PHE A 65 -0.410 -0.975 7.227 1.00 0.00 C ATOM 0 H PHE A 65 -3.652 -1.909 3.601 1.00 0.00 H new ATOM 0 HA PHE A 65 -1.078 -2.712 2.378 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -2.697 -4.128 4.512 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -1.039 -4.441 4.040 1.00 0.00 H new ATOM 0 HD1 PHE A 65 0.742 -2.726 4.592 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -3.222 -2.471 6.137 1.00 0.00 H new ATOM 0 HE1 PHE A 65 1.522 -1.198 6.347 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -2.440 -0.944 7.889 1.00 0.00 H new ATOM 0 HZ PHE A 65 -0.066 -0.302 7.999 1.00 0.00 H new ATOM 524 N VAL A 66 -2.263 -4.240 0.720 1.00 0.00 N ATOM 525 CA VAL A 66 -2.996 -5.038 -0.257 1.00 0.00 C ATOM 526 C VAL A 66 -2.294 -6.371 -0.511 1.00 0.00 C ATOM 527 O VAL A 66 -1.198 -6.407 -1.072 1.00 0.00 O ATOM 528 CB VAL A 66 -3.139 -4.277 -1.598 1.00 0.00 C ATOM 529 CG1 VAL A 66 -4.070 -5.021 -2.551 1.00 0.00 C ATOM 530 CG2 VAL A 66 -3.627 -2.849 -1.359 1.00 0.00 C ATOM 0 H VAL A 66 -1.341 -3.931 0.412 1.00 0.00 H new ATOM 0 HA VAL A 66 -3.987 -5.227 0.156 1.00 0.00 H new ATOM 0 HB VAL A 66 -2.156 -4.225 -2.065 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -4.154 -4.466 -3.485 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -3.666 -6.013 -2.753 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -5.056 -5.116 -2.096 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -3.721 -2.332 -2.314 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -4.597 -2.874 -0.863 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -2.911 -2.321 -0.729 1.00 0.00 H new ATOM 540 N THR A 67 -2.922 -7.463 -0.087 1.00 0.00 N ATOM 541 CA THR A 67 -2.402 -8.799 -0.351 1.00 0.00 C ATOM 542 C THR A 67 -3.117 -9.396 -1.560 1.00 0.00 C ATOM 543 O THR A 67 -4.348 -9.468 -1.601 1.00 0.00 O ATOM 544 CB THR A 67 -2.534 -9.730 0.884 1.00 0.00 C ATOM 545 OG1 THR A 67 -2.029 -11.037 0.578 1.00 0.00 O ATOM 546 CG2 THR A 67 -3.973 -9.837 1.372 1.00 0.00 C ATOM 0 H THR A 67 -3.794 -7.448 0.442 1.00 0.00 H new ATOM 0 HA THR A 67 -1.337 -8.712 -0.567 1.00 0.00 H new ATOM 0 HB THR A 67 -1.943 -9.286 1.685 1.00 0.00 H new ATOM 0 HG1 THR A 67 -1.094 -11.101 0.863 1.00 0.00 H new ATOM 0 HG21 THR A 67 -4.016 -10.499 2.237 1.00 0.00 H new ATOM 0 HG22 THR A 67 -4.336 -8.848 1.653 1.00 0.00 H new ATOM 0 HG23 THR A 67 -4.598 -10.241 0.576 1.00 0.00 H new ATOM 554 N VAL A 68 -2.343 -9.792 -2.563 1.00 0.00 N ATOM 555 CA VAL A 68 -2.906 -10.270 -3.820 1.00 0.00 C ATOM 556 C VAL A 68 -2.883 -11.793 -3.891 1.00 0.00 C ATOM 557 O VAL A 68 -3.924 -12.437 -4.016 1.00 0.00 O ATOM 558 CB VAL A 68 -2.127 -9.697 -5.033 1.00 0.00 C ATOM 559 CG1 VAL A 68 -2.787 -10.102 -6.352 1.00 0.00 C ATOM 560 CG2 VAL A 68 -2.005 -8.178 -4.929 1.00 0.00 C ATOM 0 H VAL A 68 -1.324 -9.792 -2.531 1.00 0.00 H new ATOM 0 HA VAL A 68 -3.939 -9.925 -3.859 1.00 0.00 H new ATOM 0 HB VAL A 68 -1.123 -10.121 -5.018 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -2.220 -9.687 -7.185 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -2.805 -11.189 -6.431 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -3.807 -9.719 -6.381 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -1.455 -7.797 -5.790 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -3.000 -7.734 -4.908 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -1.472 -7.918 -4.014 1.00 0.00 H new ATOM 570 N SER A 69 -1.683 -12.356 -3.822 1.00 0.00 N ATOM 571 CA SER A 69 -1.483 -13.787 -4.027 1.00 0.00 C ATOM 572 C SER A 69 -1.520 -14.572 -2.717 1.00 0.00 C ATOM 573 O SER A 69 -2.335 -15.479 -2.544 1.00 0.00 O ATOM 574 CB SER A 69 -0.146 -14.015 -4.733 1.00 0.00 C ATOM 575 OG SER A 69 0.096 -15.392 -4.953 1.00 0.00 O ATOM 0 H SER A 69 -0.826 -11.839 -3.624 1.00 0.00 H new ATOM 0 HA SER A 69 -2.304 -14.152 -4.644 1.00 0.00 H new ATOM 0 HB2 SER A 69 -0.142 -13.487 -5.687 1.00 0.00 H new ATOM 0 HB3 SER A 69 0.660 -13.594 -4.132 1.00 0.00 H new ATOM 0 HG SER A 69 0.566 -15.510 -5.805 1.00 0.00 H new ATOM 581 N GLY A 70 -0.642 -14.199 -1.796 1.00 0.00 N ATOM 582 CA GLY A 70 -0.398 -15.017 -0.619 1.00 0.00 C ATOM 583 C GLY A 70 0.738 -15.999 -0.859 1.00 0.00 C ATOM 584 O GLY A 70 0.768 -17.085 -0.283 1.00 0.00 O ATOM 0 H GLY A 70 -0.091 -13.342 -1.841 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -0.156 -14.376 0.229 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -1.305 -15.562 -0.357 1.00 0.00 H new ATOM 588 N ASN A 71 1.677 -15.603 -1.723 1.00 0.00 N ATOM 589 CA ASN A 71 2.820 -16.441 -2.094 1.00 0.00 C ATOM 590 C ASN A 71 4.136 -15.689 -1.845 1.00 0.00 C ATOM 591 O ASN A 71 4.271 -14.531 -2.239 1.00 0.00 O ATOM 592 CB ASN A 71 2.705 -16.858 -3.569 1.00 0.00 C ATOM 593 CG ASN A 71 3.856 -17.737 -4.032 1.00 0.00 C ATOM 594 OD1 ASN A 71 3.830 -18.951 -3.858 1.00 0.00 O ATOM 595 ND2 ASN A 71 4.865 -17.133 -4.640 1.00 0.00 N ATOM 0 H ASN A 71 1.666 -14.693 -2.184 1.00 0.00 H new ATOM 0 HA ASN A 71 2.818 -17.339 -1.476 1.00 0.00 H new ATOM 0 HB2 ASN A 71 1.766 -17.391 -3.717 1.00 0.00 H new ATOM 0 HB3 ASN A 71 2.666 -15.964 -4.191 1.00 0.00 H new ATOM 0 HD21 ASN A 71 5.655 -17.680 -4.982 1.00 0.00 H new ATOM 0 HD22 ASN A 71 4.852 -16.121 -4.767 1.00 0.00 H new ATOM 602 N PRO A 72 5.119 -16.345 -1.196 1.00 0.00 N ATOM 603 CA PRO A 72 6.378 -15.702 -0.763 1.00 0.00 C ATOM 604 C PRO A 72 7.327 -15.328 -1.911 1.00 0.00 C ATOM 605 O PRO A 72 8.263 -14.552 -1.710 1.00 0.00 O ATOM 606 CB PRO A 72 7.020 -16.762 0.145 1.00 0.00 C ATOM 607 CG PRO A 72 6.495 -18.058 -0.369 1.00 0.00 C ATOM 608 CD PRO A 72 5.084 -17.778 -0.818 1.00 0.00 C ATOM 0 HA PRO A 72 6.178 -14.747 -0.276 1.00 0.00 H new ATOM 0 HB2 PRO A 72 8.108 -16.725 0.091 1.00 0.00 H new ATOM 0 HB3 PRO A 72 6.747 -16.609 1.189 1.00 0.00 H new ATOM 0 HG2 PRO A 72 7.103 -18.426 -1.195 1.00 0.00 H new ATOM 0 HG3 PRO A 72 6.514 -18.823 0.407 1.00 0.00 H new ATOM 0 HD2 PRO A 72 4.798 -18.408 -1.660 1.00 0.00 H new ATOM 0 HD3 PRO A 72 4.365 -17.965 -0.021 1.00 0.00 H new ATOM 616 N THR A 73 7.122 -15.902 -3.092 1.00 0.00 N ATOM 617 CA THR A 73 8.031 -15.675 -4.217 1.00 0.00 C ATOM 618 C THR A 73 7.732 -14.349 -4.945 1.00 0.00 C ATOM 619 O THR A 73 6.571 -13.986 -5.151 1.00 0.00 O ATOM 620 CB THR A 73 7.966 -16.857 -5.206 1.00 0.00 C ATOM 621 OG1 THR A 73 7.949 -18.087 -4.466 1.00 0.00 O ATOM 622 CG2 THR A 73 9.164 -16.853 -6.149 1.00 0.00 C ATOM 0 H THR A 73 6.340 -16.524 -3.297 1.00 0.00 H new ATOM 0 HA THR A 73 9.040 -15.603 -3.811 1.00 0.00 H new ATOM 0 HB THR A 73 7.060 -16.759 -5.804 1.00 0.00 H new ATOM 0 HG1 THR A 73 7.906 -18.843 -5.088 1.00 0.00 H new ATOM 0 HG21 THR A 73 9.091 -17.698 -6.834 1.00 0.00 H new ATOM 0 HG22 THR A 73 9.176 -15.924 -6.718 1.00 0.00 H new ATOM 0 HG23 THR A 73 10.084 -16.935 -5.569 1.00 0.00 H new ATOM 630 N GLU A 74 8.811 -13.648 -5.321 1.00 0.00 N ATOM 631 CA GLU A 74 8.768 -12.304 -5.938 1.00 0.00 C ATOM 632 C GLU A 74 7.665 -12.120 -6.985 1.00 0.00 C ATOM 633 O GLU A 74 6.924 -11.135 -6.932 1.00 0.00 O ATOM 634 CB GLU A 74 10.115 -12.008 -6.610 1.00 0.00 C ATOM 635 CG GLU A 74 11.291 -11.899 -5.648 1.00 0.00 C ATOM 636 CD GLU A 74 12.624 -12.019 -6.366 1.00 0.00 C ATOM 637 OE1 GLU A 74 13.070 -11.029 -6.987 1.00 0.00 O ATOM 638 OE2 GLU A 74 13.220 -13.117 -6.334 1.00 0.00 O ATOM 0 H GLU A 74 9.760 -14.002 -5.205 1.00 0.00 H new ATOM 0 HA GLU A 74 8.551 -11.614 -5.122 1.00 0.00 H new ATOM 0 HB2 GLU A 74 10.326 -12.795 -7.334 1.00 0.00 H new ATOM 0 HB3 GLU A 74 10.031 -11.076 -7.168 1.00 0.00 H new ATOM 0 HG2 GLU A 74 11.245 -10.944 -5.125 1.00 0.00 H new ATOM 0 HG3 GLU A 74 11.215 -12.680 -4.892 1.00 0.00 H new ATOM 645 N LYS A 75 7.576 -13.068 -7.925 1.00 0.00 N ATOM 646 CA LYS A 75 6.758 -12.920 -9.148 1.00 0.00 C ATOM 647 C LYS A 75 5.427 -12.217 -8.880 1.00 0.00 C ATOM 648 O LYS A 75 5.003 -11.353 -9.652 1.00 0.00 O ATOM 649 CB LYS A 75 6.472 -14.286 -9.802 1.00 0.00 C ATOM 650 CG LYS A 75 7.693 -15.000 -10.384 1.00 0.00 C ATOM 651 CD LYS A 75 8.604 -15.568 -9.303 1.00 0.00 C ATOM 652 CE LYS A 75 9.719 -16.424 -9.891 1.00 0.00 C ATOM 653 NZ LYS A 75 9.187 -17.570 -10.681 1.00 0.00 N ATOM 0 H LYS A 75 8.066 -13.961 -7.865 1.00 0.00 H new ATOM 0 HA LYS A 75 7.348 -12.303 -9.826 1.00 0.00 H new ATOM 0 HB2 LYS A 75 6.011 -14.937 -9.059 1.00 0.00 H new ATOM 0 HB3 LYS A 75 5.741 -14.143 -10.598 1.00 0.00 H new ATOM 0 HG2 LYS A 75 7.361 -15.807 -11.037 1.00 0.00 H new ATOM 0 HG3 LYS A 75 8.258 -14.302 -11.002 1.00 0.00 H new ATOM 0 HD2 LYS A 75 9.039 -14.750 -8.728 1.00 0.00 H new ATOM 0 HD3 LYS A 75 8.014 -16.167 -8.609 1.00 0.00 H new ATOM 0 HE2 LYS A 75 10.352 -15.807 -10.529 1.00 0.00 H new ATOM 0 HE3 LYS A 75 10.350 -16.801 -9.