USER MOD reduce.3.24.130724 H: found=0, std=0, add=792, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 792 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 80 ASN : amide:sc= -0.499 X(o=0.38,f=-0.013) USER MOD Set 1.2: A 82 LYS NZ :NH3+ 167:sc= 0.882 (180deg=0.607) USER MOD Set 2.1: A 7 THR OG1 : rot -83:sc= 0.766 USER MOD Set 2.2: A 9 SER OG : rot 180:sc= 0.00958 USER MOD Single : A 1 MET CE :methyl -151:sc= -0.424 (180deg=-1.72!) USER MOD Single : A 1 MET N :NH3+ -105:sc= 0.106 (180deg=0) USER MOD Single : A 3 THR OG1 : rot 83:sc= 0.0475 USER MOD Single : A 4 GLN : amide:sc= -0.777 K(o=-0.78,f=-0.14) USER MOD Single : A 6 LYS NZ :NH3+ 160:sc= -0.0804 (180deg=-0.572) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= -8.11! C(o=-8.1!,f=-11!) USER MOD Single : A 19 LYS NZ :NH3+ -175:sc= 0.497 (180deg=0.477) USER MOD Single : A 26 TYR OH : rot 180:sc= -0.58 USER MOD Single : A 28 THR OG1 : rot -117:sc= 1.27 USER MOD Single : A 30 CYS SG : rot -160:sc= -1.6 USER MOD Single : A 33 CYS SG : rot -78:sc= 1.22 USER MOD Single : A 34 LYS NZ :NH3+ 170:sc=-0.00383 (180deg=-0.127) USER MOD Single : A 35 MET CE :methyl -157:sc= -0.117 (180deg=-0.754) USER MOD Single : A 39 MET CE :methyl 169:sc= -4.86! (180deg=-5.99!) USER MOD Single : A 42 LYS NZ :NH3+ 167:sc= 0.105 (180deg=-0.208) USER MOD Single : A 44 SER OG : rot 169:sc= 0.138 USER MOD Single : A 46 GLN : amide:sc= -1.01 K(o=-1,f=-0.069) USER MOD Single : A 47 TYR OH : rot -102:sc= -4.62! USER MOD Single : A 49 GLN : amide:sc= -1.38 K(o=-1.4,f=-0.14) USER MOD Single : A 53 TYR OH : rot 162:sc= 0.0172 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 66 LYS NZ :NH3+ -152:sc= 1.26 (180deg=0.821) USER MOD Single : A 67 ASN : amide:sc= -4.72! K(o=-4.7!,f=-2.1) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl 161:sc= -0.303 (180deg=-0.97) USER MOD Single : A 74 THR OG1 : rot 124:sc= -0.0832 USER MOD Single : A 79 LYS NZ :NH3+ -158:sc= 0.352 (180deg=-0.619) USER MOD Single : A 86 LYS NZ :NH3+ -160:sc= 1.26 (180deg=1.13) USER MOD Single : A 91 ASN : amide:sc= -1.86! X(o=-1.9!,f=-2.3) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 GLN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : A 102 ASN : amide:sc= -2.09 K(o=-2.1,f=-1.6) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -6.114 -6.025 10.449 1.00 0.00 N ATOM 2 CA MET A 1 -5.131 -4.937 10.637 1.00 0.00 C ATOM 3 C MET A 1 -4.132 -4.927 9.492 1.00 0.00 C ATOM 4 O MET A 1 -4.024 -5.897 8.747 1.00 0.00 O ATOM 5 CB MET A 1 -4.394 -5.100 11.964 1.00 0.00 C ATOM 6 CG MET A 1 -3.366 -6.219 11.972 1.00 0.00 C ATOM 7 SD MET A 1 -2.154 -6.014 13.287 1.00 0.00 S ATOM 8 CE MET A 1 -1.453 -4.433 12.816 1.00 0.00 C ATOM 0 H1 MET A 1 -7.021 -5.623 10.137 1.00 0.00 H new ATOM 0 H2 MET A 1 -5.763 -6.689 9.730 1.00 0.00 H new ATOM 0 H3 MET A 1 -6.250 -6.529 11.348 1.00 0.00 H new ATOM 0 HA MET A 1 -5.670 -3.989 10.650 1.00 0.00 H new ATOM 0 HB2 MET A 1 -3.895 -4.162 12.207 1.00 0.00 H new ATOM 0 HB3 MET A 1 -5.124 -5.287 12.752 1.00 0.00 H new ATOM 0 HG2 MET A 1 -3.873 -7.176 12.093 1.00 0.00 H new ATOM 0 HG3 MET A 1 -2.855 -6.248 11.010 1.00 0.00 H new ATOM 0 HE1 MET A 1 -0.417 -4.380 13.150 1.00 0.00 H new ATOM 0 HE2 MET A 1 -1.491 -4.327 11.732 1.00 0.00 H new ATOM 0 HE3 MET A 1 -2.025 -3.629 13.279 1.00 0.00 H new ATOM 20 N VAL A 2 -3.420 -3.820 9.347 1.00 0.00 N ATOM 21 CA VAL A 2 -2.401 -3.677 8.328 1.00 0.00 C ATOM 22 C VAL A 2 -1.054 -3.353 8.981 1.00 0.00 C ATOM 23 O VAL A 2 -0.959 -2.449 9.813 1.00 0.00 O ATOM 24 CB VAL A 2 -2.815 -2.590 7.313 1.00 0.00 C ATOM 25 CG1 VAL A 2 -1.663 -2.229 6.397 1.00 0.00 C ATOM 26 CG2 VAL A 2 -4.013 -3.063 6.503 1.00 0.00 C ATOM 0 H VAL A 2 -3.536 -2.995 9.936 1.00 0.00 H new ATOM 0 HA VAL A 2 -2.295 -4.616 7.785 1.00 0.00 H new ATOM 0 HB VAL A 2 -3.093 -1.693 7.866 1.00 0.00 H new ATOM 0 HG11 VAL A 2 -1.985 -1.461 5.693 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -0.831 -1.851 6.991 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -1.344 -3.115 5.847 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -4.298 -2.290 5.790 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -3.752 -3.974 5.965 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -4.849 -3.264 7.173 1.00 0.00 H new ATOM 36 N THR A 3 -0.029 -4.110 8.606 1.00 0.00 N ATOM 37 CA THR A 3 1.264 -4.085 9.287 1.00 0.00 C ATOM 38 C THR A 3 2.046 -2.797 9.014 1.00 0.00 C ATOM 39 O THR A 3 2.000 -2.235 7.922 1.00 0.00 O ATOM 40 CB THR A 3 2.105 -5.308 8.868 1.00 0.00 C ATOM 41 OG1 THR A 3 1.300 -6.493 8.941 1.00 0.00 O ATOM 42 CG2 THR A 3 3.326 -5.474 9.764 1.00 0.00 C ATOM 0 H THR A 3 -0.069 -4.760 7.821 1.00 0.00 H new ATOM 0 HA THR A 3 1.064 -4.121 10.358 1.00 0.00 H new ATOM 0 HB THR A 3 2.448 -5.148 7.846 1.00 0.00 H new ATOM 0 HG1 THR A 3 0.770 -6.579 8.121 1.00 0.00 H new ATOM 0 HG21 THR A 3 3.898 -6.345 9.442 1.00 0.00 H new ATOM 0 HG22 THR A 3 3.951 -4.584 9.695 1.00 0.00 H new ATOM 0 HG23 THR A 3 3.004 -5.612 10.796 1.00 0.00 H new ATOM 50 N GLN A 4 2.767 -2.348 10.031 1.00 0.00 N ATOM 51 CA GLN A 4 3.514 -1.101 9.980 1.00 0.00 C ATOM 52 C GLN A 4 4.943 -1.331 9.484 1.00 0.00 C ATOM 53 O GLN A 4 5.697 -2.103 10.080 1.00 0.00 O ATOM 54 CB GLN A 4 3.551 -0.497 11.383 1.00 0.00 C ATOM 55 CG GLN A 4 4.043 0.936 11.429 1.00 0.00 C ATOM 56 CD GLN A 4 3.100 1.876 10.715 1.00 0.00 C ATOM 57 OE1 GLN A 4 2.174 2.420 11.316 1.00 0.00 O ATOM 58 NE2 GLN A 4 3.324 2.069 9.431 1.00 0.00 N ATOM 0 H GLN A 4 2.850 -2.842 10.920 1.00 0.00 H new ATOM 0 HA GLN A 4 3.022 -0.423 9.283 1.00 0.00 H new ATOM 0 HB2 GLN A 4 2.550 -0.540 11.811 1.00 0.00 H new ATOM 0 HB3 GLN A 4 4.194 -1.111 12.014 1.00 0.00 H new ATOM 0 HG2 GLN A 4 4.152 1.250 12.467 1.00 0.00 H new ATOM 0 HG3 GLN A 4 5.031 0.996 10.972 1.00 0.00 H new ATOM 0 HE21 GLN A 4 4.104 1.597 8.973 1.00 0.00 H new ATOM 0 HE22 GLN A 4 2.718 2.690 8.895 1.00 0.00 H new ATOM 67 N PHE A 5 5.306 -0.667 8.392 1.00 0.00 N ATOM 68 CA PHE A 5 6.687 -0.677 7.910 1.00 0.00 C ATOM 69 C PHE A 5 7.584 0.105 8.855 1.00 0.00 C ATOM 70 O PHE A 5 7.103 0.824 9.732 1.00 0.00 O ATOM 71 CB PHE A 5 6.796 -0.044 6.527 1.00 0.00 C ATOM 72 CG PHE A 5 6.445 -0.945 5.376 1.00 0.00 C ATOM 73 CD1 PHE A 5 6.687 -2.309 5.431 1.00 0.00 C ATOM 74 CD2 PHE A 5 5.890 -0.416 4.222 1.00 0.00 C ATOM 75 CE1 PHE A 5 6.377 -3.124 4.361 1.00 0.00 C ATOM 76 CE2 PHE A 5 5.582 -1.227 3.149 1.00 0.00 C ATOM 77 CZ PHE A 5 5.827 -2.582 3.217 1.00 0.00 C ATOM 0 H PHE A 5 4.665 -0.115 7.822 1.00 0.00 H new ATOM 0 HA PHE A 5 7.001 -1.720 7.861 1.00 0.00 H new ATOM 0 HB2 PHE A 5 6.145 0.830 6.494 1.00 0.00 H new ATOM 0 HB3 PHE A 5 7.817 0.313 6.389 1.00 0.00 H new ATOM 0 HD1 PHE A 5 7.123 -2.739 6.321 1.00 0.00 H new ATOM 0 HD2 PHE A 5 5.696 0.645 4.162 1.00 0.00 H new ATOM 0 HE1 PHE A 5 6.565 -4.186 4.419 1.00 0.00 H new ATOM 0 HE2 PHE A 5 5.149 -0.800 2.256 1.00 0.00 H new ATOM 0 HZ PHE A 5 5.589 -3.218 2.377 1.00 0.00 H new ATOM 87 N LYS A 6 8.891 -0.026 8.660 1.00 0.00 N ATOM 88 CA LYS A 6 9.850 0.678 9.493 1.00 0.00 C ATOM 89 C LYS A 6 10.848 1.455 8.641 1.00 0.00 C ATOM 90 O LYS A 6 11.277 2.543 9.017 1.00 0.00 O ATOM 91 CB LYS A 6 10.597 -0.299 10.403 1.00 0.00 C ATOM 92 CG LYS A 6 9.718 -1.403 10.966 1.00 0.00 C ATOM 93 CD LYS A 6 10.435 -2.201 12.042 1.00 0.00 C ATOM 94 CE LYS A 6 10.596 -1.394 13.319 1.00 0.00 C ATOM 95 NZ LYS A 6 9.282 -0.965 13.870 1.00 0.00 N ATOM 0 H LYS A 6 9.306 -0.611 7.935 1.00 0.00 H new ATOM 0 HA LYS A 6 9.295 1.384 10.111 1.00 0.00 H new ATOM 0 HB2 LYS A 6 11.417 -0.749 9.843 1.00 0.00 H new ATOM 0 HB3 LYS A 6 11.042 0.256 11.229 1.00 0.00 H new ATOM 0 HG2 LYS A 6 8.809 -0.968 11.381 1.00 0.00 H new ATOM 0 HG3 LYS A 6 9.413 -2.071 10.161 1.00 0.00 H new ATOM 0 HD2 LYS A 6 9.876 -3.112 12.254 1.00 0.00 H new ATOM 0 HD3 LYS A 6 11.416 -2.507 11.677 1.00 0.00 H new ATOM 0 HE2 LYS A 6 11.125 -1.991 14.062 1.00 0.00 H new ATOM 0 HE3 LYS A 6 11.211 -0.516 13.119 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 9.389 -0.726 14.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 8.943 -0.130 13.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 8.594 -1.738 13.769 1.00 0.00 H new ATOM 109 N THR A 7 11.229 0.885 7.502 1.00 0.00 N ATOM 110 CA THR A 7 12.136 1.550 6.571 1.00 0.00 C ATOM 111 C THR A 7 11.763 1.215 5.130 1.00 0.00 C ATOM 112 O THR A 7 10.820 0.451 4.888 1.00 0.00 O ATOM 113 CB THR A 7 13.616 1.144 6.790 1.00 0.00 C ATOM 114 OG1 THR A 7 13.772 -0.261 6.582 1.00 0.00 O ATOM 115 CG2 THR A 7 14.109 1.508 8.182 1.00 0.00 C ATOM 0 H THR A 7 10.922 -0.040 7.200 1.00 0.00 H new ATOM 0 HA THR A 7 12.034 2.619 6.760 1.00 0.00 H new ATOM 0 HB THR A 7 14.215 1.698 6.068 1.00 0.00 H new ATOM 0 HG1 THR A 7 13.523 -0.742 7.399 1.00 0.00 H new ATOM 0 HG21 THR A 7 15.150 1.205 8.290 1.00 0.00 H new ATOM 0 HG22 THR A 7 14.028 2.585 8.327 1.00 0.00 H new ATOM 0 HG23 THR A 7 13.503 0.995 8.928 1.00 0.00 H new ATOM 123 N ALA A 8 12.502 1.769 4.176 1.00 0.00 N ATOM 124 CA ALA A 8 12.320 1.414 2.777 1.00 0.00 C ATOM 125 C ALA A 8 12.713 -0.038 2.560 1.00 0.00 C ATOM 126 O ALA A 8 12.196 -0.709 1.666 1.00 0.00 O ATOM 127 CB ALA A 8 13.134 2.320 1.874 1.00 0.00 C ATOM 0 H ALA A 8 13.230 2.463 4.346 1.00 0.00 H new ATOM 0 HA ALA A 8 11.268 1.544 2.522 1.00 0.00 H new ATOM 0 HB1 ALA A 8 12.979 2.032 0.834 1.00 0.00 H new ATOM 0 HB2 ALA A 8 12.818 3.354 2.015 1.00 0.00 H new ATOM 0 HB3 ALA A 8 14.191 2.227 2.122 1.00 0.00 H new ATOM 133 N SER A 9 13.625 -0.514 3.401 1.00 0.00 N ATOM 134 CA SER A 9 14.043 -1.904 3.382 1.00 0.00 C ATOM 135 C SER A 9 12.834 -2.809 3.584 1.00 0.00 C ATOM 136 O SER A 9 12.629 -3.766 2.839 1.00 0.00 O ATOM 137 CB SER A 9 15.076 -2.140 4.480 1.00 0.00 C ATOM 138 OG SER A 9 16.072 -1.128 4.462 1.00 0.00 O ATOM 0 H SER A 9 14.091 0.052 4.110 1.00 0.00 H new ATOM 0 HA SER A 9 14.494 -2.137 2.417 1.00 0.00 H new ATOM 0 HB2 SER A 9 14.583 -2.154 5.452 1.00 0.00 H new ATOM 0 HB3 SER A 9 15.541 -3.116 4.344 1.00 0.00 H new ATOM 0 HG SER A 9 16.723 -1.297 5.175 1.00 0.00 H new ATOM 144 N GLU A 10 12.033 -2.488 4.598 1.00 0.00 N ATOM 145 CA GLU A 10 10.783 -3.174 4.844 1.00 0.00 C ATOM 146 C GLU A 10 9.879 -3.154 3.620 1.00 0.00 C ATOM 147 O GLU A 10 9.273 -4.174 3.289 1.00 0.00 O ATOM 148 CB GLU A 10 10.069 -2.536 6.025 1.00 0.00 C ATOM 149 CG GLU A 10 10.582 -3.012 7.365 1.00 0.00 C ATOM 150 CD GLU A 10 12.046 -2.727 7.594 1.00 0.00 C ATOM 151 OE1 GLU A 10 12.891 -3.563 7.219 1.00 0.00 O ATOM 152 OE2 GLU A 10 12.357 -1.661 8.149 1.00 0.00 O ATOM 0 H GLU A 10 12.239 -1.745 5.266 1.00 0.00 H new ATOM 0 HA GLU A 10 11.012 -4.215 5.071 1.00 0.00 H new ATOM 0 HB2 GLU A 10 10.180 -1.453 5.966 1.00 0.00 H new ATOM 0 HB3 GLU A 10 9.003 -2.751 5.955 1.00 0.00 H new ATOM 0 HG2 GLU A 10 10.001 -2.537 8.155 1.00 0.00 H new ATOM 0 HG3 GLU A 10 10.413 -4.086 7.447 1.00 0.00 H new ATOM 159 N PHE A 11 9.786 -2.002 2.945 1.00 0.00 N ATOM 160 CA PHE A 11 8.930 -1.904 1.765 1.00 0.00 C ATOM 161 C PHE A 11 9.363 -2.937 0.728 1.00 0.00 C ATOM 162 O PHE A 11 8.597 -3.834 0.376 1.00 0.00 O ATOM 163 CB PHE A 11 8.958 -0.483 1.169 1.00 0.00 C ATOM 164 CG PHE A 11 7.949 -0.257 0.067 1.00 0.00 C ATOM 165 CD1 PHE A 11 8.132 -0.818 -1.187 1.00 0.00 C ATOM 166 CD2 PHE A 11 6.822 0.527 0.281 1.00 0.00 C ATOM 167 CE1 PHE A 11 7.217 -0.607 -2.199 1.00 0.00 C ATOM 168 CE2 PHE A 11 5.901 0.743 -0.736 1.00 0.00 C ATOM 169 CZ PHE A 11 6.103 0.174 -1.974 1.00 0.00 C ATOM 0 H PHE A 11 10.282 -1.145 3.191 1.00 0.00 H new ATOM 0 HA PHE A 11 7.902 -2.110 2.064 1.00 0.00 H new ATOM 0 HB2 PHE A 11 8.777 0.238 1.966 1.00 0.00 H new ATOM 0 HB3 PHE A 11 9.956 -0.283 0.780 1.00 0.00 H new ATOM 0 HD1 PHE A 11 9.003 -1.429 -1.375 1.00 0.00 H new ATOM 0 HD2 PHE A 11 6.660 0.974 1.251 1.00 0.00 H new ATOM 0 HE1 PHE A 11 7.374 -1.055 -3.169 1.00 0.00 H new ATOM 0 HE2 PHE A 11 5.029 1.355 -0.557 1.00 0.00 H new ATOM 0 HZ PHE A 11 5.390 0.339 -2.768 1.00 0.00 H new ATOM 179 N ASP A 12 10.608 -2.823 0.289 1.00 0.00 N ATOM 180 CA ASP A 12 11.174 -3.712 -0.730 1.00 0.00 C ATOM 181 C ASP A 12 11.113 -5.180 -0.301 1.00 0.00 C ATOM 182 O ASP A 12 10.843 -6.067 -1.119 1.00 0.00 O ATOM 183 CB ASP A 12 12.625 -3.315 -1.011 1.00 0.00 C ATOM 184 CG ASP A 12 13.331 -4.293 -1.931 1.00 0.00 C ATOM 185 OD1 ASP A 12 13.174 -4.177 -3.168 1.00 0.00 O ATOM 186 OD2 ASP A 12 14.044 -5.186 -1.424 1.00 0.00 O ATOM 0 H ASP A 12 11.259 -2.113 0.626 1.00 0.00 H new ATOM 0 HA ASP A 12 10.577 -3.605 -1.636 1.00 0.00 H new ATOM 0 HB2 ASP A 12 12.645 -2.321 -1.459 1.00 0.00 H new ATOM 0 HB3 ASP A 12 13.169 -3.251 -0.069 1.00 0.00 H new ATOM 191 N SER A 13 11.362 -5.433 0.978 1.00 0.00 N ATOM 192 CA SER A 13 11.330 -6.788 1.509 1.00 0.00 C ATOM 193 C SER A 13 9.948 -7.406 1.326 1.00 0.00 C ATOM 194 O SER A 13 9.826 -8.535 0.846 1.00 0.00 O ATOM 195 CB SER A 13 11.720 -6.788 2.990 1.00 0.00 C ATOM 196 OG SER A 13 11.772 -8.107 3.511 1.00 0.00 O ATOM 0 H SER A 13 11.589 -4.716 1.667 1.00 0.00 H new ATOM 0 HA SER A 13 12.051 -7.390 0.957 1.00 0.00 H new ATOM 0 HB2 SER A 13 12.691 -6.308 3.112 1.00 0.00 H new ATOM 0 HB3 SER A 13 11.000 -6.199 3.558 1.00 0.00 H new ATOM 0 HG SER A 13 12.025 -8.075 4.457 1.00 0.00 H new ATOM 202 N ALA A 14 8.910 -6.660 1.694 1.00 0.00 N ATOM 203 CA ALA A 14 7.544 -7.125 1.525 1.00 0.00 C ATOM 204 C ALA A 14 7.230 -7.324 0.049 1.00 0.00 C ATOM 205 O ALA A 14 6.484 -8.221 -0.318 1.00 0.00 O ATOM 206 CB ALA A 14 6.555 -6.153 2.158 1.00 0.00 C ATOM 0 H ALA A 14 8.993 -5.733 2.110 1.00 0.00 H new ATOM 0 HA ALA A 14 7.445 -8.084 2.033 1.00 0.00 H new ATOM 0 HB1 ALA A 14 5.540 -6.524 2.018 1.00 0.00 H new ATOM 0 HB2 ALA A 14 6.765 -6.063 3.224 1.00 0.00 H new ATOM 0 HB3 ALA A 14 6.653 -5.176 1.686 1.00 0.00 H new ATOM 212 N ILE A 15 7.828 -6.489 -0.792 1.00 0.00 N ATOM 213 CA ILE A 15 7.639 -6.579 -2.236 1.00 0.00 C ATOM 214 C ILE A 15 8.085 -7.937 -2.770 1.00 0.00 C ATOM 215 O ILE A 15 7.460 -8.502 -3.668 1.00 0.00 O ATOM 216 CB ILE A 15 8.430 -5.484 -2.976 1.00 0.00 C ATOM 217 CG1 ILE A 15 8.041 -4.094 -2.498 1.00 0.00 C ATOM 218 CG2 ILE A 15 8.219 -5.571 -4.469 1.00 0.00 C ATOM 219 CD1 ILE A 15 6.551 -3.894 -2.326 1.00 0.00 C ATOM 0 H ILE A 15 8.452 -5.738 -0.497 1.00 0.00 H new ATOM 0 HA ILE A 15 6.573 -6.445 -2.418 1.00 0.00 H new ATOM 0 HB ILE A 15 9.483 -5.653 -2.752 1.00 0.00 H new ATOM 0 HG12 ILE A 15 8.535 -3.897 -1.547 1.00 0.00 H new ATOM 0 HG13 ILE A 15 8.416 -3.359 -3.210 1.00 0.00 H new ATOM 0 HG21 ILE A 15 8.790 -4.785 -4.964 1.00 0.00 H new ATOM 0 HG22 ILE A 15 8.555 -6.544 -4.828 1.00 0.00 H new ATOM 0 HG23 ILE A 15 7.160 -5.447 -4.695 1.00 0.00 H new ATOM 0 HD11 ILE A 15 6.358 -2.878 -1.983 1.00 0.00 H new ATOM 0 HD12 ILE A 15 6.050 -4.057 -3.280 1.00 0.00 H new ATOM 0 HD13 ILE A 15 6.171 -4.603 -1.591 1.00 0.00 H new ATOM 231 N ALA A 16 9.155 -8.460 -2.188 1.00 0.00 N ATOM 232 CA ALA A 16 9.802 -9.674 -2.682 1.00 0.00 C ATOM 233 C ALA A 16 9.039 -10.952 -2.328 1.00 0.00 C ATOM 234 O ALA A 16 9.583 -12.051 -2.428 1.00 0.00 O ATOM 235 CB ALA A 16 11.222 -9.747 -2.149 1.00 0.00 C ATOM 0 H ALA A 16 9.600 -8.059 -1.363 1.00 0.00 H new ATOM 0 HA ALA A 16 9.809 -9.612 -3.770 1.00 0.00 H new ATOM 0 HB1 ALA A 16 11.703 -10.653 -2.518 1.00 0.00 H new ATOM 0 HB2 ALA A 16 11.782 -8.875 -2.486 1.00 0.00 H new ATOM 0 HB3 ALA A 16 11.201 -9.766 -1.059 1.00 0.00 H new ATOM 241 N GLN A 17 7.795 -10.814 -1.902 1.00 0.00 N ATOM 242 CA GLN A 17 6.969 -11.956 -1.590 1.00 0.00 C ATOM 243 C GLN A 17 6.328 -12.516 -2.858 1.00 0.00 C ATOM 244 O GLN A 17 6.114 -11.788 -3.827 1.00 0.00 O ATOM 245 CB GLN A 17 5.899 -11.530 -0.599 1.00 0.00 C ATOM 246 CG GLN A 17 4.867 -10.577 -1.180 1.00 0.00 C ATOM 247 CD GLN A 17 3.891 -10.055 -0.145 1.00 0.00 C ATOM 248 OE1 GLN A 17 2.725 -9.817 -0.444 1.00 0.00 O ATOM 249 NE2 GLN A 17 4.365 -9.842 1.069 1.00 0.00 N ATOM 0 H GLN A 17 7.337 -9.913 -1.765 1.00 0.00 H new ATOM 0 HA GLN A 17 7.584 -12.741 -1.151 1.00 0.00 H new ATOM 0 HB2 GLN A 17 5.389 -12.418 -0.225 1.00 0.00 H new ATOM 0 HB3 GLN A 17 6.378 -11.054 0.256 1.00 0.00 H new ATOM 0 HG2 GLN A 17 5.380 -9.735 -1.644 1.00 0.00 H new ATOM 0 HG3 GLN A 17 4.313 -11.087 -1.968 1.00 0.00 H new ATOM 0 HE21 GLN A 17 5.341 -10.052 1.280 1.00 0.00 H new ATOM 0 HE22 GLN A 17 3.756 -9.467 1.796 1.00 0.00 H new ATOM 258 N ASP A 18 6.008 -13.804 -2.845 1.00 0.00 N ATOM 259 CA ASP A 18 5.410 -14.456 -4.009 1.00 0.00 C ATOM 260 C ASP A 18 3.885 -14.320 -3.971 1.00 0.00 C ATOM 261 O ASP A 18 3.150 -15.245 -4.307 1.00 0.00 O ATOM 262 CB ASP A 18 5.824 -15.934 -4.055 1.00 0.00 C ATOM 263 CG ASP A 18 5.415 -16.625 -5.346 1.00 0.00 C ATOM 264 OD1 ASP A 18 5.956 -16.271 -6.413 1.00 0.00 O ATOM 265 OD2 ASP A 18 4.562 -17.537 -5.300 1.00 0.00 O ATOM 0 H ASP A 18 6.151 -14.419 -2.044 1.00 0.00 H new ATOM 0 HA ASP A 18 5.773 -13.967 -4.913 1.00 0.00 H new ATOM 0 HB2 ASP A 18 6.905 -16.007 -3.937 1.00 0.00 H new ATOM 0 HB3 ASP A 18 5.375 -16.458 -3.211 1.00 0.00 H new ATOM 270 N LYS A 19 3.417 -13.157 -3.554 1.00 0.00 N ATOM 271 CA LYS A 19 1.990 -12.879 -3.477 1.00 0.00 C ATOM 272 C LYS A 19 1.740 -11.387 -3.636 1.00 0.00 C ATOM 273 O LYS A 19 2.679 -10.614 -3.819 1.00 0.00 O ATOM 274 CB LYS A 19 1.388 -13.381 -2.161 1.00 0.00 C ATOM 275 CG LYS A 19 2.077 -12.848 -0.915 1.00 0.00 C ATOM 276 CD LYS A 19 1.237 -13.085 0.329 1.00 0.00 C ATOM 277 CE LYS A 19 0.934 -14.560 0.534 1.00 0.00 C ATOM 278 NZ LYS A 19 0.025 -14.780 1.686 1.00 0.00 N ATOM 0 H LYS A 19 4.010 -12.381 -3.260 1.00 0.00 H new ATOM 0 HA LYS A 19 1.500 -13.415 -4.290 1.00 0.00 H new ATOM 0 HB2 LYS A 19 0.335 -13.102 -2.127 1.00 0.00 H new ATOM 0 HB3 LYS A 19 1.430 -14.470 -2.148 1.00 0.00 H new ATOM 0 HG2 LYS A 19 3.047 -13.332 -0.799 1.00 0.00 H new ATOM 0 HG3 LYS A 19 2.266 -11.781 -1.030 1.00 0.00 H new ATOM 0 HD2 LYS A 19 1.763 -12.697 1.202 1.00 0.00 H new ATOM 0 HD3 LYS A 19 0.302 -12.530 0.247 1.00 0.00 H new ATOM 0 HE2 LYS A 19 0.481 -14.967 -0.370 1.00 0.00 H new ATOM 0 HE3 LYS A 19 1.865 -15.103 0.696 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -0.091 -15.801 1.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 0.430 -14.339 2.537 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -0.902 -14.354 1.483 1.00 0.00 H new ATOM 292 N LEU A 20 0.476 -10.995 -3.581 1.00 0.00 N ATOM 293 CA LEU A 20 0.100 -9.605 -3.773 1.00 0.00 C ATOM 294 C LEU A 20 0.413 -8.787 -2.526 1.00 0.00 C ATOM 295 O LEU A 20 -0.092 -9.073 -1.436 1.00 0.00 O ATOM 296 CB LEU A 20 -1.392 -9.512 -4.116 1.00 0.00 C ATOM 297 CG LEU A 20 -1.865 -8.199 -4.763 1.00 0.00 C ATOM 298 CD1 LEU A 20 -1.838 -7.043 -3.779 1.00 0.00 C ATOM 299 CD2 LEU A 20 -1.008 -7.870 -5.970 1.00 0.00 C ATOM 0 H LEU A 20 -0.308 -11.623 -3.404 1.00 0.00 H new ATOM 0 HA LEU A 20 0.679 -9.196 -4.601 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -1.640 -10.333 -4.789 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -1.963 -9.667 -3.201 1.00 0.00 H new ATOM 0 HG LEU A 20 -2.898 -8.344 -5.079 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -2.179 -6.135 -4.275 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -2.495 -7.266 -2.938 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -0.821 -6.898 -3.416 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -1.353 -6.939 -6.418 1.00 0.00 H new ATOM 0 HD22 LEU A 20 0.031 -7.760 -5.659 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -1.085 -8.675 -6.701 1.00 0.00 H new ATOM 311 N VAL A 21 1.236 -7.766 -2.702 1.00 0.00 N ATOM 312 CA VAL A 21 1.583 -6.866 -1.618 1.00 0.00 C ATOM 313 C VAL A 21 0.697 -5.633 -1.661 1.00 0.00 C ATOM 314 O VAL A 21 0.736 -4.871 -2.629 1.00 0.00 O ATOM 315 CB VAL A 21 3.052 -6.401 -1.701 1.00 0.00 C ATOM 316 CG1 VAL A 21 3.609 -6.124 -0.313 1.00 0.00 C ATOM 317 CG2 VAL A 21 3.905 -7.409 -2.454 1.00 0.00 C ATOM 0 H VAL A 21 1.678 -7.540 -3.593 1.00 0.00 H new ATOM 0 HA VAL A 21 1.438 -7.418 -0.689 1.00 0.00 H new ATOM 0 HB VAL A 21 3.081 -5.467 -2.263 1.00 0.00 H new ATOM 0 HG11 VAL A 21 4.646 -5.798 -0.395 1.00 0.00 H new ATOM 0 HG12 VAL A 21 3.019 -5.342 0.166 1.00 0.00 H new ATOM 0 HG13 VAL A 21 3.562 -7.033 0.286 1.00 0.00 H new ATOM 0 HG21 VAL A 21 4.935 -7.054 -2.496 1.00 0.00 H new ATOM 0 HG22 VAL A 21 3.873 -8.369 -1.939 1.00 0.00 H new ATOM 0 HG23 VAL A 21 3.520 -7.527 -3.467 1.00 0.00 H new ATOM 327 N VAL A 22 -0.111 -5.443 -0.631 1.00 0.00 N ATOM 328 CA VAL A 22 -0.934 -4.251 -0.529 1.00 0.00 C ATOM 329 C VAL A 22 -0.246 -3.238 0.362 1.00 0.00 C ATOM 330 O VAL A 22 -0.238 -3.377 1.588 1.00 0.00 O ATOM 331 CB VAL A 22 -2.334 -4.558 0.040 1.00 0.00 C ATOM 332 CG1 VAL A 22 -3.176 -3.292 0.121 1.00 0.00 C ATOM 333 CG2 VAL A 22 -3.027 -5.605 -0.805 1.00 0.00 C ATOM 0 H VAL A 22 -0.214 -6.098 0.144 1.00 0.00 H new ATOM 0 HA VAL A 22 -1.062 -3.853 -1.535 1.00 0.00 H new ATOM 0 HB VAL A 22 -2.215 -4.950 1.050 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -4.159 -3.534 0.525 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -2.684 -2.569 0.772 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -3.289 -2.866 -0.876 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -4.014 -5.812 -0.391 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -3.131 -5.238 -1.826 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -2.436 -6.521 -0.807 1.00 0.00 H new ATOM 343 N VAL A 23 0.346 -2.231 -0.252 1.00 0.00 N ATOM 344 CA VAL A 23 1.059 -1.228 0.502 1.00 0.00 C ATOM 345 C VAL A 23 0.268 0.066 0.584 1.00 0.00 C ATOM 346 O VAL A 23 -0.157 0.628 -0.427 1.00 0.00 O ATOM 347 CB VAL A 23 2.454 -0.948 -0.071 1.00 0.00 C ATOM 348 CG1 VAL A 23 3.184 0.033 0.818 1.00 0.00 C ATOM 349 CG2 VAL A 23 3.248 -2.233 -0.208 1.00 0.00 C ATOM 0 H VAL A 23 0.346 -2.090 -1.262 1.00 0.00 H new ATOM 0 HA VAL A 23 1.185 -1.633 1.506 1.00 0.00 H new ATOM 0 HB VAL A 23 2.343 -0.514 -1.065 1.00 0.00 H new ATOM 0 HG11 VAL A 23 4.174 0.229 0.407 1.00 0.00 H new ATOM 0 HG12 VAL A 23 2.622 0.965 0.870 1.00 0.00 H new ATOM 0 HG13 VAL A 23 3.283 -0.387 1.819 1.00 0.00 H new ATOM 0 HG21 VAL A 23 4.234 -2.010 -0.616 1.00 0.00 H new ATOM 0 HG22 VAL A 23 3.358 -2.699 0.771 1.00 0.00 H new ATOM 0 HG23 VAL A 23 2.724 -2.915 -0.878 1.00 0.00 H new ATOM 359 N ALA A 24 0.087 0.515 1.807 1.00 0.00 N ATOM 360 CA ALA A 24 -0.684 1.707 2.105 1.00 0.00 C ATOM 361 C ALA A 24 0.233 2.867 2.480 1.00 0.00 C ATOM 362 O ALA A 24 0.729 2.927 3.606 1.00 0.00 O ATOM 363 CB ALA A 24 -1.603 1.416 3.274 1.00 0.00 C ATOM 0 H ALA A 24 0.474 0.059 2.633 1.00 0.00 H new ATOM 0 HA ALA A 24 -1.257 1.983 1.220 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -2.188 2.306 3.507 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -2.275 0.598 3.014 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -1.008 1.135 4.143 1.00 0.00 H new ATOM 369 N PHE A 25 0.477 3.777 1.559 1.00 0.00 N ATOM 370 CA PHE A 25 1.285 4.947 1.873 1.00 0.00 C ATOM 371 C PHE A 25 0.437 6.196 2.031 1.00 0.00 C ATOM 372 O PHE A 25 -0.285 6.599 1.122 1.00 0.00 O ATOM 373 CB PHE A 25 2.370 5.154 0.825 1.00 0.00 C ATOM 374 CG PHE A 25 3.678 4.573 1.257 1.00 0.00 C ATOM 375 CD1 PHE A 25 3.752 3.255 1.656 1.00 0.00 C ATOM 376 CD2 PHE A 25 4.823 5.346 1.289 1.00 0.00 C ATOM 377 CE1 PHE A 25 4.943 2.709 2.075 1.00 0.00 C ATOM 378 CE2 PHE A 25 6.020 4.808 1.709 1.00 0.00 C ATOM 379 CZ PHE A 25 6.079 3.485 2.103 1.00 0.00 C ATOM 0 H PHE A 25 0.135 3.735 0.599 1.00 0.00 H new ATOM 0 HA PHE