USER MOD reduce.3.24.130724 H: found=0, std=0, add=934, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 935 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 70 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 133 SER OG : rot -122:sc= -0.567 USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 TYR OH : rot 180:sc= -0.15 USER MOD Single : A 21 THR OG1 : rot 130:sc= -0.0471 USER MOD Single : A 27 THR OG1 : rot 150:sc= 0.0139 USER MOD Single : A 28 SER OG : rot 180:sc= 0.0512 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot -37:sc= -5.62! USER MOD Single : A 42 GLN : amide:sc= -15.1! C(o=-15!,f=-20!) USER MOD Single : A 43 TYR OH : rot -80:sc= -6.39! USER MOD Single : A 50 ASN : amide:sc= -2.42! C(o=-2.4!,f=-5.1!) USER MOD Single : A 58 THR OG1 : rot 104:sc= 0.0376 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0.0145 USER MOD Single : A 60 TYR OH : rot 50:sc= -1.94! USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 TYR OH : rot 180:sc= -0.306 USER MOD Single : A 65 THR OG1 : rot 153:sc= -3.17! USER MOD Single : A 67 THR OG1 : rot 142:sc= -2.4! USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 GLN : amide:sc= -11.2! C(o=-11!,f=-12!) USER MOD Single : A 81 ASN : amide:sc= -2.88! C(o=-2.9!,f=-2.8!) USER MOD Single : A 85 TYR OH : rot 74:sc= 0.356 USER MOD Single : A 87 THR OG1 : rot 180:sc= 0.0784 USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 35:sc= 0.24 USER MOD Single : A 96 THR OG1 : rot 35:sc= 1.25 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 101 GLN :FLIP amide:sc= 0 F(o=-0.61,f=0) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 65:sc= -0.0409 USER MOD Single : A 111 THR OG1 : rot 180:sc= -0.98 USER MOD Single : A 112 TYR OH : rot 16:sc= -2.85! USER MOD Single : A 124 GLN :FLIP amide:sc= -2.67 F(o=-5.1!,f=-2.7) USER MOD Single : A 128 GLN : amide:sc= 0 X(o=0,f=-0.0043) USER MOD Single : A 138 THR OG1 : rot -79:sc= 0.237 USER MOD Single : A 148 SER OG : rot -20:sc= 0.88 USER MOD ----------------------------------------------------------------- ATOM 24 N PRO A 3 -8.017 5.372 9.148 1.00 0.00 N ATOM 25 CA PRO A 3 -6.895 6.171 9.699 1.00 0.00 C ATOM 26 C PRO A 3 -5.553 5.509 9.370 1.00 0.00 C ATOM 27 O PRO A 3 -4.951 4.860 10.202 1.00 0.00 O ATOM 28 CB PRO A 3 -7.151 6.156 11.203 1.00 0.00 C ATOM 29 CG PRO A 3 -7.959 4.921 11.448 1.00 0.00 C ATOM 30 CD PRO A 3 -8.752 4.654 10.194 1.00 0.00 C ATOM 0 HA PRO A 3 -6.845 7.179 9.288 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -6.216 6.133 11.762 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -7.690 7.049 11.520 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -7.311 4.076 11.681 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -8.623 5.058 12.302 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -8.811 3.587 9.979 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -9.775 5.018 10.284 1.00 0.00 H new ATOM 38 N ILE A 4 -5.080 5.670 8.165 1.00 0.00 N ATOM 39 CA ILE A 4 -3.777 5.052 7.788 1.00 0.00 C ATOM 40 C ILE A 4 -2.701 6.132 7.661 1.00 0.00 C ATOM 41 O ILE A 4 -1.783 6.019 6.873 1.00 0.00 O ATOM 42 CB ILE A 4 -4.030 4.385 6.435 1.00 0.00 C ATOM 43 CG1 ILE A 4 -4.339 5.457 5.385 1.00 0.00 C ATOM 44 CG2 ILE A 4 -5.220 3.432 6.551 1.00 0.00 C ATOM 45 CD1 ILE A 4 -3.867 4.978 4.011 1.00 0.00 C ATOM 0 H ILE A 4 -5.539 6.202 7.426 1.00 0.00 H new ATOM 0 HA ILE A 4 -3.426 4.338 8.533 1.00 0.00 H new ATOM 0 HB ILE A 4 -3.143 3.827 6.135 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -5.410 5.661 5.363 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -3.842 6.391 5.647 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -5.401 2.956 5.587 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -5.003 2.668 7.297 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -6.106 3.991 6.851 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -4.087 5.741 3.264 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -2.793 4.796 4.038 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -4.385 4.055 3.750 1.00 0.00 H new ATOM 57 N GLY A 5 -2.811 7.184 8.425 1.00 0.00 N ATOM 58 CA GLY A 5 -1.800 8.274 8.340 1.00 0.00 C ATOM 59 C GLY A 5 -2.132 9.173 7.150 1.00 0.00 C ATOM 60 O GLY A 5 -3.187 9.067 6.557 1.00 0.00 O ATOM 0 H GLY A 5 -3.557 7.335 9.104 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -1.797 8.856 9.261 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -0.801 7.852 8.226 1.00 0.00 H new ATOM 64 N GLU A 6 -1.243 10.058 6.791 1.00 0.00 N ATOM 65 CA GLU A 6 -1.519 10.958 5.635 1.00 0.00 C ATOM 66 C GLU A 6 -0.380 11.966 5.461 1.00 0.00 C ATOM 67 O GLU A 6 -0.563 13.155 5.625 1.00 0.00 O ATOM 68 CB GLU A 6 -2.820 11.679 5.994 1.00 0.00 C ATOM 69 CG GLU A 6 -2.756 12.157 7.446 1.00 0.00 C ATOM 70 CD GLU A 6 -3.990 13.005 7.759 1.00 0.00 C ATOM 71 OE1 GLU A 6 -5.050 12.685 7.246 1.00 0.00 O ATOM 72 OE2 GLU A 6 -3.855 13.961 8.505 1.00 0.00 O ATOM 0 H GLU A 6 -0.341 10.197 7.246 1.00 0.00 H new ATOM 0 HA GLU A 6 -1.602 10.408 4.698 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -2.974 12.528 5.327 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -3.669 11.009 5.858 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -2.709 11.302 8.120 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -1.850 12.741 7.608 1.00 0.00 H new ATOM 79 N GLY A 7 0.793 11.502 5.127 1.00 0.00 N ATOM 80 CA GLY A 7 1.932 12.442 4.941 1.00 0.00 C ATOM 81 C GLY A 7 3.252 11.670 4.937 1.00 0.00 C ATOM 82 O GLY A 7 3.954 11.634 3.947 1.00 0.00 O ATOM 0 H GLY A 7 1.011 10.517 4.976 1.00 0.00 H new ATOM 0 HA2 GLY A 7 1.816 12.986 4.003 1.00 0.00 H new ATOM 0 HA3 GLY A 7 1.937 13.183 5.740 1.00 0.00 H new ATOM 86 N THR A 8 3.599 11.057 6.034 1.00 0.00 N ATOM 87 CA THR A 8 4.880 10.293 6.083 1.00 0.00 C ATOM 88 C THR A 8 4.818 9.222 7.174 1.00 0.00 C ATOM 89 O THR A 8 3.758 8.754 7.540 1.00 0.00 O ATOM 90 CB THR A 8 5.950 11.335 6.414 1.00 0.00 C ATOM 91 OG1 THR A 8 5.636 11.957 7.653 1.00 0.00 O ATOM 92 CG2 THR A 8 5.996 12.390 5.308 1.00 0.00 C ATOM 0 H THR A 8 3.055 11.051 6.896 1.00 0.00 H new ATOM 0 HA THR A 8 5.089 9.777 5.146 1.00 0.00 H new ATOM 0 HB THR A 8 6.922 10.848 6.488 1.00 0.00 H new ATOM 0 HG1 THR A 8 6.322 12.624 7.867 1.00 0.00 H new ATOM 0 HG21 THR A 8 6.759 13.132 5.545 1.00 0.00 H new ATOM 0 HG22 THR A 8 6.237 11.912 4.359 1.00 0.00 H new ATOM 0 HG23 THR A 8 5.025 12.879 5.231 1.00 0.00 H new ATOM 100 N PHE A 9 5.948 8.829 7.694 1.00 0.00 N ATOM 101 CA PHE A 9 5.957 7.787 8.759 1.00 0.00 C ATOM 102 C PHE A 9 6.904 8.194 9.891 1.00 0.00 C ATOM 103 O PHE A 9 7.655 7.389 10.405 1.00 0.00 O ATOM 104 CB PHE A 9 6.462 6.521 8.066 1.00 0.00 C ATOM 105 CG PHE A 9 5.359 5.938 7.215 1.00 0.00 C ATOM 106 CD1 PHE A 9 4.144 5.568 7.804 1.00 0.00 C ATOM 107 CD2 PHE A 9 5.553 5.763 5.840 1.00 0.00 C ATOM 108 CE1 PHE A 9 3.122 5.024 7.017 1.00 0.00 C ATOM 109 CE2 PHE A 9 4.531 5.218 5.053 1.00 0.00 C ATOM 110 CZ PHE A 9 3.316 4.849 5.642 1.00 0.00 C ATOM 0 H PHE A 9 6.866 9.185 7.427 1.00 0.00 H new ATOM 0 HA PHE A 9 4.973 7.644 9.206 1.00 0.00 H new ATOM 0 HB2 PHE A 9 7.329 6.753 7.447 1.00 0.00 H new ATOM 0 HB3 PHE A 9 6.787 5.792 8.809 1.00 0.00 H new ATOM 0 HD1 PHE A 9 3.995 5.702 8.865 1.00 0.00 H new ATOM 0 HD2 PHE A 9 6.491 6.048 5.386 1.00 0.00 H new ATOM 0 HE1 PHE A 9 2.184 4.739 7.471 1.00 0.00 H new ATOM 0 HE2 PHE A 9 4.680 5.082 3.992 1.00 0.00 H new ATOM 0 HZ PHE A 9 2.528 4.429 5.035 1.00 0.00 H new ATOM 120 N ASP A 10 6.876 9.439 10.283 1.00 0.00 N ATOM 121 CA ASP A 10 7.775 9.896 11.381 1.00 0.00 C ATOM 122 C ASP A 10 7.100 9.689 12.739 1.00 0.00 C ATOM 123 O ASP A 10 7.066 10.580 13.563 1.00 0.00 O ATOM 124 CB ASP A 10 8.001 11.384 11.115 1.00 0.00 C ATOM 125 CG ASP A 10 9.253 11.852 11.859 1.00 0.00 C ATOM 126 OD1 ASP A 10 10.121 11.028 12.094 1.00 0.00 O ATOM 127 OD2 ASP A 10 9.322 13.026 12.182 1.00 0.00 O ATOM 0 H ASP A 10 6.270 10.159 9.890 1.00 0.00 H new ATOM 0 HA ASP A 10 8.712 9.340 11.405 1.00 0.00 H new ATOM 0 HB2 ASP A 10 8.114 11.560 10.045 1.00 0.00 H new ATOM 0 HB3 ASP A 10 7.135 11.958 11.443 1.00 0.00 H new ATOM 132 N ASP A 11 6.568 8.515 12.973 1.00 0.00 N ATOM 133 CA ASP A 11 5.885 8.221 14.275 1.00 0.00 C ATOM 134 C ASP A 11 4.983 6.994 14.120 1.00 0.00 C ATOM 135 O ASP A 11 3.786 7.109 13.949 1.00 0.00 O ATOM 136 CB ASP A 11 5.030 9.452 14.600 1.00 0.00 C ATOM 137 CG ASP A 11 4.375 9.982 13.322 1.00 0.00 C ATOM 138 OD1 ASP A 11 3.455 9.340 12.842 1.00 0.00 O ATOM 139 OD2 ASP A 11 4.805 11.019 12.845 1.00 0.00 O ATOM 0 H ASP A 11 6.577 7.738 12.312 1.00 0.00 H new ATOM 0 HA ASP A 11 6.606 8.015 15.066 1.00 0.00 H new ATOM 0 HB2 ASP A 11 4.264 9.191 15.331 1.00 0.00 H new ATOM 0 HB3 ASP A 11 5.650 10.228 15.050 1.00 0.00 H new ATOM 144 N GLY A 12 5.548 5.819 14.177 1.00 0.00 N ATOM 145 CA GLY A 12 4.723 4.588 14.031 1.00 0.00 C ATOM 146 C GLY A 12 4.086 4.567 12.639 1.00 0.00 C ATOM 147 O GLY A 12 3.449 5.520 12.236 1.00 0.00 O ATOM 0 H GLY A 12 6.545 5.659 14.318 1.00 0.00 H new ATOM 0 HA2 GLY A 12 5.342 3.702 14.173 1.00 0.00 H new ATOM 0 HA3 GLY A 12 3.949 4.562 14.798 1.00 0.00 H new ATOM 151 N PRO A 13 4.282 3.476 11.945 1.00 0.00 N