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 9.929 -18.291 -10.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 8.371 -17.984 -10.186 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 8.890 -17.236 -11.620 1.00 0.00 H new ATOM 667 N GLU A 76 4.793 -12.582 -7.773 1.00 0.00 N ATOM 668 CA GLU A 76 3.466 -12.083 -7.437 1.00 0.00 C ATOM 669 C GLU A 76 3.462 -10.557 -7.310 1.00 0.00 C ATOM 670 O GLU A 76 2.909 -9.859 -8.167 1.00 0.00 O ATOM 671 CB GLU A 76 2.978 -12.733 -6.135 1.00 0.00 C ATOM 672 CG GLU A 76 3.186 -14.245 -6.092 1.00 0.00 C ATOM 673 CD GLU A 76 2.615 -14.960 -7.310 1.00 0.00 C ATOM 674 OE1 GLU A 76 1.383 -15.166 -7.364 1.00 0.00 O ATOM 675 OE2 GLU A 76 3.395 -15.333 -8.207 1.00 0.00 O ATOM 0 H GLU A 76 5.181 -13.229 -7.086 1.00 0.00 H new ATOM 0 HA GLU A 76 2.785 -12.349 -8.245 1.00 0.00 H new ATOM 0 HB2 GLU A 76 3.501 -12.279 -5.294 1.00 0.00 H new ATOM 0 HB3 GLU A 76 1.918 -12.517 -6.006 1.00 0.00 H new ATOM 0 HG2 GLU A 76 4.253 -14.457 -6.020 1.00 0.00 H new ATOM 0 HG3 GLU A 76 2.720 -14.645 -5.191 1.00 0.00 H new ATOM 682 N THR A 77 4.093 -10.046 -6.252 1.00 0.00 N ATOM 683 CA THR A 77 4.123 -8.607 -5.999 1.00 0.00 C ATOM 684 C THR A 77 4.823 -7.874 -7.141 1.00 0.00 C ATOM 685 O THR A 77 4.398 -6.796 -7.553 1.00 0.00 O ATOM 686 CB THR A 77 4.820 -8.264 -4.657 1.00 0.00 C ATOM 687 OG1 THR A 77 4.664 -6.870 -4.358 1.00 0.00 O ATOM 688 CG2 THR A 77 6.307 -8.611 -4.696 1.00 0.00 C ATOM 0 H THR A 77 4.589 -10.606 -5.559 1.00 0.00 H new ATOM 0 HA THR A 77 3.087 -8.276 -5.934 1.00 0.00 H new ATOM 0 HB THR A 77 4.346 -8.861 -3.878 1.00 0.00 H new ATOM 0 HG1 THR A 77 4.269 -6.769 -3.467 1.00 0.00 H new ATOM 0 HG21 THR A 77 6.765 -8.358 -3.740 1.00 0.00 H new ATOM 0 HG22 THR A 77 6.427 -9.678 -4.885 1.00 0.00 H new ATOM 0 HG23 THR A 77 6.792 -8.045 -5.491 1.00 0.00 H new ATOM 696 N GLU A 78 5.886 -8.483 -7.662 1.00 0.00 N ATOM 697 CA GLU A 78 6.675 -7.888 -8.732 1.00 0.00 C ATOM 698 C GLU A 78 5.780 -7.502 -9.910 1.00 0.00 C ATOM 699 O GLU A 78 5.629 -6.319 -10.238 1.00 0.00 O ATOM 700 CB GLU A 78 7.754 -8.880 -9.192 1.00 0.00 C ATOM 701 CG GLU A 78 8.702 -8.328 -10.250 1.00 0.00 C ATOM 702 CD GLU A 78 9.632 -9.393 -10.811 1.00 0.00 C ATOM 703 OE1 GLU A 78 10.629 -9.743 -10.140 1.00 0.00 O ATOM 704 OE2 GLU A 78 9.364 -9.894 -11.923 1.00 0.00 O ATOM 0 H GLU A 78 6.221 -9.396 -7.355 1.00 0.00 H new ATOM 0 HA GLU A 78 7.154 -6.984 -8.354 1.00 0.00 H new ATOM 0 HB2 GLU A 78 8.337 -9.192 -8.326 1.00 0.00 H new ATOM 0 HB3 GLU A 78 7.267 -9.772 -9.587 1.00 0.00 H new ATOM 0 HG2 GLU A 78 8.121 -7.893 -11.063 1.00 0.00 H new ATOM 0 HG3 GLU A 78 9.296 -7.523 -9.817 1.00 0.00 H new ATOM 711 N GLU A 79 5.152 -8.504 -10.507 1.00 0.00 N ATOM 712 CA GLU A 79 4.375 -8.312 -11.721 1.00 0.00 C ATOM 713 C GLU A 79 3.075 -7.549 -11.450 1.00 0.00 C ATOM 714 O GLU A 79 2.682 -6.690 -12.246 1.00 0.00 O ATOM 715 CB GLU A 79 4.104 -9.672 -12.379 1.00 0.00 C ATOM 716 CG GLU A 79 5.382 -10.371 -12.845 1.00 0.00 C ATOM 717 CD GLU A 79 5.136 -11.756 -13.424 1.00 0.00 C ATOM 718 OE1 GLU A 79 4.302 -11.881 -14.344 1.00 0.00 O ATOM 719 OE2 GLU A 79 5.797 -12.721 -12.982 1.00 0.00 O ATOM 0 H GLU A 79 5.166 -9.465 -10.167 1.00 0.00 H new ATOM 0 HA GLU A 79 4.955 -7.698 -12.410 1.00 0.00 H new ATOM 0 HB2 GLU A 79 3.581 -10.315 -11.671 1.00 0.00 H new ATOM 0 HB3 GLU A 79 3.440 -9.532 -13.232 1.00 0.00 H new ATOM 0 HG2 GLU A 79 5.872 -9.753 -13.597 1.00 0.00 H new ATOM 0 HG3 GLU A 79 6.070 -10.454 -12.003 1.00 0.00 H new ATOM 726 N ILE A 80 2.418 -7.828 -10.322 1.00 0.00 N ATOM 727 CA ILE A 80 1.154 -7.157 -10.011 1.00 0.00 C ATOM 728 C ILE A 80 1.389 -5.660 -9.767 1.00 0.00 C ATOM 729 O ILE A 80 0.611 -4.817 -10.222 1.00 0.00 O ATOM 730 CB ILE A 80 0.419 -7.795 -8.793 1.00 0.00 C ATOM 731 CG1 ILE A 80 -1.048 -7.338 -8.744 1.00 0.00 C ATOM 732 CG2 ILE A 80 1.119 -7.459 -7.479 1.00 0.00 C ATOM 733 CD1 ILE A 80 -1.863 -7.745 -9.956 1.00 0.00 C ATOM 0 H ILE A 80 2.732 -8.500 -9.622 1.00 0.00 H new ATOM 0 HA ILE A 80 0.505 -7.286 -10.878 1.00 0.00 H new ATOM 0 HB ILE A 80 0.447 -8.877 -8.923 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -1.516 -7.749 -7.850 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -1.076 -6.253 -8.648 1.00 0.00 H new ATOM 0 HG21 ILE A 80 0.580 -7.920 -6.651 1.00 0.00 H new ATOM 0 HG22 ILE A 80 2.140 -7.839 -7.503 1.00 0.00 H new ATOM 0 HG23 ILE A 80 1.138 -6.378 -7.343 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -2.886 -7.385 -9.844 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -1.422 -7.311 -10.853 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -1.868 -8.832 -10.043 1.00 0.00 H new ATOM 745 N THR A 81 2.485 -5.334 -9.080 1.00 0.00 N ATOM 746 CA THR A 81 2.849 -3.944 -8.835 1.00 0.00 C ATOM 747 C THR A 81 3.271 -3.276 -10.142 1.00 0.00 C ATOM 748 O THR A 81 3.009 -2.089 -10.356 1.00 0.00 O ATOM 749 CB THR A 81 3.982 -3.829 -7.787 1.00 0.00 C ATOM 750 OG1 THR A 81 3.558 -4.424 -6.552 1.00 0.00 O ATOM 751 CG2 THR A 81 4.374 -2.373 -7.537 1.00 0.00 C ATOM 0 H THR A 81 3.133 -6.015 -8.685 1.00 0.00 H new ATOM 0 HA THR A 81 1.973 -3.434 -8.435 1.00 0.00 H new ATOM 0 HB THR A 81 4.854 -4.353 -8.179 1.00 0.00 H new ATOM 0 HG1 THR A 81 3.719 -5.390 -6.582 1.00 0.00 H new ATOM 0 HG21 THR A 81 5.172 -2.333 -6.796 1.00 0.00 H new ATOM 0 HG22 THR A 81 4.721 -1.925 -8.468 1.00 0.00 H new ATOM 0 HG23 THR A 81 3.509 -1.821 -7.169 1.00 0.00 H new ATOM 759 N SER A 82 3.915 -4.049 -11.022 1.00 0.00 N ATOM 760 CA SER A 82 4.268 -3.558 -12.350 1.00 0.00 C ATOM 761 C SER A 82 3.011 -3.094 -13.091 1.00 0.00 C ATOM 762 O SER A 82 2.994 -2.016 -13.692 1.00 0.00 O ATOM 763 CB SER A 82 4.987 -4.647 -13.158 1.00 0.00 C ATOM 764 OG SER A 82 6.190 -5.050 -12.521 1.00 0.00 O ATOM 0 H SER A 82 4.199 -5.011 -10.837 1.00 0.00 H new ATOM 0 HA SER A 82 4.945 -2.712 -12.236 1.00 0.00 H new ATOM 0 HB2 SER A 82 4.330 -5.508 -13.278 1.00 0.00 H new ATOM 0 HB3 SER A 82 5.209 -4.274 -14.158 1.00 0.00 H new ATOM 0 HG SER A 82 5.987 -5.709 -11.825 1.00 0.00 H new ATOM 770 N LEU A 83 1.955 -3.910 -13.022 1.00 0.00 N ATOM 771 CA LEU A 83 0.673 -3.564 -13.637 1.00 0.00 C ATOM 772 C LEU A 83 0.118 -2.285 -13.016 1.00 0.00 C ATOM 773 O LEU A 83 -0.216 -1.327 -13.719 1.00 0.00 O ATOM 774 CB LEU A 83 -0.343 -4.708 -13.462 1.00 0.00 C ATOM 775 CG LEU A 83 0.094 -6.072 -14.026 1.00 0.00 C ATOM 776 CD1 LEU A 83 -0.967 -7.135 -13.756 1.00 0.00 C ATOM 777 CD2 LEU A 83 0.392 -5.972 -15.523 1.00 0.00 C ATOM 0 H LEU A 83 1.964 -4.813 -12.547 1.00 0.00 H new ATOM 0 HA LEU A 83 0.840 -3.404 -14.702 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -0.554 -4.824 -12.399 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -1.277 -4.418 -13.942 1.00 0.00 H new ATOM 0 HG LEU A 83 1.011 -6.370 -13.517 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -0.637 -8.091 -14.163 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -1.120 -7.232 -12.681 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -1.904 -6.843 -14.230 1.00 0.00 H new ATOM 0 HD21 LEU A 83 0.699 -6.948 -15.899 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -0.504 -5.645 -16.051 1.00 0.00 H new ATOM 0 HD23 LEU A 83 1.193 -5.252 -15.687 1.00 0.00 H new ATOM 789 N TRP A 84 0.050 -2.272 -11.689 1.00 0.00 N ATOM 790 CA TRP A 84 -0.516 -1.148 -10.952 1.00 0.00 C ATOM 791 C TRP A 84 0.281 0.134 -11.186 1.00 0.00 C ATOM 792 O TRP A 84 -0.266 1.233 -11.108 1.00 0.00 O ATOM 793 CB TRP A 84 -0.599 -1.481 -9.457 1.00 0.00 C ATOM 794 CG TRP A 84 -1.545 -2.609 -9.157 1.00 0.00 C ATOM 795 CD1 TRP A 84 -2.401 -3.215 -10.034 1.00 0.00 C ATOM 796 CD2 TRP A 84 -1.736 -3.266 -7.899 1.00 0.00 C ATOM 797 NE1 TRP A 84 -3.108 -4.202 -9.399 1.00 0.00 N ATOM 798 CE2 TRP A 84 -2.719 -4.255 -8.086 1.00 0.00 C ATOM 799 CE3 TRP A 84 -1.169 -3.114 -6.633 1.00 0.00 C ATOM 800 CZ2 TRP A 84 -3.149 -5.084 -7.054 1.00 0.00 C ATOM 801 CZ3 TRP A 84 -1.596 -3.938 -5.608 1.00 0.00 C ATOM 802 CH2 TRP A 84 -2.577 -4.913 -5.824 1.00 0.00 C ATOM 0 H TRP A 84 0.383 -3.034 -11.098 1.00 0.00 H new ATOM 0 HA TRP A 84 -1.525 -0.973 -11.325 1.00 0.00 H new ATOM 0 HB2 TRP A 84 0.395 -1.741 -9.093 1.00 0.00 H new ATOM 0 HB3 TRP A 84 -0.916 -0.593 -8.910 1.00 0.00 H new ATOM 0 HD1 TRP A 84 -2.505 -2.953 -11.077 1.00 0.00 H new ATOM 0 HE1 TRP A 84 -3.810 -4.801 -9.833 1.00 0.00 H new ATOM 0 HE3 TRP A 84 -0.410 -2.366 -6.457 1.00 0.00 H new ATOM 0 HZ2 TRP A 84 -3.907 -5.835 -7.219 1.00 0.00 H new ATOM 0 HZ3 TRP A 84 -1.165 -3.827 -4.624 1.00 0.00 H new ATOM 0 HH2 TRP A 84 -2.888 -5.542 -5.003 1.00 0.00 H new ATOM 813 N GLN A 85 1.568 -0.001 -11.482 1.00 0.00 N ATOM 814 CA GLN A 85 2.387 1.150 -11.848 1.00 0.00 C ATOM 815 C GLN A 85 1.989 1.613 -13.246 1.00 0.00 C ATOM 816 O GLN A 85 1.594 2.769 -13.440 1.00 0.00 O ATOM 817 CB GLN A 85 3.884 0.781 -11.782 1.00 0.00 C ATOM 818 CG GLN A 85 4.852 1.942 -12.045 1.00 0.00 C ATOM 819 CD GLN A 85 5.102 2.208 -13.525 1.00 0.00 C ATOM 820 OE1 GLN A 85 5.997 1.616 -14.126 1.00 0.00 O ATOM 821 NE2 GLN A 85 4.329 3.102 -14.119 1.00 0.00 N ATOM 0 H GLN A 85 2.066 -0.891 -11.476 1.00 0.00 H new ATOM 0 HA GLN A 85 2.220 1.967 -11.146 1.00 0.00 H new ATOM 0 HB2 GLN A 85 4.097 0.367 -10.797 1.00 0.00 H new ATOM 0 HB3 GLN A 85 4.080 -0.007 -12.509 1.00 0.00 H new ATOM 0 HG2 GLN A 85 4.454 2.846 -11.584 1.00 0.00 H new ATOM 0 HG3 GLN A 85 5.803 1.728 -11.558 1.00 0.00 H new ATOM 0 HE21 GLN A 85 3.596 3.574 -13.590 1.00 0.00 H new ATOM 0 HE22 GLN A 85 4.466 3.319 -15.106 1.00 0.00 H new ATOM 830 N GLY A 86 2.095 0.698 -14.210 1.00 0.00 N ATOM 831 CA GLY A 86 1.680 0.969 -15.579 1.00 0.00 C ATOM 832 C GLY A 86 0.224 1.398 -15.703 1.00 0.00 C ATOM 833 O GLY A 86 -0.201 1.849 -16.769 1.00 0.00 O ATOM 0 H GLY A 86 2.467 -0.240 -14.063 1.00 0.00 H new ATOM 0 HA2 GLY A 86 2.317 1.750 -15.994 1.00 0.00 H new ATOM 0 HA3 GLY A 86 1.839 0.075 -16.181 1.00 0.00 H new ATOM 837 N SER A 87 -0.551 1.227 -14.635 1.00 0.00 N ATOM 838 CA SER A 87 -1.927 1.715 -14.601 1.00 0.00 C ATOM 839 C SER A 87 -2.003 3.091 -13.921 1.00 0.00 C ATOM 840 O SER A 87 -2.256 4.104 -14.576 1.00 0.00 O ATOM 841 CB SER A 87 -2.823 0.709 -13.869 1.00 0.00 C ATOM 842 OG SER A 87 -2.728 -0.580 -14.455 1.00 0.00 O ATOM 0 H SER A 87 -0.250 0.755 -13.783 1.00 0.00 H new ATOM 0 HA SER A 87 -2.280 1.824 -15.627 1.00 0.00 H new ATOM 0 HB2 SER A 87 -2.534 0.657 -12.819 1.00 0.00 H new ATOM 0 HB3 SER A 87 -3.858 1.050 -13.899 1.00 0.00 H new ATOM 0 HG SER A 87 -1.842 -0.958 -14.272 1.00 0.00 H new ATOM 848 N LEU A 88 -1.740 3.125 -12.613 1.00 0.00 N ATOM 849 CA LEU A 88 -1.923 4.339 -11.811 1.00 0.00 C ATOM 850 C LEU A 88 -0.946 5.440 -12.221 1.00 0.00 C ATOM 851 O LEU A 88 -1.360 6.542 -12.580 1.00 0.00 O ATOM 852 CB LEU A 88 -1.780 4.033 -10.308 1.00 0.00 C ATOM 853 CG LEU A 88 -2.968 3.295 -9.652 1.00 0.00 C ATOM 854 CD1 LEU A 88 -3.152 1.900 -10.239 1.00 0.00 C ATOM 855 CD2 LEU A 88 -2.786 3.223 -8.139 1.00 0.00 C ATOM 0 H LEU A 88 -1.398 2.323 -12.084 1.00 0.00 H new ATOM 0 HA LEU A 88 -2.934 4.700 -12.000 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -0.881 3.434 -10.163 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -1.625 4.973 -9.779 1.00 0.00 H new ATOM 0 HG LEU A 88 -3.872 3.865 -9.866 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -3.996 1.410 -9.754 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -3.343 1.978 -11.309 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -2.248 1.314 -10.074 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -3.633 2.700 -7.695 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -1.866 2.686 -7.908 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -2.729 4.232 -7.731 1.00 0.00 H new ATOM 867 N PHE A 89 0.348 5.140 -12.179 1.00 0.00 N ATOM 868 CA PHE A 89 1.377 6.143 -12.475 1.00 0.00 C ATOM 869 C PHE A 89 1.317 6.580 -13.937 1.00 0.00 C ATOM 870 O PHE A 89 1.706 7.700 -14.276 1.00 0.00 O ATOM 871 CB PHE A 89 2.770 5.609 -12.121 1.00 0.00 C ATOM 872 CG PHE A 89 3.010 5.521 -10.633 1.00 0.00 C ATOM 873 CD1 PHE A 89 2.517 4.454 -9.894 1.00 0.00 C ATOM 874 CD2 PHE A 89 3.724 6.512 -9.973 1.00 0.00 C ATOM 875 CE1 PHE A 89 2.732 4.380 -8.532 1.00 0.00 C ATOM 876 CE2 PHE A 89 3.941 6.442 -8.611 1.00 0.00 C ATOM 877 CZ PHE A 89 3.444 5.375 -7.889 1.00 0.00 C ATOM 0 H PHE A 89 0.713 4.217 -11.945 1.00 0.00 H new ATOM 0 HA PHE A 89 1.180 7.020 -11.858 1.00 0.00 H new ATOM 0 HB2 PHE A 89 2.897 4.620 -12.562 1.00 0.00 H new ATOM 0 HB3 PHE A 89 3.525 6.256 -12.567 1.00 0.00 H new ATOM 0 HD1 PHE A 89 1.959 3.673 -10.390 1.00 0.00 H new ATOM 0 HD2 PHE A 89 4.115 7.349 -10.532 1.00 0.00 H new ATOM 0 HE1 PHE A 89 2.344 3.544 -7.969 1.00 0.00 H new ATOM 0 HE2 PHE A 89 4.498 7.220 -8.111 1.00 0.00 H new ATOM 0 HZ PHE A 89 3.611 5.318 -6.824 1.00 0.00 H new ATOM 887 N ASN A 90 0.815 5.698 -14.794 1.00 0.00 N ATOM 888 CA ASN A 90 0.610 6.029 -16.204 1.00 0.00 C ATOM 889 C ASN A 90 -0.570 6.992 -16.340 1.00 0.00 C ATOM 890 O ASN A 90 -0.607 7.830 -17.237 1.00 0.00 O ATOM 891 CB ASN A 90 0.362 4.752 -17.017 1.00 0.00 C ATOM 892 CG ASN A 90 0.162 5.009 -18.504 1.00 0.00 C ATOM 893 OD1 ASN A 90 0.681 5.976 -19.062 1.00 0.00 O ATOM 894 ND2 ASN A 90 -0.586 4.132 -19.157 1.00 0.00 N ATOM 0 H ASN A 90 0.542 4.749 -14.540 1.00 0.00 H new ATOM 0 HA ASN A 90 1.505 6.513 -16.593 1.00 0.00 H new ATOM 0 HB2 ASN A 90 1.206 4.076 -16.883 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -0.518 4.245 -16.622 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -0.749 4.245 -20.158 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -0.999 3.343 -18.659 1.00 0.00 H new ATOM 901 N ALA A 91 -1.526 6.869 -15.417 1.00 0.00 N ATOM 902 CA ALA A 91 -2.666 7.782 -15.351 1.00 0.00 C ATOM 903 C ALA A 91 -2.297 9.047 -14.570 1.00 0.00 C ATOM 904 O ALA A 91 -3.153 9.891 -14.296 1.00 0.00 O ATOM 905 CB ALA A 91 -3.864 7.087 -14.711 1.00 0.00 C ATOM 0 H ALA A 91 -1.532 6.142 -14.702 1.00 0.00 H new ATOM 0 HA ALA A 91 -2.936 8.074 -16.366 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -4.706 7.778 -14.668 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -4.140 6.216 -15.306 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -3.604 6.769 -13.701 1.00 0.00 H new ATOM 911 N ASN A 92 -1.013 9.146 -14.211 1.00 0.00 N ATOM 912 CA ASN A 92 -0.447 10.317 -13.529 1.00 0.00 C ATOM 913 C ASN A 92 -0.835 10.340 -12.044 1.00 0.00 C ATOM 914 O ASN A 92 -0.730 11.369 -11.374 1.00 0.00 O ATOM 915 CB ASN A 92 -0.854 11.625 -14.242 1.00 0.00 C ATOM 916 CG ASN A 92 -0.043 12.835 -13.788 1.00 0.00 C ATOM 917 OD1 ASN A 92 -0.453 13.587 -12.902 1.00 0.00 O ATOM 918 ND2 ASN A 92 1.125 13.022 -14.387 1.00 0.00 N ATOM 0 H ASN A 92 -0.330 8.409 -14.387 1.00 0.00 H new ATOM 0 HA ASN A 92 0.639 10.239 -13.579 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -0.733 11.498 -15.318 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -1.912 11.816 -14.061 1.00 0.00 H new ATOM 0 HD21 ASN A 92 1.716 13.809 -14.118 1.00 0.00 H new ATOM 0 HD22 ASN A 92 1.433 12.379 -15.117 1.00 0.00 H new ATOM 925 N TYR A 93 -1.269 9.194 -11.519 1.00 0.00 N ATOM 926 CA TYR A 93 -1.501 9.058 -10.084 1.00 0.00 C ATOM 927 C TYR A 93 -0.171 8.851 -9.366 1.00 0.00 C ATOM 928 O TYR A 93 0.308 7.720 -9.244 1.00 0.00 O ATOM 929 CB TYR A 93 -2.441 7.882 -9.767 1.00 0.00 C