A 25 1.766 4.761 2.833 1.00 0.00 H new ATOM 0 HB2 PHE A 25 2.061 4.695 -0.114 1.00 0.00 H new ATOM 0 HB3 PHE A 25 2.492 6.220 0.633 1.00 0.00 H new ATOM 0 HD1 PHE A 25 2.862 2.643 1.639 1.00 0.00 H new ATOM 0 HD2 PHE A 25 4.779 6.381 0.982 1.00 0.00 H new ATOM 0 HE1 PHE A 25 4.986 1.674 2.381 1.00 0.00 H new ATOM 0 HE2 PHE A 25 6.910 5.419 1.730 1.00 0.00 H new ATOM 0 HZ PHE A 25 7.016 3.060 2.433 1.00 0.00 H new ATOM 389 N TYR A 26 0.532 6.802 3.199 1.00 0.00 N ATOM 390 CA TYR A 26 -0.228 7.998 3.516 1.00 0.00 C ATOM 391 C TYR A 26 0.538 8.833 4.526 1.00 0.00 C ATOM 392 O TYR A 26 1.454 8.335 5.168 1.00 0.00 O ATOM 393 CB TYR A 26 -1.605 7.621 4.074 1.00 0.00 C ATOM 394 CG TYR A 26 -1.553 6.716 5.291 1.00 0.00 C ATOM 395 CD1 TYR A 26 -1.460 5.339 5.147 1.00 0.00 C ATOM 396 CD2 TYR A 26 -1.600 7.239 6.579 1.00 0.00 C ATOM 397 CE1 TYR A 26 -1.410 4.507 6.244 1.00 0.00 C ATOM 398 CE2 TYR A 26 -1.551 6.411 7.684 1.00 0.00 C ATOM 399 CZ TYR A 26 -1.455 5.047 7.512 1.00 0.00 C ATOM 400 OH TYR A 26 -1.400 4.221 8.610 1.00 0.00 O ATOM 0 H TYR A 26 1.137 6.480 3.955 1.00 0.00 H new ATOM 0 HA TYR A 26 -0.373 8.581 2.606 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -2.142 8.533 4.335 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -2.180 7.126 3.291 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -1.426 4.911 4.156 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -1.676 8.307 6.717 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -1.336 3.438 6.112 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -1.588 6.831 8.678 1.00 0.00 H new ATOM 0 HH TYR A 26 -1.442 4.760 9.427 1.00 0.00 H new ATOM 410 N ALA A 27 0.175 10.097 4.658 1.00 0.00 N ATOM 411 CA ALA A 27 0.821 10.968 5.626 1.00 0.00 C ATOM 412 C ALA A 27 -0.151 11.328 6.737 1.00 0.00 C ATOM 413 O ALA A 27 -1.289 11.713 6.475 1.00 0.00 O ATOM 414 CB ALA A 27 1.341 12.223 4.952 1.00 0.00 C ATOM 0 H ALA A 27 -0.561 10.542 4.110 1.00 0.00 H new ATOM 0 HA ALA A 27 1.668 10.436 6.059 1.00 0.00 H new ATOM 0 HB1 ALA A 27 1.821 12.862 5.693 1.00 0.00 H new ATOM 0 HB2 ALA A 27 2.065 11.950 4.184 1.00 0.00 H new ATOM 0 HB3 ALA A 27 0.511 12.760 4.493 1.00 0.00 H new ATOM 420 N THR A 28 0.314 11.201 7.970 1.00 0.00 N ATOM 421 CA THR A 28 -0.516 11.426 9.147 1.00 0.00 C ATOM 422 C THR A 28 -1.041 12.859 9.233 1.00 0.00 C ATOM 423 O THR A 28 -2.072 13.107 9.860 1.00 0.00 O ATOM 424 CB THR A 28 0.260 11.084 10.431 1.00 0.00 C ATOM 425 OG1 THR A 28 1.607 11.568 10.325 1.00 0.00 O ATOM 426 CG2 THR A 28 0.263 9.583 10.678 1.00 0.00 C ATOM 0 H THR A 28 1.276 10.939 8.185 1.00 0.00 H new ATOM 0 HA THR A 28 -1.377 10.765 9.049 1.00 0.00 H new ATOM 0 HB THR A 28 -0.233 11.567 11.274 1.00 0.00 H new ATOM 0 HG1 THR A 28 2.230 10.812 10.357 1.00 0.00 H new ATOM 0 HG21 THR A 28 0.817 9.366 11.591 1.00 0.00 H new ATOM 0 HG22 THR A 28 -0.763 9.230 10.783 1.00 0.00 H new ATOM 0 HG23 THR A 28 0.736 9.077 9.837 1.00 0.00 H new ATOM 434 N TRP A 29 -0.341 13.799 8.607 1.00 0.00 N ATOM 435 CA TRP A 29 -0.787 15.187 8.599 1.00 0.00 C ATOM 436 C TRP A 29 -1.803 15.424 7.485 1.00 0.00 C ATOM 437 O TRP A 29 -2.533 16.412 7.501 1.00 0.00 O ATOM 438 CB TRP A 29 0.400 16.154 8.452 1.00 0.00 C ATOM 439 CG TRP A 29 1.197 15.979 7.189 1.00 0.00 C ATOM 440 CD1 TRP A 29 2.381 15.317 7.055 1.00 0.00 C ATOM 441 CD2 TRP A 29 0.879 16.491 5.886 1.00 0.00 C ATOM 442 NE1 TRP A 29 2.810 15.371 5.752 1.00 0.00 N ATOM 443 CE2 TRP A 29 1.906 16.087 5.015 1.00 0.00 C ATOM 444 CE3 TRP A 29 -0.178 17.248 5.371 1.00 0.00 C ATOM 445 CZ2 TRP A 29 1.908 16.412 3.662 1.00 0.00 C ATOM 446 CZ3 TRP A 29 -0.175 17.570 4.028 1.00 0.00 C ATOM 447 CH2 TRP A 29 0.862 17.151 3.187 1.00 0.00 C ATOM 0 H TRP A 29 0.529 13.628 8.103 1.00 0.00 H new ATOM 0 HA TRP A 29 -1.268 15.383 9.557 1.00 0.00 H new ATOM 0 HB2 TRP A 29 0.025 17.177 8.491 1.00 0.00 H new ATOM 0 HB3 TRP A 29 1.065 16.025 9.306 1.00 0.00 H new ATOM 0 HD1 TRP A 29 2.906 14.821 7.858 1.00 0.00 H new ATOM 0 HE1 TRP A 29 3.664 14.946 5.391 1.00 0.00 H new ATOM 0 HE3 TRP A 29 -0.983 17.575 6.012 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 2.708 16.091 3.011 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 -0.986 18.155 3.620 1.00 0.00 H new ATOM 0 HH2 TRP A 29 0.835 17.417 2.141 1.00 0.00 H new ATOM 458 N CYS A 30 -1.851 14.508 6.527 1.00 0.00 N ATOM 459 CA CYS A 30 -2.722 14.655 5.369 1.00 0.00 C ATOM 460 C CYS A 30 -4.173 14.392 5.760 1.00 0.00 C ATOM 461 O CYS A 30 -4.435 13.648 6.707 1.00 0.00 O ATOM 462 CB CYS A 30 -2.284 13.699 4.254 1.00 0.00 C ATOM 463 SG CYS A 30 -3.270 13.793 2.742 1.00 0.00 S ATOM 0 H CYS A 30 -1.295 13.653 6.529 1.00 0.00 H new ATOM 0 HA CYS A 30 -2.645 15.678 5.000 1.00 0.00 H new ATOM 0 HB2 CYS A 30 -1.243 13.906 4.005 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -2.324 12.678 4.634 1.00 0.00 H new ATOM 0 HG CYS A 30 -3.110 12.704 2.051 1.00 0.00 H new ATOM 469 N GLY A 31 -5.106 14.996 5.045 1.00 0.00 N ATOM 470 CA GLY A 31 -6.508 14.863 5.389 1.00 0.00 C ATOM 471 C GLY A 31 -7.051 13.458 5.174 1.00 0.00 C ATOM 472 O GLY A 31 -7.225 12.703 6.137 1.00 0.00 O ATOM 0 H GLY A 31 -4.919 15.579 4.229 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -6.647 15.142 6.433 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -7.090 15.565 4.791 1.00 0.00 H new ATOM 476 N PRO A 32 -7.300 13.066 3.910 1.00 0.00 N ATOM 477 CA PRO A 32 -7.974 11.802 3.578 1.00 0.00 C ATOM 478 C PRO A 32 -7.095 10.560 3.741 1.00 0.00 C ATOM 479 O PRO A 32 -7.387 9.508 3.169 1.00 0.00 O ATOM 480 CB PRO A 32 -8.363 11.991 2.112 1.00 0.00 C ATOM 481 CG PRO A 32 -7.335 12.920 1.568 1.00 0.00 C ATOM 482 CD PRO A 32 -6.954 13.836 2.698 1.00 0.00 C ATOM 0 HA PRO A 32 -8.811 11.617 4.252 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -8.363 11.042 1.576 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -9.365 12.410 2.018 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -6.467 12.370 1.204 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -7.730 13.486 0.725 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -5.893 14.084 2.671 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -7.502 14.777 2.652 1.00 0.00 H new ATOM 490 N CYS A 33 -6.033 10.668 4.531 1.00 0.00 N ATOM 491 CA CYS A 33 -5.186 9.517 4.830 1.00 0.00 C ATOM 492 C CYS A 33 -5.983 8.500 5.636 1.00 0.00 C ATOM 493 O CYS A 33 -5.765 7.282 5.553 1.00 0.00 O ATOM 494 CB CYS A 33 -3.947 9.954 5.613 1.00 0.00 C ATOM 495 SG CYS A 33 -4.313 10.778 7.179 1.00 0.00 S ATOM 0 H CYS A 33 -5.738 11.537 4.975 1.00 0.00 H new ATOM 0 HA CYS A 33 -4.858 9.063 3.895 1.00 0.00 H new ATOM 0 HB2 CYS A 33 -3.329 9.078 5.812 1.00 0.00 H new ATOM 0 HB3 CYS A 33 -3.356 10.626 4.991 1.00 0.00 H new ATOM 0 HG CYS A 33 -4.662 12.009 6.950 1.00 0.00 H new ATOM 501 N LYS A 34 -6.946 9.020 6.384 1.00 0.00 N ATOM 502 CA LYS A 34 -7.801 8.204 7.219 1.00 0.00 C ATOM 503 C LYS A 34 -8.724 7.327 6.384 1.00 0.00 C ATOM 504 O LYS A 34 -9.404 6.464 6.928 1.00 0.00 O ATOM 505 CB LYS A 34 -8.620 9.077 8.173 1.00 0.00 C ATOM 506 CG LYS A 34 -9.503 10.103 7.477 1.00 0.00 C ATOM 507 CD LYS A 34 -10.321 10.901 8.481 1.00 0.00 C ATOM 508 CE LYS A 34 -11.194 11.946 7.801 1.00 0.00 C ATOM 509 NZ LYS A 34 -12.194 11.334 6.887 1.00 0.00 N ATOM 0 H LYS A 34 -7.152 10.018 6.426 1.00 0.00 H new ATOM 0 HA LYS A 34 -7.157 7.550 7.807 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -9.247 8.433 8.789 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -7.939 9.597 8.846 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -8.883 10.780 6.890 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -10.171 9.597 6.780 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -10.950 10.223 9.058 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -9.651 11.392 9.187 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -11.710 12.535 8.559 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -10.563 12.634 7.238 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -12.872 12.060 6.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -11.709 10.938 6.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -12.702 10.576 7.386 1.00 0.00 H new ATOM 523 N MET A 35 -8.761 7.534 5.065 1.00 0.00 N ATOM 524 CA MET A 35 -9.581 6.677 4.222 1.00 0.00 C ATOM 525 C MET A 35 -8.795 5.431 3.866 1.00 0.00 C ATOM 526 O MET A 35 -9.362 4.375 3.594 1.00 0.00 O ATOM 527 CB MET A 35 -10.038 7.372 2.940 1.00 0.00 C ATOM 528 CG MET A 35 -11.143 6.594 2.240 1.00 0.00 C ATOM 529 SD MET A 35 -11.739 7.368 0.727 1.00 0.00 S ATOM 530 CE MET A 35 -12.796 6.056 0.106 1.00 0.00 C ATOM 0 H MET A 35 -8.248 8.266 4.574 1.00 0.00 H new ATOM 0 HA MET A 35 -10.477 6.423 4.788 1.00 0.00 H new ATOM 0 HB2 MET A 35 -10.393 8.375 3.177 1.00 0.00 H new ATOM 0 HB3 MET A 35 -9.189 7.485 2.265 1.00 0.00 H new ATOM 0 HG2 MET A 35 -10.777 5.595 2.005 1.00 0.00 H new ATOM 0 HG3 MET A 35 -11.980 6.473 2.928 1.00 0.00 H new ATOM 0 HE1 MET A 35 -12.920 6.168 -0.971 1.00 0.00 H new ATOM 0 HE2 MET A 35 -12.340 5.089 0.320 1.00 0.00 H new ATOM 0 HE3 MET A 35 -13.770 6.113 0.591 1.00 0.00 H new ATOM 540 N ILE A 36 -7.478 5.557 3.884 1.00 0.00 N ATOM 541 CA ILE A 36 -6.613 4.433 3.588 1.00 0.00 C ATOM 542 C ILE A 36 -6.483 3.538 4.799 1.00 0.00 C ATOM 543 O ILE A 36 -6.244 2.339 4.671 1.00 0.00 O ATOM 544 CB ILE A 36 -5.235 4.911 3.078 1.00 0.00 C ATOM 545 CG1 ILE A 36 -5.256 4.957 1.554 1.00 0.00 C ATOM 546 CG2 ILE A 36 -4.097 4.032 3.573 1.00 0.00 C ATOM 547 CD1 ILE A 36 -6.384 5.795 1.006 1.00 0.00 C ATOM 0 H ILE A 36 -6.988 6.425 4.100 1.00 0.00 H new ATOM 0 HA ILE A 36 -7.065 3.848 2.787 1.00 0.00 H new ATOM 0 HB ILE A 36 -5.052 5.908 3.478 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -4.307 5.355 1.195 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -5.343 3.942 1.166 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -3.151 4.410 3.187 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -4.075 4.044 4.663 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -4.249 3.010 3.225 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -6.346 5.789 -0.083 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -7.337 5.384 1.338 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -6.285 6.819 1.367 1.00 0.00 H new ATOM 559 N ALA A 37 -6.693 4.114 5.972 1.00 0.00 N ATOM 560 CA ALA A 37 -6.741 3.320 7.186 1.00 0.00 C ATOM 561 C ALA A 37 -7.774 2.176 7.075 1.00 0.00 C ATOM 562 O ALA A 37 -7.386 1.004 7.074 1.00 0.00 O ATOM 563 CB ALA A 37 -6.987 4.200 8.412 1.00 0.00 C ATOM 0 H ALA A 37 -6.831 5.115 6.108 1.00 0.00 H new ATOM 0 HA ALA A 37 -5.765 2.852 7.316 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -7.018 3.578 9.306 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -6.181 4.928 8.505 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -7.937 4.722 8.300 1.00 0.00 H new ATOM 569 N PRO A 38 -9.093 2.465 6.927 1.00 0.00 N ATOM 570 CA PRO A 38 -10.121 1.434 6.974 1.00 0.00 C ATOM 571 C PRO A 38 -10.341 0.714 5.646 1.00 0.00 C ATOM 572 O PRO A 38 -10.631 -0.479 5.644 1.00 0.00 O ATOM 573 CB PRO A 38 -11.391 2.197 7.388 1.00 0.00 C ATOM 574 CG PRO A 38 -11.005 3.643 7.431 1.00 0.00 C ATOM 575 CD PRO A 38 -9.711 3.758 6.677 1.00 0.00 C ATOM 0 HA PRO A 38 -9.834 0.639 7.662 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -12.198 2.029 6.674 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -11.750 1.859 8.360 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -11.776 4.265 6.976 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -10.887 3.983 8.460 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -9.874 3.933 5.613 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -9.097 