ATOM 152 CA PRO A 13 3.720 3.329 10.582 1.00 0.00 C ATOM 153 C PRO A 13 2.244 2.923 10.638 1.00 0.00 C ATOM 154 O PRO A 13 1.801 2.082 9.885 1.00 0.00 O ATOM 155 CB PRO A 13 4.553 2.209 9.974 1.00 0.00 C ATOM 156 CG PRO A 13 5.054 1.405 11.136 1.00 0.00 C ATOM 157 CD PRO A 13 5.042 2.293 12.357 1.00 0.00 C ATOM 0 HA PRO A 13 3.758 4.256 10.009 1.00 0.00 H new ATOM 0 HB2 PRO A 13 3.954 1.595 9.302 1.00 0.00 H new ATOM 0 HB3 PRO A 13 5.380 2.609 9.388 1.00 0.00 H new ATOM 0 HG2 PRO A 13 4.423 0.530 11.295 1.00 0.00 H new ATOM 0 HG3 PRO A 13 6.062 1.040 10.940 1.00 0.00 H new ATOM 0 HD2 PRO A 13 4.572 1.795 13.205 1.00 0.00 H new ATOM 0 HD3 PRO A 13 6.054 2.559 12.664 1.00 0.00 H new ATOM 165 N GLU A 14 1.479 3.507 11.517 1.00 0.00 N ATOM 166 CA GLU A 14 0.036 3.141 11.603 1.00 0.00 C ATOM 167 C GLU A 14 -0.127 1.617 11.597 1.00 0.00 C ATOM 168 O GLU A 14 -0.090 0.978 12.629 1.00 0.00 O ATOM 169 CB GLU A 14 -0.603 3.758 10.358 1.00 0.00 C ATOM 170 CG GLU A 14 -1.165 5.138 10.703 1.00 0.00 C ATOM 171 CD GLU A 14 -2.212 5.002 11.810 1.00 0.00 C ATOM 172 OE1 GLU A 14 -2.490 3.880 12.200 1.00 0.00 O ATOM 173 OE2 GLU A 14 -2.717 6.022 12.248 1.00 0.00 O ATOM 0 H GLU A 14 1.788 4.220 12.178 1.00 0.00 H new ATOM 0 HA GLU A 14 -0.429 3.503 12.520 1.00 0.00 H new ATOM 0 HB2 GLU A 14 0.136 3.843 9.561 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -1.399 3.112 9.987 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -0.361 5.799 11.028 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -1.613 5.591 9.819 1.00 0.00 H new ATOM 180 N GLY A 15 -0.313 1.028 10.445 1.00 0.00 N ATOM 181 CA GLY A 15 -0.484 -0.454 10.388 1.00 0.00 C ATOM 182 C GLY A 15 0.247 -1.032 9.169 1.00 0.00 C ATOM 183 O GLY A 15 0.231 -2.225 8.939 1.00 0.00 O ATOM 0 H GLY A 15 -0.354 1.506 9.545 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -0.096 -0.906 11.301 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -1.544 -0.702 10.335 1.00 0.00 H new ATOM 187 N TRP A 16 0.884 -0.205 8.386 1.00 0.00 N ATOM 188 CA TRP A 16 1.608 -0.719 7.187 1.00 0.00 C ATOM 189 C TRP A 16 2.580 -1.832 7.587 1.00 0.00 C ATOM 190 O TRP A 16 3.736 -1.584 7.868 1.00 0.00 O ATOM 191 CB TRP A 16 2.378 0.486 6.645 1.00 0.00 C ATOM 192 CG TRP A 16 1.516 1.247 5.690 1.00 0.00 C ATOM 193 CD1 TRP A 16 0.849 2.387 5.985 1.00 0.00 C ATOM 194 CD2 TRP A 16 1.220 0.950 4.294 1.00 0.00 C ATOM 195 NE1 TRP A 16 0.163 2.807 4.860 1.00 0.00 N ATOM 196 CE2 TRP A 16 0.359 1.954 3.793 1.00 0.00 C ATOM 197 CE3 TRP A 16 1.611 -0.084 3.424 1.00 0.00 C ATOM 198 CZ2 TRP A 16 -0.099 1.933 2.475 1.00 0.00 C ATOM 199 CZ3 TRP A 16 1.152 -0.108 2.096 1.00 0.00 C ATOM 200 CH2 TRP A 16 0.299 0.899 1.623 1.00 0.00 C ATOM 0 H TRP A 16 0.935 0.804 8.524 1.00 0.00 H new ATOM 0 HA TRP A 16 0.928 -1.141 6.447 1.00 0.00 H new ATOM 0 HB2 TRP A 16 2.686 1.133 7.467 1.00 0.00 H new ATOM 0 HB3 TRP A 16 3.287 0.153 6.144 1.00 0.00 H new ATOM 0 HD1 TRP A 16 0.852 2.887 6.942 1.00 0.00 H new ATOM 0 HE1 TRP A 16 -0.417 3.645 4.823 1.00 0.00 H new ATOM 0 HE3 TRP A 16 2.268 -0.864 3.779 1.00 0.00 H new ATOM 0 HZ2 TRP A 16 -0.757 2.711 2.116 1.00 0.00 H new ATOM 0 HZ3 TRP A 16 1.458 -0.906 1.436 1.00 0.00 H new ATOM 0 HH2 TRP A 16 -0.050 0.876 0.601 1.00 0.00 H new ATOM 211 N VAL A 17 2.130 -3.058 7.608 1.00 0.00 N ATOM 212 CA VAL A 17 3.048 -4.174 7.983 1.00 0.00 C ATOM 213 C VAL A 17 3.776 -4.682 6.736 1.00 0.00 C ATOM 214 O VAL A 17 3.258 -4.622 5.639 1.00 0.00 O ATOM 215 CB VAL A 17 2.159 -5.279 8.589 1.00 0.00 C ATOM 216 CG1 VAL A 17 0.977 -4.656 9.337 1.00 0.00 C ATOM 217 CG2 VAL A 17 1.630 -6.201 7.481 1.00 0.00 C ATOM 0 H VAL A 17 1.174 -3.334 7.384 1.00 0.00 H new ATOM 0 HA VAL A 17 3.807 -3.855 8.697 1.00 0.00 H new ATOM 0 HB VAL A 17 2.761 -5.862 9.287 1.00 0.00 H new ATOM 0 HG11 VAL A 17 0.357 -5.446 9.760 1.00 0.00 H new ATOM 0 HG12 VAL A 17 1.349 -4.018 10.139 1.00 0.00 H new ATOM 0 HG13 VAL A 17 0.382 -4.059 8.645 1.00 0.00 H new ATOM 0 HG21 VAL A 17 1.004 -6.977 7.921 1.00 0.00 H new ATOM 0 HG22 VAL A 17 1.041 -5.618 6.773 1.00 0.00 H new ATOM 0 HG23 VAL A 17 2.469 -6.664 6.961 1.00 0.00 H new ATOM 227 N ALA A 18 4.963 -5.189 6.893 1.00 0.00 N ATOM 228 CA ALA A 18 5.706 -5.705 5.713 1.00 0.00 C ATOM 229 C ALA A 18 6.255 -7.100 6.015 1.00 0.00 C ATOM 230 O ALA A 18 6.400 -7.488 7.157 1.00 0.00 O ATOM 231 CB ALA A 18 6.835 -4.705 5.483 1.00 0.00 C ATOM 0 H ALA A 18 5.451 -5.269 7.785 1.00 0.00 H new ATOM 0 HA ALA A 18 5.076 -5.800 4.829 1.00 0.00 H new ATOM 0 HB1 ALA A 18 7.430 -5.019 4.625 1.00 0.00 H new ATOM 0 HB2 ALA A 18 6.414 -3.718 5.291 1.00 0.00 H new ATOM 0 HB3 ALA A 18 7.469 -4.662 6.368 1.00 0.00 H new ATOM 237 N TYR A 19 6.543 -7.863 4.999 1.00 0.00 N ATOM 238 CA TYR A 19 7.060 -9.241 5.224 1.00 0.00 C ATOM 239 C TYR A 19 7.973 -9.664 4.075 1.00 0.00 C ATOM 240 O TYR A 19 8.013 -9.038 3.034 1.00 0.00 O ATOM 241 CB TYR A 19 5.805 -10.122 5.276 1.00 0.00 C ATOM 242 CG TYR A 19 4.851 -9.716 4.172 1.00 0.00 C ATOM 243 CD1 TYR A 19 4.074 -8.555 4.300 1.00 0.00 C ATOM 244 CD2 TYR A 19 4.749 -10.498 3.016 1.00 0.00 C ATOM 245 CE1 TYR A 19 3.200 -8.182 3.272 1.00 0.00 C ATOM 246 CE2 TYR A 19 3.875 -10.125 1.990 1.00 0.00 C ATOM 247 CZ TYR A 19 3.100 -8.967 2.117 1.00 0.00 C ATOM 248 OH TYR A 19 2.239 -8.598 1.104 1.00 0.00 O ATOM 0 H TYR A 19 6.443 -7.592 4.021 1.00 0.00 H new ATOM 0 HA TYR A 19 7.654 -9.319 6.134 1.00 0.00 H new ATOM 0 HB2 TYR A 19 6.080 -11.171 5.165 1.00 0.00 H new ATOM 0 HB3 TYR A 19 5.318 -10.021 6.246 1.00 0.00 H new ATOM 0 HD1 TYR A 19 4.150 -7.949 5.191 1.00 0.00 H new ATOM 0 HD2 TYR A 19 5.347 -11.392 2.916 1.00 0.00 H new ATOM 0 HE1 TYR A 19 2.602 -7.288 3.370 1.00 0.00 H new ATOM 0 HE2 TYR A 19 3.798 -10.731 1.099 1.00 0.00 H new ATOM 0 HH TYR A 19 2.293 -9.251 0.375 1.00 0.00 H new ATOM 258 N GLY A 20 8.711 -10.721 4.263 1.00 0.00 N ATOM 259 CA GLY A 20 9.632 -11.194 3.195 1.00 0.00 C ATOM 260 C GLY A 20 10.683 -12.112 3.815 1.00 0.00 C ATOM 261 O GLY A 20 10.452 -13.288 4.015 1.00 0.00 O ATOM 0 H GLY A 20 8.715 -11.281 5.116 1.00 0.00 H new ATOM 0 HA2 GLY A 20 9.074 -11.727 2.425 1.00 0.00 H new ATOM 0 HA3 GLY A 20 10.113 -10.345 2.710 1.00 0.00 H new ATOM 265 N THR A 21 11.839 -11.589 4.125 1.00 0.00 N ATOM 266 CA THR A 21 12.899 -12.449 4.736 1.00 0.00 C ATOM 267 C THR A 21 13.865 -11.618 5.588 1.00 0.00 C ATOM 268 O THR A 21 14.956 -12.056 5.893 1.00 0.00 O ATOM 269 CB THR A 21 13.659 -13.065 3.555 1.00 0.00 C ATOM 270 OG1 THR A 21 14.577 -12.112 3.039 1.00 0.00 O ATOM 271 CG2 THR A 21 12.682 -13.477 2.454 1.00 0.00 C ATOM 0 H THR A 21 12.096 -10.612 3.984 1.00 0.00 H new ATOM 0 HA THR A 21 12.460 -13.202 5.391 1.00 0.00 H new ATOM 0 HB THR A 21 14.196 -13.948 3.900 1.00 0.00 H new ATOM 0 HG1 THR A 21 15.463 -12.523 2.957 1.00 0.00 H new ATOM 0 HG21 THR A 21 13.235 -13.913 1.622 1.00 0.00 H new ATOM 0 HG22 THR A 21 11.979 -14.212 2.847 1.00 0.00 H new ATOM 0 HG23 THR A 21 12.134 -12.601 2.107 1.00 0.00 H new ATOM 279 N ASP A 22 13.489 -10.431 5.984 1.00 0.00 N ATOM 280 CA ASP A 22 14.420 -9.618 6.818 1.00 0.00 C ATOM 281 C ASP A 22 13.664 -8.937 7.961 1.00 0.00 C ATOM 282 O ASP A 22 12.468 -9.093 8.107 1.00 0.00 O ATOM 283 CB ASP A 22 15.008 -8.582 5.864 1.00 0.00 C ATOM 284 CG ASP A 22 16.428 -8.995 5.472 1.00 0.00 C ATOM 285 OD1 ASP A 22 17.165 -9.414 6.349 1.00 0.00 O ATOM 286 OD2 ASP A 22 16.754 -8.886 4.301 1.00 0.00 O ATOM 0 H ASP A 22 12.592 -9.995 5.770 1.00 0.00 H new ATOM 0 HA ASP A 22 15.195 -10.230 7.280 1.00 0.00 H new ATOM 0 HB2 ASP A 22 14.384 -8.497 4.974 1.00 0.00 H new ATOM 0 HB3 ASP A 22 15.022 -7.601 6.339 1.00 0.00 H new ATOM 291 N GLY A 23 14.358 -8.188 8.775 1.00 0.00 N ATOM 292 CA GLY A 23 13.690 -7.498 9.915 1.00 0.00 C ATOM 293 C GLY A 23 12.356 -6.911 9.453 1.00 0.00 C ATOM 294 O GLY A 23 12.105 -6.792 8.271 1.00 0.00 O ATOM 0 H GLY A 23 15.362 -8.024 8.699 1.00 0.00 H new ATOM 0 HA2 GLY A 23 13.525 -8.201 10.732 1.00 0.00 H new ATOM 0 HA3 GLY A 23 14.333 -6.706 10.300 1.00 0.00 H new ATOM 298 N PRO A 24 11.543 -6.563 10.412 1.00 0.00 N ATOM 299 CA PRO A 24 10.214 -5.980 10.110 1.00 0.00 C ATOM 300 C PRO A 24 10.365 -4.549 9.588 1.00 0.00 C ATOM 301 O PRO A 24 11.382 -3.912 9.778 1.00 0.00 O ATOM 302 CB PRO A 24 9.501 -5.995 11.459 1.00 0.00 C ATOM 303 CG PRO A 24 10.597 -5.984 12.476 1.00 0.00 C ATOM 304 CD PRO A 24 11.783 -6.677 11.854 1.00 0.00 C ATOM 0 HA PRO A 24 9.670 -6.528 9.341 1.00 0.00 H new ATOM 0 HB2 PRO A 24 8.850 -5.128 11.571 1.00 0.00 H new ATOM 0 HB3 PRO A 24 8.874 -6.880 11.564 1.00 0.00 H new ATOM 0 HG2 PRO A 24 10.851 -4.962 12.758 1.00 0.00 H new ATOM 0 HG3 PRO A 24 10.284 -6.497 13.386 1.00 0.00 H new ATOM 0 HD2 PRO A 24 12.720 -6.200 12.142 1.00 0.00 H new ATOM 0 HD3 PRO A 24 11.846 -7.719 12.167 1.00 0.00 H new ATOM 312 N LEU A 25 9.360 -4.041 8.929 1.00 0.00 N ATOM 313 CA LEU A 25 9.441 -2.653 8.392 1.00 0.00 C ATOM 314 C LEU A 25 10.092 -1.721 9.418 1.00 0.00 C ATOM 315 O LEU A 25 10.000 -1.933 10.610 1.00 0.00 O ATOM 316 CB LEU A 25 7.990 -2.242 8.141 1.00 0.00 C ATOM 317 CG LEU A 25 7.197 -2.349 9.446 1.00 0.00 C ATOM 318 CD1 LEU A 25 6.150 -1.236 9.499 1.00 0.00 C ATOM 319 CD2 LEU A 25 6.498 -3.708 9.507 1.00 0.00 C ATOM 0 H LEU A 25 8.484 -4.528 8.739 1.00 0.00 H new ATOM 0 HA LEU A 25 10.045 -2.597 7.487 1.00 0.00 H new ATOM 0 HB2 LEU A 25 7.950 -1.221 7.761 1.00 0.00 H new ATOM 0 HB3 LEU A 25 7.546 -2.883 7.379 1.00 0.00 H new ATOM 0 HG LEU A 25 7.876 -2.250 10.293 1.00 0.00 H new ATOM 0 HD11 LEU A 25 5.585 -1.312 10.428 1.00 0.00 H new ATOM 0 HD12 LEU A 25 6.647 -0.267 9.454 1.00 0.00 H new ATOM 0 HD13 LEU A 25 5.471 -1.335 8.652 1.00 0.00 H new ATOM 0 HD21 LEU A 25 5.933 -3.785 10.436 1.00 0.00 H new ATOM 0 HD22 LEU A 25 5.819 -3.806 8.660 1.00 0.00 H new ATOM 0 HD23 LEU A 25 7.243 -4.503 9.469 1.00 0.00 H new ATOM 331 N ASP A 26 10.748 -0.689 8.961 1.00 0.00 N ATOM 332 CA ASP A 26 11.403 0.259 9.907 1.00 0.00 C ATOM 333 C ASP A 26 10.903 1.681 9.646 1.00 0.00 C ATOM 334 O ASP A 26 10.774 2.104 8.514 1.00 0.00 O ATOM 335 CB ASP A 26 12.898 0.151 9.607 1.00 0.00 C ATOM 336 CG ASP A 26 13.405 -1.230 10.027 1.00 0.00 C ATOM 337 OD1 ASP A 26 12.906 -1.748 11.013 1.00 0.00 O ATOM 338 OD2 ASP A 26 14.284 -1.746 9.357 1.00 0.00 O ATOM 0 H ASP A 26 10.859 -0.461 7.973 1.00 0.00 H new ATOM 0 HA ASP A 26 11.183 0.027 10.949 1.00 0.00 H new ATOM 0 HB2 ASP A 26 13.079 0.308 8.544 1.00 0.00 H new ATOM 0 HB3 ASP A 26 13.444 0.928 10.141 1.00 0.00 H new ATOM 343 N THR A 27 10.616 2.423 10.679 1.00 0.00 N ATOM 344 CA THR A 27 10.119 3.813 10.477 1.00 0.00 C ATOM 345 C THR A 27 11.063 4.822 11.135 1.00 0.00 C ATOM 346 O THR A 27 11.142 5.956 10.722 1.00 0.00 O ATOM 347 CB THR A 27 8.751 3.843 11.156 1.00 0.00 C ATOM 348 OG1 THR A 27 8.742 2.925 12.240 1.00 0.00 O ATOM 349 CG2 THR A 27 7.670 3.456 10.146 1.00 0.00 C ATOM 0 H THR A 27 10.704 2.129 11.652 1.00 0.00 H new ATOM 0 HA THR A 27 10.062 4.078 9.421 1.00 0.00 H new ATOM 0 HB THR A 27 8.552 4.847 11.530 1.00 0.00 H new ATOM 0 HG1 THR A 27 8.131 3.246 12.936 1.00 0.00 H new ATOM 0 HG21 THR A 27 6.694 3.478 10.631 1.00 0.00 H new ATOM 0 HG22 THR A 27 7.678 4.162 9.316 1.00 0.00 H new ATOM 0 HG23 THR A 27 7.866 2.452 9.770 1.00 0.00 H new ATOM 357 N SER A 28 11.769 4.410 12.154 1.00 0.00 N ATOM 358 CA SER A 28 12.716 5.331 12.861 1.00 0.00 C ATOM 359 C SER A 28 13.637 6.052 11.867 1.00 0.00 C ATOM 360 O SER A 28 14.757 5.640 11.640 1.00 0.00 O ATOM 361 CB SER A 28 13.533 4.422 13.779 1.00 0.00 C ATOM 362 OG SER A 28 12.652 3.582 14.513 1.00 0.00 O ATOM 0 H SER A 28 11.732 3.464 12.533 1.00 0.00 H new ATOM 0 HA SER A 28 12.186 6.111 13.408 1.00 0.00 H new ATOM 0 HB2 SER A 28 14.224 3.818 13.191 1.00 0.00 H new ATOM 0 HB3 SER A 28 14.135 5.022 14.462 1.00 0.00 H new ATOM 0 HG SER A 28 13.173 2.996 15.102 1.00 0.00 H new ATOM 368 N THR A 29 13.176 7.124 11.276 1.00 0.00 N ATOM 369 CA THR A 29 14.023 7.872 10.297 1.00 0.00 C ATOM 370 C THR A 29 13.161 8.865 9.512 1.00 0.00 C ATOM 371 O THR A 29 13.616 9.918 9.113 1.00 0.00 O ATOM 372 CB THR A 29 14.606 6.813 9.352 1.00 0.00 C ATOM 373 OG1 THR A 29 15.006 7.436 8.140 1.00 0.00 O ATOM 374 CG2 THR A 29 13.552 5.744 9.051 1.00 0.00 C ATOM 0 H THR A 29 12.247 7.515 11.429 1.00 0.00 H new ATOM 0 HA THR A 29 14.809 8.441 10.794 1.00 0.00 H new ATOM 0 HB THR A 29 15.467 6.342 9.827 1.00 0.00 H new ATOM 0 HG1 THR A 29 15.380 6.763 7.534 1.00 0.00 H new ATOM 0 HG21 THR A 29 13.974 4.996 8.380 1.00 0.00 H new ATOM 0 HG22 THR A 29 13.244 5.265 9.980 1.00 0.00 H new ATOM 0 HG23 THR A 29 12.687 6.209 8.578 1.00 0.00 H new ATOM 382 N GLY A 30 11.919 8.534 9.286 1.00 0.00 N ATOM 383 CA GLY A 30 11.025 9.453 8.527 1.00 0.00 C ATOM 384 C GLY A 30 10.353 8.687 7.385 1.00 0.00 C ATOM 385 O GLY A 30 9.581 9.239 6.625 1.00 0.00 O ATOM 0 H GLY A 30 11.484 7.665 9.595 1.00 0.00 H new ATOM 0 HA2 GLY A 30 10.269 9.873 9.191 1.00 0.00 H new ATOM 0 HA3 GLY A 30 11.600 10.289 8.129 1.00 0.00 H new ATOM 389 N ALA A 31 10.638 7.419 7.255 1.00 0.00 N ATOM 390 CA ALA A 31 10.012 6.621 6.160 1.00 0.00 C ATOM 391 C ALA A 31 9.869 5.158 6.587 1.00 0.00 C ATOM 392 O ALA A 31 10.522 4.702 7.505 1.00 0.00 O ATOM 393 CB ALA A 31 10.976 6.745 4.980 1.00 0.00 C ATOM 0 H ALA A 31 11.277 6.901 7.859 1.00 0.00 H new ATOM 0 HA ALA A 31 9.013 6.976 5.909 1.00 0.00 H new ATOM 0 HB1 ALA A 31 10.586 6.184 4.131 1.00 0.00 H new ATOM 0 HB2 ALA A 31 11.080 7.794 4.704 1.00 0.00 H new ATOM 0 HB3 ALA A 31 11.950 6.346 5.262 1.00 0.00 H new ATOM 399 N LEU A 32 9.022 4.416 5.926 1.00 0.00 N ATOM 400 CA LEU A 32 8.840 2.982 6.294 1.00 0.00 C ATOM 401 C LEU A 32 9.548 2.083 5.277 1.00 0.00 C ATOM 402 O LEU A 32 9.033 1.817 4.210 1.00 0.00 O ATOM 403 CB LEU A 32 7.330 2.755 6.252 1.00 0.00 C ATOM 404 CG LEU A 32 7.039 1.254 6.224 1.00 0.00 C ATOM 405 CD1 LEU A 32 6.050 0.907 7.337 1.00 0.00 C ATOM 406 CD2 LEU A 32 6.434 0.878 4.870 1.00 0.00 C ATOM 0 H LEU A 32 8.448 4.740 5.147 1.00 0.00 H new ATOM 0 HA LEU A 32 9.261 2.747 7.272 1.00 0.00 H new ATOM 0 HB2 LEU A 32 6.859 3.211 7.123 1.00 0.00 H new ATOM 0 HB3 LEU A 32 6.904 3.235 5.371 1.00 0.00 H new ATOM 0 HG LEU A 32 7.966 0.701 6.375 1.00 0.00 H new ATOM 0 HD11 LEU A 32 5.842 -0.163 7.318 1.00 0.00 H new ATOM 0 HD12 LEU A 32 6.479 1.176 8.302 1.00 0.00 H new ATOM 0 HD13 LEU A 32 5.123 1.460 7.185 1.00 0.00 H new ATOM 0 HD21 LEU A 32 6.226 -0.192 4.849 1.00 0.00 H new ATOM 0 HD22 LEU A 32 5.507 1.431 4.720 1.00 0.00 H new ATOM 0 HD23 LEU A 32 7.138 1.127 4.075 1.00 0.00 H new ATOM 418 N CYS A 33 10.725 1.614 5.596 1.00 0.00 N ATOM 419 CA CYS A 33 11.460 0.737 4.638 1.00 0.00 C ATOM 420 C CYS A 33 11.242 -0.743 4.949 1.00 0.00 C ATOM 421 O CYS A 33 11.642 -1.239 5.983 1.00 0.00 O ATOM 422 CB CYS A 33 12.937 1.094 4.798 1.00 0.00 C ATOM 423 SG CYS A 33 13.448 2.155 3.424 1.00 0.00 S ATOM 0 H CYS A 33 11.208 1.799 6.475 1.00 0.00 H new ATOM 0 HA CYS A 33 11.105 0.895 3.620 1.00 0.00 H new ATOM 0 HB2 CYS A 33 13.099 1.605 5.747 1.00 0.00 H new ATOM 0 HB3 CYS A 33 13.542 0.188 4.817 1.00 0.00 H new ATOM 428 N VAL A 34 10.641 -1.458 4.038 1.00 0.00 N ATOM 429 CA VAL A 34 10.432 -2.915 4.254 1.00 0.00 C ATOM 430 C VAL A 34 11.654 -3.650 3.707 1.00 0.00 C ATOM 431 O VAL A 34 12.301 -3.177 2.792 1.00 0.00 O ATOM 432 CB VAL A 34 9.176 -3.264 3.458 1.00 0.00 C ATOM 433 CG1 VAL A 34 7.973 -2.540 4.065 1.00 0.00 C ATOM 434 CG2 VAL A 34 9.354 -2.821 2.004 1.00 0.00 C ATOM 0 H VAL A 34 10.286 -1.095 3.153 1.00 0.00 H new ATOM 0 HA VAL A 34 10.311 -3.191 5.302 1.00 0.00 H new ATOM 0 HB VAL A 34 9.011 -4.341 3.493 1.00 0.00 H new ATOM 0 HG11 VAL A 34 7.075 -2.788 3.498 1.00 0.00 H new ATOM 0 HG12 VAL A 34 7.845 -2.852 5.102 1.00 0.00 H new ATOM 0 HG13 VAL A 34 8.140 -1.463 4.028 1.00 0.00 H new ATOM 0 HG21 VAL A 34 8.458 -3.070 1.436 1.00 0.00 H new ATOM 0 HG22 VAL A 34 9.518 -1.744 1.969 1.00 0.00 H new ATOM 0 HG23 VAL A 34 10.213 -3.333 1.570 1.00 0.00 H new ATOM 444 N ALA A 35 12.002 -4.777 4.264 1.00 0.00 N ATOM 445 CA ALA A 35 13.211 -5.489 3.770 1.00 0.00 C ATOM 446 C ALA A 35 12.867 -6.464 2.645 1.00 0.00 C ATOM 447 O ALA A 35 12.018 -7.322 2.780 1.00 0.00 O ATOM 448 CB ALA A 35 13.747 -6.238 4.986 1.00 0.00 C ATOM 0 H ALA A 35 11.507 -5.231 5.032 1.00 0.00 H new ATOM 0 HA ALA A 35 13.942 -4.797 3.352 1.00 0.00 H new ATOM 0 HB1 ALA A 35 14.643 -6.792 4.706 1.00 0.00 H new ATOM 0 HB2 ALA A 35 13.992 -5.525 5.773 1.00 0.00 H new ATOM 0 HB3 ALA A 35 12.989 -6.933 5.348 1.00 0.00 H new ATOM 454 N VAL A 36 13.543 -6.336 1.539 1.00 0.00 N ATOM 455 CA VAL A 36 13.297 -7.246 0.389 1.00 0.00 C ATOM 456 C VAL A 36 14.629 -7.869 -0.047 1.00 0.00 C ATOM 457 O VAL A 36 15.551 -7.166 -0.409 1.00 0.00 O ATOM 458 CB VAL A 36 12.730 -6.341 -0.706 1.00 0.00 C ATOM 459 CG1 VAL A 36 12.371 -7.178 -1.932 1.00 0.00 C ATOM 460 CG2 VAL A 36 11.471 -5.640 -0.186 1.00 0.00 C ATOM 0 H VAL A 36 14.264 -5.631 1.382 1.00 0.00 H new ATOM 0 HA VAL A 36 12.616 -8.065 0.622 1.00 0.00 H new ATOM 0 HB VAL A 36 13.478 -5.597 -0.981 1.00 0.00 H new ATOM 0 HG11 VAL A 36 11.967 -6.530 -2.710 1.00 0.00 H new ATOM 0 HG12 VAL A 36 13.264 -7.679 -2.305 1.00 0.00 H new ATOM 0 HG13 VAL A 36 11.625 -7.924 -1.658 1.00 0.00 H new ATOM 0 HG21 VAL A 36 11.066 -4.995 -0.965 1.00 0.00 H new ATOM 0 HG22 VAL A 36 10.727 -6.387 0.090 1.00 0.00 H new ATOM 0 HG23 VAL A 36 11.724 -5.039 0.688 1.00 0.00 H new ATOM 470 N PRO A 37 14.693 -9.172 0.021 1.00 0.00 N ATOM 471 CA PRO A 37 15.938 -9.896 -0.353 1.00 0.00 C ATOM 472 C PRO A 37 16.239 -9.751 -1.848 1.00 0.00 C ATOM 473 O PRO A 37 15.546 -9.063 -2.571 1.00 0.00 O ATOM 474 CB PRO A 37 15.633 -11.346 0.021 1.00 0.00 C ATOM 475 CG PRO A 37 14.143 -11.438 0.001 1.00 0.00 C ATOM 476 CD PRO A 37 13.630 -10.091 0.440 1.00 0.00 C ATOM 0 HA PRO A 37 16.823 -9.509 0.152 1.00 0.00 H new ATOM 0 HB2 PRO A 37 16.082 -12.041 -0.689 1.00 0.00 H new ATOM 0 HB3 PRO A 37 16.032 -11.593 1.005 1.00 0.00 H new ATOM 0 HG2 PRO A 37 13.782 -11.685 -0.997 1.00 0.00 H new ATOM 0 HG3 PRO A 37 13.793 -12.224 0.670 1.00 0.00 H new ATOM 0 HD2 PRO A 37 12.679 -9.849 -0.034 1.00 0.00 H new ATOM 0 HD3 PRO A 37 13.468 -10.054 1.517 1.00 0.00 H new ATOM 484 N ALA A 38 17.287 -10.383 -2.308 1.00 0.00 N ATOM 485 CA ALA A 38 17.662 -10.277 -3.749 1.00 0.00 C ATOM 486 C ALA A 38 16.503 -10.701 -4.654 1.00 0.00 C ATOM 487 O ALA A 38 15.955 -11.777 -4.520 