ATOM 930 CG TYR A 93 -3.873 8.078 -10.227 1.00 0.00 C ATOM 931 CD1 TYR A 93 -4.543 9.275 -10.002 1.00 0.00 C ATOM 932 CD2 TYR A 93 -4.560 7.055 -10.871 1.00 0.00 C ATOM 933 CE1 TYR A 93 -5.851 9.450 -10.409 1.00 0.00 C ATOM 934 CE2 TYR A 93 -5.867 7.220 -11.279 1.00 0.00 C ATOM 935 CZ TYR A 93 -6.510 8.419 -11.046 1.00 0.00 C ATOM 936 OH TYR A 93 -7.814 8.588 -11.450 1.00 0.00 O ATOM 0 H TYR A 93 -1.465 8.353 -12.062 1.00 0.00 H new ATOM 0 HA TYR A 93 -1.978 9.974 -9.736 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -2.044 6.980 -10.233 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -2.439 7.712 -8.690 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -4.031 10.083 -9.500 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -4.061 6.115 -11.055 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -6.355 10.388 -10.230 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -6.385 6.415 -11.779 1.00 0.00 H new ATOM 0 HH TYR A 93 -8.131 7.768 -11.883 1.00 0.00 H new ATOM 946 N ASP A 94 0.439 9.945 -8.924 1.00 0.00 N ATOM 947 CA ASP A 94 1.717 9.876 -8.222 1.00 0.00 C ATOM 948 C ASP A 94 1.485 9.554 -6.746 1.00 0.00 C ATOM 949 O ASP A 94 1.605 10.415 -5.871 1.00 0.00 O ATOM 950 CB ASP A 94 2.501 11.187 -8.384 1.00 0.00 C ATOM 951 CG ASP A 94 3.941 11.064 -7.906 1.00 0.00 C ATOM 952 OD1 ASP A 94 4.780 10.541 -8.673 1.00 0.00 O ATOM 953 OD2 ASP A 94 4.245 11.491 -6.771 1.00 0.00 O ATOM 0 H ASP A 94 0.071 10.889 -9.039 1.00 0.00 H new ATOM 0 HA ASP A 94 2.315 9.077 -8.661 1.00 0.00 H new ATOM 0 HB2 ASP A 94 2.493 11.485 -9.432 1.00 0.00 H new ATOM 0 HB3 ASP A 94 2.001 11.978 -7.824 1.00 0.00 H new ATOM 958 N VAL A 95 1.100 8.308 -6.497 1.00 0.00 N ATOM 959 CA VAL A 95 0.854 7.815 -5.144 1.00 0.00 C ATOM 960 C VAL A 95 2.156 7.281 -4.554 1.00 0.00 C ATOM 961 O VAL A 95 3.187 7.292 -5.235 1.00 0.00 O ATOM 962 CB VAL A 95 -0.211 6.686 -5.154 1.00 0.00 C ATOM 963 CG1 VAL A 95 -1.445 7.112 -5.949 1.00 0.00 C ATOM 964 CG2 VAL A 95 0.367 5.382 -5.713 1.00 0.00 C ATOM 0 H VAL A 95 0.949 7.610 -7.225 1.00 0.00 H new ATOM 0 HA VAL A 95 0.480 8.639 -4.536 1.00 0.00 H new ATOM 0 HB VAL A 95 -0.512 6.504 -4.122 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -2.178 6.305 -5.943 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -1.881 8.002 -5.495 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -1.157 7.333 -6.977 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -0.403 4.611 -5.707 1.00 0.00 H new ATOM 0 HG22 VAL A 95 0.710 5.545 -6.735 1.00 0.00 H new ATOM 0 HG23 VAL A 95 1.206 5.062 -5.095 1.00 0.00 H new ATOM 974 N GLN A 96 2.141 6.819 -3.302 1.00 0.00 N ATOM 975 CA GLN A 96 3.318 6.142 -2.766 1.00 0.00 C ATOM 976 C GLN A 96 3.025 4.664 -2.593 1.00 0.00 C ATOM 977 O GLN A 96 1.913 4.280 -2.229 1.00 0.00 O ATOM 978 CB GLN A 96 3.784 6.767 -1.447 1.00 0.00 C ATOM 979 CG GLN A 96 5.038 6.120 -0.839 1.00 0.00 C ATOM 980 CD GLN A 96 6.259 6.120 -1.763 1.00 0.00 C ATOM 981 OE1 GLN A 96 6.143 6.033 -2.983 1.00 0.00 O ATOM 982 NE2 GLN A 96 7.446 6.221 -1.179 1.00 0.00 N ATOM 0 H GLN A 96 1.353 6.898 -2.660 1.00 0.00 H new ATOM 0 HA GLN A 96 4.134 6.263 -3.479 1.00 0.00 H new ATOM 0 HB2 GLN A 96 3.982 7.826 -1.612 1.00 0.00 H new ATOM 0 HB3 GLN A 96 2.971 6.703 -0.723 1.00 0.00 H new ATOM 0 HG2 GLN A 96 5.294 6.645 0.081 1.00 0.00 H new ATOM 0 HG3 GLN A 96 4.805 5.091 -0.565 1.00 0.00 H new ATOM 0 HE21 GLN A 96 7.510 6.292 -0.163 1.00 0.00 H new ATOM 0 HE22 GLN A 96 8.294 6.228 -1.746 1.00 0.00 H new ATOM 991 N ARG A 97 4.022 3.842 -2.880 1.00 0.00 N ATOM 992 CA ARG A 97 3.871 2.401 -2.801 1.00 0.00 C ATOM 993 C ARG A 97 5.204 1.754 -2.448 1.00 0.00 C ATOM 994 O ARG A 97 6.251 2.122 -2.996 1.00 0.00 O ATOM 995 CB ARG A 97 3.327 1.830 -4.132 1.00 0.00 C ATOM 996 CG ARG A 97 4.341 1.756 -5.279 1.00 0.00 C ATOM 997 CD ARG A 97 4.946 3.116 -5.625 1.00 0.00 C ATOM 998 NE ARG A 97 5.922 3.022 -6.714 1.00 0.00 N ATOM 999 CZ ARG A 97 7.227 2.778 -6.545 1.00 0.00 C ATOM 1000 NH1 ARG A 97 7.722 2.569 -5.327 1.00 0.00 N ATOM 1001 NH2 ARG A 97 8.035 2.734 -7.600 1.00 0.00 N ATOM 0 H ARG A 97 4.949 4.152 -3.171 1.00 0.00 H new ATOM 0 HA ARG A 97 3.150 2.172 -2.016 1.00 0.00 H new ATOM 0 HB2 ARG A 97 2.940 0.828 -3.947 1.00 0.00 H new ATOM 0 HB3 ARG A 97 2.485 2.443 -4.453 1.00 0.00 H new ATOM 0 HG2 ARG A 97 5.140 1.067 -5.007 1.00 0.00 H new ATOM 0 HG3 ARG A 97 3.853 1.345 -6.163 1.00 0.00 H new ATOM 0 HD2 ARG A 97 4.151 3.805 -5.910 1.00 0.00 H new ATOM 0 HD3 ARG A 97 5.428 3.534 -4.741 1.00 0.00 H new ATOM 0 HE ARG A 97 5.583 3.152 -7.667 1.00 0.00 H new ATOM 0 HH11 ARG A 97 7.106 2.594 -4.515 1.00 0.00 H new ATOM 0 HH12 ARG A 97 8.718 2.384 -5.206 1.00 0.00 H new ATOM 0 HH21 ARG A 97 7.660 2.886 -8.536 1.00 0.00 H new ATOM 0 HH22 ARG A 97 9.030 2.548 -7.473 1.00 0.00 H new ATOM 1015 N PHE A 98 5.168 0.814 -1.518 1.00 0.00 N ATOM 1016 CA PHE A 98 6.347 0.048 -1.151 1.00 0.00 C ATOM 1017 C PHE A 98 6.114 -1.420 -1.482 1.00 0.00 C ATOM 1018 O PHE A 98 5.034 -1.970 -1.210 1.00 0.00 O ATOM 1019 CB PHE A 98 6.684 0.211 0.339 1.00 0.00 C ATOM 1020 CG PHE A 98 6.978 1.632 0.758 1.00 0.00 C ATOM 1021 CD1 PHE A 98 7.901 2.400 0.060 1.00 0.00 C ATOM 1022 CD2 PHE A 98 6.334 2.198 1.849 1.00 0.00 C ATOM 1023 CE1 PHE A 98 8.175 3.699 0.445 1.00 0.00 C ATOM 1024 CE2 PHE A 98 6.606 3.497 2.237 1.00 0.00 C ATOM 1025 CZ PHE A 98 7.527 4.248 1.534 1.00 0.00 C ATOM 0 H PHE A 98 4.327 0.562 -0.999 1.00 0.00 H new ATOM 0 HA PHE A 98 7.196 0.425 -1.721 1.00 0.00 H new ATOM 0 HB2 PHE A 98 5.850 -0.165 0.931 1.00 0.00 H new ATOM 0 HB3 PHE A 98 7.548 -0.411 0.574 1.00 0.00 H new ATOM 0 HD1 PHE A 98 8.410 1.977 -0.793 1.00 0.00 H new ATOM 0 HD2 PHE A 98 5.611 1.617 2.402 1.00 0.00 H new ATOM 0 HE1 PHE A 98 8.896 4.285 -0.106 1.00 0.00 H new ATOM 0 HE2 PHE A 98 6.098 3.924 3.089 1.00 0.00 H new ATOM 0 HZ PHE A 98 7.740 5.263 1.835 1.00 0.00 H new ATOM 1035 N ILE A 99 7.115 -2.035 -2.097 1.00 0.00 N ATOM 1036 CA ILE A 99 7.059 -3.443 -2.451 1.00 0.00 C ATOM 1037 C ILE A 99 7.832 -4.268 -1.421 1.00 0.00 C ATOM 1038 O ILE A 99 9.043 -4.455 -1.525 1.00 0.00 O ATOM 1039 CB ILE A 99 7.602 -3.688 -3.891 1.00 0.00 C ATOM 1040 CG1 ILE A 99 7.634 -5.193 -4.218 1.00 0.00 C ATOM 1041 CG2 ILE A 99 8.980 -3.049 -4.080 1.00 0.00 C ATOM 1042 CD1 ILE A 99 8.083 -5.506 -5.632 1.00 0.00 C ATOM 0 H ILE A 99 7.984 -1.573 -2.363 1.00 0.00 H new ATOM 0 HA ILE A 99 6.017 -3.761 -2.443 1.00 0.00 H new ATOM 0 HB ILE A 99 6.919 -3.208 -4.592 1.00 0.00 H new ATOM 0 HG12 ILE A 99 8.302 -5.693 -3.516 1.00 0.00 H new ATOM 0 HG13 ILE A 99 6.639 -5.610 -4.063 1.00 0.00 H new ATOM 0 HG21 ILE A 99 9.332 -3.237 -5.094 1.00 0.00 H new ATOM 0 HG22 ILE A 99 8.908 -1.974 -3.914 1.00 0.00 H new ATOM 0 HG23 ILE A 99 9.682 -3.480 -3.366 1.00 0.00 H new ATOM 0 HD11 ILE A 99 8.079 -6.585 -5.785 1.00 0.00 H new ATOM 0 HD12 ILE A 99 7.402 -5.037 -6.342 1.00 0.00 H new ATOM 0 HD13 ILE A 99 9.091 -5.121 -5.787 1.00 0.00 H new ATOM 1054 N VAL A 100 7.120 -4.708 -0.395 1.00 0.00 N ATOM 1055 CA VAL A 100 7.698 -5.513 0.673 1.00 0.00 C ATOM 1056 C VAL A 100 6.736 -6.642 1.018 1.00 0.00 C ATOM 1057 O VAL A 100 5.525 -6.421 1.110 1.00 0.00 O ATOM 1058 CB VAL A 100 8.003 -4.654 1.929 1.00 0.00 C ATOM 1059 CG1 VAL A 100 6.746 -3.946 2.428 1.00 0.00 C ATOM 1060 CG2 VAL A 100 8.633 -5.502 3.037 1.00 0.00 C ATOM 0 H VAL A 100 6.125 -4.518 -0.278 1.00 0.00 H new ATOM 0 HA VAL A 100 8.645 -5.928 0.328 1.00 0.00 H new ATOM 0 HB VAL A 100 8.725 -3.890 1.642 1.00 0.00 H new ATOM 0 HG11 VAL A 100 6.989 -3.351 3.309 1.00 0.00 H new ATOM 0 HG12 VAL A 100 6.361 -3.294 1.645 1.00 0.00 H new ATOM 0 HG13 VAL A 100 5.990 -4.687 2.688 1.00 0.00 H new ATOM 0 HG21 VAL A 100 8.836 -4.874 3.905 1.00 0.00 H new ATOM 0 HG22 VAL A 100 7.946 -6.300 3.319 1.00 0.00 H new ATOM 0 HG23 VAL A 100 9.566 -5.936 2.677 1.00 0.00 H new ATOM 1070 N GLY A 101 7.267 -7.845 1.209 1.00 0.00 N ATOM 1071 CA GLY A 101 6.415 -9.014 1.319 1.00 0.00 C ATOM 1072 C GLY A 101 5.898 -9.400 -0.047 1.00 0.00 C ATOM 1073 O GLY A 101 4.987 -8.768 -0.568 1.00 0.00 O ATOM 0 H GLY A 101 8.267 -8.031 1.289 1.00 0.00 H new ATOM 0 HA2 GLY A 101 6.973 -9.843 1.754 1.00 0.00 H new ATOM 0 HA3 GLY A 101 5.580 -8.806 1.988 1.00 0.00 H new ATOM 1077 N SER A 102 6.494 -10.424 -0.635 1.00 0.00 N ATOM 1078 CA SER A 102 6.287 -10.745 -2.044 1.00 0.00 C ATOM 1079 C SER A 102 4.826 -11.061 -2.404 1.00 0.00 C ATOM 1080 O SER A 102 4.493 -11.171 -3.589 1.00 0.00 O ATOM 1081 CB SER A 102 7.191 -11.910 -2.430 1.00 0.00 C ATOM 1082 OG SER A 102 8.532 -11.651 -2.047 1.00 0.00 O ATOM 0 H SER A 102 7.134 -11.056 -0.154 1.00 0.00 H new ATOM 0 HA SER A 102 6.544 -9.852 -2.613 1.00 0.00 H new ATOM 0 HB2 SER A 102 6.840 -12.824 -1.950 1.00 0.00 H new ATOM 0 HB3 SER A 102 7.140 -12.075 -3.506 1.00 0.00 H new ATOM 0 HG SER A 102 8.971 -12.492 -1.802 1.00 0.00 H new ATOM 1088 N ASP A 103 3.955 -11.216 -1.410 1.00 0.00 N ATOM 1089 CA ASP A 103 2.540 -11.496 -1.670 1.00 0.00 C ATOM 1090 C ASP A 103 1.692 -10.230 -1.534 1.00 0.00 C ATOM 1091 O ASP A 103 0.486 -10.242 -1.817 1.00 0.00 O ATOM 1092 CB ASP A 103 2.024 -12.564 -0.701 1.00 0.00 C ATOM 1093 CG ASP A 103 1.769 -12.026 0.703 1.00 0.00 C ATOM 1094 OD1 ASP A 103 2.743 -11.672 1.397 1.00 0.00 O ATOM 1095 OD2 ASP A 103 0.588 -11.961 1.112 1.00 0.00 O ATOM 0 H ASP A 103 4.199 -11.153 -0.422 1.00 0.00 H new ATOM 0 HA ASP A 103 2.456 -11.862 -2.693 1.00 0.00 H new ATOM 0 HB2 ASP A 103 1.100 -12.987 -1.095 1.00 0.00 H new ATOM 0 HB3 ASP A 103 2.748 -13.377 -0.646 1.00 0.00 H new ATOM 1100 N ARG A 104 2.329 -9.141 -1.117 1.00 0.00 N ATOM 1101 CA ARG A 104 1.632 -7.895 -0.809 1.00 0.00 C ATOM 1102 C ARG A 104 2.303 -6.694 -1.463 1.00 0.00 C ATOM 1103 O ARG A 104 3.505 -6.694 -1.729 1.00 0.00 O ATOM 1104 CB ARG A 104 1.579 -7.653 0.707 1.00 0.00 C ATOM 1105 CG ARG A 104 0.725 -8.650 1.478 1.00 0.00 C ATOM 1106 CD ARG A 104 0.506 -8.211 2.921 1.00 0.00 C ATOM 1107 NE ARG A 104 -0.414 -9.103 3.634 1.00 0.00 N ATOM 1108 CZ ARG A 104 -1.194 -8.719 4.650 1.00 0.00 C ATOM 1109 NH1 ARG A 104 -1.165 -7.462 5.079 1.00 0.00 N ATOM 1110 NH2 ARG A 104 -1.993 -9.599 5.243 1.00 0.00 N ATOM 0 H ARG A 104 3.339 -9.096 -0.983 1.00 0.00 H new ATOM 0 HA ARG A 104 0.622 -8.001 -1.205 1.00 0.00 H new ATOM 0 HB2 ARG A 104 2.594 -7.682 1.102 1.00 0.00 H new ATOM 0 HB3 ARG A 104 1.195 -6.649 0.888 1.00 0.00 H new ATOM 0 HG2 ARG A 104 -0.239 -8.763 0.982 1.00 0.00 H new ATOM 0 HG3 ARG A 104 1.207 -9.628 1.465 1.00 0.00 H new ATOM 0 HD2 ARG A 104 1.463 -8.187 3.442 1.00 0.00 H new ATOM 0 HD3 ARG A 104 0.110 -7.196 2.935 1.00 0.00 H new ATOM 0 HE ARG A 104 -0.462 -10.077 3.336 1.00 0.00 H new ATOM 0 HH11 ARG A 104 -0.546 -6.785 4.633 1.00 0.00 H new ATOM 0 HH12 ARG A 104 -1.762 -7.174 5.854 1.00 0.00 H new ATOM 0 HH21 ARG A 104 -2.011 -10.567 4.923 1.00 0.00 H new ATOM 0 HH22 ARG A 104 -2.588 -9.306 6.018 1.00 0.00 H new ATOM 1124 N ALA A 105 1.490 -5.687 -1.735 1.00 0.00 N ATOM 1125 CA ALA A 105 1.962 -4.358 -2.089 1.00 0.00 C ATOM 1126 C ALA A 105 1.278 -3.350 -1.173 1.00 0.00 C ATOM 1127 O ALA A 105 0.073 -3.461 -0.915 1.00 0.00 O ATOM 1128 CB ALA A 105 1.666 -4.055 -3.555 1.00 0.00 C ATOM 0 H ALA A 105 0.474 -5.770 -1.716 1.00 0.00 H new ATOM 0 HA ALA A 105 3.043 -4.298 -1.959 1.00 0.00 H new ATOM 0 HB1 ALA A 105 2.027 -3.056 -3.800 1.00 0.00 H new ATOM 0 HB2 ALA A 105 2.169 -4.788 -4.187 1.00 0.00 H new ATOM 0 HB3 ALA A 105 0.591 -4.105 -3.727 1.00 0.00 H new ATOM 1134 N ILE A 106 2.032 -2.386 -0.655 1.00 0.00 N ATOM 1135 CA ILE A 106 1.457 -1.396 0.257 1.00 0.00 C ATOM 1136 C ILE A 106 1.442 -0.014 -0.384 1.00 0.00 C ATOM 1137 O ILE A 106 2.455 0.455 -0.904 1.00 0.00 O ATOM 1138 CB ILE A 106 2.197 -1.351 1.618 1.00 0.00 C ATOM 1139 CG1 ILE A 106 1.628 -0.228 2.507 1.00 0.00 C ATOM 1140 CG2 ILE A 106 3.700 -1.188 1.424 1.00 0.00 C ATOM 1141 CD1 ILE A 106 2.371 -0.045 3.808 1.00 0.00 C ATOM 0 H ILE A 106 3.027 -2.267 -0.845 1.00 0.00 H new ATOM 0 HA ILE A 106 0.431 -1.706 0.455 1.00 0.00 H new ATOM 0 HB ILE A 106 2.033 -2.303 2.124 1.00 0.00 H new ATOM 0 HG12 ILE A 106 1.651 0.709 1.951 1.00 0.00 H new ATOM 0 HG13 ILE A 106 0.582 -0.444 2.724 1.00 0.00 H new ATOM 0 HG21 ILE A 106 4.191 -1.160 2.397 1.00 0.00 H new ATOM 0 HG22 ILE A 106 4.086 -2.028 0.847 1.00 0.00 H new ATOM 0 HG23 ILE A 106 3.899 -0.259 0.890 1.00 0.00 H new ATOM 0 HD11 ILE A 106 1.912 0.763 4.379 1.00 0.00 H new ATOM 0 HD12 ILE A 106 2.326 -0.968 4.386 1.00 0.00 H new ATOM 0 HD13 ILE A 106 3.412 0.203 3.601 1.00 0.00 H new ATOM 1153 N PHE A 107 0.277 0.623 -0.352 1.00 0.00 N ATOM 1154 CA PHE A 107 0.083 1.948 -0.938 1.00 0.00 C ATOM 1155 C PHE A 107 -0.308 2.943 0.145 1.00 0.00 C ATOM 1156 O PHE A 107 -0.996 2.586 1.102 1.00 0.00 O ATOM 1157 CB PHE A 107 -1.010 1.910 -2.022 1.00 0.00 C ATOM 1158 CG PHE A 107 -0.594 1.232 -3.307 1.00 0.00 C ATOM 1159 CD1 PHE A 107 -0.266 -0.116 -3.327 1.00 0.00 C ATOM 1160 CD2 PHE A 107 -0.542 1.947 -4.498 1.00 0.00 C ATOM 1161 CE1 PHE A 107 0.109 -0.734 -4.504 1.00 0.00 C ATOM 1162 CE2 PHE A 107 -0.167 1.331 -5.677 1.00 0.00 C ATOM 1163 CZ PHE A 107 0.159 -0.010 -5.679 1.00 0.00 C ATOM 0 H PHE A 107 -0.562 0.237 0.081 1.00 0.00 H new ATOM 0 HA PHE A 107 1.021 2.260 -1.398 1.00 0.00 H new ATOM 0 HB2 PHE A 107 -1.884 1.396 -1.621 1.00 0.00 H new ATOM 0 HB3 PHE A 107 -1.316 2.932 -2.247 1.00 0.00 H new ATOM 0 HD1 PHE A 107 -0.304 -0.688 -2.412 1.00 0.00 H new ATOM 0 HD2 PHE A 107 -0.798 2.996 -4.502 1.00 0.00 H new ATOM 0 HE1 PHE A 107 0.363 -1.784 -4.505 1.00 0.00 H new ATOM 0 HE2 PHE A 107 -0.129 1.898 -6.595 1.00 0.00 H new ATOM 0 HZ PHE A 107 0.453 -0.493 -6.599 1.00 0.00 H new ATOM 1173 N MET A 108 0.133 4.184 -0.002 1.00 0.00 N ATOM 1174 CA MET A 108 -0.248 5.244 0.920 1.00 0.00 C ATOM 1175 C MET A 108 -0.474 6.556 0.175 1.00 0.00 C ATOM 1176 O MET A 108 0.178 6.844 -0.853 1.00 0.00 O ATOM 1177 CB MET A 108 0.796 5.428 2.034 1.00 0.00 C ATOM 1178 CG MET A 108 2.206 5.703 1.535 1.00 0.00 C ATOM 1179 SD MET A 108 2.957 4.274 0.734 1.00 0.00 S ATOM 1180 CE MET A 108 2.984 3.109 2.093 1.00 0.00 C ATOM 0 H MET A 108 0.756 4.482 -0.753 1.00 0.00 H new ATOM 0 HA MET A 108 -1.185 4.947 1.390 1.00 0.00 H new ATOM 0 HB2 MET A 108 0.484 6.252 2.675 1.00 0.00 H new ATOM 0 HB3 MET A 108 0.811 4.531 2.653 1.00 0.00 H new ATOM 0 HG2 MET A 108 2.181 6.536 0.832 1.00 0.00 H new ATOM 0 HG3 MET A 108 2.829 6.012 2.374 1.00 0.00 H new ATOM 0 HE1 MET A 108 3.486 2.194 1.778 1.00 0.00 H new ATOM 0 HE2 MET A 108 3.520 3.546 2.936 1.00 0.00 H new ATOM 0 HE3 MET A 108 1.962 2.877 2.394 1.00 0.00 H new ATOM 1190 N LEU A 109 -1.411 7.341 0.708 1.00 0.00 N ATOM 1191 CA LEU A 109 -1.820 8.604 0.115 1.00 0.00 C ATOM 1192 C LEU A 109 -1.854 9.710 1.162 1.00 0.00 C ATOM 1193 O LEU A 109 -2.326 9.507 2.282 1.00 0.00 O ATOM 1194 CB LEU A 109 -3.221 8.467 -0.504 1.00 0.00 C ATOM 1195 CG LEU A 109 -3.315 7.576 -1.750 1.00 0.00 C ATOM 1196 CD1 LEU A 109 -4.768 7.413 -2.195 1.00 0.00 C ATOM 1197 CD2 LEU A 109 -2.473 8.157 -2.876 1.00 0.00 C ATOM 0 H LEU A 109 -1.908 7.112 1.569 1.00 0.00 H new ATOM 0 HA LEU A 109 -1.094 8.862 -0.656 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -3.896 8.071 0.255 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -3.582 9.462 -0.764 1.00 0.00 H new ATOM 0 HG LEU A 109 -2.928 6.589 -1.497 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -4.808 6.778 -3.080 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -5.345 6.954 -1.392 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -5.188 8.391 -2.431 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -2.548 7.516 -3.754 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -2.835 9.155 -3.123 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -1.432 8.217 -2.558 1.00 0.00 H new ATOM 1209 N ARG A 110 -1.327 10.871 0.799 1.00 0.00 N ATOM 1210 CA ARG A 110 -1.576 12.093 1.555 1.00 0.00 C ATOM 1211 C ARG A 110 -2.786 12.794 0.938 1.00 0.00 C ATOM 1212 O ARG A 110 -3.557 13.468 1.625 1.00 