4.580 7.045 1.00 0.00 H new ATOM 583 N MET A 39 -10.204 1.418 4.519 1.00 0.00 N ATOM 584 CA MET A 39 -10.474 0.813 3.219 1.00 0.00 C ATOM 585 C MET A 39 -9.450 -0.275 2.938 1.00 0.00 C ATOM 586 O MET A 39 -9.783 -1.365 2.481 1.00 0.00 O ATOM 587 CB MET A 39 -10.400 1.880 2.124 1.00 0.00 C ATOM 588 CG MET A 39 -10.346 1.303 0.727 1.00 0.00 C ATOM 589 SD MET A 39 -9.353 2.306 -0.388 1.00 0.00 S ATOM 590 CE MET A 39 -7.923 2.640 0.646 1.00 0.00 C ATOM 0 H MET A 39 -9.911 2.394 4.483 1.00 0.00 H new ATOM 0 HA MET A 39 -11.473 0.377 3.229 1.00 0.00 H new ATOM 0 HB2 MET A 39 -11.268 2.535 2.206 1.00 0.00 H new ATOM 0 HB3 MET A 39 -9.517 2.498 2.288 1.00 0.00 H new ATOM 0 HG2 MET A 39 -9.935 0.294 0.769 1.00 0.00 H new ATOM 0 HG3 MET A 39 -11.358 1.218 0.332 1.00 0.00 H new ATOM 0 HE1 MET A 39 -7.132 3.083 0.041 1.00 0.00 H new ATOM 0 HE2 MET A 39 -8.202 3.332 1.441 1.00 0.00 H new ATOM 0 HE3 MET A 39 -7.566 1.708 1.085 1.00 0.00 H new ATOM 600 N ILE A 40 -8.207 0.031 3.246 1.00 0.00 N ATOM 601 CA ILE A 40 -7.106 -0.879 3.004 1.00 0.00 C ATOM 602 C ILE A 40 -7.125 -2.029 3.998 1.00 0.00 C ATOM 603 O ILE A 40 -6.819 -3.169 3.642 1.00 0.00 O ATOM 604 CB ILE A 40 -5.785 -0.097 3.048 1.00 0.00 C ATOM 605 CG1 ILE A 40 -5.219 0.045 1.643 1.00 0.00 C ATOM 606 CG2 ILE A 40 -4.762 -0.732 3.980 1.00 0.00 C ATOM 607 CD1 ILE A 40 -4.264 1.199 1.505 1.00 0.00 C ATOM 0 H ILE A 40 -7.931 0.916 3.671 1.00 0.00 H new ATOM 0 HA ILE A 40 -7.208 -1.323 2.014 1.00 0.00 H new ATOM 0 HB ILE A 40 -6.003 0.892 3.452 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -4.707 -0.877 1.369 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -6.040 0.175 0.938 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -3.847 -0.140 3.974 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -5.165 -0.767 4.992 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -4.541 -1.744 3.642 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -3.896 1.246 0.480 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -4.779 2.128 1.749 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -3.424 1.060 2.186 1.00 0.00 H new ATOM 619 N GLU A 41 -7.501 -1.739 5.239 1.00 0.00 N ATOM 620 CA GLU A 41 -7.724 -2.805 6.206 1.00 0.00 C ATOM 621 C GLU A 41 -8.881 -3.690 5.751 1.00 0.00 C ATOM 622 O GLU A 41 -8.905 -4.888 6.024 1.00 0.00 O ATOM 623 CB GLU A 41 -8.030 -2.243 7.594 1.00 0.00 C ATOM 624 CG GLU A 41 -6.802 -1.809 8.375 1.00 0.00 C ATOM 625 CD GLU A 41 -7.153 -1.297 9.755 1.00 0.00 C ATOM 626 OE1 GLU A 41 -7.958 -1.954 10.448 1.00 0.00 O ATOM 627 OE2 GLU A 41 -6.625 -0.239 10.157 1.00 0.00 O ATOM 0 H GLU A 41 -7.655 -0.795 5.593 1.00 0.00 H new ATOM 0 HA GLU A 41 -6.810 -3.395 6.267 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -8.700 -1.390 7.488 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -8.565 -2.999 8.170 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -6.115 -2.650 8.466 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -6.279 -1.029 7.822 1.00 0.00 H new ATOM 634 N LYS A 42 -9.827 -3.087 5.039 1.00 0.00 N ATOM 635 CA LYS A 42 -11.024 -3.785 4.605 1.00 0.00 C ATOM 636 C LYS A 42 -10.734 -4.718 3.429 1.00 0.00 C ATOM 637 O LYS A 42 -11.401 -5.744 3.265 1.00 0.00 O ATOM 638 CB LYS A 42 -12.123 -2.779 4.247 1.00 0.00 C ATOM 639 CG LYS A 42 -13.455 -3.435 3.937 1.00 0.00 C ATOM 640 CD LYS A 42 -14.549 -2.407 3.723 1.00 0.00 C ATOM 641 CE LYS A 42 -15.916 -3.066 3.691 1.00 0.00 C ATOM 642 NZ LYS A 42 -16.226 -3.757 4.974 1.00 0.00 N ATOM 0 H LYS A 42 -9.784 -2.110 4.750 1.00 0.00 H new ATOM 0 HA LYS A 42 -11.373 -4.404 5.432 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -12.252 -2.082 5.075 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -11.804 -2.194 3.385 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -13.357 -4.054 3.045 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -13.734 -4.098 4.756 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -14.517 -1.666 4.521 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -14.376 -1.876 2.787 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -16.678 -2.313 3.490 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -15.954 -3.785 2.872 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -17.236 -4.003 5.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -15.657 -4.624 5.048 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -16.002 -3.127 5.771 1.00 0.00 H new ATOM 656 N PHE A 43 -9.738 -4.374 2.618 1.00 0.00 N ATOM 657 CA PHE A 43 -9.326 -5.248 1.521 1.00 0.00 C ATOM 658 C PHE A 43 -8.956 -6.624 2.064 1.00 0.00 C ATOM 659 O PHE A 43 -9.564 -7.629 1.695 1.00 0.00 O ATOM 660 CB PHE A 43 -8.138 -4.663 0.745 1.00 0.00 C ATOM 661 CG PHE A 43 -8.430 -3.343 0.100 1.00 0.00 C ATOM 662 CD1 PHE A 43 -9.700 -3.048 -0.369 1.00 0.00 C ATOM 663 CD2 PHE A 43 -7.431 -2.401 -0.044 1.00 0.00 C ATOM 664 CE1 PHE A 43 -9.965 -1.835 -0.965 1.00 0.00 C ATOM 665 CE2 PHE A 43 -7.691 -1.187 -0.639 1.00 0.00 C ATOM 666 CZ PHE A 43 -8.958 -0.904 -1.101 1.00 0.00 C ATOM 0 H PHE A 43 -9.206 -3.507 2.696 1.00 0.00 H new ATOM 0 HA PHE A 43 -10.167 -5.336 0.833 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -7.294 -4.546 1.425 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -7.833 -5.373 -0.024 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -10.490 -3.777 -0.266 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -6.435 -2.619 0.314 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -10.959 -1.614 -1.325 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -6.902 -0.457 -0.744 1.00 0.00 H new ATOM 0 HZ PHE A 43 -9.162 0.047 -1.570 1.00 0.00 H new ATOM 676 N SER A 44 -7.992 -6.674 2.981 1.00 0.00 N ATOM 677 CA SER A 44 -7.547 -7.947 3.518 1.00 0.00 C ATOM 678 C SER A 44 -8.559 -8.484 4.531 1.00 0.00 C ATOM 679 O SER A 44 -8.497 -9.644 4.936 1.00 0.00 O ATOM 680 CB SER A 44 -6.161 -7.813 4.134 1.00 0.00 C ATOM 681 OG SER A 44 -6.155 -6.878 5.203 1.00 0.00 O ATOM 0 H SER A 44 -7.513 -5.857 3.360 1.00 0.00 H new ATOM 0 HA SER A 44 -7.479 -8.666 2.702 1.00 0.00 H new ATOM 0 HB2 SER A 44 -5.828 -8.785 4.498 1.00 0.00 H new ATOM 0 HB3 SER A 44 -5.451 -7.498 3.370 1.00 0.00 H new ATOM 0 HG SER A 44 -5.304 -6.938 5.685 1.00 0.00 H new ATOM 687 N GLU A 45 -9.476 -7.617 4.955 1.00 0.00 N ATOM 688 CA GLU A 45 -10.620 -8.030 5.763 1.00 0.00 C ATOM 689 C GLU A 45 -11.458 -9.033 4.976 1.00 0.00 C ATOM 690 O GLU A 45 -12.078 -9.934 5.545 1.00 0.00 O ATOM 691 CB GLU A 45 -11.465 -6.807 6.134 1.00 0.00 C ATOM 692 CG GLU A 45 -12.694 -7.118 6.970 1.00 0.00 C ATOM 693 CD GLU A 45 -13.574 -5.900 7.178 1.00 0.00 C ATOM 694 OE1 GLU A 45 -13.302 -5.114 8.109 1.00 0.00 O ATOM 695 OE2 GLU A 45 -14.552 -5.727 6.417 1.00 0.00 O ATOM 0 H GLU A 45 -9.448 -6.618 4.750 1.00 0.00 H new ATOM 0 HA GLU A 45 -10.268 -8.500 6.681 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -10.839 -6.101 6.680 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -11.782 -6.309 5.218 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -13.273 -7.902 6.482 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -12.382 -7.508 7.939 1.00 0.00 H new ATOM 702 N GLN A 46 -11.466 -8.864 3.659 1.00 0.00 N ATOM 703 CA GLN A 46 -12.136 -9.793 2.773 1.00 0.00 C ATOM 704 C GLN A 46 -11.188 -10.917 2.380 1.00 0.00 C ATOM 705 O GLN A 46 -11.544 -12.092 2.435 1.00 0.00 O ATOM 706 CB GLN A 46 -12.633 -9.069 1.518 1.00 0.00 C ATOM 707 CG GLN A 46 -13.618 -7.951 1.810 1.00 0.00 C ATOM 708 CD GLN A 46 -14.886 -8.447 2.476 1.00 0.00 C ATOM 709 OE1 GLN A 46 -15.497 -7.742 3.276 1.00 0.00 O ATOM 710 NE2 GLN A 46 -15.302 -9.658 2.140 1.00 0.00 N ATOM 0 H GLN A 46 -11.011 -8.085 3.184 1.00 0.00 H new ATOM 0 HA GLN A 46 -12.993 -10.216 3.297 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -11.777 -8.657 0.984 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -13.105 -9.793 0.854 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -13.141 -7.211 2.452 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -13.875 -7.447 0.879 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -14.768 -10.214 1.472 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -16.157 -10.035 2.549 1.00 0.00 H new ATOM 719 N TYR A 47 -9.975 -10.543 1.994 1.00 0.00 N ATOM 720 CA TYR A 47 -8.983 -11.506 1.542 1.00 0.00 C ATOM 721 C TYR A 47 -7.639 -11.326 2.254 1.00 0.00 C ATOM 722 O TYR A 47 -6.765 -10.593 1.792 1.00 0.00 O ATOM 723 CB TYR A 47 -8.814 -11.397 0.026 1.00 0.00 C ATOM 724 CG TYR A 47 -8.842 -9.980 -0.503 1.00 0.00 C ATOM 725 CD1 TYR A 47 -7.752 -9.127 -0.367 1.00 0.00 C ATOM 726 CD2 TYR A 47 -9.977 -9.498 -1.137 1.00 0.00 C ATOM 727 CE1 TYR A 47 -7.798 -7.836 -0.852 1.00 0.00 C ATOM 728 CE2 TYR A 47 -10.029 -8.209 -1.621 1.00 0.00 C ATOM 729 CZ TYR A 47 -8.939 -7.386 -1.477 1.00 0.00 C ATOM 730 OH TYR A 47 -8.998 -6.100 -1.944 1.00 0.00 O ATOM 0 H TYR A 47 -9.655 -9.575 1.986 1.00 0.00 H new ATOM 0 HA TYR A 47 -9.342 -12.504 1.795 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -7.868 -11.859 -0.257 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -9.606 -11.969 -0.458 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -6.858 -9.480 0.125 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -10.835 -10.144 -1.253 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -6.945 -7.183 -0.742 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -10.921 -7.848 -2.111 1.00 0.00 H new ATOM 0 HH TYR A 47 -9.519 -5.550 -1.323 1.00 0.00 H new ATOM 740 N PRO A 48 -7.441 -12.008 3.387 1.00 0.00 N ATOM 741 CA PRO A 48 -6.189 -11.921 4.144 1.00 0.00 C ATOM 742 C PRO A 48 -5.039 -12.643 3.442 1.00 0.00 C ATOM 743 O PRO A 48 -3.911 -12.657 3.932 1.00 0.00 O ATOM 744 CB PRO A 48 -6.531 -12.591 5.471 1.00 0.00 C ATOM 745 CG PRO A 48 -7.613 -13.558 5.134 1.00 0.00 C ATOM 746 CD PRO A 48 -8.413 -12.915 4.033 1.00 0.00 C ATOM 0 HA PRO A 48 -5.844 -10.893 4.256 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -5.664 -13.098 5.895 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -6.866 -11.862 6.209 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -7.197 -14.512 4.809 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -8.238 -13.763 6.003 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -8.799 -13.655 3.332 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -9.271 -12.370 4.426 1.00 0.00 H new ATOM 754 N GLN A 49 -5.340 -13.247 2.291 1.00 0.00 N ATOM 755 CA GLN A 49 -4.332 -13.937 1.488 1.00 0.00 C ATOM 756 C GLN A 49 -3.307 -12.968 0.902 1.00 0.00 C ATOM 757 O GLN A 49 -2.274 -13.383 0.375 1.00 0.00 O ATOM 758 CB GLN A 49 -4.984 -14.767 0.384 1.00 0.00 C ATOM 759 CG GLN A 49 -5.972 -14.000 -0.440 1.00 0.00 C ATOM 760 CD GLN A 49 -5.374 -13.370 -1.689 1.00 0.00 C ATOM 761 OE1 GLN A 49 -5.275 -14.009 -2.736 1.00 0.00 O ATOM 762 NE2 GLN A 49 -5.003 -12.104 -1.601 1.00 0.00 N ATOM 0 H GLN A 49 -6.279 -13.271 1.894 1.00 0.00 H new ATOM 0 HA GLN A 49 -3.798 -14.612 2.156 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -4.206 -15.161 -0.270 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -5.486 -15.624 0.834 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -6.782 -14.668 -0.734 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -6.413 -13.216 0.175 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -5.099 -11.605 -0.717 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -4.621 -11.627 -2.417 1.00 0.00 H new ATOM 771 N ALA A 50 -3.591 -11.679 1.010 1.00 0.00 N ATOM 772 CA ALA A 50 -2.669 -10.651 0.550 1.00 0.00 C ATOM 773 C ALA A 50 -1.921 -10.086 1.740 1.00 0.00 C ATOM 774 O ALA A 50 -2.423 -10.137 2.864 1.00 0.00 O ATOM 775 CB ALA