1.00 0.00 O ATOM 488 CB ALA A 38 18.849 -11.225 -3.918 1.00 0.00 C ATOM 0 H ALA A 38 17.902 -10.971 -1.745 1.00 0.00 H new ATOM 0 HA ALA A 38 17.907 -9.252 -4.028 1.00 0.00 H new ATOM 0 HB1 ALA A 38 19.186 -11.205 -4.954 1.00 0.00 H new ATOM 0 HB2 ALA A 38 19.663 -10.909 -3.266 1.00 0.00 H new ATOM 0 HB3 ALA A 38 18.546 -12.238 -3.654 1.00 0.00 H new ATOM 494 N GLY A 39 16.135 -9.857 -5.581 1.00 0.00 N ATOM 495 CA GLY A 39 15.018 -10.189 -6.513 1.00 0.00 C ATOM 496 C GLY A 39 13.893 -10.888 -5.751 1.00 0.00 C ATOM 497 O GLY A 39 13.156 -11.671 -6.314 1.00 0.00 O ATOM 0 H GLY A 39 16.564 -8.944 -5.734 1.00 0.00 H new ATOM 0 HA2 GLY A 39 14.641 -9.280 -6.981 1.00 0.00 H new ATOM 0 HA3 GLY A 39 15.381 -10.833 -7.314 1.00 0.00 H new ATOM 501 N SER A 40 13.760 -10.607 -4.476 1.00 0.00 N ATOM 502 CA SER A 40 12.687 -11.249 -3.655 1.00 0.00 C ATOM 503 C SER A 40 12.390 -12.659 -4.166 1.00 0.00 C ATOM 504 O SER A 40 11.284 -12.964 -4.567 1.00 0.00 O ATOM 505 CB SER A 40 11.460 -10.352 -3.814 1.00 0.00 C ATOM 506 OG SER A 40 10.314 -11.019 -3.295 1.00 0.00 O ATOM 0 H SER A 40 14.355 -9.954 -3.966 1.00 0.00 H new ATOM 0 HA SER A 40 12.983 -11.348 -2.611 1.00 0.00 H new ATOM 0 HB2 SER A 40 11.615 -9.410 -3.288 1.00 0.00 H new ATOM 0 HB3 SER A 40 11.308 -10.109 -4.866 1.00 0.00 H new ATOM 0 HG SER A 40 10.375 -11.977 -3.494 1.00 0.00 H new ATOM 512 N ALA A 41 13.368 -13.519 -4.160 1.00 0.00 N ATOM 513 CA ALA A 41 13.134 -14.904 -4.652 1.00 0.00 C ATOM 514 C ALA A 41 12.656 -15.785 -3.508 1.00 0.00 C ATOM 515 O ALA A 41 13.433 -16.323 -2.745 1.00 0.00 O ATOM 516 CB ALA A 41 14.480 -15.388 -5.165 1.00 0.00 C ATOM 0 H ALA A 41 14.316 -13.324 -3.837 1.00 0.00 H new ATOM 0 HA ALA A 41 12.372 -14.938 -5.431 1.00 0.00 H new ATOM 0 HB1 ALA A 41 14.381 -16.405 -5.544 1.00 0.00 H new ATOM 0 HB2 ALA A 41 14.820 -14.734 -5.968 1.00 0.00 H new ATOM 0 HB3 ALA A 41 15.206 -15.373 -4.352 1.00 0.00 H new ATOM 522 N GLN A 42 11.375 -15.924 -3.393 1.00 0.00 N ATOM 523 CA GLN A 42 10.798 -16.760 -2.300 1.00 0.00 C ATOM 524 C GLN A 42 9.272 -16.751 -2.391 1.00 0.00 C ATOM 525 O GLN A 42 8.704 -16.615 -3.456 1.00 0.00 O ATOM 526 CB GLN A 42 11.256 -16.088 -1.005 1.00 0.00 C ATOM 527 CG GLN A 42 10.608 -14.706 -0.898 1.00 0.00 C ATOM 528 CD GLN A 42 11.643 -13.684 -0.427 1.00 0.00 C ATOM 529 OE1 GLN A 42 12.832 -13.910 -0.533 1.00 0.00 O ATOM 530 NE2 GLN A 42 11.236 -12.559 0.094 1.00 0.00 N ATOM 0 H GLN A 42 10.689 -15.493 -4.012 1.00 0.00 H new ATOM 0 HA GLN A 42 11.121 -17.800 -2.357 1.00 0.00 H new ATOM 0 HB2 GLN A 42 10.979 -16.700 -0.146 1.00 0.00 H new ATOM 0 HB3 GLN A 42 12.342 -15.995 -0.994 1.00 0.00 H new ATOM 0 HG2 GLN A 42 10.203 -14.408 -1.865 1.00 0.00 H new ATOM 0 HG3 GLN A 42 9.772 -14.739 -0.199 1.00 0.00 H new ATOM 0 HE21 GLN A 42 10.238 -12.370 0.183 1.00 0.00 H new ATOM 0 HE22 GLN A 42 11.916 -11.869 0.412 1.00 0.00 H new ATOM 539 N TYR A 43 8.605 -16.888 -1.280 1.00 0.00 N ATOM 540 CA TYR A 43 7.115 -16.878 -1.304 1.00 0.00 C ATOM 541 C TYR A 43 6.611 -15.533 -1.838 1.00 0.00 C ATOM 542 O TYR A 43 5.452 -15.377 -2.167 1.00 0.00 O ATOM 543 CB TYR A 43 6.687 -17.092 0.151 1.00 0.00 C ATOM 544 CG TYR A 43 6.834 -15.808 0.932 1.00 0.00 C ATOM 545 CD1 TYR A 43 8.098 -15.391 1.368 1.00 0.00 C ATOM 546 CD2 TYR A 43 5.702 -15.041 1.230 1.00 0.00 C ATOM 547 CE1 TYR A 43 8.229 -14.204 2.102 1.00 0.00 C ATOM 548 CE2 TYR A 43 5.833 -13.857 1.966 1.00 0.00 C ATOM 549 CZ TYR A 43 7.094 -13.439 2.401 1.00 0.00 C ATOM 550 OH TYR A 43 7.218 -12.276 3.132 1.00 0.00 O ATOM 0 H TYR A 43 9.025 -17.006 -0.358 1.00 0.00 H new ATOM 0 HA TYR A 43 6.702 -17.649 -1.955 1.00 0.00 H new ATOM 0 HB2 TYR A 43 5.652 -17.432 0.187 1.00 0.00 H new ATOM 0 HB3 TYR A 43 7.295 -17.874 0.605 1.00 0.00 H new ATOM 0 HD1 TYR A 43 8.971 -15.984 1.139 1.00 0.00 H new ATOM 0 HD2 TYR A 43 4.728 -15.362 0.892 1.00 0.00 H new ATOM 0 HE1 TYR A 43 9.203 -13.880 2.437 1.00 0.00 H new ATOM 0 HE2 TYR A 43 4.959 -13.266 2.198 1.00 0.00 H new ATOM 0 HH TYR A 43 7.290 -12.494 4.085 1.00 0.00 H new ATOM 560 N GLY A 44 7.480 -14.563 -1.932 1.00 0.00 N ATOM 561 CA GLY A 44 7.064 -13.231 -2.451 1.00 0.00 C ATOM 562 C GLY A 44 7.069 -12.210 -1.313 1.00 0.00 C ATOM 563 O GLY A 44 6.488 -12.429 -0.268 1.00 0.00 O ATOM 0 H GLY A 44 8.463 -14.637 -1.670 1.00 0.00 H new ATOM 0 HA2 GLY A 44 7.741 -12.911 -3.243 1.00 0.00 H new ATOM 0 HA3 GLY A 44 6.068 -13.296 -2.890 1.00 0.00 H new ATOM 567 N VAL A 45 7.710 -11.089 -1.508 1.00 0.00 N ATOM 568 CA VAL A 45 7.736 -10.053 -0.440 1.00 0.00 C ATOM 569 C VAL A 45 6.533 -9.133 -0.626 1.00 0.00 C ATOM 570 O VAL A 45 5.846 -9.206 -1.624 1.00 0.00 O ATOM 571 CB VAL A 45 9.045 -9.283 -0.655 1.00 0.00 C ATOM 572 CG1 VAL A 45 9.332 -8.407 0.566 1.00 0.00 C ATOM 573 CG2 VAL A 45 10.208 -10.262 -0.856 1.00 0.00 C ATOM 0 H VAL A 45 8.216 -10.848 -2.360 1.00 0.00 H new ATOM 0 HA VAL A 45 7.687 -10.472 0.565 1.00 0.00 H new ATOM 0 HB VAL A 45 8.943 -8.659 -1.543 1.00 0.00 H new ATOM 0 HG11 VAL A 45 10.262 -7.861 0.411 1.00 0.00 H new ATOM 0 HG12 VAL A 45 8.515 -7.699 0.706 1.00 0.00 H new ATOM 0 HG13 VAL A 45 9.423 -9.036 1.452 1.00 0.00 H new ATOM 0 HG21 VAL A 45 11.132 -9.703 -1.008 1.00 0.00 H new ATOM 0 HG22 VAL A 45 10.307 -10.895 0.026 1.00 0.00 H new ATOM 0 HG23 VAL A 45 10.013 -10.884 -1.729 1.00 0.00 H new ATOM 583 N GLY A 46 6.260 -8.271 0.312 1.00 0.00 N ATOM 584 CA GLY A 46 5.091 -7.368 0.143 1.00 0.00 C ATOM 585 C GLY A 46 4.796 -6.622 1.445 1.00 0.00 C ATOM 586 O GLY A 46 5.526 -6.711 2.408 1.00 0.00 O ATOM 0 H GLY A 46 6.788 -8.154 1.177 1.00 0.00 H new ATOM 0 HA2 GLY A 46 5.289 -6.653 -0.656 1.00 0.00 H new ATOM 0 HA3 GLY A 46 4.218 -7.947 -0.157 1.00 0.00 H new ATOM 590 N VAL A 47 3.720 -5.886 1.469 1.00 0.00 N ATOM 591 CA VAL A 47 3.343 -5.125 2.690 1.00 0.00 C ATOM 592 C VAL A 47 1.821 -4.991 2.736 1.00 0.00 C ATOM 593 O VAL A 47 1.198 -4.597 1.771 1.00 0.00 O ATOM 594 CB VAL A 47 4.009 -3.758 2.528 1.00 0.00 C ATOM 595 CG1 VAL A 47 3.780 -2.922 3.788 1.00 0.00 C ATOM 596 CG2 VAL A 47 5.512 -3.948 2.314 1.00 0.00 C ATOM 0 H VAL A 47 3.078 -5.779 0.683 1.00 0.00 H new ATOM 0 HA VAL A 47 3.659 -5.609 3.614 1.00 0.00 H new ATOM 0 HB VAL A 47 3.577 -3.245 1.669 1.00 0.00 H new ATOM 0 HG11 VAL A 47 4.256 -1.948 3.670 1.00 0.00 H new ATOM 0 HG12 VAL A 47 2.710 -2.787 3.945 1.00 0.00 H new ATOM 0 HG13 VAL A 47 4.211 -3.435 4.648 1.00 0.00 H new ATOM 0 HG21 VAL A 47 5.989 -2.975 2.198 1.00 0.00 H new ATOM 0 HG22 VAL A 47 5.940 -4.462 3.175 1.00 0.00 H new ATOM 0 HG23 VAL A 47 5.679 -4.543 1.416 1.00 0.00 H new ATOM 606 N VAL A 48 1.213 -5.331 3.835 1.00 0.00 N ATOM 607 CA VAL A 48 -0.274 -5.234 3.909 1.00 0.00 C ATOM 608 C VAL A 48 -0.706 -4.276 5.021 1.00 0.00 C ATOM 609 O VAL A 48 -0.186 -4.305 6.119 1.00 0.00 O ATOM 610 CB VAL A 48 -0.750 -6.658 4.201 1.00 0.00 C ATOM 611 CG1 VAL A 48 -0.362 -7.573 3.039 1.00 0.00 C ATOM 612 CG2 VAL A 48 -0.094 -7.168 5.486 1.00 0.00 C ATOM 0 H VAL A 48 1.673 -5.669 4.680 1.00 0.00 H new ATOM 0 HA VAL A 48 -0.702 -4.841 2.987 1.00 0.00 H new ATOM 0 HB VAL A 48 -1.833 -6.657 4.322 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -0.701 -8.588 3.246 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -0.830 -7.215 2.122 1.00 0.00 H new ATOM 0 HG13 VAL A 48 0.721 -7.570 2.919 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -0.435 -8.183 5.691 1.00 0.00 H new ATOM 0 HG22 VAL A 48 0.989 -7.167 5.367 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -0.368 -6.518 6.317 1.00 0.00 H new ATOM 622 N LEU A 49 -1.658 -3.426 4.741 1.00 0.00 N ATOM 623 CA LEU A 49 -2.131 -2.463 5.777 1.00 0.00 C ATOM 624 C LEU A 49 -3.656 -2.527 5.903 1.00 0.00 C ATOM 625 O LEU A 49 -4.375 -1.902 5.150 1.00 0.00 O ATOM 626 CB LEU A 49 -1.697 -1.087 5.271 1.00 0.00 C ATOM 627 CG LEU A 49 -2.421 0.002 6.068 1.00 0.00 C ATOM 628 CD1 LEU A 49 -1.880 0.035 7.498 1.00 0.00 C ATOM 629 CD2 LEU A 49 -2.188 1.360 5.404 1.00 0.00 C ATOM 0 H LEU A 49 -2.129 -3.357 3.839 1.00 0.00 H new ATOM 0 HA LEU A 49 -1.719 -2.685 6.761 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -0.618 -0.973 5.376 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -1.926 -0.989 4.210 1.00 0.00 H new ATOM 0 HG LEU A 49 -3.489 -0.214 6.089 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -2.396 0.810 8.064 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -2.046 -0.932 7.972 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -0.812 0.250 7.478 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -2.703 2.135 5.971 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -1.120 1.576 5.382 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -2.575 1.338 4.385 1.00 0.00 H new ATOM 641 N ASN A 50 -4.154 -3.272 6.852 1.00 0.00 N ATOM 642 CA ASN A 50 -5.632 -3.369 7.024 1.00 0.00 C ATOM 643 C ASN A 50 -6.174 -2.090 7.667 1.00 0.00 C ATOM 644 O ASN A 50 -5.621 -1.582 8.622 1.00 0.00 O ATOM 645 CB ASN A 50 -5.844 -4.567 7.950 1.00 0.00 C ATOM 646 CG ASN A 50 -5.415 -4.197 9.371 1.00 0.00 C ATOM 647 OD1 ASN A 50 -6.059 -3.399 10.023 1.00 0.00 O ATOM 648 ND2 ASN A 50 -4.347 -4.746 9.881 1.00 0.00 N ATOM 0 H ASN A 50 -3.603 -3.817 7.515 1.00 0.00 