0.00 O ATOM 1213 CB ARG A 110 -0.341 13.011 1.555 1.00 0.00 C ATOM 1214 CG ARG A 110 0.804 12.507 2.437 1.00 0.00 C ATOM 1215 CD ARG A 110 0.394 12.422 3.910 1.00 0.00 C ATOM 1216 NE ARG A 110 1.515 12.065 4.788 1.00 0.00 N ATOM 1217 CZ ARG A 110 1.462 12.113 6.127 1.00 0.00 C ATOM 1218 NH1 ARG A 110 0.375 12.581 6.734 1.00 0.00 N ATOM 1219 NH2 ARG A 110 2.510 11.727 6.851 1.00 0.00 N ATOM 0 H ARG A 110 -0.724 10.994 -0.014 1.00 0.00 H new ATOM 0 HA ARG A 110 -1.781 11.847 2.597 1.00 0.00 H new ATOM 0 HB2 ARG A 110 0.021 13.118 0.532 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -0.638 14.004 1.893 1.00 0.00 H new ATOM 0 HG2 ARG A 110 1.123 11.524 2.091 1.00 0.00 H new ATOM 0 HG3 ARG A 110 1.661 13.174 2.336 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -0.018 13.381 4.225 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -0.399 11.683 4.021 1.00 0.00 H new ATOM 0 HE ARG A 110 2.387 11.762 4.353 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -0.419 12.904 6.181 1.00 0.00 H new ATOM 0 HH12 ARG A 110 0.335 12.617 7.753 1.00 0.00 H new ATOM 0 HH21 ARG A 110 3.355 11.394 6.387 1.00 0.00 H new ATOM 0 HH22 ARG A 110 2.468 11.764 7.869 1.00 0.00 H new ATOM 1233 N ASP A 111 -2.933 12.611 -0.374 1.00 0.00 N ATOM 1234 CA ASP A 111 -4.129 13.021 -1.102 1.00 0.00 C ATOM 1235 C ASP A 111 -4.997 11.785 -1.337 1.00 0.00 C ATOM 1236 O ASP A 111 -4.632 10.909 -2.124 1.00 0.00 O ATOM 1237 CB ASP A 111 -3.748 13.651 -2.454 1.00 0.00 C ATOM 1238 CG ASP A 111 -2.834 14.859 -2.311 1.00 0.00 C ATOM 1239 OD1 ASP A 111 -1.639 14.672 -1.997 1.00 0.00 O ATOM 1240 OD2 ASP A 111 -3.298 16.001 -2.527 1.00 0.00 O ATOM 0 H ASP A 111 -2.223 12.173 -0.961 1.00 0.00 H new ATOM 0 HA ASP A 111 -4.674 13.764 -0.520 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -3.255 12.901 -3.072 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -4.656 13.949 -2.978 1.00 0.00 H new ATOM 1245 N GLY A 112 -6.138 11.715 -0.660 1.00 0.00 N ATOM 1246 CA GLY A 112 -6.963 10.514 -0.699 1.00 0.00 C ATOM 1247 C GLY A 112 -8.297 10.725 -1.387 1.00 0.00 C ATOM 1248 O GLY A 112 -9.185 9.877 -1.301 1.00 0.00 O ATOM 0 H GLY A 112 -6.510 12.469 -0.082 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -6.417 9.723 -1.214 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -7.138 10.169 0.320 1.00 0.00 H new ATOM 1252 N SER A 113 -8.430 11.843 -2.089 1.00 0.00 N ATOM 1253 CA SER A 113 -9.682 12.191 -2.764 1.00 0.00 C ATOM 1254 C SER A 113 -10.055 11.144 -3.828 1.00 0.00 C ATOM 1255 O SER A 113 -11.215 11.039 -4.229 1.00 0.00 O ATOM 1256 CB SER A 113 -9.557 13.585 -3.396 1.00 0.00 C ATOM 1257 OG SER A 113 -10.811 14.065 -3.859 1.00 0.00 O ATOM 0 H SER A 113 -7.685 12.529 -2.208 1.00 0.00 H new ATOM 0 HA SER A 113 -10.482 12.203 -2.024 1.00 0.00 H new ATOM 0 HB2 SER A 113 -9.148 14.281 -2.664 1.00 0.00 H new ATOM 0 HB3 SER A 113 -8.853 13.546 -4.227 1.00 0.00 H new ATOM 0 HG SER A 113 -10.695 14.954 -4.254 1.00 0.00 H new ATOM 1263 N TYR A 114 -9.067 10.368 -4.270 1.00 0.00 N ATOM 1264 CA TYR A 114 -9.279 9.339 -5.296 1.00 0.00 C ATOM 1265 C TYR A 114 -8.952 7.947 -4.748 1.00 0.00 C ATOM 1266 O TYR A 114 -8.760 6.996 -5.507 1.00 0.00 O ATOM 1267 CB TYR A 114 -8.427 9.652 -6.541 1.00 0.00 C ATOM 1268 CG TYR A 114 -6.942 9.829 -6.258 1.00 0.00 C ATOM 1269 CD1 TYR A 114 -6.455 11.015 -5.715 1.00 0.00 C ATOM 1270 CD2 TYR A 114 -6.029 8.818 -6.542 1.00 0.00 C ATOM 1271 CE1 TYR A 114 -5.105 11.185 -5.462 1.00 0.00 C ATOM 1272 CE2 TYR A 114 -4.680 8.982 -6.290 1.00 0.00 C ATOM 1273 CZ TYR A 114 -4.225 10.165 -5.751 1.00 0.00 C ATOM 1274 OH TYR A 114 -2.880 10.331 -5.501 1.00 0.00 O ATOM 0 H TYR A 114 -8.106 10.430 -3.934 1.00 0.00 H new ATOM 0 HA TYR A 114 -10.331 9.345 -5.583 1.00 0.00 H new ATOM 0 HB2 TYR A 114 -8.553 8.847 -7.265 1.00 0.00 H new ATOM 0 HB3 TYR A 114 -8.807 10.561 -7.007 1.00 0.00 H new ATOM 0 HD1 TYR A 114 -7.143 11.816 -5.487 1.00 0.00 H new ATOM 0 HD2 TYR A 114 -6.381 7.889 -6.967 1.00 0.00 H new ATOM 0 HE1 TYR A 114 -4.744 12.111 -5.041 1.00 0.00 H new ATOM 0 HE2 TYR A 114 -3.986 8.186 -6.515 1.00 0.00 H new ATOM 0 HH TYR A 114 -2.761 10.938 -4.741 1.00 0.00 H new ATOM 1284 N ALA A 115 -8.930 7.831 -3.421 1.00 0.00 N ATOM 1285 CA ALA A 115 -8.559 6.581 -2.753 1.00 0.00 C ATOM 1286 C ALA A 115 -9.519 5.442 -3.095 1.00 0.00 C ATOM 1287 O ALA A 115 -9.093 4.322 -3.386 1.00 0.00 O ATOM 1288 CB ALA A 115 -8.514 6.786 -1.245 1.00 0.00 C ATOM 0 H ALA A 115 -9.166 8.591 -2.783 1.00 0.00 H new ATOM 0 HA ALA A 115 -7.570 6.299 -3.114 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -8.237 5.851 -0.759 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -7.777 7.552 -1.004 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -9.495 7.102 -0.891 1.00 0.00 H new ATOM 1294 N TRP A 116 -10.814 5.738 -3.059 1.00 0.00 N ATOM 1295 CA TRP A 116 -11.844 4.719 -3.252 1.00 0.00 C ATOM 1296 C TRP A 116 -11.787 4.148 -4.668 1.00 0.00 C ATOM 1297 O TRP A 116 -12.047 2.960 -4.883 1.00 0.00 O ATOM 1298 CB TRP A 116 -13.235 5.304 -2.947 1.00 0.00 C ATOM 1299 CG TRP A 116 -14.017 4.480 -1.964 1.00 0.00 C ATOM 1300 CD1 TRP A 116 -15.259 3.945 -2.137 1.00 0.00 C ATOM 1301 CD2 TRP A 116 -13.591 4.095 -0.652 1.00 0.00 C ATOM 1302 NE1 TRP A 116 -15.632 3.246 -1.012 1.00 0.00 N ATOM 1303 CE2 TRP A 116 -14.624 3.325 -0.087 1.00 0.00 C ATOM 1304 CE3 TRP A 116 -12.434 4.328 0.099 1.00 0.00 C ATOM 1305 CZ2 TRP A 116 -14.531 2.784 1.193 1.00 0.00 C ATOM 1306 CZ3 TRP A 116 -12.343 3.794 1.366 1.00 0.00 C ATOM 1307 CH2 TRP A 116 -13.387 3.029 1.904 1.00 0.00 C ATOM 0 H TRP A 116 -11.178 6.677 -2.898 1.00 0.00 H new ATOM 0 HA TRP A 116 -11.656 3.900 -2.557 1.00 0.00 H new ATOM 0 HB2 TRP A 116 -13.120 6.314 -2.555 1.00 0.00 H new ATOM 0 HB3 TRP A 116 -13.800 5.385 -3.875 1.00 0.00 H new ATOM 0 HD1 TRP A 116 -15.862 4.054 -3.027 1.00 0.00 H new ATOM 0 HE1 TRP A 116 -16.515 2.750 -0.887 1.00 0.00 H new ATOM 0 HE3 TRP A 116 -11.625 4.917 -0.308 1.00 0.00 H new ATOM 0 HZ2 TRP A 116 -15.333 2.192 1.610 1.00 0.00 H new ATOM 0 HZ3 TRP A 116 -11.454 3.968 1.954 1.00 0.00 H new ATOM 0 HH2 TRP A 116 -13.287 2.624 2.900 1.00 0.00 H new ATOM 1318 N GLU A 117 -11.429 4.995 -5.627 1.00 0.00 N ATOM 1319 CA GLU A 117 -11.278 4.568 -7.014 1.00 0.00 C ATOM 1320 C GLU A 117 -10.188 3.501 -7.110 1.00 0.00 C ATOM 1321 O GLU A 117 -10.372 2.453 -7.738 1.00 0.00 O ATOM 1322 CB GLU A 117 -10.932 5.765 -7.908 1.00 0.00 C ATOM 1323 CG GLU A 117 -11.915 6.925 -7.785 1.00 0.00 C ATOM 1324 CD GLU A 117 -13.349 6.520 -8.095 1.00 0.00 C ATOM 1325 OE1 GLU A 117 -13.705 6.439 -9.291 1.00 0.00 O ATOM 1326 OE2 GLU A 117 -14.128 6.286 -7.144 1.00 0.00 O ATOM 0 H GLU A 117 -11.237 5.984 -5.469 1.00 0.00 H new ATOM 0 HA GLU A 117 -12.221 4.144 -7.358 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -9.932 6.119 -7.656 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -10.901 5.435 -8.946 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -11.867 7.330 -6.774 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -11.614 7.724 -8.463 1.00 0.00 H new ATOM 1333 N ILE A 118 -9.059 3.772 -6.460 1.00 0.00 N ATOM 1334 CA ILE A 118 -7.946 2.831 -6.421 1.00 0.00 C ATOM 1335 C ILE A 118 -8.358 1.532 -5.737 1.00 0.00 C ATOM 1336 O ILE A 118 -8.022 0.454 -6.214 1.00 0.00 O ATOM 1337 CB ILE A 118 -6.696 3.445 -5.730 1.00 0.00 C ATOM 1338 CG1 ILE A 118 -5.855 4.221 -6.754 1.00 0.00 C ATOM 1339 CG2 ILE A 118 -5.841 2.375 -5.039 1.00 0.00 C ATOM 1340 CD1 ILE A 118 -6.574 5.386 -7.404 1.00 0.00 C ATOM 0 H ILE A 118 -8.892 4.640 -5.951 1.00 0.00 H new ATOM 0 HA ILE A 118 -7.673 2.607 -7.452 1.00 0.00 H new ATOM 0 HB ILE A 118 -7.047 4.130 -4.959 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -4.958 4.594 -6.260 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -5.527 3.532 -7.533 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -4.978 2.847 -4.569 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -6.436 1.868 -4.279 