A 50 -3.422 -9.538 -0.158 1.00 0.00 C ATOM 0 H ALA A 50 -4.456 -11.319 1.414 1.00 0.00 H new ATOM 0 HA ALA A 50 -1.965 -11.094 -0.154 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -2.717 -8.778 -0.495 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -3.953 -9.947 -1.018 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -4.138 -9.088 0.530 1.00 0.00 H new ATOM 781 N ASP A 51 -0.734 -9.552 1.513 1.00 0.00 N ATOM 782 CA ASP A 51 0.034 -8.996 2.610 1.00 0.00 C ATOM 783 C ASP A 51 -0.262 -7.527 2.773 1.00 0.00 C ATOM 784 O ASP A 51 -0.165 -6.744 1.829 1.00 0.00 O ATOM 785 CB ASP A 51 1.536 -9.219 2.445 1.00 0.00 C ATOM 786 CG ASP A 51 2.010 -10.491 3.121 1.00 0.00 C ATOM 787 OD1 ASP A 51 1.186 -11.406 3.330 1.00 0.00 O ATOM 788 OD2 ASP A 51 3.211 -10.583 3.451 1.00 0.00 O ATOM 0 H ASP A 51 -0.289 -9.492 0.597 1.00 0.00 H new ATOM 0 HA ASP A 51 -0.273 -9.526 3.512 1.00 0.00 H new ATOM 0 HB2 ASP A 51 1.779 -9.263 1.383 1.00 0.00 H new ATOM 0 HB3 ASP A 51 2.075 -8.368 2.861 1.00 0.00 H new ATOM 793 N PHE A 52 -0.632 -7.174 3.983 1.00 0.00 N ATOM 794 CA PHE A 52 -1.064 -5.832 4.304 1.00 0.00 C ATOM 795 C PHE A 52 0.039 -5.052 5.001 1.00 0.00 C ATOM 796 O PHE A 52 0.461 -5.406 6.099 1.00 0.00 O ATOM 797 CB PHE A 52 -2.307 -5.903 5.197 1.00 0.00 C ATOM 798 CG PHE A 52 -2.355 -7.120 6.090 1.00 0.00 C ATOM 799 CD1 PHE A 52 -1.663 -7.152 7.292 1.00 0.00 C ATOM 800 CD2 PHE A 52 -3.097 -8.232 5.724 1.00 0.00 C ATOM 801 CE1 PHE A 52 -1.711 -8.267 8.108 1.00 0.00 C ATOM 802 CE2 PHE A 52 -3.149 -9.349 6.536 1.00 0.00 C ATOM 803 CZ PHE A 52 -2.455 -9.366 7.729 1.00 0.00 C ATOM 0 H PHE A 52 -0.642 -7.814 4.777 1.00 0.00 H new ATOM 0 HA PHE A 52 -1.305 -5.310 3.378 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -2.347 -5.008 5.818 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -3.196 -5.893 4.566 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -1.079 -6.295 7.594 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -3.642 -8.225 4.792 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -1.167 -8.278 9.041 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -3.732 -10.208 6.237 1.00 0.00 H new ATOM 0 HZ PHE A 52 -2.494 -10.238 8.365 1.00 0.00 H new ATOM 813 N TYR A 53 0.511 -3.991 4.364 1.00 0.00 N ATOM 814 CA TYR A 53 1.533 -3.149 4.964 1.00 0.00 C ATOM 815 C TYR A 53 1.255 -1.683 4.698 1.00 0.00 C ATOM 816 O TYR A 53 0.632 -1.329 3.703 1.00 0.00 O ATOM 817 CB TYR A 53 2.923 -3.503 4.438 1.00 0.00 C ATOM 818 CG TYR A 53 3.400 -4.899 4.773 1.00 0.00 C ATOM 819 CD1 TYR A 53 3.930 -5.188 6.021 1.00 0.00 C ATOM 820 CD2 TYR A 53 3.336 -5.923 3.834 1.00 0.00 C ATOM 821 CE1 TYR A 53 4.378 -6.457 6.329 1.00 0.00 C ATOM 822 CE2 TYR A 53 3.784 -7.195 4.134 1.00 0.00 C ATOM 823 CZ TYR A 53 4.304 -7.456 5.385 1.00 0.00 C ATOM 824 OH TYR A 53 4.752 -8.720 5.693 1.00 0.00 O ATOM 0 H TYR A 53 0.205 -3.694 3.437 1.00 0.00 H new ATOM 0 HA TYR A 53 1.506 -3.329 6.039 1.00 0.00 H new ATOM 0 HB2 TYR A 53 2.925 -3.385 3.354 1.00 0.00 H new ATOM 0 HB3 TYR A 53 3.639 -2.785 4.838 1.00 0.00 H new ATOM 0 HD1 TYR A 53 3.993 -4.407 6.765 1.00 0.00 H new ATOM 0 HD2 TYR A 53 2.929 -5.720 2.854 1.00 0.00 H new ATOM 0 HE1 TYR A 53 4.785 -6.665 7.307 1.00 0.00 H new ATOM 0 HE2 TYR A 53 3.728 -7.980 3.394 1.00 0.00 H new ATOM 0 HH TYR A 53 4.375 -9.364 5.058 1.00 0.00 H new ATOM 834 N LYS A 54 1.725 -0.836 5.600 1.00 0.00 N ATOM 835 CA LYS A 54 1.462 0.585 5.515 1.00 0.00 C ATOM 836 C LYS A 54 2.617 1.387 6.101 1.00 0.00 C ATOM 837 O LYS A 54 3.433 0.847 6.856 1.00 0.00 O ATOM 838 CB LYS A 54 0.159 0.892 6.250 1.00 0.00 C ATOM 839 CG LYS A 54 0.238 0.748 7.762 1.00 0.00 C ATOM 840 CD LYS A 54 -1.128 0.953 8.396 1.00 0.00 C ATOM 841 CE LYS A 54 -1.083 0.782 9.903 1.00 0.00 C ATOM 842 NZ LYS A 54 -2.433 0.916 10.508 1.00 0.00 N ATOM 0 H LYS A 54 2.292 -1.113 6.401 1.00 0.00 H new ATOM 0 HA LYS A 54 1.364 0.873 4.468 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -0.147 1.910 6.010 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -0.620 0.228 5.875 1.00 0.00 H new ATOM 0 HG2 LYS A 54 0.618 -0.241 8.018 1.00 0.00 H new ATOM 0 HG3 LYS A 54 0.944 1.475 8.165 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -1.494 1.951 8.155 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -1.836 0.242 7.971 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -0.670 -0.197 10.147 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -0.414 1.527 10.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -2.365 0.794 11.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -2.816 1.859 10.296 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -3.064 0.189 10.114 1.00 0.00 H new ATOM 856 N LEU A 55 2.696 2.666 5.746 1.00 0.00 N ATOM 857 CA LEU A 55 3.737 3.541 6.247 1.00 0.00 C ATOM 858 C LEU A 55 3.293 4.998 6.147 1.00 0.00 C ATOM 859 O LEU A 55 2.489 5.355 5.280 1.00 0.00 O ATOM 860 CB LEU A 55 5.026 3.295 5.453 1.00 0.00 C ATOM 861 CG LEU A 55 6.219 4.187 5.799 1.00 0.00 C ATOM 862 CD1 LEU A 55 7.518 3.429 5.577 1.00 0.00 C ATOM 863 CD2 LEU A 55 6.193 5.438 4.942 1.00 0.00 C ATOM 0 H LEU A 55 2.042 3.118 5.107 1.00 0.00 H new ATOM 0 HA LEU A 55 3.928 3.326 7.298 1.00 0.00 H new ATOM 0 HB2 LEU A 55 5.323 2.256 5.597 1.00 0.00 H new ATOM 0 HB3 LEU A 55 4.803 3.419 4.393 1.00 0.00 H new ATOM 0 HG LEU A 55 6.155 4.475 6.848 1.00 0.00 H new ATOM 0 HD11 LEU A 55 8.362 4.072 5.826 1.00 0.00 H new ATOM 0 HD12 LEU A 55 7.536 2.544 6.213 1.00 0.00 H new ATOM 0 HD13 LEU A 55 7.589 3.126 4.532 1.00 0.00 H new ATOM 0 HD21 LEU A 55 7.045 6.069 5.193 1.00 0.00 H new ATOM 0 HD22 LEU A 55 6.246 5.159 3.890 1.00 0.00 H new ATOM 0 HD23 LEU A 55 5.269 5.986 5.126 1.00 0.00 H new ATOM 875 N ASP A 56 3.809 5.825 7.046 1.00 0.00 N ATOM 876 CA ASP A 56 3.481 7.245 7.075 1.00 0.00 C ATOM 877 C ASP A 56 4.560 8.068 6.371 1.00 0.00 C ATOM 878 O ASP A 56 5.722 8.073 6.782 1.00 0.00 O ATOM 879 CB ASP A 56 3.317 7.703 8.525 1.00 0.00 C ATOM 880 CG ASP A 56 3.149 9.203 8.673 1.00 0.00 C ATOM 881 OD1 ASP A 56 2.692 9.867 7.722 1.00 0.00 O ATOM 882 OD2 ASP A 56 3.472 9.726 9.757 1.00 0.00 O ATOM 0 H ASP A 56 4.463 5.533 7.772 1.00 0.00 H new ATOM 0 HA ASP A 56 2.543 7.400 6.542 1.00 0.00 H new ATOM 0 HB2 ASP A 56 2.450 7.204 8.959 1.00 0.00 H new ATOM 0 HB3 ASP A 56 4.188 7.385 9.098 1.00 0.00 H new ATOM 887 N VAL A 57 4.157 8.768 5.312 1.00 0.00 N ATOM 888 CA VAL A 57 5.074 9.571 4.504 1.00 0.00 C ATOM 889 C VAL A 57 5.674 10.706 5.331 1.00 0.00 C ATOM 890 O VAL A 57 6.781 11.171 5.059 1.00 0.00 O ATOM 891 CB VAL A 57 4.353 10.169 3.274 1.00 0.00 C ATOM 892 CG1 VAL A 57 5.337 10.870 2.349 1.00 0.00 C ATOM 893 CG2 VAL A 57 3.585 9.091 2.522 1.00 0.00 C ATOM 0 H VAL A 57 3.189 8.795 4.991 1.00 0.00 H new ATOM 0 HA VAL A 57 5.871 8.910 4.164 1.00 0.00 H new ATOM 0 HB VAL A 57 3.640 10.912 3.633 1.00 0.00 H new ATOM 0 HG11 VAL A 57 4.802 11.281 1.493 1.00 0.00 H new ATOM 0 HG12 VAL A 57 5.832 11.677 2.889 1.00 0.00 H new ATOM 0 HG13 VAL A 57 6.083 10.155 2.002 1.00 0.00 H new ATOM 0 HG21 VAL A 57 3.085 9.534 1.660 1.00 0.00 H new ATOM 0 HG22 VAL A 57 4.277 8.320 2.183 1.00 0.00 H new ATOM 0 HG23 VAL A 57 2.842 8.646 3.183 1.00 0.00 H new ATOM 903 N ASP A 58 4.941 11.142 6.352 1.00 0.00 N ATOM 904 CA ASP A 58 5.421 12.196 7.241 1.00 0.00 C ATOM 905 C ASP A 58 6.625 11.703 8.029 1.00 0.00 C ATOM 906 O ASP A 58 7.567 12.453 8.299 1.00 0.00 O ATOM 907 CB ASP A 58 4.317 12.631 8.207 1.00 0.00 C ATOM 908 CG ASP A 58 4.800 13.645 9.229 1.00 0.00 C ATOM 909 OD1 ASP A 58 5.093 14.795 8.847 1.00 0.00 O ATOM 910 OD2 ASP A 58 4.898 13.292 10.425 1.00 0.00 O ATOM 0 H ASP A 58 4.015 10.783 6.584 1.00 0.00 H new ATOM 0 HA ASP A 58 5.712 13.053 6.633 1.00 0.00 H new ATOM 0 HB2 ASP A 58 3.491 13.059 7.639 1.00 0.00 H new ATOM 0 HB3 ASP A 58 3.928 11.755 8.726 1.00 0.00 H new ATOM 915 N GLU A 59 6.585 10.427 8.375 1.00 0.00 N ATOM 916 CA GLU A 59 7.643 9.803 9.147 1.00 0.00 C ATOM 917 C GLU A 59 8.805 9.411 8.241 1.00 0.00 C ATOM 918 O GLU A 59 9.972 9.619 8.585 1.00 0.00 O ATOM 919 CB GLU A 59 7.087 8.573 9.874 1.00 0.00 C ATOM 920 CG GLU A 59 8.068 7.911 10.825 1.00 0.00 C ATOM 921 CD GLU A 59 7.461 6.722 11.540 1.00 0.00 C ATOM 922 OE1 GLU A 59 6.821 6.920 12.594 1.00 0.00 O ATOM 923 OE2 GLU A 59 7.612 5.585 11.052 1.00 0.00 O ATOM 0 H GLU A 59 5.821 9.798 8.129 1.00 0.00 H new ATOM 0 HA GLU A 59 8.016 10.514 9.884 1.00 0.00 H new ATOM 0 HB2 GLU A 59 6.199 8.867 10.434 1.00 0.00 H new ATOM 0 HB3 GLU A 59 6.768 7.841 9.132 1.00 0.00 H new ATOM 0 HG2 GLU A 59 8.948 7.587 10.269 1.00 0.00 H new ATOM 0 HG3 GLU A 59 8.406 8.641 11.561 1.00 0.00 H new ATOM 930 N LEU A 60 8.485 8.858 7.075 1.00 0.00 N ATOM 931 CA LEU A 60 9.510 8.400 6.147 1.00 0.00 C ATOM 932 C LEU A 60 9.206 8.830 4.709 1.00 0.00 C ATOM 933 O LEU A 60 8.651 8.065 3.908 1.00 0.00 O ATOM 934 CB LEU A 60 9.641 6.884 6.242 1.00 0.00 C ATOM 935 CG LEU A 60 10.114 6.366 7.601 1.00 0.00 C ATOM 936 CD1 LEU A 60 9.929 4.866 7.692 1.00 0.00 C ATOM 937 CD2 LEU A 60 11.571 6.735 7.834 1.00 0.00 C ATOM 0 H LEU A 60 7.528 8.717 6.752 1.00 0.00 H new ATOM 0 HA LEU A 60 10.457 8.863 6.425 1.00 0.00 H new ATOM 0 HB2 LEU A 60 8.674 6.435 6.014 1.00 0.00 H new ATOM 0 HB3 LEU A 60 10.339 6.545 5.476 1.00 0.00 H new ATOM 0 HG LEU A 60 9.509 6.836 8.377 1.00 0.00 H new ATOM 0 HD11 LEU A 60 10.271 4.516 8.666 1.00 0.00 H new ATOM 0 HD12 LEU A 60 8.874 4.621 7.568 1.00 0.00 H new ATOM 0 HD13 LEU A 60 10.509 4.380 6.907 1.00 0.00 H new ATOM 0 HD21 LEU A 60 11.891 6.359 8.806 1.00 0.00 H new ATOM 0 HD22 LEU A 60 12.188 6.292 7.052 1.00 0.00 H new ATOM 0 HD23 LEU A 60 11.680 7.819 7.811 1.00 0.00 H new ATOM 949 N GLY A 61 9.596 10.056 4.385 1.00 0.00 N ATOM 950 CA GLY A 61 9.345 10.596 3.065 1.00 0.00 C ATOM 951 C GLY A 61 10.265 10.013 2.015 1.00 0.00 C ATOM 952 O GLY A 61 9.864 9.824 0.867 1.00 0.00 O ATOM 0 H GLY A 61 10.085 10.689 5.018 1.00 0.00 H new ATOM 0 HA2 GLY A 61 8.310 10.399 2.786 1.00 0.00 H new ATOM 0 HA3 GLY A 61 9.468 11.679 3.090 1.00 0.00 H new ATOM 956 N ASP A 62 11.498 9.710 2.410 1.00 0.00 N ATOM 957 CA ASP A 62 12.479 9.140 1.491 1.00 0.00 C ATOM 958 C ASP A 62 12.049 7.750 1.057 1.00 0.00 C ATOM 959 O ASP A 62 12.303 7.330 -0.070 1.00 0.00 O ATOM 960 CB ASP A 62 13.864 9.094 2.136 1.00 0.00 C ATOM 961 CG ASP A 62 14.926 8.541 1.206 1.00 0.00 C ATOM 962 OD1 ASP A 62 15.391 9.287 0.320 1.00 0.00 O ATOM 963 OD2 ASP A 62 15.305 7.360 1.358 1.00 0.00 O ATOM 0 H ASP A 62 11.842 9.849 3.360 1.00 0.00 H new ATOM 0 HA ASP A 62 12.535 9.779 0.610 1.00 0.00 H new ATOM 0 HB2 ASP A 62 14.148 10.099 2.448 1.00 0.00 H new ATOM 0 HB3 ASP A 62 13.821 8.481 3.036 1.00 0.00 H new ATOM 968 N VAL A 63 11.376 7.052 1.956 1.00 0.00 N ATOM 969 CA VAL A 63 10.789 5.761 1.636 1.00 0.00 C ATOM 970 C VAL A 63 9.719 5.929 0.574 1.00 0.00 C ATOM 971 O VAL A 63 9.749 5.245 -0.438 1.00 0.00 O ATOM 972 CB VAL A 63 10.171 5.083 2.869 1.00 0.00 C ATOM 973 CG1 VAL A 63 9.451 3.805 2.470 1.00 0.00 C ATOM 974 CG2 VAL A 63 11.229 4.769 3.911 1.00 0.00 C ATOM 0 H VAL A 63 11.222 7.359 2.917 1.00 0.00 H new ATOM 0 HA VAL A 63 11.593 5.124 1.268 1.00 0.00 H new ATOM 0 HB VAL A 63 9.453 5.779 3.303 1.00 0.00 H new ATOM 0 HG11 VAL A 63 9.020 3.339 3.356 1.00 0.00 H new ATOM 0 HG12 VAL A 63 8.657 4.041 1.761 1.00 0.00 H new ATOM 0 HG13 VAL A 63 10.159 3.118 2.007 1.00 0.00 H new ATOM 0 HG21 VAL A 63 10.762 4.290 4.771 1.00 0.00 H new ATOM 0 HG22 VAL A 63 11.974 4.098 3.483 1.00 0.00 H new ATOM 0 HG23 VAL A 63 11.713 5.693 4.228 1.00 0.00 H new ATOM 984 N ALA A 64 8.783 6.852 0.797 1.00 0.00 N ATOM 985 CA ALA A 64 7.762 7.147 -0.196 1.00 0.00 C ATOM 986 C ALA A 64 8.395 7.424 -1.557 1.00 