H new ATOM 0 HA ASN A 50 -6.152 -3.491 6.074 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -6.892 -4.865 7.942 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -5.267 -5.421 7.595 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -4.052 -4.505 10.827 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -3.807 -5.416 9.333 1.00 0.00 H new ATOM 655 N GLY A 51 -7.253 -1.565 7.152 1.00 0.00 N ATOM 656 CA GLY A 51 -7.827 -0.320 7.738 1.00 0.00 C ATOM 657 C GLY A 51 -8.230 0.640 6.618 1.00 0.00 C ATOM 658 O GLY A 51 -7.550 1.609 6.343 1.00 0.00 O ATOM 0 H GLY A 51 -7.761 -1.944 6.352 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -8.695 -0.562 8.352 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -7.096 0.156 8.392 1.00 0.00 H new ATOM 662 N VAL A 52 -9.334 0.383 5.971 1.00 0.00 N ATOM 663 CA VAL A 52 -9.783 1.285 4.871 1.00 0.00 C ATOM 664 C VAL A 52 -11.299 1.485 4.943 1.00 0.00 C ATOM 665 O VAL A 52 -11.993 0.783 5.652 1.00 0.00 O ATOM 666 CB VAL A 52 -9.396 0.563 3.581 1.00 0.00 C ATOM 667 CG1 VAL A 52 -9.599 1.503 2.391 1.00 0.00 C ATOM 668 CG2 VAL A 52 -7.926 0.146 3.652 1.00 0.00 C ATOM 0 H VAL A 52 -9.945 -0.413 6.156 1.00 0.00 H new ATOM 0 HA VAL A 52 -9.328 2.273 4.933 1.00 0.00 H new ATOM 0 HB VAL A 52 -10.021 -0.322 3.458 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -9.323 0.989 1.470 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -10.645 1.804 2.339 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -8.973 2.387 2.515 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -7.649 -0.369 2.732 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -7.302 1.031 3.774 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -7.778 -0.522 4.501 1.00 0.00 H new ATOM 678 N ALA A 53 -11.819 2.438 4.219 1.00 0.00 N ATOM 679 CA ALA A 53 -13.290 2.678 4.255 1.00 0.00 C ATOM 680 C ALA A 53 -13.825 2.941 2.844 1.00 0.00 C ATOM 681 O ALA A 53 -13.986 4.072 2.432 1.00 0.00 O ATOM 682 CB ALA A 53 -13.467 3.916 5.134 1.00 0.00 C ATOM 0 H ALA A 53 -11.291 3.059 3.606 1.00 0.00 H new ATOM 0 HA ALA A 53 -13.836 1.818 4.643 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -14.527 4.159 5.211 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -13.068 3.716 6.128 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -12.933 4.756 4.691 1.00 0.00 H new ATOM 688 N ILE A 54 -14.108 1.904 2.103 1.00 0.00 N ATOM 689 CA ILE A 54 -14.640 2.095 0.723 1.00 0.00 C ATOM 690 C ILE A 54 -16.062 1.535 0.630 1.00 0.00 C ATOM 691 O ILE A 54 -16.466 0.711 1.426 1.00 0.00 O ATOM 692 CB ILE A 54 -13.691 1.310 -0.185 1.00 0.00 C ATOM 693 CG1 ILE A 54 -12.258 1.802 0.029 1.00 0.00 C ATOM 694 CG2 ILE A 54 -14.089 1.524 -1.646 1.00 0.00 C ATOM 695 CD1 ILE A 54 -12.197 3.314 -0.192 1.00 0.00 C ATOM 0 H ILE A 54 -13.994 0.933 2.393 1.00 0.00 H new ATOM 0 HA ILE A 54 -14.690 3.146 0.440 1.00 0.00 H new ATOM 0 HB ILE A 54 -13.752 0.249 0.057 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -11.926 1.558 1.038 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -11.582 1.296 -0.660 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -13.413 0.965 -2.293 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -15.110 1.175 -1.800 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -14.028 2.585 -1.888 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -11.176 3.663 -0.039 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -12.511 3.546 -1.210 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -12.860 3.812 0.515 1.00 0.00 H new ATOM 707 N GLU A 55 -16.825 1.976 -0.333 1.00 0.00 N ATOM 708 CA GLU A 55 -18.220 1.464 -0.466 1.00 0.00 C ATOM 709 C GLU A 55 -18.672 1.523 -1.927 1.00 0.00 C ATOM 710 O GLU A 55 -18.476 2.511 -2.605 1.00 0.00 O ATOM 711 CB GLU A 55 -19.068 2.401 0.395 1.00 0.00 C ATOM 712 CG GLU A 55 -20.551 2.111 0.157 1.00 0.00 C ATOM 713 CD GLU A 55 -20.878 0.697 0.641 1.00 0.00 C ATOM 714 OE1 GLU A 55 -20.662 -0.233 -0.119 1.00 0.00 O ATOM 715 OE2 GLU A 55 -21.339 0.568 1.763 1.00 0.00 O ATOM 0 H GLU A 55 -16.545 2.665 -1.031 1.00 0.00 H new ATOM 0 HA GLU A 55 -18.309 0.425 -0.150 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -18.824 2.264 1.449 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -18.846 3.439 0.149 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -21.165 2.839 0.687 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -20.786 2.208 -0.903 1.00 0.00 H new ATOM 722 N GLU A 56 -19.277 0.467 -2.409 1.00 0.00 N ATOM 723 CA GLU A 56 -19.755 0.438 -3.825 1.00 0.00 C ATOM 724 C GLU A 56 -18.769 1.168 -4.746 1.00 0.00 C ATOM 725 O GLU A 56 -17.604 1.311 -4.434 1.00 0.00 O ATOM 726 CB GLU A 56 -21.133 1.124 -3.797 1.00 0.00 C ATOM 727 CG GLU A 56 -21.013 2.613 -4.143 1.00 0.00 C ATOM 728 CD GLU A 56 -22.025 3.412 -3.321 1.00 0.00 C ATOM 729 OE1 GLU A 56 -21.802 3.568 -2.132 1.00 0.00 O ATOM 730 OE2 GLU A 56 -23.007 3.854 -3.894 1.00 0.00 O ATOM 0 H GLU A 56 -19.462 -0.384 -1.877 1.00 0.00 H new ATOM 0 HA GLU A 56 -19.828 -0.576 -4.218 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -21.801 0.635 -4.506 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -21.579 1.011 -2.809 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -20.002 2.965 -3.936 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -21.192 2.765 -5.207 1.00 0.00 H new ATOM 737 N GLY A 57 -19.229 1.628 -5.878 1.00 0.00 N ATOM 738 CA GLY A 57 -18.320 2.345 -6.817 1.00 0.00 C ATOM 739 C GLY A 57 -18.216 3.816 -6.409 1.00 0.00 C ATOM 740 O GLY A 57 -18.988 4.647 -6.845 1.00 0.00 O ATOM 0 H GLY A 57 -20.195 1.538 -6.193 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -17.333 1.884 -6.806 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -18.698 2.266 -7.836 1.00 0.00 H new ATOM 744 N THR A 58 -17.265 4.144 -5.579 1.00 0.00 N ATOM 745 CA THR A 58 -17.107 5.562 -5.145 1.00 0.00 C ATOM 746 C THR A 58 -15.731 6.087 -5.576 1.00 0.00 C ATOM 747 O THR A 58 -14.908 5.351 -6.083 1.00 0.00 O ATOM 748 CB THR A 58 -17.241 5.519 -3.616 1.00 0.00 C ATOM 749 OG1 THR A 58 -18.614 5.609 -3.265 1.00 0.00 O ATOM 750 CG2 THR A 58 -16.477 6.686 -2.982 1.00 0.00 C ATOM 0 H THR A 58 -16.589 3.491 -5.182 1.00 0.00 H new ATOM 0 HA THR A 58 -17.845 6.230 -5.590 1.00 0.00 H new ATOM 0 HB THR A 58 -16.823 4.582 -3.248 1.00 0.00 H new ATOM 0 HG1 THR A 58 -18.942 4.725 -2.996 1.00 0.00 H new ATOM 0 HG21 THR A 58 -16.581 6.643 -1.898 1.00 0.00 H new ATOM 0 HG22 THR A 58 -15.422 6.618 -3.248 1.00 0.00 H new ATOM 0 HG23 THR A 58 -16.884 7.629 -3.348 1.00 0.00 H new ATOM 758 N THR A 59 -15.479 7.353 -5.381 1.00 0.00 N ATOM 759 CA THR A 59 -14.160 7.921 -5.785 1.00 0.00 C ATOM 760 C THR A 59 -13.156 7.816 -4.634 1.00 0.00 C ATOM 761 O THR A 59 -13.524 7.784 -3.476 1.00 0.00 O ATOM 762 CB THR A 59 -14.445 9.387 -6.113 1.00 0.00 C ATOM 763 OG1 THR A 59 -15.773 9.511 -6.602 1.00 0.00 O ATOM 764 CG2 THR A 59 -13.460 9.877 -7.175 1.00 0.00 C ATOM 0 H THR A 59 -16.128 8.018 -4.960 1.00 0.00 H new ATOM 0 HA THR A 59 -13.726 7.388 -6.631 1.00 0.00 H new ATOM 0 HB THR A 59 -14.331 9.989 -5.212 1.00 0.00 H new ATOM 0 HG1 THR A 59 -15.958 10.450 -6.811 1.00 0.00 H new ATOM 0 HG21 THR A 59 -13.665 10.922 -7.407 1.00 0.00 H new ATOM 0 HG22 THR A 59 -12.442 9.782 -6.798 1.00 0.00 H new ATOM 0 HG23 THR A 59 -13.570 9.277 -8.078 1.00 0.00 H new ATOM 772 N TYR A 60 -11.889 7.765 -4.944 1.00 0.00 N ATOM 773 CA TYR A 60 -10.859 7.665 -3.870 1.00 0.00 C ATOM 774 C TYR A 60 -9.496 8.114 -4.401 1.00 0.00 C ATOM 775 O TYR A 60 -8.979 7.564 -5.353 1.00 0.00 O ATOM 776 CB TYR A 60 -10.819 6.185 -3.491 1.00 0.00 C ATOM 777 CG TYR A 60 -12.041 5.838 -2.678 1.00 0.00 C ATOM 778 CD1 TYR A 60 -12.120 6.214 -1.333 1.00 0.00 C ATOM 779 CD2 TYR A 60 -13.096 5.138 -3.272 1.00 0.00 C ATOM 780 CE1 TYR A 60 -13.255 5.888 -0.581 1.00 0.00 C ATOM 781 CE2 TYR A 60 -14.230 4.812 -2.522 1.00 0.00 C ATOM 782 CZ TYR A 60 -14.310 5.187 -1.175 1.00 0.00 C ATOM 783 OH TYR A 60 -15.430 4.866 -0.435 1.00 0.00 O ATOM 0 H TYR A 60 -11.522 7.788 -5.895 1.00 0.00 H new ATOM 0 HA TYR A 60 -11.095 8.299 -3.015 1.00 0.00 H new ATOM 0 HB2 TYR A 60 -10.781 5.570 -4.390 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -9.916 5.970 -2.919 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -11.306 6.756 -0.875 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -13.035 4.849 -4.311 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -13.316 6.178 0.458 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -15.044 4.271 -2.981 1.00 0.00 H new ATOM 0 HH TYR A 60 -15.757 5.666 0.028 1.00 0.00 H new ATOM 793 N THR A 61 -8.907 9.104 -3.791 1.00 0.00 N ATOM 794 CA THR A 61 -7.576 9.580 -4.261 1.00 0.00 C ATOM 795 C THR A 61 -6.463 8.832 -3.524 1.00 0.00 C ATOM 796 O THR A 61 -6.303 8.962 -2.327 1.00 0.00 O ATOM 797 CB THR A 61 -7.541 11.070 -3.917 1.00 0.00 C ATOM 798 OG1 THR A 61 -8.631 11.726 -4.549 1.00 0.00 O ATOM 799 CG2 THR A 61 -6.224 11.677 -4.404 1.00 0.00 C ATOM 0 H THR A 61 -9.289 9.604 -2.988 1.00 0.00 H new ATOM 0 HA THR A 61 -7.427 9.407 -5.327 1.00 0.00 H new ATOM 0 HB THR A 61 -7.618 11.196 -2.837 1.00 0.00 H new ATOM 0 HG1 THR A 61 -8.611 12.681 -4.328 1.00 