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -5.500 1.649 -5.777 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -5.906 5.876 -8.112 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -7.456 5.021 -7.930 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -6.878 6.099 -6.638 1.00 0.00 H new ATOM 1352 N LYS A 119 -9.100 1.641 -4.638 1.00 0.00 N ATOM 1353 CA LYS A 119 -9.604 0.462 -3.936 1.00 0.00 C ATOM 1354 C LYS A 119 -10.352 -0.451 -4.908 1.00 0.00 C ATOM 1355 O LYS A 119 -10.046 -1.643 -5.029 1.00 0.00 O ATOM 1356 CB LYS A 119 -10.539 0.869 -2.788 1.00 0.00 C ATOM 1357 CG LYS A 119 -11.191 -0.321 -2.086 1.00 0.00 C ATOM 1358 CD LYS A 119 -12.365 0.103 -1.210 1.00 0.00 C ATOM 1359 CE LYS A 119 -13.179 -1.102 -0.749 1.00 0.00 C ATOM 1360 NZ LYS A 119 -14.484 -0.702 -0.157 1.00 0.00 N ATOM 0 H LYS A 119 -9.365 2.530 -4.215 1.00 0.00 H new ATOM 0 HA LYS A 119 -8.752 -0.075 -3.519 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -9.974 1.448 -2.057 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -11.319 1.523 -3.179 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -11.536 -1.037 -2.832 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -10.448 -0.832 -1.473 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -11.995 0.648 -0.341 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -13.007 0.787 -1.765 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -13.354 -1.766 -1.595 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -12.606 -1.667 -0.014 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -14.717 -1.338 0.632 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -14.421 0.275 0.193 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -15.227 -0.763 -0.882 1.00 0.00 H new ATOM 1374 N ASP A 120 -11.323 0.131 -5.611 1.00 0.00 N ATOM 1375 CA ASP A 120 -12.122 -0.609 -6.585 1.00 0.00 C ATOM 1376 C ASP A 120 -11.242 -1.184 -7.692 1.00 0.00 C ATOM 1377 O ASP A 120 -11.472 -2.305 -8.156 1.00 0.00 O ATOM 1378 CB ASP A 120 -13.231 0.281 -7.175 1.00 0.00 C ATOM 1379 CG ASP A 120 -14.443 0.392 -6.257 1.00 0.00 C ATOM 1380 OD1 ASP A 120 -14.285 0.847 -5.103 1.00 0.00 O ATOM 1381 OD2 ASP A 120 -15.557 -0.001 -6.672 1.00 0.00 O ATOM 0 H ASP A 120 -11.575 1.115 -5.523 1.00 0.00 H new ATOM 0 HA ASP A 120 -12.596 -1.442 -6.065 1.00 0.00 H new ATOM 0 HB2 ASP A 120 -12.831 1.277 -7.364 1.00 0.00 H new ATOM 0 HB3 ASP A 120 -13.544 -0.125 -8.137 1.00 0.00 H new ATOM 1386 N PHE A 121 -10.210 -0.444 -8.092 1.00 0.00 N ATOM 1387 CA PHE A 121 -9.292 -0.917 -9.123 1.00 0.00 C ATOM 1388 C PHE A 121 -8.530 -2.146 -8.623 1.00 0.00 C ATOM 1389 O PHE A 121 -8.432 -3.155 -9.321 1.00 0.00 O ATOM 1390 CB PHE A 121 -8.307 0.191 -9.525 1.00 0.00 C ATOM 1391 CG PHE A 121 -7.250 -0.267 -10.501 1.00 0.00 C ATOM 1392 CD1 PHE A 121 -7.533 -0.370 -11.856 1.00 0.00 C ATOM 1393 CD2 PHE A 121 -5.976 -0.603 -10.061 1.00 0.00 C ATOM 1394 CE1 PHE A 121 -6.570 -0.799 -12.748 1.00 0.00 C ATOM 1395 CE2 PHE A 121 -5.010 -1.030 -10.950 1.00 0.00 C ATOM 1396 CZ PHE A 121 -5.306 -1.128 -12.295 1.00 0.00 C ATOM 0 H PHE A 121 -9.990 0.480 -7.720 1.00 0.00 H new ATOM 0 HA PHE A 121 -9.874 -1.193 -10.003 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -8.863 1.018 -9.966 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -7.820 0.576 -8.629 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -8.518 -0.112 -12.217 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -5.738 -0.529 -9.010 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -6.804 -0.877 -13.799 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -4.023 -1.287 -10.594 1.00 0.00 H new ATOM 0 HZ PHE A 121 -4.551 -1.461 -12.992 1.00 0.00 H new ATOM 1406 N LEU A 122 -7.984 -2.038 -7.413 1.00 0.00 N ATOM 1407 CA LEU A 122 -7.267 -3.144 -6.774 1.00 0.00 C ATOM 1408 C LEU A 122 -8.121 -4.415 -6.731 1.00 0.00 C ATOM 1409 O LEU A 122 -7.650 -5.503 -7.080 1.00 0.00 O ATOM 1410 CB LEU A 122 -6.841 -2.757 -5.349 1.00 0.00 C ATOM 1411 CG LEU A 122 -5.928 -1.522 -5.244 1.00 0.00 C ATOM 1412 CD1 LEU A 122 -5.636 -1.190 -3.785 1.00 0.00 C ATOM 1413 CD2 LEU A 122 -4.632 -1.734 -6.022 1.00 0.00 C ATOM 0 H LEU A 122 -8.025 -1.188 -6.850 1.00 0.00 H new ATOM 0 HA LEU A 122 -6.379 -3.348 -7.373 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -7.738 -2.576 -4.757 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -6.328 -3.606 -4.898 1.00 0.00 H new ATOM 0 HG LEU A 122 -6.452 -0.675 -5.688 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -4.989 -0.314 -3.734 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -6.571 -0.982 -3.265 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -5.139 -2.037 -3.312 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -4.004 -0.847 -5.932 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -4.102 -2.596 -5.618 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -4.863 -1.910 -7.073 1.00 0.00 H new ATOM 1425 N VAL A 123 -9.379 -4.275 -6.310 1.00 0.00 N ATOM 1426 CA VAL A 123 -10.277 -5.428 -6.192 1.00 0.00 C ATOM 1427 C VAL A 123 -10.851 -5.831 -7.556 1.00 0.00 C ATOM 1428 O VAL A 123 -11.413 -6.915 -7.704 1.00 0.00 O ATOM 1429 CB VAL A 123 -11.432 -5.161 -5.193 1.00 0.00 C ATOM 1430 CG1 VAL A 123 -10.879 -4.783 -3.820 1.00 0.00 C ATOM 1431 CG2 VAL A 123 -12.378 -4.081 -5.716 1.00 0.00 C ATOM 0 H VAL A 123 -9.798 -3.383 -6.047 1.00 0.00 H new ATOM 0 HA VAL A 123 -9.677 -6.252 -5.807 1.00 0.00 H new ATOM 0 HB VAL A 123 -12.006 -6.082 -5.089 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -11.705 -4.600 -3.133 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -10.264 -5.598 -3.439 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -10.273 -3.881 -3.908 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -13.177 -3.916 -4.993 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -11.825 -3.153 -5.863 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -12.807 -4.402 -6.665 1.00 0.00 H new ATOM 1441 N SER A 124 -10.700 -4.953 -8.546 1.00 0.00 N ATOM 1442 CA SER A 124 -11.104 -5.244 -9.927 1.00 0.00 C ATOM 1443 C SER A 124 -10.121 -6.211 -10.609 1.00 0.00 C ATOM 1444 O SER A 124 -10.267 -6.532 -11.788 1.00 0.00 O ATOM 1445 CB SER A 124 -11.216 -3.939 -10.730 1.00 0.00 C ATOM 1446 OG SER A 124 -11.655 -4.177 -12.059 1.00 0.00 O ATOM 0 H SER A 124 -10.297 -4.025 -8.419 1.00 0.00 H new ATOM 0 HA SER A 124 -12.079 -5.730 -9.898 1.00 0.00 H new ATOM 0 HB2 SER A 124 -11.912 -3.264 -10.232 1.00 0.00 H new ATOM 0 HB3 SER A 124 -10.247 -3.440 -10.750 1.00 0.00 H new ATOM 0 HG SER A 124 -11.316 -5.044 -12.365 1.00 0.00 H new ATOM 1452 N GLN A 125 -9.116 -6.661 -9.859 1.00 0.00 N ATOM 1453 CA GLN A 125 -8.065 -7.527 -10.394 1.00 0.00 C ATOM 1454 C GLN A 125 -8.542 -8.979 -10.524 1.00 0.00 C ATOM 1455 O GLN A 125 -9.548 -9.372 -9.932 1.00 0.00 O ATOM 1456 CB GLN A 125 -6.786 -7.439 -9.538 1.00 0.00 C ATOM 1457 CG GLN A 125 -5.684 -6.591 -10.174 1.00 0.00 C ATOM 1458 CD GLN A 125 -6.128 -5.170 -10.484 1.00 0.00 C ATOM 1459 OE1 GLN A 125 -6.673 -4.894 -11.551 1.00 0.00 O ATOM 1460 NE2 GLN A 125 -5.863 -4.252 -9.569 1.00 0.00 N ATOM 0 H GLN A 125 -9.007 -6.438 -8.870 1.00 0.00 H new ATOM 0 HA GLN A 125 -7.826 -7.170 -11.396 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -7.038 -7.021 -8.564 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -6.405 -8.445 -9.364 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -4.826 -6.559 -9.503 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -5.351 -7.070 -11.095 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -5.410 -4.519 -8.695 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -6.112 -3.277 -9.737 1.00 0.00 H new ATOM 1469 N ASP A 126 -7.777 -9.761 -11.284 1.00 0.00 N ATOM 1470 CA ASP A 126 -8.156 -11.134 -11.648 1.00 0.00 C ATOM 1471 C ASP A 126 -8.503 -11.953 -10.409 1.00 0.00 C ATOM 1472 O ASP A 126 -9.641 -12.393 -10.234 1.00 0.00 O ATOM 1473 CB ASP A 126 -7.024 -11.838 -12.416 1.00 0.00 C ATOM 1474 CG ASP A 126 -6.794 -11.257 -13.800 