0.00 C ATOM 987 O ALA A 64 7.904 6.970 -2.592 1.00 0.00 O ATOM 988 CB ALA A 64 6.924 8.332 0.249 1.00 0.00 C ATOM 0 H ALA A 64 8.715 7.403 1.653 1.00 0.00 H new ATOM 0 HA ALA A 64 7.114 6.276 -0.293 1.00 0.00 H new ATOM 0 HB1 ALA A 64 6.163 8.543 -0.503 1.00 0.00 H new ATOM 0 HB2 ALA A 64 6.441 8.100 1.198 1.00 0.00 H new ATOM 0 HB3 ALA A 64 7.565 9.205 0.371 1.00 0.00 H new ATOM 994 N GLN A 65 9.512 8.132 -1.539 1.00 0.00 N ATOM 995 CA GLN A 65 10.230 8.467 -2.766 1.00 0.00 C ATOM 996 C GLN A 65 10.871 7.222 -3.369 1.00 0.00 C ATOM 997 O GLN A 65 10.979 7.089 -4.588 1.00 0.00 O ATOM 998 CB GLN A 65 11.298 9.519 -2.480 1.00 0.00 C ATOM 999 CG GLN A 65 10.732 10.824 -1.952 1.00 0.00 C ATOM 1000 CD GLN A 65 11.809 11.786 -1.498 1.00 0.00 C ATOM 1001 OE1 GLN A 65 12.929 11.770 -2.007 1.00 0.00 O ATOM 1002 NE2 GLN A 65 11.475 12.633 -0.539 1.00 0.00 N ATOM 0 H GLN A 65 9.945 8.489 -0.687 1.00 0.00 H new ATOM 0 HA GLN A 65 9.516 8.872 -3.483 1.00 0.00 H new ATOM 0 HB2 GLN A 65 12.006 9.119 -1.755 1.00 0.00 H new ATOM 0 HB3 GLN A 65 11.856 9.717 -3.395 1.00 0.00 H new ATOM 0 HG2 GLN A 65 10.133 11.297 -2.730 1.00 0.00 H new ATOM 0 HG3 GLN A 65 10.063 10.614 -1.118 1.00 0.00 H new ATOM 0 HE21 GLN A 65 10.535 12.612 -0.145 1.00 0.00 H new ATOM 0 HE22 GLN A 65 12.158 13.307 -0.194 1.00 0.00 H new ATOM 1011 N LYS A 66 11.275 6.309 -2.499 1.00 0.00 N ATOM 1012 CA LYS A 66 11.863 5.049 -2.887 1.00 0.00 C ATOM 1013 C LYS A 66 10.845 4.177 -3.630 1.00 0.00 C ATOM 1014 O LYS A 66 11.214 3.282 -4.390 1.00 0.00 O ATOM 1015 CB LYS A 66 12.393 4.362 -1.613 1.00 0.00 C ATOM 1016 CG LYS A 66 12.162 2.867 -1.534 1.00 0.00 C ATOM 1017 CD LYS A 66 13.449 2.066 -1.721 1.00 0.00 C ATOM 1018 CE LYS A 66 13.931 2.058 -3.165 1.00 0.00 C ATOM 1019 NZ LYS A 66 13.031 1.269 -4.050 1.00 0.00 N ATOM 0 H LYS A 66 11.200 6.431 -1.489 1.00 0.00 H new ATOM 0 HA LYS A 66 12.689 5.210 -3.580 1.00 0.00 H new ATOM 0 HB2 LYS A 66 13.464 4.551 -1.538 1.00 0.00 H new ATOM 0 HB3 LYS A 66 11.925 4.831 -0.747 1.00 0.00 H new ATOM 0 HG2 LYS A 66 11.722 2.621 -0.568 1.00 0.00 H new ATOM 0 HG3 LYS A 66 11.441 2.573 -2.297 1.00 0.00 H new ATOM 0 HD2 LYS A 66 14.228 2.485 -1.084 1.00 0.00 H new ATOM 0 HD3 LYS A 66 13.285 1.040 -1.391 1.00 0.00 H new ATOM 0 HE2 LYS A 66 13.993 3.082 -3.532 1.00 0.00 H new ATOM 0 HE3 LYS A 66 14.938 1.642 -3.209 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 13.577 0.888 -4.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 12.614 0.484 -3.510 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 12.273 1.883 -4.410 1.00 0.00 H new ATOM 1033 N ASN A 67 9.563 4.466 -3.439 1.00 0.00 N ATOM 1034 CA ASN A 67 8.508 3.631 -3.975 1.00 0.00 C ATOM 1035 C ASN A 67 7.760 4.330 -5.088 1.00 0.00 C ATOM 1036 O ASN A 67 6.919 3.719 -5.743 1.00 0.00 O ATOM 1037 CB ASN A 67 7.513 3.312 -2.888 1.00 0.00 C ATOM 1038 CG ASN A 67 8.158 2.946 -1.584 1.00 0.00 C ATOM 1039 OD1 ASN A 67 9.111 2.173 -1.524 1.00 0.00 O ATOM 1040 ND2 ASN A 67 7.664 3.560 -0.534 1.00 0.00 N ATOM 0 H ASN A 67 9.234 5.276 -2.914 1.00 0.00 H new ATOM 0 HA ASN A 67 8.974 2.726 -4.364 1.00 0.00 H new ATOM 0 HB2 ASN A 67 6.863 4.174 -2.735 1.00 0.00 H new ATOM 0 HB3 ASN A 67 6.878 2.489 -3.216 1.00 0.00 H new ATOM 0 HD21 ASN A 67 8.073 3.405 0.387 1.00 0.00 H new ATOM 0 HD22 ASN A 67 6.871 4.193 -0.639 1.00 0.00 H new ATOM 1047 N GLU A 68 8.054 5.619 -5.265 1.00 0.00 N ATOM 1048 CA GLU A 68 7.415 6.448 -6.286 1.00 0.00 C ATOM 1049 C GLU A 68 6.040 6.933 -5.814 1.00 0.00 C ATOM 1050 O GLU A 68 5.148 7.224 -6.615 1.00 0.00 O ATOM 1051 CB GLU A 68 7.295 5.687 -7.612 1.00 0.00 C ATOM 1052 CG GLU A 68 6.895 6.547 -8.801 1.00 0.00 C ATOM 1053 CD GLU A 68 6.539 5.724 -10.020 1.00 0.00 C ATOM 1054 OE1 GLU A 68 7.461 5.221 -10.695 1.00 0.00 O ATOM 1055 OE2 GLU A 68 5.333 5.579 -10.313 1.00 0.00 O ATOM 0 H GLU A 68 8.744 6.118 -4.703 1.00 0.00 H new ATOM 0 HA GLU A 68 8.045 7.322 -6.452 1.00 0.00 H new ATOM 0 HB2 GLU A 68 8.251 5.210 -7.830 1.00 0.00 H new ATOM 0 HB3 GLU A 68 6.561 4.890 -7.493 1.00 0.00 H new ATOM 0 HG2 GLU A 68 6.043 7.168 -8.525 1.00 0.00 H new ATOM 0 HG3 GLU A 68 7.715 7.222 -9.049 1.00 0.00 H new ATOM 1062 N VAL A 69 5.864 7.022 -4.505 1.00 0.00 N ATOM 1063 CA VAL A 69 4.647 7.591 -3.952 1.00 0.00 C ATOM 1064 C VAL A 69 4.911 8.987 -3.391 1.00 0.00 C ATOM 1065 O VAL A 69 5.582 9.151 -2.373 1.00 0.00 O ATOM 1066 CB VAL A 69 3.977 6.674 -2.885 1.00 0.00 C ATOM 1067 CG1 VAL A 69 4.993 5.949 -2.014 1.00 0.00 C ATOM 1068 CG2 VAL A 69 3.025 7.474 -2.010 1.00 0.00 C ATOM 0 H VAL A 69 6.543 6.710 -3.811 1.00 0.00 H new ATOM 0 HA VAL A 69 3.936 7.672 -4.774 1.00 0.00 H new ATOM 0 HB VAL A 69 3.418 5.917 -3.434 1.00 0.00 H new ATOM 0 HG11 VAL A 69 4.471 5.325 -1.289 1.00 0.00 H new ATOM 0 HG12 VAL A 69 5.629 5.323 -2.641 1.00 0.00 H new ATOM 0 HG13 VAL A 69 5.608 6.679 -1.488 1.00 0.00 H new ATOM 0 HG21 VAL A 69 2.568 6.815 -1.272 1.00 0.00 H new ATOM 0 HG22 VAL A 69 3.577 8.263 -1.499 1.00 0.00 H new ATOM 0 HG23 VAL A 69 2.247 7.918 -2.631 1.00 0.00 H new ATOM 1078 N SER A 70 4.412 9.992 -4.094 1.00 0.00 N ATOM 1079 CA SER A 70 4.531 11.370 -3.647 1.00 0.00 C ATOM 1080 C SER A 70 3.148 11.957 -3.380 1.00 0.00 C ATOM 1081 O SER A 70 2.995 12.899 -2.600 1.00 0.00 O ATOM 1082 CB SER A 70 5.281 12.197 -4.692 1.00 0.00 C ATOM 1083 OG SER A 70 6.539 11.611 -4.992 1.00 0.00 O ATOM 0 H SER A 70 3.919 9.878 -4.980 1.00 0.00 H new ATOM 0 HA SER A 70 5.098 11.396 -2.717 1.00 0.00 H new ATOM 0 HB2 SER A 70 4.684 12.271 -5.601 1.00 0.00 H new ATOM 0 HB3 SER A 70 5.427 13.212 -4.323 1.00 0.00 H new ATOM 0 HG SER A 70 7.001 12.155 -5.664 1.00 0.00 H new ATOM 1089 N ALA A 71 2.142 11.392 -4.034 1.00 0.00 N ATOM 1090 CA ALA A 71 0.763 11.754 -3.759 1.00 0.00 C ATOM 1091 C ALA A 71 0.292 11.026 -2.510 1.00 0.00 C ATOM 1092 O ALA A 71 0.858 9.997 -2.137 1.00 0.00 O ATOM 1093 CB ALA A 71 -0.126 11.421 -4.947 1.00 0.00 C ATOM 0 H ALA A 71 2.257 10.682 -4.757 1.00 0.00 H new ATOM 0 HA ALA A 71 0.700 12.829 -3.590 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -1.155 11.700 -4.721 1.00 0.00 H new ATOM 0 HB2 ALA A 71 0.215 11.973 -5.823 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -0.076 10.351 -5.150 1.00 0.00 H new ATOM 1099 N MET A 72 -0.730 11.549 -1.863 1.00 0.00 N ATOM 1100 CA MET A 72 -1.206 10.962 -0.624 1.00 0.00 C ATOM 1101 C MET A 72 -2.694 11.217 -0.428 1.00 0.00 C ATOM 1102 O MET A 72 -3.184 12.317 -0.685 1.00 0.00 O ATOM 1103 CB MET A 72 -0.408 11.512 0.563 1.00 0.00 C ATOM 1104 CG MET A 72 -0.364 13.032 0.620 1.00 0.00 C ATOM 1105 SD MET A 72 0.652 13.649 1.973 1.00 0.00 S ATOM 1106 CE MET A 72 2.243 12.921 1.575 1.00 0.00 C ATOM 0 H MET A 72 -1.245 12.374 -2.171 1.00 0.00 H new ATOM 0 HA MET A 72 -1.057 9.884 -0.681 1.00 0.00 H new ATOM 0 HB2 MET A 72 -0.844 11.135 1.488 1.00 0.00 H new ATOM 0 HB3 MET A 72 0.611 11.130 0.512 1.00 0.00 H new ATOM 0 HG2 MET A 72 0.024 13.416 -0.324 1.00 0.00 H new ATOM 0 HG3 MET A 72 -1.378 13.417 0.728 1.00 0.00 H new ATOM 0 HE1 MET A 72 3.032 13.461 2.099 1.00 0.00 H new ATOM 0 HE2 MET A 72 2.252 11.876 1.883 1.00 0.00 H new ATOM 0 HE3 MET A 72 2.413 12.984 0.500 1.00 0.00 H new ATOM 1116 N PRO A 73 -3.438 10.196 0.021 1.00 0.00 N ATOM 1117 CA PRO A 73 -2.891 8.855 0.247 1.00 0.00 C ATOM 1118 C PRO A 73 -2.710 8.052 -1.053 1.00 0.00 C ATOM 1119 O PRO A 73 -3.378 8.314 -2.057 1.00 0.00 O ATOM 1120 CB PRO A 73 -3.934 8.205 1.154 1.00 0.00 C ATOM 1121 CG PRO A 73 -5.221 8.902 0.849 1.00 0.00 C ATOM 1122 CD PRO A 73 -4.865 10.289 0.381 1.00 0.00 C ATOM 0 HA PRO A 73 -1.891 8.890 0.679 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -4.011 7.135 0.959 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -3.666 8.319 2.204 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -5.778 8.366 0.081 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -5.857 8.944 1.733 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -5.472 10.589 -0.473 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -5.030 11.028 1.165 1.00 0.00 H new ATOM 1130 N THR A 74 -1.798 7.082 -1.016 1.00 0.00 N ATOM 1131 CA THR A 74 -1.445 6.277 -2.184 1.00 0.00 C ATOM 1132 C THR A 74 -1.370 4.794 -1.834 1.00 0.00 C ATOM 1133 O THR A 74 -0.934 4.412 -0.749 1.00 0.00 O ATOM 1134 CB THR A 74 -0.091 6.737 -2.775 1.00 0.00 C ATOM 1135 OG1 THR A 74 -0.255 7.984 -3.457 1.00 0.00 O ATOM 1136 CG2 THR A 74 0.520 5.703 -3.720 1.00 0.00 C ATOM 0 H THR A 74 -1.282 6.832 -0.173 1.00 0.00 H new ATOM 0 HA THR A 74 -2.230 6.420 -2.927 1.00 0.00 H new ATOM 0 HB THR A 74 0.600 6.857 -1.940 1.00 0.00 H new ATOM 0 HG1 THR A 74 0.368 8.644 -3.087 1.00 0.00 H new ATOM 0 HG21 THR A 74 1.468 6.078 -4.105 1.00 0.00 H new ATOM 0 HG22 THR A 74 0.690 4.772 -3.179 1.00 0.00 H new ATOM 0 HG23 THR A 74 -0.162 5.521 -4.550 1.00 0.00 H new ATOM 1144 N LEU A 75 -1.812 3.971 -2.766 1.00 0.00 N ATOM 1145 CA LEU A 75 -1.755 2.533 -2.626 1.00 0.00 C ATOM 1146 C LEU A 75 -0.800 1.952 -3.661 1.00 0.00 C ATOM 1147 O LEU A 75 -0.911 2.258 -4.850 1.00 0.00 O ATOM 1148 CB LEU A 75 -3.136 1.931 -2.843 1.00 0.00 C ATOM 1149 CG LEU A 75 -4.256 2.478 -1.964 1.00 0.00 C ATOM 1150 CD1 LEU A 75 -5.023 3.595 -2.667 1.00 0.00 C ATOM 1151 CD2 LEU A 75 -5.187 1.352 -1.585 1.00 0.00 C ATOM 0 H LEU A 75 -2.222 4.286 -3.645 1.00 0.00 H new ATOM 0 HA LEU A 75 -1.405 2.295 -1.621 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -3.415 2.081 -3.886 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -3.069 0.855 -2.683 1.00 0.00 H new ATOM 0 HG LEU A 75 -3.815 2.905 -1.064 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -5.814 3.962 -2.012 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -4.341 4.411 -2.904 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -5.463 3.211 -3.587 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -5.989 1.739 -0.957 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -5.613 0.913 -2.487 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -4.632 0.590 -1.037 1.00 0.00 H new ATOM 1163 N LEU A 76 0.128 1.122 -3.224 1.00 0.00 N ATOM 1164 CA LEU A 76 1.061 0.481 -4.138 1.00 0.00 C ATOM 1165 C LEU A 76 0.977 -1.034 -4.029 1.00 0.00 C ATOM 1166 O LEU A 76 1.238 -1.613 -2.976 1.00 0.00 O ATOM 1167 CB LEU A 76 2.489 0.966 -3.874 1.00 0.00 C ATOM 1168 CG LEU A 76 3.051 1.914 -4.940 1.00 0.00 C ATOM 1169 CD1 LEU A 76 4.373 2.516 -4.487 1.00 0.00 C ATOM 1170 CD2 LEU A 76 3.234 1.176 -6.256 1.00 0.00 C ATOM 0 H LEU A 76 0.258 0.874 -2.243 1.00 0.00 H new ATOM 0 HA LEU A 76 0.786 0.759 -5.155 1.00 0.00 H new ATOM 0 HB2 LEU A 76 2.514 1.471 -2.908 1.00 0.00 H new ATOM 0 HB3 LEU A 76 3.144 0.098 -3.797 1.00 0.00 H new ATOM 0 HG LEU A 76 2.338 2.725 -5.086 1.00 0.00 H new ATOM 0 HD11 LEU A 76 4.752 3.185 -5.260 1.00 0.00 H new ATOM 0 HD12 LEU A 76 4.220 3.077 -3.565 1.00 0.00 H new ATOM 0 HD13 LEU A 76 5.095 1.718 -4.312 1.00 0.00 H new ATOM 0 HD21 LEU A 76 3.634 1.860 -7.004 1.00 0.00 H new ATOM 0 HD22 LEU A 76 3.928 0.347 -6.115 1.00 0.00 H new ATOM 0 HD23 LEU A 76 2.272 0.790 -6.594 1.00 0.00 H new ATOM 1182 N LEU A 77 0.583 -1.660 -5.128 1.00 0.00 N ATOM 1183 CA LEU A 77 0.479 -3.106 -5.211 1.00 0.00 C ATOM 1184 C LEU A 77 1.698 -3.652 -5.941 1.00 0.00 C ATOM 1185 O LEU A 77 2.037 -3.183 -7.031 1.00 0.00 O ATOM 1186 CB LEU A 77 -0.775 -3.528 -5.995 1.00 0.00 C ATOM 1187 CG LEU A 77 -2.154 -3.384 -5.323 1.00 0.00 C ATOM 1188 CD1 LEU A 77 -2.273 -2.108 -4.501 1.00 0.00 C ATOM 1189 CD2 LEU A 77 -3.215 -3.394 -6.407 1.00 0.00 C ATOM 0 H LEU A 77 0.326 -1.177 -5.989 1.00 0.00 H new ATOM 0 HA LEU A 77 0.417 -3.501 -4.197 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -0.796 -2.950 -6.919 