0.00 H new ATOM 0 HG21 THR A 61 -6.200 12.739 -4.158 1.00 0.00 H new ATOM 0 HG22 THR A 61 -5.389 11.173 -3.917 1.00 0.00 H new ATOM 0 HG23 THR A 61 -6.143 11.552 -5.484 1.00 0.00 H new ATOM 807 N LEU A 62 -5.692 8.050 -4.228 1.00 0.00 N ATOM 808 CA LEU A 62 -4.592 7.297 -3.561 1.00 0.00 C ATOM 809 C LEU A 62 -3.314 8.136 -3.556 1.00 0.00 C ATOM 810 O LEU A 62 -2.808 8.522 -4.592 1.00 0.00 O ATOM 811 CB LEU A 62 -4.401 6.035 -4.403 1.00 0.00 C ATOM 812 CG LEU A 62 -3.118 5.320 -3.971 1.00 0.00 C ATOM 813 CD1 LEU A 62 -3.361 4.583 -2.653 1.00 0.00 C ATOM 814 CD2 LEU A 62 -2.708 4.313 -5.047 1.00 0.00 C ATOM 0 H LEU A 62 -5.775 7.900 -5.233 1.00 0.00 H new ATOM 0 HA LEU A 62 -4.825 7.058 -2.523 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -5.257 5.372 -4.282 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -4.346 6.295 -5.460 1.00 0.00 H new ATOM 0 HG LEU A 62 -2.323 6.054 -3.836 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -2.447 4.074 -2.347 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -3.653 5.299 -1.884 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -4.156 3.850 -2.787 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -1.795 3.804 -4.740 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -3.504 3.581 -5.182 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -2.533 4.836 -5.987 1.00 0.00 H new ATOM 826 N ARG A 63 -2.788 8.421 -2.398 1.00 0.00 N ATOM 827 CA ARG A 63 -1.543 9.235 -2.328 1.00 0.00 C ATOM 828 C ARG A 63 -0.473 8.497 -1.520 1.00 0.00 C ATOM 829 O ARG A 63 -0.720 8.032 -0.428 1.00 0.00 O ATOM 830 CB ARG A 63 -1.954 10.527 -1.621 1.00 0.00 C ATOM 831 CG ARG A 63 -0.703 11.318 -1.234 1.00 0.00 C ATOM 832 CD ARG A 63 -0.977 12.815 -1.387 1.00 0.00 C ATOM 833 NE ARG A 63 -1.882 13.157 -0.254 1.00 0.00 N ATOM 834 CZ ARG A 63 -2.456 14.328 -0.208 1.00 0.00 C ATOM 835 NH1 ARG A 63 -1.779 15.399 -0.521 1.00 0.00 N ATOM 836 NH2 ARG A 63 -3.706 14.428 0.151 1.00 0.00 N ATOM 0 H ARG A 63 -3.166 8.126 -1.498 1.00 0.00 H new ATOM 0 HA ARG A 63 -1.119 9.427 -3.314 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -2.588 11.126 -2.275 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -2.541 10.297 -0.732 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -0.421 11.093 -0.205 1.00 0.00 H new ATOM 0 HG3 ARG A 63 0.135 11.025 -1.866 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -0.053 13.392 -1.343 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -1.445 13.035 -2.347 1.00 0.00 H new ATOM 0 HE ARG A 63 -2.053 12.476 0.486 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -0.801 15.321 -0.802 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -2.227 16.314 -0.485 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -4.235 13.591 0.396 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -4.155 15.343 0.187 1.00 0.00 H new ATOM 850 N TYR A 64 0.715 8.389 -2.050 1.00 0.00 N ATOM 851 CA TYR A 64 1.805 7.686 -1.312 1.00 0.00 C ATOM 852 C TYR A 64 3.143 7.904 -2.029 1.00 0.00 C ATOM 853 O TYR A 64 3.208 7.942 -3.241 1.00 0.00 O ATOM 854 CB TYR A 64 1.394 6.203 -1.302 1.00 0.00 C ATOM 855 CG TYR A 64 1.930 5.491 -2.526 1.00 0.00 C ATOM 856 CD1 TYR A 64 3.282 5.130 -2.594 1.00 0.00 C ATOM 857 CD2 TYR A 64 1.072 5.194 -3.591 1.00 0.00 C ATOM 858 CE1 TYR A 64 3.773 4.472 -3.728 1.00 0.00 C ATOM 859 CE2 TYR A 64 1.564 4.536 -4.724 1.00 0.00 C ATOM 860 CZ TYR A 64 2.914 4.176 -4.793 1.00 0.00 C ATOM 861 OH TYR A 64 3.399 3.527 -5.911 1.00 0.00 O ATOM 0 H TYR A 64 0.979 8.758 -2.964 1.00 0.00 H new ATOM 0 HA TYR A 64 1.938 8.058 -0.296 1.00 0.00 H new ATOM 0 HB2 TYR A 64 1.773 5.722 -0.400 1.00 0.00 H new ATOM 0 HB3 TYR A 64 0.307 6.122 -1.275 1.00 0.00 H new ATOM 0 HD1 TYR A 64 3.945 5.359 -1.773 1.00 0.00 H new ATOM 0 HD2 TYR A 64 0.030 5.473 -3.539 1.00 0.00 H new ATOM 0 HE1 TYR A 64 4.815 4.193 -3.781 1.00 0.00 H new ATOM 0 HE2 TYR A 64 0.901 4.306 -5.545 1.00 0.00 H new ATOM 0 HH TYR A 64 2.672 3.397 -6.555 1.00 0.00 H new ATOM 871 N THR A 65 4.206 8.052 -1.289 1.00 0.00 N ATOM 872 CA THR A 65 5.533 8.273 -1.932 1.00 0.00 C ATOM 873 C THR A 65 6.493 7.144 -1.556 1.00 0.00 C ATOM 874 O THR A 65 7.096 7.151 -0.501 1.00 0.00 O ATOM 875 CB THR A 65 6.027 9.608 -1.372 1.00 0.00 C ATOM 876 OG1 THR A 65 5.260 10.666 -1.930 1.00 0.00 O ATOM 877 CG2 THR A 65 7.501 9.799 -1.731 1.00 0.00 C ATOM 0 H THR A 65 4.215 8.030 -0.269 1.00 0.00 H new ATOM 0 HA THR A 65 5.470 8.287 -3.020 1.00 0.00 H new ATOM 0 HB THR A 65 5.916 9.612 -0.288 1.00 0.00 H new ATOM 0 HG1 THR A 65 5.246 11.423 -1.308 1.00 0.00 H new ATOM 0 HG21 THR A 65 7.852 10.750 -1.332 1.00 0.00 H new ATOM 0 HG22 THR A 65 8.088 8.987 -1.303 1.00 0.00 H new ATOM 0 HG23 THR A 65 7.615 9.796 -2.815 1.00 0.00 H new ATOM 885 N ALA A 66 6.633 6.171 -2.411 1.00 0.00 N ATOM 886 CA ALA A 66 7.548 5.036 -2.107 1.00 0.00 C ATOM 887 C ALA A 66 8.893 5.233 -2.813 1.00 0.00 C ATOM 888 O ALA A 66 8.970 5.822 -3.874 1.00 0.00 O ATOM 889 CB ALA A 66 6.829 3.801 -2.651 1.00 0.00 C ATOM 0 H ALA A 66 6.153 6.112 -3.309 1.00 0.00 H new ATOM 0 HA ALA A 66 7.763 4.949 -1.042 1.00 0.00 H new ATOM 0 HB1 ALA A 66 7.438 2.915 -2.468 1.00 0.00 H new ATOM 0 HB2 ALA A 66 5.867 3.690 -2.151 1.00 0.00 H new ATOM 0 HB3 ALA A 66 6.669 3.916 -3.723 1.00 0.00 H new ATOM 895 N THR A 67 9.954 4.743 -2.231 1.00 0.00 N ATOM 896 CA THR A 67 11.293 4.896 -2.868 1.00 0.00 C ATOM 897 C THR A 67 12.198 3.723 -2.484 1.00 0.00 C ATOM 898 O THR A 67 12.736 3.674 -1.395 1.00 0.00 O ATOM 899 CB THR A 67 11.855 6.207 -2.315 1.00 0.00 C ATOM 900 OG1 THR A 67 10.957 7.267 -2.611 1.00 0.00 O ATOM 901 CG2 THR A 67 13.216 6.490 -2.956 1.00 0.00 C ATOM 0 H THR A 67 9.951 4.243 -1.342 1.00 0.00 H new ATOM 0 HA THR A 67 11.230 4.909 -3.956 1.00 0.00 H new ATOM 0 HB THR A 67 11.976 6.126 -1.235 1.00 0.00 H new ATOM 0 HG1 THR A 67 10.924 7.889 -1.854 1.00 0.00 H new ATOM 0 HG21 THR A 67 13.617 7.424 -2.562 1.00 0.00 H new ATOM 0 HG22 THR A 67 13.903 5.675 -2.726 1.00 0.00 H new ATOM 0 HG23 THR A 67 13.099 6.572 -4.037 1.00 0.00 H new ATOM 909 N ALA A 68 12.373 2.781 -3.367 1.00 0.00 N ATOM 910 CA ALA A 68 13.247 1.617 -3.046 1.00 0.00 C ATOM 911 C ALA A 68 14.689 1.917 -3.458 1.00 0.00 C ATOM 912 O ALA A 68 14.947 2.353 -4.562 1.00 0.00 O ATOM 913 CB ALA A 68 12.689 0.457 -3.874 1.00 0.00 C ATOM 0 H ALA A 68 11.950 2.765 -4.295 1.00 0.00 H new ATOM 0 HA ALA A 68 13.255 1.389 -1.980 1.00 0.00 H new ATOM 0 HB1 ALA A 68 13.282 -0.439 -3.691 1.00 0.00 H new ATOM 0 HB2 ALA A 68 11.654 0.271 -3.589 1.00 0.00 H new ATOM 0 HB3 ALA A 68 12.733 0.711 -4.933 1.00 0.00 H new ATOM 919 N SER A 69 15.631 1.682 -2.584 1.00 0.00 N ATOM 920 CA SER A 69 17.055 1.951 -2.938 1.00 0.00 C ATOM 921 C SER A 69 17.330 1.459 -4.361 1.00 0.00 C ATOM 922 O SER A 69 18.192 1.965 -5.051 1.00 0.00 O ATOM 923 CB SER A 69 17.874 1.154 -1.924 1.00 0.00 C ATOM 924 OG SER A 69 18.238 -0.096 -2.494 1.00 0.00 O ATOM 0 H SER A 69 15.477 1.317 -1.644 1.00 0.00 H new ATOM 0 HA SER A 69 17.303 3.012 -2.908 1.00 0.00 H new ATOM 0 HB2 SER A 69 18.767 1.712 -1.641 1.00 0.00 H new ATOM 0 HB3 SER A 69 17.295 0.997 -1.014 1.00 0.00 H new ATOM 0 HG SER A 69 18.765 -0.610 -1.847 1.00 0.00 H new ATOM 930 N THR A 70 16.592 0.477 -4.801 1.00 0.00 N ATOM 931 CA THR A 70 16.791 -0.054 -6.178 1.00 0.00 C ATOM 932 C THR A 70 15.596 0.328 -7.061 1.00 0.00 C ATOM 933 O THR A 70 14.531 0.648 -6.572 1.00 0.00 O ATOM 934 CB THR A 70 16.873 -1.577 -5.998 1.00 0.00 C ATOM 935 OG1 THR A 70 17.586 -2.142 -7.089 1.00 0.00 O ATOM 936 CG2 THR A 70 15.462 -2.176 -5.943 1.00 0.00 C ATOM 0 H THR A 70 15.857 0.018 -4.263 1.00 0.00 H new ATOM 0 HA THR A 70 17.682 0.346 -6.662 1.00 0.00 H new ATOM 0 HB THR A 70 17.391 -1.800 -5.065 1.00 0.00 H new ATOM 0 HG1 THR A 70 17.641 -3.114 -6.976 1.00 0.00 H new ATOM 0 HG21 THR A 70 15.530 -3.256 -5.815 1.00 0.00 H new ATOM 0 HG22 THR A 70 14.916 -1.745 -5.104 1.00 0.00 H new ATOM 0 HG23 THR A 70 14.936 -1.953 -6.871 1.00 0.00 H new ATOM 944 N ASP A 71 15.755 0.280 -8.354 1.00 0.00 N ATOM 945 CA ASP A 71 14.615 0.622 -9.252 1.00 0.00 C ATOM 946 C ASP A 71 13.678 -0.583 -9.359 1.00 0.00 C ATOM 947 O ASP A 71 13.688 -1.304 -10.336 1.00 0.00 O ATOM 948 CB ASP A 71 15.253 0.933 -10.607 1.00 0.00 C ATOM 949 CG ASP A 71 14.851 2.341 -11.049 1.00 0.00 C ATOM 950 OD1 ASP A 71 13.697 2.523 -11.403 1.00 0.00 O ATOM 951 OD2 ASP A 71 15.703 3.214 -11.026 1.00 0.00 O ATOM 0 H ASP A 71 16.620 0.020 -8.827 1.00 0.00 H new ATOM 0 HA ASP A 71 14.026 1.463 -8.886 1.00 0.00 H new ATOM 0 HB2 ASP A 71 16.338 0.859 -10.536 1.00 0.00 H new ATOM 0 HB3 ASP A 71 14.932 0.202 -11.349 1.00 0.00 H new ATOM 956 N VAL A 72 12.882 -0.819 -8.350 1.00 0.00 N ATOM 957 CA VAL A 72 11.964 -1.993 -8.388 1.00 0.00 C ATOM 958 C VAL A 72 10.544 -1.576 -8.781 1.00 0.00 C ATOM 959 O VAL A 72 10.004 -0.609 -8.281 1.00 0.00 O ATOM 960 CB VAL A 72 11.977 -2.556 -6.963 1.00 0.00 C ATOM 961 CG1 VAL A 72 11.097 -1.693 -6.053 1.00 0.00 C ATOM 962 CG2 VAL A 72 11.435 -3.986 -6.979 1.00 0.00 C ATOM 0 H VAL A 72 12.828 -0.251 -7.504 1.00 0.00 H new ATOM 0 HA VAL A 72 12.285 -2.726 -9.128 1.00 0.00 H new ATOM 0 HB VAL A 72 12.999 -2.551 -6.585 