1.00 0.00 C ATOM 1475 OD1 ASP A 126 -6.011 -10.289 -13.924 1.00 0.00 O ATOM 1476 OD2 ASP A 126 -7.391 -11.771 -14.772 1.00 0.00 O ATOM 0 H ASP A 126 -6.879 -9.466 -11.666 1.00 0.00 H new ATOM 0 HA ASP A 126 -9.034 -11.065 -12.290 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -6.102 -11.765 -11.840 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -7.260 -12.898 -12.508 1.00 0.00 H new ATOM 1481 N ARG A 127 -7.510 -12.148 -9.546 1.00 0.00 N ATOM 1482 CA ARG A 127 -7.690 -12.906 -8.306 1.00 0.00 C ATOM 1483 C ARG A 127 -8.454 -12.088 -7.263 1.00 0.00 C ATOM 1484 O ARG A 127 -8.804 -12.605 -6.200 1.00 0.00 O ATOM 1485 CB ARG A 127 -6.326 -13.329 -7.738 1.00 0.00 C ATOM 1486 CG ARG A 127 -5.521 -14.236 -8.666 1.00 0.00 C ATOM 1487 CD ARG A 127 -4.166 -14.603 -8.067 1.00 0.00 C ATOM 1488 NE ARG A 127 -3.408 -15.505 -8.938 1.00 0.00 N ATOM 1489 CZ ARG A 127 -2.098 -15.742 -8.829 1.00 0.00 C ATOM 1490 NH1 ARG A 127 -1.376 -15.136 -7.893 1.00 0.00 N ATOM 1491 NH2 ARG A 127 -1.516 -16.594 -9.658 1.00 0.00 N ATOM 0 H ARG A 127 -6.565 -11.790 -9.682 1.00 0.00 H new ATOM 0 HA ARG A 127 -8.275 -13.795 -8.540 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -5.741 -12.435 -7.523 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -6.482 -13.843 -6.790 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -6.088 -15.145 -8.867 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -5.372 -13.736 -9.623 1.00 0.00 H new ATOM 0 HD2 ARG A 127 -3.588 -13.695 -7.894 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -4.315 -15.076 -7.096 1.00 0.00 H new ATOM 0 HE ARG A 127 -3.917 -15.986 -9.680 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -1.821 -14.483 -7.249 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -0.376 -15.324 -7.819 1.00 0.00 H new ATOM 0 HH21 ARG A 127 -2.067 -17.065 -10.375 1.00 0.00 H new ATOM 0 HH22 ARG A 127 -0.516 -16.779 -9.580 1.00 0.00 H new ATOM 1505 N CYS A 128 -8.729 -10.822 -7.587 1.00 0.00 N ATOM 1506 CA CYS A 128 -9.323 -9.874 -6.644 1.00 0.00 C ATOM 1507 C CYS A 128 -8.390 -9.680 -5.448 1.00 0.00 C ATOM 1508 O CYS A 128 -8.265 -10.552 -4.584 1.00 0.00 O ATOM 1509 CB CYS A 128 -10.711 -10.340 -6.182 1.00 0.00 C ATOM 1510 SG CYS A 128 -11.558 -9.185 -5.076 1.00 0.00 S ATOM 0 H CYS A 128 -8.546 -10.427 -8.509 1.00 0.00 H new ATOM 0 HA CYS A 128 -9.453 -8.918 -7.152 1.00 0.00 H new ATOM 0 HB2 CYS A 128 -11.335 -10.507 -7.060 1.00 0.00 H new ATOM 0 HB3 CYS A 128 -10.609 -11.300 -5.676 1.00 0.00 H new ATOM 0 HG CYS A 128 -12.718 -9.671 -4.747 1.00 0.00 H new ATOM 1516 N ALA A 129 -7.709 -8.543 -5.425 1.00 0.00 N ATOM 1517 CA ALA A 129 -6.746 -8.246 -4.375 1.00 0.00 C ATOM 1518 C ALA A 129 -7.454 -7.960 -3.054 1.00 0.00 C ATOM 1519 O ALA A 129 -8.436 -7.213 -3.012 1.00 0.00 O ATOM 1520 CB ALA A 129 -5.870 -7.066 -4.782 1.00 0.00 C ATOM 0 H ALA A 129 -7.807 -7.808 -6.125 1.00 0.00 H new ATOM 0 HA ALA A 129 -6.110 -9.120 -4.234 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -5.154 -6.854 -3.988 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -5.334 -7.310 -5.699 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -6.496 -6.189 -4.950 1.00 0.00 H new ATOM 1526 N GLU A 130 -6.966 -8.575 -1.984 1.00 0.00 N ATOM 1527 CA GLU A 130 -7.497 -8.339 -0.649 1.00 0.00 C ATOM 1528 C GLU A 130 -6.857 -7.085 -0.060 1.00 0.00 C ATOM 1529 O GLU A 130 -5.653 -7.054 0.209 1.00 0.00 O ATOM 1530 CB GLU A 130 -7.231 -9.553 0.252 1.00 0.00 C ATOM 1531 CG GLU A 130 -7.940 -10.828 -0.198 1.00 0.00 C ATOM 1532 CD GLU A 130 -9.453 -10.699 -0.152 1.00 0.00 C ATOM 1533 OE1 GLU A 130 -10.016 -10.622 0.962 1.00 0.00 O ATOM 1534 OE2 GLU A 130 -10.092 -10.671 -1.225 1.00 0.00 O ATOM 0 H GLU A 130 -6.198 -9.245 -2.017 1.00 0.00 H new ATOM 0 HA GLU A 130 -8.575 -8.191 -0.712 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -6.158 -9.739 0.286 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -7.545 -9.314 1.268 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -7.630 -11.073 -1.214 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -7.630 -11.657 0.439 1.00 0.00 H new ATOM 1541 N VAL A 131 -7.665 -6.051 0.132 1.00 0.00 N ATOM 1542 CA VAL A 131 -7.174 -4.761 0.598 1.00 0.00 C ATOM 1543 C VAL A 131 -7.630 -4.491 2.028 1.00 0.00 C ATOM 1544 O VAL A 131 -8.794 -4.709 2.376 1.00 0.00 O ATOM 1545 CB VAL A 131 -7.647 -3.613 -0.336 1.00 0.00 C ATOM 1546 CG1 VAL A 131 -9.173 -3.580 -0.448 1.00 0.00 C ATOM 1547 CG2 VAL A 131 -7.105 -2.265 0.141 1.00 0.00 C ATOM 0 H VAL A 131 -8.672 -6.082 -0.029 1.00 0.00 H new ATOM 0 HA VAL A 131 -6.085 -4.796 0.579 1.00 0.00 H new ATOM 0 HB VAL A 131 -7.246 -3.807 -1.331 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -9.472 -2.766 -1.108 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -9.528 -4.527 -0.855 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -9.607 -3.424 0.540 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -7.449 -1.477 -0.529 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -7.463 -2.066 1.151 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -6.015 -2.290 0.141 1.00 0.00 H new ATOM 1557 N THR A 132 -6.701 -4.032 2.859 1.00 0.00 N ATOM 1558 CA THR A 132 -6.998 -3.663 4.236 1.00 0.00 C ATOM 1559 C THR A 132 -6.606 -2.208 4.468 1.00 0.00 C ATOM 1560 O THR A 132 -5.606 -1.733 3.918 1.00 0.00 O ATOM 1561 CB THR A 132 -6.259 -4.583 5.240 1.00 0.00 C ATOM 1562 OG1 THR A 132 -4.868 -4.678 4.895 1.00 0.00 O ATOM 1563 CG2 THR A 132 -6.874 -5.978 5.264 1.00 0.00 C ATOM 0 H THR A 132 -5.723 -3.906 2.597 1.00 0.00 H new ATOM 0 HA THR A 132 -8.068 -3.785 4.402 1.00 0.00 H new ATOM 0 HB THR A 132 -6.359 -4.143 6.232 1.00 0.00 H new ATOM 0 HG1 THR A 132 -4.774 -4.710 3.920 1.00 0.00 H new ATOM 0 HG21 THR A 132 -6.335 -6.601 5.977 1.00 0.00 H new ATOM 0 HG22 THR A 132 -7.921 -5.909 5.561 1.00 0.00 H new ATOM 0 HG23 THR A 132 -6.807 -6.422 4.271 1.00 0.00 H new ATOM 1571 N LEU A 133 -7.398 -1.498 5.267 1.00 0.00 N ATOM 1572 CA LEU A 133 -7.190 -0.071 5.500 1.00 0.00 C ATOM 1573 C LEU A 133 -6.652 0.144 6.910 1.00 0.00 C ATOM 1574 O LEU A 133 -7.151 -0.465 7.858 1.00 0.00 O ATOM 1575 CB LEU A 133 -8.518 0.693 5.338 1.00 0.00 C ATOM 1576 CG LEU A 133 -9.328 0.369 4.070 1.00 0.00 C ATOM 1577 CD1 LEU A 133 -10.632 1.165 4.042 1.00 0.00 C ATOM 1578 CD2 LEU A 133 -8.506 0.642 2.813 1.00 0.00 C ATOM 0 H LEU A 133 -8.195 -1.891 5.767 1.00 0.00 H new ATOM 0 HA LEU A 133 -6.471 0.304 4.771 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -9.142 0.487 6.207 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -8.304 1.762 5.346 1.00 0.00 H new ATOM 0 HG LEU A 133 -9.574 -0.693 4.091 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -11.188 0.920 3.137 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -11.232 0.912 4.916 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -10.408 2.232 4.053 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -9.101 0.405 1.931 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -8.220 1.694 2.786 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -7.609 0.022 2.823 1.00 0.00 H new ATOM 1590 N GLU A 134 -5.637 0.991 7.055 1.00 0.00 N ATOM 1591 CA GLU A 134 -5.110 1.312 8.381 1.00 0.00 C ATOM 1592 C GLU A 134 -5.739 2.615 8.876 1.00 0.00 C ATOM 1593 O GLU A 134 -5.946 3.546 8.093 1.00 0.00 O ATOM 1594 CB GLU A 134 -3.576 1.430 8.342 1.00 0.00 C ATOM 1595 CG GLU A 134 -2.869 0.968 9.621 1.00 0.00 C ATOM 1596 CD GLU A 134 -3.298 1.727 10.868 1.00 0.00 C ATOM 1597 OE1 GLU A 134 -2.916 2.905 11.015 1.00 0.00 O ATOM 1598 OE2 GLU A 134 -4.018 1.144 11.712 1.00 0.00 O ATOM 0 H GLU A 134 -5.167 1.463 6.283 1.00 0.00 H new ATOM 0 HA GLU A 134 -5.365 0.508 9.071 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -3.201 0.844 7.503 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -3.309 2.469 8.150 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -3.063 -0.094 9.769 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -1.793 1.080 9.491 1.00 0.00 H new