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -0.652 -4.574 -6.276 1.00 0.00 H new ATOM 0 HG LEU A 77 -2.287 -4.217 -4.633 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -3.264 -2.057 -4.050 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -1.517 -2.109 -3.716 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -2.124 -1.243 -5.148 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -4.201 -3.293 -5.952 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -3.044 -2.563 -7.091 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -3.164 -4.333 -6.958 1.00 0.00 H new ATOM 1201 N PHE A 78 2.349 -4.636 -5.357 1.00 0.00 N ATOM 1202 CA PHE A 78 3.470 -5.296 -6.009 1.00 0.00 C ATOM 1203 C PHE A 78 3.252 -6.801 -6.010 1.00 0.00 C ATOM 1204 O PHE A 78 2.424 -7.306 -5.249 1.00 0.00 O ATOM 1205 CB PHE A 78 4.786 -4.975 -5.296 1.00 0.00 C ATOM 1206 CG PHE A 78 5.294 -3.580 -5.534 1.00 0.00 C ATOM 1207 CD1 PHE A 78 4.769 -2.504 -4.842 1.00 0.00 C ATOM 1208 CD2 PHE A 78 6.311 -3.351 -6.444 1.00 0.00 C ATOM 1209 CE1 PHE A 78 5.249 -1.230 -5.055 1.00 0.00 C ATOM 1210 CE2 PHE A 78 6.793 -2.077 -6.663 1.00 0.00 C ATOM 1211 CZ PHE A 78 6.260 -1.014 -5.967 1.00 0.00 C ATOM 0 H PHE A 78 2.124 -5.000 -4.431 1.00 0.00 H new ATOM 0 HA PHE A 78 3.531 -4.930 -7.034 1.00 0.00 H new ATOM 0 HB2 PHE A 78 4.650 -5.122 -4.224 1.00 0.00 H new ATOM 0 HB3 PHE A 78 5.545 -5.686 -5.622 1.00 0.00 H new ATOM 0 HD1 PHE A 78 3.975 -2.664 -4.128 1.00 0.00 H new ATOM 0 HD2 PHE A 78 6.733 -4.181 -6.990 1.00 0.00 H new ATOM 0 HE1 PHE A 78 4.832 -0.399 -4.506 1.00 0.00 H new ATOM 0 HE2 PHE A 78 7.586 -1.913 -7.378 1.00 0.00 H new ATOM 0 HZ PHE A 78 6.633 -0.015 -6.135 1.00 0.00 H new ATOM 1221 N LYS A 79 3.959 -7.518 -6.872 1.00 0.00 N ATOM 1222 CA LYS A 79 3.999 -8.968 -6.762 1.00 0.00 C ATOM 1223 C LYS A 79 5.375 -9.477 -7.129 1.00 0.00 C ATOM 1224 O LYS A 79 5.811 -9.317 -8.267 1.00 0.00 O ATOM 1225 CB LYS A 79 2.961 -9.647 -7.659 1.00 0.00 C ATOM 1226 CG LYS A 79 2.596 -11.048 -7.186 1.00 0.00 C ATOM 1227 CD LYS A 79 1.329 -11.591 -7.844 1.00 0.00 C ATOM 1228 CE LYS A 79 1.481 -11.805 -9.345 1.00 0.00 C ATOM 1229 NZ LYS A 79 1.101 -10.602 -10.132 1.00 0.00 N ATOM 0 H LYS A 79 4.503 -7.128 -7.642 1.00 0.00 H new ATOM 0 HA LYS A 79 3.765 -9.216 -5.727 1.00 0.00 H new ATOM 0 HB2 LYS A 79 2.060 -9.034 -7.693 1.00 0.00 H new ATOM 0 HB3 LYS A 79 3.348 -9.702 -8.677 1.00 0.00 H new ATOM 0 HG2 LYS A 79 3.425 -11.723 -7.396 1.00 0.00 H new ATOM 0 HG3 LYS A 79 2.460 -11.036 -6.105 1.00 0.00 H new ATOM 0 HD2 LYS A 79 1.059 -12.536 -7.374 1.00 0.00 H new ATOM 0 HD3 LYS A 79 0.507 -10.898 -7.663 1.00 0.00 H new ATOM 0 HE2 LYS A 79 2.514 -12.070 -9.568 1.00 0.00 H new ATOM 0 HE3 LYS A 79 0.862 -12.648 -9.653 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 0.860 -10.885 -11.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 0.278 -10.144 -9.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 1.899 -9.935 -10.153 1.00 0.00 H new ATOM 1243 N ASN A 80 6.062 -10.068 -6.161 1.00 0.00 N ATOM 1244 CA ASN A 80 7.324 -10.743 -6.425 1.00 0.00 C ATOM 1245 C ASN A 80 8.395 -9.751 -6.907 1.00 0.00 C ATOM 1246 O ASN A 80 8.946 -9.873 -8.002 1.00 0.00 O ATOM 1247 CB ASN A 80 7.062 -11.870 -7.433 1.00 0.00 C ATOM 1248 CG ASN A 80 8.296 -12.594 -7.919 1.00 0.00 C ATOM 1249 OD1 ASN A 80 9.298 -12.720 -7.214 1.00 0.00 O ATOM 1250 ND2 ASN A 80 8.211 -13.075 -9.146 1.00 0.00 N ATOM 0 H ASN A 80 5.766 -10.093 -5.185 1.00 0.00 H new ATOM 0 HA ASN A 80 7.721 -11.179 -5.508 1.00 0.00 H new ATOM 0 HB2 ASN A 80 6.390 -12.596 -6.976 1.00 0.00 H new ATOM 0 HB3 ASN A 80 6.542 -11.452 -8.295 1.00 0.00 H new ATOM 0 HD21 ASN A 80 8.999 -13.579 -9.552 1.00 0.00 H new ATOM 0 HD22 ASN A 80 7.357 -12.943 -9.688 1.00 0.00 H new ATOM 1257 N GLY A 81 8.629 -8.723 -6.095 1.00 0.00 N ATOM 1258 CA GLY A 81 9.724 -7.792 -6.339 1.00 0.00 C ATOM 1259 C GLY A 81 9.468 -6.849 -7.496 1.00 0.00 C ATOM 1260 O GLY A 81 10.323 -6.034 -7.841 1.00 0.00 O ATOM 0 H GLY A 81 8.075 -8.515 -5.264 1.00 0.00 H new ATOM 0 HA2 GLY A 81 9.901 -7.207 -5.436 1.00 0.00 H new ATOM 0 HA3 GLY A 81 10.634 -8.358 -6.536 1.00 0.00 H new ATOM 1264 N LYS A 82 8.294 -6.945 -8.091 1.00 0.00 N ATOM 1265 CA LYS A 82 7.927 -6.076 -9.180 1.00 0.00 C ATOM 1266 C LYS A 82 6.529 -5.550 -8.935 1.00 0.00 C ATOM 1267 O LYS A 82 5.794 -6.114 -8.131 1.00 0.00 O ATOM 1268 CB LYS A 82 8.013 -6.828 -10.507 1.00 0.00 C ATOM 1269 CG LYS A 82 6.984 -7.938 -10.657 1.00 0.00 C ATOM 1270 CD LYS A 82 7.212 -8.751 -11.922 1.00 0.00 C ATOM 1271 CE LYS A 82 8.542 -9.493 -11.889 1.00 0.00 C ATOM 1272 NZ LYS A 82 8.631 -10.446 -10.748 1.00 0.00 N ATOM 0 H LYS A 82 7.577 -7.623 -7.832 1.00 0.00 H new ATOM 0 HA LYS A 82 8.617 -5.234 -9.235 1.00 0.00 H new ATOM 0 HB2 LYS A 82 7.888 -6.118 -11.324 1.00 0.00 H new ATOM 0 HB3 LYS A 82 9.011 -7.256 -10.607 1.00 0.00 H new ATOM 0 HG2 LYS A 82 7.029 -8.596 -9.789 1.00 0.00 H new ATOM 0 HG3 LYS A 82 5.983 -7.506 -10.678 1.00 0.00 H new ATOM 0 HD2 LYS A 82 6.400 -9.467 -12.044 1.00 0.00 H new ATOM 0 HD3 LYS A 82 7.187 -8.090 -12.788 1.00 0.00 H new ATOM 0 HE2 LYS A 82 8.675 -10.037 -12.824 1.00 0.00 H new ATOM 0 HE3 LYS A 82 9.356 -8.771 -11.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 9.444 -11.079 -10.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 8.752 -9.916 -9.862 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 7.758 -11.010 -10.698 1.00 0.00 H new ATOM 1286 N GLU A 83 6.176 -4.468 -9.597 1.00 0.00 N ATOM 1287 CA GLU A 83 4.882 -3.836 -9.404 1.00 0.00 C ATOM 1288 C GLU A 83 3.751 -4.759 -9.863 1.00 0.00 C ATOM 1289 O GLU A 83 3.987 -5.895 -10.279 1.00 0.00 O ATOM 1290 CB GLU A 83 4.854 -2.527 -10.201 1.00 0.00 C ATOM 1291 CG GLU A 83 3.706 -1.592 -9.852 1.00 0.00 C ATOM 1292 CD GLU A 83 3.767 -0.300 -10.639 1.00 0.00 C ATOM 1293 OE1 GLU A 83 4.742 0.465 -10.472 1.00 0.00 O ATOM 1294 OE2 GLU A 83 2.851 -0.054 -11.450 1.00 0.00 O ATOM 0 H GLU A 83 6.772 -4.002 -10.281 1.00 0.00 H new ATOM 0 HA GLU A 83 4.734 -3.631 -8.344 1.00 0.00 H new ATOM 0 HB2 GLU A 83 5.795 -2.000 -10.041 1.00 0.00 H new ATOM 0 HB3 GLU A 83 4.799 -2.766 -11.263 1.00 0.00 H new ATOM 0 HG2 GLU A 83 2.758 -2.092 -10.050 1.00 0.00 H new ATOM 0 HG3 GLU A 83 3.732 -1.368 -8.786 1.00 0.00 H new ATOM 1301 N VAL A 84 2.527 -4.291 -9.682 1.00 0.00 N ATOM 1302 CA VAL A 84 1.370 -4.805 -10.397 1.00 0.00 C ATOM 1303 C VAL A 84 0.360 -3.687 -10.592 1.00 0.00 C ATOM 1304 O VAL A 84 -0.285 -3.599 -11.635 1.00 0.00 O ATOM 1305 CB VAL A 84 0.684 -6.007 -9.717 1.00 0.00 C ATOM 1306 CG1 VAL A 84 1.380 -7.311 -10.065 1.00 0.00 C ATOM 1307 CG2 VAL A 84 0.645 -5.816 -8.224 1.00 0.00 C ATOM 0 H VAL A 84 2.307 -3.538 -9.030 1.00 0.00 H new ATOM 0 HA VAL A 84 1.743 -5.173 -11.353 1.00 0.00 H new ATOM 0 HB VAL A 84 -0.338 -6.062 -10.091 1.00 0.00 H new ATOM 0 HG11 VAL A 84 0.872 -8.138 -9.570 1.00 0.00 H new ATOM 0 HG12 VAL A 84 1.352 -7.462 -11.144 1.00 0.00 H new ATOM 0 HG13 VAL A 84 2.417 -7.270 -9.731 1.00 0.00 H new ATOM 0 HG21 VAL A 84 0.158 -6.673 -7.760 1.00 0.00 H new ATOM 0 HG22 VAL A 84 1.662 -5.726 -7.842 1.00 0.00 H new ATOM 0 HG23 VAL A 84 0.087 -4.910 -7.988 1.00 0.00 H new ATOM 1317 N ALA A 85 0.257 -2.800 -9.602 1.00 0.00 N ATOM 1318 CA ALA A 85 -0.666 -1.680 -9.686 1.00 0.00 C ATOM 1319 C ALA A 85 -0.325 -0.598 -8.670 1.00 0.00 C ATOM 1320 O ALA A 85 0.267 -0.871 -7.634 1.00 0.00 O ATOM 1321 CB ALA A 85 -2.099 -2.160 -9.507 1.00 0.00 C ATOM 0 H ALA A 85 0.800 -2.839 -8.739 1.00 0.00 H new ATOM 0 HA ALA A 85 -0.569 -1.238 -10.678 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -2.778 -1.310 -9.572 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -2.342 -2.880 -10.289 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -2.205 -2.635 -8.531 1.00 0.00 H new ATOM 1327 N LYS A 86 -0.690 0.636 -8.991 1.00 0.00 N ATOM 1328 CA LYS A 86 -0.469 1.769 -8.103 1.00 0.00 C ATOM 1329 C LYS A 86 -1.582 2.793 -8.272 1.00 0.00 C ATOM 1330 O LYS A 86 -1.889 3.209 -9.389 1.00 0.00 O ATOM 1331 CB LYS A 86 0.900 2.405 -8.367 1.00 0.00 C ATOM 1332 CG LYS A 86 1.189 2.697 -9.831 1.00 0.00 C ATOM 1333 CD LYS A 86 2.642 3.097 -10.025 1.00 0.00 C ATOM 1334 CE LYS A 86 2.976 3.322 -11.488 1.00 0.00 C ATOM 1335 NZ LYS A 86 4.439 3.491 -11.695 1.00 0.00 N ATOM 0 H LYS A 86 -1.146 0.879 -9.871 1.00 0.00 H new ATOM 0 HA LYS A 86 -0.481 1.412 -7.073 1.00 0.00 H new ATOM 0 HB2 LYS A 86 0.969 3.336 -7.804 1.00 0.00 H new ATOM 0 HB3 LYS A 86 1.675 1.742 -7.982 1.00 0.00 H new ATOM 0 HG2 LYS A 86 0.966 1.816 -10.433 1.00 0.00 H new ATOM 0 HG3 LYS A 86 0.537 3.497 -10.183 1.00 0.00 H new ATOM 0 HD2 LYS A 86 2.846 4.008 -9.462 1.00 0.00 H new ATOM 0 HD3 LYS A 86 3.290 2.320 -9.620 1.00 0.00 H new ATOM 0 HE2 LYS A 86 2.620 2.477 -12.077 1.00 0.00 H new ATOM 0 HE3 LYS A 86 2.452 4.207 -11.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 4.608 3.967 -12.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 4.835 4.066 -10.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 4.899 2.558 -11.702 1.00 0.00 H new ATOM 1349 N VAL A 87 -2.204 3.173 -7.165 1.00 0.00 N ATOM 1350 CA VAL A 87 -3.362 4.057 -7.204 1.00 0.00 C ATOM 1351 C VAL A 87 -3.207 5.173 -6.185 1.00 0.00 C ATOM 1352 O VAL A 87 -2.840 4.930 -5.040 1.00 0.00 O ATOM 1353 CB VAL A 87 -4.675 3.289 -6.931 1.00 0.00 C ATOM 1354 CG1 VAL A 87 -5.875 4.218 -7.033 1.00 0.00 C ATOM 1355 CG2 VAL A 87 -4.824 2.117 -7.892 1.00 0.00 C ATOM 0 H VAL A 87 -1.926 2.883 -6.227 1.00 0.00 H new ATOM 0 HA VAL A 87 -3.416 4.480 -8.207 1.00 0.00 H new ATOM 0 HB VAL A 87 -4.632 2.896 -5.915 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -6.788 3.656 -6.837 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -5.778 5.019 -6.301 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -5.920 4.646 -8.035 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -5.755 1.590 -7.682 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -4.840 2.487 -8.917 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -3.984 1.434 -7.766 1.00 0.00 H new ATOM 1365 N VAL A 88 -3.491 6.392 -6.601 1.00 0.00 N ATOM 1366 CA VAL A 88 -3.370 7.538 -5.716 1.00 0.00 C ATOM 1367 C VAL A 88 -4.745 8.002 -5.239 1.00 0.00 C ATOM 1368 O VAL A 88 -5.091 9.180 -5.337 1.00 0.00 O ATOM 1369 CB VAL A 88 -2.614 8.700 -6.403 1.00 0.00 C ATOM 1370 CG1 VAL A 88 -1.147 8.341 -6.582 1.00 0.00 C ATOM 1371 CG2 VAL A 88 -3.238 9.036 -7.752 1.00 0.00 C ATOM 0 H VAL A 88 -3.807 6.616 -7.545 1.00 0.00 H new ATOM 0 HA VAL A 88 -2.790 7.226 -4.847 1.00 0.00 H new ATOM 0 HB VAL A 88 -2.690 9.579 -5.762 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -0.627 9.167 -7.067 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -0.697 8.151 -5.607 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -1.064 7.447 -7.201 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -2.688 9.856 -8.213 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -3.196 8.161 -8.400 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -4.277 9.332 -7.609 1.00 0.00 H new ATOM 1381 N GLY A 89 -5.523 7.068 -4.709 1.00 0.00 N ATOM 1382 CA GLY A 89 -6.854 7.385 -4.249 1.00 0.00 C ATOM 1383 C GLY A 89 -7.587 6.162 -3.743 1.00 0.00 C ATOM 1384 O GLY A 89 -7.622 5.130 -4.412 1.00 0.00 O ATOM 0 H GLY A 89 -5.251 6.092 -4.590 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -6.795 8.127 -3.453 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -7.421 7.836 -5.063 1.00 0.00 H new ATOM 1388 N ALA A 90 -8.144 6.271 -2.548 1.00 0.00 N ATOM 1389 CA ALA A 90 -8.923 5.201 -1.957 1.00 0.00 C ATOM 1390 C ALA A 90 -10.184 4.922 -2.754 1.00 0.00 C ATOM 1391 O ALA A 90 -11.146 5.688 -2.698 1.00 0.00 O ATOM 1392 CB ALA A 90 -9.285 5.565 -0.536 1.00 0.00 C ATOM 0 H ALA A 90 -8.068 7.103 -1.963 1.00 0.00 H new ATOM 0 HA ALA A 90 -8.316 4.296 -1.966 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -9.871 4.760 -0.092 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -8.375 5.714 0.045 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -9.871 6.484 -0.534 1.00 0.00 H new ATOM 1398 N ASN A 91 -10.175 3.846 -3.512 1.00 0.00 N ATOM 1399 CA ASN A 91 -11.359 3.445 -4.244 1.00 0.00 C ATOM 1400 C ASN A 91 -11.834 2.079 -3.761 1.00 0.00 C ATOM 1401 O ASN A 91 -11.442 1.052 -4.311 1.00 0.00 O ATOM 1402 CB ASN A 91 -11.067 3.420 -5.741 1.00 0.00 C ATOM 1403 CG ASN A 91 -12.217 3.982 -6.563 1.00 0.00 C ATOM 1404 OD1 ASN A 91 -12.453 3.558 -7.696 1.00 0.00 O ATOM 1405 ND2 ASN A 91 -12.941 4.946 -6.006 1.00 0.00 N ATOM 0 H ASN A 91 -9.367 3.236 -3.638 1.00 0.00 H new ATOM 0 HA ASN A 91 -12.153 4.169 -4.063 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -10.164 3.996 -5.942 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -10.867 2.395 -6.053 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -13.720 5.359 -6.518 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -12.718 5.273 -5.066 1.00 0.00 H new ATOM 1412 N PRO A 92 -12.696 2.069 -2.728 1.00 0.00 N ATOM 1413 CA PRO A 92 -13.152 0.855 -2.036 1.00 0.00 C ATOM 1414 C PRO A 92 -13.331 -0.377 -2.927 1.00 0.00 C ATOM 1415 O PRO A 92 -12.574 -1.343 -2.821 1.00 0.00 O ATOM 1416 CB PRO A 92 -14.492 1.296 -1.462 1.00 0.00 C ATOM 1417 CG PRO A 92 -14.302 2.739 -1.136 1.00 0.00 C ATOM 1418 CD PRO A 92 -13.286 3.279 -2.114 1.00 0.00 C ATOM 0 HA PRO A 92 -12.413 0.520 -1.308 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -15.298 1.155 -2.182 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -14.753 0.720 -0.574 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -15.244 3.281 -1.219 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -13.954 2.861 -0.110 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -13.754 3.918 -2.863 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -12.529 3.880 -1.611 1.00 0.00 H new ATOM 1426 N ALA A 93 -14.313 -0.335 -3.815 1.00 0.00 N ATOM 1427 CA ALA A 93 -14.690 -1.514 -4.582 1.00 0.00 C ATOM 1428 C ALA A 93 -13.735 -1.779 -5.734 1.00 0.00 C ATOM 1429 O ALA A 93 -13.500 -2.930 -6.101 1.00 0.00 O ATOM 1430 CB ALA A 93 -16.113 -1.377 -5.096 1.00 0.00 C ATOM 0 H ALA A 93 -14.862 0.499 -4.022 1.00 0.00 H new ATOM 0 HA ALA A 93 -14.632 -2.370 -3.910 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -16.381 -2.266 -5.667 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -16.795 -1.268 -4.253 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -16.185 -0.498 -5.737 1.00 0.00 H new ATOM 1436 N ALA A 94 -13.180 -0.721 -6.301 1.00 0.00 N ATOM 1437 CA ALA A 94 -12.281 -0.862 -7.438 1.00 0.00 C ATOM 1438 C ALA A 94 -10.936 -1.407 -7.007 1.00 0.00 C ATOM 1439 O ALA A 94 -10.288 -2.134 -7.755 1.00 0.00 O ATOM 1440 CB ALA A 94 -12.094 0.469 -8.146 1.00 0.00 C ATOM 0 H ALA A 94 -13.334 0.240 -5.996 1.00 0.00 H new ATOM 0 HA ALA A 94 -12.736 -1.570 -8.130 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -11.419 0.340 -8.992 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -13.058 0.830 -8.504 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -11.670 1.194 -7.451 1.00 0.00 H new ATOM 1446 N ILE A 95 -10.519 -1.068 -5.799 1.00 0.00 N ATOM 1447 CA ILE A 95 -9.224 -1.508 -5.320 1.00 0.00 C ATOM 1448 C ILE A 95 -9.343 -2.873 -4.662 1.00 0.00 C ATOM 1449 O ILE A 95 -8.439 -3.695 -4.771 1.00 0.00 O ATOM 1450 CB ILE A 95 -8.571 -0.502 -4.353 1.00 0.00 C ATOM 1451 CG1 ILE A 95 -8.500 0.890 -4.985 1.00 0.00 C ATOM 1452 CG2 ILE A 95 -7.176 -0.974 -3.975 1.00 0.00 C ATOM 1453 CD1 ILE A 95 -7.795 0.918 -6.323 1.00 0.00 C ATOM 0 H ILE A 95 -11.051 -0.498 -5.142 1.00 0.00 H new ATOM 0 HA ILE A 95 -8.571 -1.578 -6.190 1.00 0.00 H new ATOM 0 HB ILE A 95 -9.184 -0.441 -3.454 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -9.512 1.274 -5.110 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -7.986 1.564 -4.300 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -6.722 -0.257 -3.291 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -7.240 -1.948 -3.489 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -6.564 -1.056 -4.873 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -7.785 1.938 -6.708 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -6.771 0.565 -6.202 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -8.321 0.271 -7.025 1.00 0.00 H new ATOM 1465 N LYS A 96 -10.465 -3.130 -4.000 1.00 0.00 N ATOM 1466 CA LYS A 96 -10.754 -4.477 -3.515 1.00 0.00 C ATOM 1467 C LYS A 96 -10.791 -5.439 -4.700 1.00 0.00 C ATOM 1468 O LYS A 96 -10.355 -6.587 -4.610 1.00 0.00 O ATOM 1469 CB LYS A 96 -12.069 -4.500 -2.719 1.00 0.00 C ATOM 1470 CG LYS A 96 -12.739 -5.863 -2.637 1.00 0.00 C ATOM 1471 CD LYS A 96 -14.157 -5.752 -2.102 1.00 0.00 C ATOM 1472 CE LYS A 96 -14.841 -7.106 -2.065 1.00 0.00 C ATOM 1473 NZ LYS A 96 -16.269 -7.002 -1.663 1.00 0.00 N ATOM 0 H LYS A 96 -11.181 -2.435 -3.788 1.00 0.00 H new ATOM 0 HA LYS A 96 -9.966 -4.797 -2.833 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -11.872 -4.146 -1.707 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -12.765 -3.795 -3.173 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -12.756 -6.322 -3.626 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -12.155 -6.519 -1.991 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -14.137 -5.325 -1.099 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -14.732 -5.069 -2.728 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -14.775 -7.572 -3.048 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -14.315 -7.758 -1.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -16.696 -7.950 -1.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -16.333 -6.582 -0.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -16.778 -6.401 -2.342 1.00 0.00 H new ATOM 1487 N GLN A 97 -11.281 -4.940 -5.827 1.00 0.00 N ATOM 1488 CA GLN A 97 -11.240 -5.685 -7.073 1.00 0.00 C ATOM 1489 C GLN A 97 -9.815 -5.729 -7.619 1.00 0.00 C ATOM 1490 O GLN A 97 -9.410 -6.708 -8.244 1.00 0.00 O ATOM 1491 CB GLN A 97 -12.182 -5.049 -8.104 1.00 0.00 C ATOM 1492 CG GLN A 97 -12.116 -5.707 -9.472 1.00 0.00 C ATOM 1493 CD GLN A 97 -12.906 -4.957 -10.523 1.00 0.00 C ATOM 1494 OE1 GLN A 97 -13.921 -4.321 -10.225 1.00 0.00 O ATOM 1495 NE2 GLN A 97 -12.439 -5.015 -11.758 1.00 0.00 N ATOM 0 H GLN A 97 -11.713 -4.019 -5.901 1.00 0.00 H new ATOM 0 HA GLN A 97 -11.571 -6.705 -6.878 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -13.205 -5.104 -7.732 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -11.936 -3.992 -8.206 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -11.075 -5.776 -9.787 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -12.495 -6.726 -9.398 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -11.596 -5.553 -11.960 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -12.921 -4.522 -12.509 1.00 0.00 H new ATOM 1504 N ALA A 98 -9.045 -4.682 -7.350 1.00 0.00 N ATOM 1505 CA ALA A 98 -7.691 -4.591 -7.856 1.00 0.00 C ATOM 1506 C ALA A 98 -6.821 -5.624 -7.179 1.00 0.00 C ATOM 1507 O ALA A 98 -6.176 -6.427 -7.837 1.00 0.00 O ATOM 1508 CB ALA A 98 -7.125 -3.196 -7.651 1.00 0.00 C ATOM 0 H ALA A 98 -9.340 -3.886 -6.784 1.00 0.00 H new ATOM 0 HA ALA A 98 -7.707 -4.788 -8.928 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -6.107 -3.155 -8.040 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -7.744 -2.471 -8.179 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -7.117 -2.960 -6.587 1.00 0.00 H new ATOM 1514 N ILE A 99 -6.838 -5.625 -5.861 1.00 0.00 N ATOM 1515 CA ILE A 99 -6.026 -6.552 -5.090 1.00 0.00 C ATOM 1516 C ILE A 99 -6.302 -7.988 -5.526 1.00 0.00 C ATOM 1517 O ILE A 99 -5.392 -8.811 -5.612 1.00 0.00 O ATOM 1518 CB ILE A 99 -6.277 -6.444 -3.569 1.00 0.00 C ATOM 1519 CG1 ILE A 99 -6.366 -4.988 -3.114 1.00 0.00 C ATOM 1520 CG2 ILE A 99 -5.162 -7.159 -2.842 1.00 0.00 C ATOM 1521 CD1 ILE A 99 -5.338 -4.096 -3.739 1.00 0.00 C ATOM 0 H ILE A 99 -7.407 -4.993 -5.298 1.00 0.00 H new ATOM 0 HA ILE A 99 -4.988 -6.283 -5.284 1.00 0.00 H new ATOM 0 HB ILE A 99 -7.234 -6.910 -3.336 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -7.358 -4.604 -3.349 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -6.257 -4.948 -2.030 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -5.326 -7.091 -1.767 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -5.146 -8.207 -3.141 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -4.208 -6.696 -3.093 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -5.464 -3.079 -3.368 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -4.341 -4.455 -3.483 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -5.459 -4.104 -4.822 1.00 0.00 H new ATOM 1533 N ALA A 100 -7.564 -8.266 -5.830 1.00 0.00 N ATOM 1534 CA ALA A 100 -7.973 -9.590 -6.276 1.00 0.00 C ATOM 1535 C ALA A 100 -7.483 -9.868 -7.695 1.00 0.00 C ATOM 1536 O ALA A 100 -7.178 -11.010 -8.050 1.00 0.00 O ATOM 1537 CB ALA A 100 -9.485 -9.716 -6.205 1.00 0.00 C ATOM 0 H ALA A 100 -8.324 -7.588 -5.775 1.00 0.00 H new ATOM 0 HA ALA A 100 -7.521 -10.329 -5.615 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -9.783 -10.709 -6.540 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -9.815 -9.566 -5.177 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -9.943 -8.964 -6.847 1.00 0.00 H new ATOM 1543 N ALA A 101 -7.408 -8.818 -8.499 1.00 0.00 N ATOM 1544 CA ALA A 101 -6.991 -8.928 -9.892 1.00 0.00 C ATOM 1545 C ALA A 101 -5.482 -9.101 -10.020 1.00 0.00 C ATOM 1546 O ALA A 101 -5.001 -9.948 -10.776 1.00 0.00 O ATOM 1547 CB ALA A 101 -7.428 -7.686 -10.659 1.00 0.00 C ATOM 0 H ALA A 101 -7.634 -7.867 -8.207 1.00 0.00 H new ATOM 0 HA ALA A 101 -7.467 -9.814 -10.312 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -7.115 -7.772 -11.699 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -8.513 -7.593 -10.613 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -6.969 -6.803 -10.214 1.00 0.00 H new ATOM 1553 N ASN A 102 -4.741 -8.306 -9.260 1.00 0.00 N ATOM 1554 CA ASN A 102 -3.288 -8.245 -9.387 1.00 0.00 C ATOM 1555 C ASN A 102 -2.613 -9.421 -8.692 1.00 0.00 C ATOM 1556 O ASN A 102 -1.439 -9.708 -8.942 1.00 0.00 O ATOM 1557 CB ASN A 102 -2.755 -6.922 -8.825 1.00 0.00 C ATOM 1558 CG ASN A 102 -3.332 -5.712 -9.533 1.00 0.00 C ATOM 1559 OD1 ASN A 102 -2.885 -5.333 -10.614 1.00 0.00 O ATOM 1560 ND2 ASN A 102 -4.295 -5.070 -8.896 1.00 0.00 N ATOM 0 H ASN A 102 -5.124 -7.689 -8.543 1.00 0.00 H new ATOM 0 HA ASN A 102 -3.049 -8.303 -10.449 1.00 0.00 H new ATOM 0 HB2 ASN A 102 -2.990 -6.862 -7.762 1.00 0.00 H new ATOM 0 HB3 ASN A 102 -1.669 -6.906 -8.913 1.00 0.00 H new ATOM 0 HD21 ASN A 102 -4.698 -4.224 -9.300 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -4.636 -5.420 -8.001 1.00 0.00 H new ATOM 1567 N ALA A 103 -3.353 -10.093 -7.816 1.00 0.00 N ATOM 1568 CA ALA A 103 -2.840 -11.267 -7.123 1.00 0.00 C ATOM 1569 C ALA A 103 -2.804 -12.469 -8.058 1.00 0.00 C ATOM 1570 O ALA A 103 -3.802 -13.217 -8.109 1.00 0.00 O ATOM 1571 CB ALA A 103 -3.689 -11.573 -5.896 1.00 0.00 C ATOM 1572 OXT ALA A 103 -1.789 -12.650 -8.757 1.00 0.00 O ATOM 0 H ALA A 103 -4.311 -9.843 -7.570 1.00 0.00 H new ATOM 0 HA ALA A 103 -1.822 -11.056 -6.797 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -3.292 -12.453 -5.389 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -3.666 -10.721 -5.216 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -4.717 -11.764 -6.203 1.00 0.00 H new TER 1578 ALA A 103