1.00 0.00 H new ATOM 0 HG11 VAL A 72 11.111 -2.099 -5.042 1.00 0.00 H new ATOM 0 HG12 VAL A 72 11.479 -0.672 -6.039 1.00 0.00 H new ATOM 0 HG13 VAL A 72 10.074 -1.693 -6.430 1.00 0.00 H new ATOM 0 HG21 VAL A 72 11.443 -4.389 -5.966 1.00 0.00 H new ATOM 0 HG22 VAL A 72 10.414 -3.984 -7.361 1.00 0.00 H new ATOM 0 HG23 VAL A 72 12.061 -4.605 -7.621 1.00 0.00 H new ATOM 972 N THR A 73 9.932 -2.323 -9.655 1.00 0.00 N ATOM 973 CA THR A 73 8.538 -2.009 -10.073 1.00 0.00 C ATOM 974 C THR A 73 7.652 -3.213 -9.752 1.00 0.00 C ATOM 975 O THR A 73 7.457 -4.088 -10.572 1.00 0.00 O ATOM 976 CB THR A 73 8.612 -1.776 -11.583 1.00 0.00 C ATOM 977 OG1 THR A 73 9.453 -0.662 -11.847 1.00 0.00 O ATOM 978 CG2 THR A 73 7.209 -1.499 -12.127 1.00 0.00 C ATOM 0 H THR A 73 10.341 -3.144 -10.101 1.00 0.00 H new ATOM 0 HA THR A 73 8.122 -1.140 -9.563 1.00 0.00 H new ATOM 0 HB THR A 73 9.019 -2.663 -12.069 1.00 0.00 H new ATOM 0 HG1 THR A 73 9.503 -0.512 -12.814 1.00 0.00 H new ATOM 0 HG21 THR A 73 7.262 -1.333 -13.203 1.00 0.00 H new ATOM 0 HG22 THR A 73 6.564 -2.354 -11.923 1.00 0.00 H new ATOM 0 HG23 THR A 73 6.800 -0.612 -11.643 1.00 0.00 H new ATOM 986 N VAL A 74 7.133 -3.278 -8.556 1.00 0.00 N ATOM 987 CA VAL A 74 6.285 -4.446 -8.182 1.00 0.00 C ATOM 988 C VAL A 74 4.816 -4.180 -8.519 1.00 0.00 C ATOM 989 O VAL A 74 4.503 -3.481 -9.462 1.00 0.00 O ATOM 990 CB VAL A 74 6.490 -4.614 -6.674 1.00 0.00 C ATOM 991 CG1 VAL A 74 7.990 -4.602 -6.363 1.00 0.00 C ATOM 992 CG2 VAL A 74 5.812 -3.466 -5.921 1.00 0.00 C ATOM 0 H VAL A 74 7.258 -2.577 -7.825 1.00 0.00 H new ATOM 0 HA VAL A 74 6.559 -5.348 -8.729 1.00 0.00 H new ATOM 0 HB VAL A 74 6.051 -5.560 -6.358 1.00 0.00 H new ATOM 0 HG11 VAL A 74 8.140 -4.721 -5.290 1.00 0.00 H new ATOM 0 HG12 VAL A 74 8.478 -5.421 -6.891 1.00 0.00 H new ATOM 0 HG13 VAL A 74 8.421 -3.655 -6.686 1.00 0.00 H new ATOM 0 HG21 VAL A 74 5.963 -3.594 -4.849 1.00 0.00 H new ATOM 0 HG22 VAL A 74 6.245 -2.517 -6.238 1.00 0.00 H new ATOM 0 HG23 VAL A 74 4.744 -3.468 -6.139 1.00 0.00 H new ATOM 1002 N ARG A 75 3.913 -4.741 -7.763 1.00 0.00 N ATOM 1003 CA ARG A 75 2.467 -4.526 -8.052 1.00 0.00 C ATOM 1004 C ARG A 75 1.728 -4.062 -6.794 1.00 0.00 C ATOM 1005 O ARG A 75 1.709 -4.740 -5.787 1.00 0.00 O ATOM 1006 CB ARG A 75 1.954 -5.895 -8.501 1.00 0.00 C ATOM 1007 CG ARG A 75 2.100 -6.023 -10.019 1.00 0.00 C ATOM 1008 CD ARG A 75 0.719 -6.219 -10.649 1.00 0.00 C ATOM 1009 NE ARG A 75 0.119 -4.857 -10.688 1.00 0.00 N ATOM 1010 CZ ARG A 75 -0.642 -4.508 -11.690 1.00 0.00 C ATOM 1011 NH1 ARG A 75 -0.103 -4.105 -12.808 1.00 0.00 N ATOM 1012 NH2 ARG A 75 -1.940 -4.562 -11.573 1.00 0.00 N ATOM 0 H ARG A 75 4.113 -5.337 -6.960 1.00 0.00 H new ATOM 0 HA ARG A 75 2.308 -3.756 -8.807 1.00 0.00 H new ATOM 0 HB2 ARG A 75 2.515 -6.686 -8.003 1.00 0.00 H new ATOM 0 HB3 ARG A 75 0.909 -6.016 -8.214 1.00 0.00 H new ATOM 0 HG2 ARG A 75 2.574 -5.130 -10.426 1.00 0.00 H new ATOM 0 HG3 ARG A 75 2.746 -6.866 -10.263 1.00 0.00 H new ATOM 0 HD2 ARG A 75 0.798 -6.645 -11.649 1.00 0.00 H new ATOM 0 HD3 ARG A 75 0.109 -6.903 -10.059 1.00 0.00 H new ATOM 0 HE ARG A 75 0.302 -4.197 -9.932 1.00 0.00 H new ATOM 0 HH11 ARG A 75 0.912 -4.063 -12.899 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -0.697 -3.832 -13.591 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -2.361 -4.877 -10.699 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -2.534 -4.289 -12.356 1.00 0.00 H new ATOM 1026 N ALA A 76 1.110 -2.913 -6.848 1.00 0.00 N ATOM 1027 CA ALA A 76 0.362 -2.406 -5.661 1.00 0.00 C ATOM 1028 C ALA A 76 -1.115 -2.237 -6.018 1.00 0.00 C ATOM 1029 O ALA A 76 -1.475 -2.172 -7.176 1.00 0.00 O ATOM 1030 CB ALA A 76 0.995 -1.052 -5.337 1.00 0.00 C ATOM 0 H ALA A 76 1.091 -2.302 -7.665 1.00 0.00 H new ATOM 0 HA ALA A 76 0.415 -3.087 -4.812 1.00 0.00 H new ATOM 0 HB1 ALA A 76 0.496 -0.615 -4.472 1.00 0.00 H new ATOM 0 HB2 ALA A 76 2.053 -1.189 -5.115 1.00 0.00 H new ATOM 0 HB3 ALA A 76 0.887 -0.386 -6.193 1.00 0.00 H new ATOM 1036 N LEU A 77 -1.976 -2.165 -5.038 1.00 0.00 N ATOM 1037 CA LEU A 77 -3.426 -2.003 -5.337 1.00 0.00 C ATOM 1038 C LEU A 77 -4.245 -2.014 -4.041 1.00 0.00 C ATOM 1039 O LEU A 77 -3.735 -1.762 -2.968 1.00 0.00 O ATOM 1040 CB LEU A 77 -3.789 -3.207 -6.212 1.00 0.00 C ATOM 1041 CG LEU A 77 -3.291 -4.494 -5.551 1.00 0.00 C ATOM 1042 CD1 LEU A 77 -4.254 -4.900 -4.434 1.00 0.00 C ATOM 1043 CD2 LEU A 77 -3.225 -5.610 -6.596 1.00 0.00 C ATOM 0 H LEU A 77 -1.738 -2.211 -4.047 1.00 0.00 H new ATOM 0 HA LEU A 77 -3.638 -1.057 -5.835 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -4.869 -3.254 -6.353 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -3.343 -3.098 -7.200 1.00 0.00 H new ATOM 0 HG LEU A 77 -2.299 -4.327 -5.132 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -3.899 -5.817 -3.963 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -4.303 -4.105 -3.690 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -5.247 -5.068 -4.852 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -2.870 -6.528 -6.127 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -4.218 -5.776 -7.014 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -2.540 -5.322 -7.393 1.00 0.00 H new ATOM 1055 N VAL A 78 -5.513 -2.306 -4.140 1.00 0.00 N ATOM 1056 CA VAL A 78 -6.381 -2.338 -2.927 1.00 0.00 C ATOM 1057 C VAL A 78 -7.496 -3.366 -3.131 1.00 0.00 C ATOM 1058 O VAL A 78 -7.740 -3.809 -4.236 1.00 0.00 O ATOM 1059 CB VAL A 78 -6.960 -0.926 -2.819 1.00 0.00 C ATOM 1060 CG1 VAL A 78 -7.693 -0.769 -1.486 1.00 0.00 C ATOM 1061 CG2 VAL A 78 -5.823 0.096 -2.896 1.00 0.00 C ATOM 0 H VAL A 78 -5.989 -2.525 -5.015 1.00 0.00 H new ATOM 0 HA VAL A 78 -5.839 -2.619 -2.024 1.00 0.00 H new ATOM 0 HB VAL A 78 -7.660 -0.760 -3.638 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -8.104 0.238 -1.413 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -8.503 -1.496 -1.428 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -6.996 -0.937 -0.665 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -6.233 1.103 -2.819 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -5.124 -0.075 -2.077 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -5.301 -0.012 -3.847 1.00 0.00 H new ATOM 1071 N GLY A 79 -8.176 -3.758 -2.088 1.00 0.00 N ATOM 1072 CA GLY A 79 -9.263 -4.762 -2.268 1.00 0.00 C ATOM 1073 C GLY A 79 -10.043 -4.948 -0.968 1.00 0.00 C ATOM 1074 O GLY A 79 -9.928 -4.171 -0.041 1.00 0.00 O ATOM 0 H GLY A 79 -8.029 -3.432 -1.133 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -9.938 -4.437 -3.060 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -8.837 -5.715 -2.583 1.00 0.00 H new ATOM 1078 N GLN A 80 -10.843 -5.978 -0.900 1.00 0.00 N ATOM 1079 CA GLN A 80 -11.645 -6.228 0.330 1.00 0.00 C ATOM 1080 C GLN A 80 -11.192 -7.524 1.008 1.00 0.00 C ATOM 1081 O GLN A 80 -11.755 -8.578 0.790 1.00 0.00 O ATOM 1082 CB GLN A 80 -13.092 -6.348 -0.167 1.00 0.00 C ATOM 1083 CG GLN A 80 -13.950 -7.124 0.844 1.00 0.00 C ATOM 1084 CD GLN A 80 -13.564 -6.736 2.274 1.00 0.00 C ATOM 1085 OE1 GLN A 80 -13.646 -5.583 2.645 1.00 0.00 O ATOM 1086 NE2 GLN A 80 -13.143 -7.659 3.097 1.00 0.00 N ATOM 0 H GLN A 80 -10.975 -6.659 -1.647 1.00 0.00 H new ATOM 0 HA GLN A 80 -11.531 -5.436 1.070 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -13.512 -5.354 -0.321 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -13.110 -6.855 -1.132 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -15.006 -6.912 0.674 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -13.813 -8.196 0.701 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -13.074 -8.628 2.785 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -12.883 -7.411 4.052 1.00 0.00 H new ATOM 1095 N ASN A 81 -10.189 -7.456 1.839 1.00 0.00 N ATOM 1096 CA ASN A 81 -9.726 -8.688 2.535 1.00 0.00 C ATOM 1097 C ASN A 81 -10.821 -9.173 3.487 1.00 0.00 C ATOM 1098 O ASN A 81 -10.991 -8.651 4.574 1.00 0.00 O ATOM 1099 CB ASN A 81 -8.476 -8.268 3.312 1.00 0.00 C ATOM 1100 CG ASN A 81 -7.239 -8.466 2.434 1.00 0.00 C ATOM 1101 OD1 ASN A 81 -6.363 -9.241 2.764 1.00 0.00 O ATOM 1102 ND2 ASN A 81 -7.130 -7.794 1.320 1.00 0.00 N ATOM 0 H ASN A 81 -9.673 -6.606 2.065 1.00 0.00 H new ATOM 0 HA ASN A 81 -9.508 -9.504 1.846 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -8.557 -7.224 3.615 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -8.386 -8.858 4.224 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -6.310 -7.920 0.727 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -7.865 -7.143 1.043 1.00 0.00 H new ATOM 1109 N GLY A 82 -11.575 -10.160 3.077 1.00 0.00 N ATOM 1110 CA GLY A 82 -12.672 -10.682 3.942 1.00 0.00 C ATOM 1111 C GLY A 82 -13.777 -11.269 3.061 1.00 0.00 C ATOM 1112 O GLY A 82 -13.787 -12.447 2.766 1.00 0.00 O ATOM 0 H GLY A 82 -11.477 -10.628 2.176 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -12.286 -11.445 4.617 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -13.073 -9.881 4.563 1.00 0.00 H new ATOM 1116 N ALA A 83 -14.709 -10.458 2.638 1.00 0.00 N ATOM 1117 CA ALA A 83 -15.810 -10.972 1.776 1.00 0.00 C ATOM 1118 C ALA A 83 -16.862 -9.877 1.551 1.00 0.00 C ATOM 1119 O ALA A 83 -17.113 -9.078 2.432 1.00 0.00 O ATOM 1120 CB ALA A 83 -16.409 -12.136 2.562 1.00 0.00 C ATOM 0 H ALA A 83 -14.755 -9.462 2.853 1.00 0.00 H new ATOM 0 HA ALA A 83 -15.458 -11.280 0.791 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -17.231 -12.573 1.995 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -15.643 -12.892 2.733 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -16.782 -11.774 3.520 1.00 0.00 H new ATOM 1126 N PRO A 84 -17.452 -9.873 0.378 1.00 0.00 N ATOM 1127 CA PRO A 84 -17.117 -10.866 -0.671 1.00 0.00 C ATOM 1128 C PRO A 84 -15.893 -10.411 -1.476 1.00 0.00 C ATOM 1129 O PRO A 84 -15.784 -10.679 -2.656 1.00 0.00 O ATOM 1130 CB PRO A 84 -18.360 -10.878 -1.552 1.00 0.00 C ATOM 1131 CG PRO A 84 -19.007 -9.537 -1.360 1.00 0.00 C ATOM 1132 CD PRO A 84 -18.494 -8.945 -0.067 1.00 0.00 C ATOM 0 HA PRO A 84 -16.867 -11.847 -0.266 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -18.097 -11.040 -2.597 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -19.036 -11.684 -1.265 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -18.774 -8.879 -2.198 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -20.092 -9.640 -1.327 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -18.093 -7.943 -0.222 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -19.290 -8.859 0.673 1.00 0.00 H new ATOM 1140 N TYR A 85 -14.974 -9.725 -0.851 1.00 0.00 N ATOM 1141 CA TYR A 85 -13.761 -9.254 -1.584 1.00 0.00 C ATOM 1142 C TYR A 85 -14.151 -8.249 -2.671 1.00 0.00 C ATOM 1143 O TYR A 85 -15.287 -7.828 -2.765 1.00 0.00 O ATOM 1144 CB TYR A 85 -13.152 -10.509 -2.214 1.00 0.00 C ATOM 1145 CG TYR A 85 -13.147 -11.636 -1.210 1.00 0.00 C ATOM 1146 CD1 TYR A 85 -12.154 -11.692 -0.225 1.00 0.00 C ATOM 1147 CD2 TYR A 85 -14.133 -12.629 -1.266 1.00 0.00 C ATOM 1148 CE1 TYR A 85 -12.146 -12.740 0.704 1.00 0.00 C ATOM 1149 CE2 TYR A 85 -14.125 -13.677 -0.338 1.00 0.00 C ATOM 1150 CZ TYR A 85 -13.132 -13.732 0.646 1.00 0.00 C ATOM 1151 OH TYR A 85 -13.124 -14.766 1.561 1.00 0.00 O ATOM 0 H TYR A 85 -15.010 -9.470 0.136 1.00 0.00 H new ATOM 0 HA TYR A 85 -13.058 -8.751 -0.921 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -13.724 -10.798 -3.096 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -12.135 -10.302 -2.547 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -11.393 -10.926 -0.181 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -14.900 -12.586 -2.025 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -11.380 -12.783 1.464 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -14.885 -14.443 -0.382 1.00 0.00 H new ATOM 0 HH TYR A 85 -13.423 -14.434 2.433 1.00 0.00 H new ATOM 1161 N GLY A 86 -13.213 -7.861 -3.491 1.00 0.00 N ATOM 1162 CA GLY A 86 -13.520 -6.882 -4.572 1.00 0.00 C ATOM 1163 C GLY A 86 -12.359 -5.894 -4.703 1.00 0.00 C ATOM 1164 O GLY A 86 -12.245 -4.953 -3.943 1.00 0.00 O ATOM 0 H GLY A 86 -12.245 -8.181 -3.459 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -13.678 -7.403 -5.516 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -14.443 -6.349 -4.344 1.00 0.00 H new ATOM 1168 N THR A 87 -11.494 -6.102 -5.657 1.00 0.00 N ATOM 1169 CA THR A 87 -10.339 -5.174 -5.830 1.00 0.00 C ATOM 1170 C THR A 87 -10.712 -4.030 -6.775 1.00 0.00 C ATOM 1171 O THR A 87 -11.436 -4.213 -7.733 1.00 0.00 O ATOM 1172 CB THR A 87 -9.228 -6.030 -6.440 1.00 0.00 C ATOM 1173 OG1 THR A 87 -9.797 -6.972 -7.339 1.00 0.00 O ATOM 1174 CG2 THR A 87 -8.481 -6.769 -5.328 1.00 0.00 C ATOM 0 H THR A 87 -11.536 -6.873 -6.324 1.00 0.00 H new ATOM 0 HA THR A 87 -10.034 -4.720 -4.887 1.00 0.00 H new ATOM 0 HB THR A 87 -8.530 -5.389 -6.979 1.00 0.00 H new ATOM 0 HG1 THR A 87 -9.086 -7.520 -7.732 1.00 0.00 H new ATOM 0 HG21 THR A 87 -7.690 -7.379 -5.764 1.00 0.00 H new ATOM 0 HG22 THR A 87 -8.044 -6.045 -4.640 1.00 0.00 H new ATOM 0 HG23 THR A 87 -9.176 -7.410 -4.787 1.00 0.00 H new ATOM 1182 N VAL A 88 -10.222 -2.850 -6.511 1.00 0.00 N ATOM 1183 CA VAL A 88 -10.547 -1.692 -7.393 1.00 0.00 C ATOM 1184 C VAL A 88 -9.261 -1.046 -7.919 1.00 0.00 C ATOM 1185 O VAL A 88 -9.278 -0.300 -8.878 1.00 0.00 O ATOM 1186 CB VAL A 88 -11.313 -0.717 -6.499 1.00 0.00 C ATOM 1187 CG1 VAL A 88 -12.623 -1.363 -6.044 1.00 0.00 C ATOM 1188 CG2 VAL A 88 -10.463 -0.374 -5.273 1.00 0.00 C ATOM 0 H VAL A 88 -9.611 -2.637 -5.723 1.00 0.00 H new ATOM 0 HA VAL A 88 -11.129 -1.988 -8.265 1.00 0.00 H new ATOM 0 HB VAL A 88 -11.531 0.193 -7.058 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -13.169 -0.668 -5.406 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -13.229 -1.609 -6.916 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -12.405 -2.273 -5.485 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -11.009 0.321 -4.635 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -10.246 -1.285 -4.715 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -9.529 0.086 -5.595 1.00 0.00 H new ATOM 1198 N LEU A 89 -8.146 -1.329 -7.302 1.00 0.00 N ATOM 1199 CA LEU A 89 -6.862 -0.733 -7.771 1.00 0.00 C ATOM 1200 C LEU A 89 -6.015 -1.771 -8.507 1.00 0.00 C ATOM 1201 O LEU A 89 -5.932 -2.916 -8.110 1.00 0.00 O ATOM 1202 CB LEU A 89 -6.150 -0.270 -6.512 1.00 0.00 C ATOM 1203 CG LEU A 89 -6.516 1.183 -6.248 1.00 0.00 C ATOM 1204 CD1 LEU A 89 -7.857 1.249 -5.523 1.00 0.00 C ATOM 1205 CD2 LEU A 89 -5.428 1.816 -5.389 1.00 0.00 C ATOM 0 H LEU A 89 -8.068 -1.947 -6.494 1.00 0.00 H new ATOM 0 HA LEU A 89 -7.033 0.085 -8.471 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -6.439 -0.892 -5.665 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -5.071 -0.372 -6.629 1.00 0.00 H new ATOM 0 HG LEU A 89 -6.598 1.724 -7.191 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -8.118 2.290 -5.335 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -8.628 0.788 -6.141 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -7.785 0.716 -4.575 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -5.680 2.858 -5.193 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -5.351 1.278 -4.444 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -4.474 1.765 -5.914 1.00 0.00 H new ATOM 1217 N ASP A 90 -5.380 -1.375 -9.574 1.00 0.00 N ATOM 1218 CA ASP A 90 -4.530 -2.334 -10.336 1.00 0.00 C ATOM 1219 C ASP A 90 -3.381 -1.590 -11.026 1.00 0.00 C ATOM 1220 O ASP A 90 -3.531 -1.077 -12.117 1.00 0.00 O ATOM 1221 CB ASP A 90 -5.466 -2.957 -11.372 1.00 0.00 C ATOM 1222 CG ASP A 90 -5.861 -4.364 -10.923 1.00 0.00 C ATOM 1223 OD1 ASP A 90 -5.074 -4.986 -10.229 1.00 0.00 O ATOM 1224 OD2 ASP A 90 -6.944 -4.797 -11.280 1.00 0.00 O ATOM 0 H ASP A 90 -5.412 -0.428 -9.952 1.00 0.00 H new ATOM 0 HA ASP A 90 -4.078 -3.088 -9.691 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -6.356 -2.339 -11.492 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -4.974 -2.999 -12.344 1.00 0.00 H new ATOM 1229 N THR A 91 -2.236 -1.525 -10.400 1.00 0.00 N ATOM 1230 CA THR A 91 -1.086 -0.811 -11.029 1.00 0.00 C ATOM 1231 C THR A 91 0.235 -1.264 -10.398 1.00 0.00 C ATOM 1232 O THR A 91 0.267 -2.156 -9.574 1.00 0.00 O ATOM 1233 CB THR A 91 -1.336 0.670 -10.742 1.00 0.00 C ATOM 1234 OG1 THR A 91 -1.814 0.818 -9.412 1.00 0.00 O ATOM 1235 CG2 THR A 91 -2.375 1.214 -11.723 1.00 0.00 C ATOM 0 H THR A 91 -2.047 -1.933 -9.485 1.00 0.00 H new ATOM 0 HA THR A 91 -1.011 -1.015 -12.097 1.00 0.00 H new ATOM 0 HB THR A 91 -0.405 1.225 -10.858 1.00 0.00 H new ATOM 0 HG1 THR A 91 -1.973 1.767 -9.225 1.00 0.00 H new ATOM 0 HG21 THR A 91 -2.552 2.270 -11.517 1.00 0.00 H new ATOM 0 HG22 THR A 91 -2.007 1.100 -12.743 1.00 0.00 H new ATOM 0 HG23 THR A 91 -3.307 0.661 -11.609 1.00 0.00 H new ATOM 1243 N SER A 92 1.325 -0.653 -10.779 1.00 0.00 N ATOM 1244 CA SER A 92 2.644 -1.046 -10.202 1.00 0.00 C ATOM 1245 C SER A 92 3.346 0.180 -9.606 1.00 0.00 C ATOM 1246 O SER A 92 3.475 1.198 -10.257 1.00 0.00 O ATOM 1247 CB SER A 92 3.443 -1.599 -11.382 1.00 0.00 C ATOM 1248 OG SER A 92 3.371 -0.684 -12.467 1.00 0.00 O ATOM 0 H SER A 92 1.359 0.101 -11.465 1.00 0.00 H new ATOM 0 HA SER A 92 2.543 -1.777 -9.400 1.00 0.00 H new ATOM 0 HB2 SER A 92 4.482 -1.755 -11.091 1.00 0.00 H new ATOM 0 HB3 SER A 92 3.046 -2.569 -11.682 1.00 0.00 H new ATOM 0 HG SER A 92 3.362 0.233 -12.122 1.00 0.00 H new ATOM 1254 N PRO A 93 3.773 0.041 -8.379 1.00 0.00 N ATOM 1255 CA PRO A 93 4.465 1.152 -7.680 1.00 0.00 C ATOM 1256 C PRO A 93 5.889 1.331 -8.211 1.00 0.00 C ATOM 1257 O PRO A 93 6.847 0.938 -7.576 1.00 0.00 O ATOM 1258 CB PRO A 93 4.499 0.693 -6.226 1.00 0.00 C ATOM 1259 CG PRO A 93 4.425 -0.797 -6.290 1.00 0.00 C ATOM 1260 CD PRO A 93 3.651 -1.151 -7.533 1.00 0.00 C ATOM 0 HA PRO A 93 3.965 2.111 -7.819 1.00 0.00 H new ATOM 0 HB2 PRO A 93 5.412 1.022 -5.729 1.00 0.00 H new ATOM 0 HB3 PRO A 93 3.663 1.106 -5.662 1.00 0.00 H new ATOM 0 HG2 PRO A 93 5.424 -1.231 -6.322 1.00 0.00 H new ATOM 0 HG3 PRO A 93 3.933 -1.196 -5.403 1.00 0.00 H new ATOM 0 HD2 PRO A 93 4.065 -2.032 -8.023 1.00 0.00 H new ATOM 0 HD3 PRO A 93 2.609 -1.373 -7.304 1.00 0.00 H new ATOM 1268 N ALA A 94 6.044 1.928 -9.360 1.00 0.00 N ATOM 1269 CA ALA A 94 7.418 2.132 -9.900 1.00 0.00 C ATOM 1270 C ALA A 94 8.296 2.773 -8.823 1.00 0.00 C ATOM 1271 O ALA A 94 7.878 3.681 -8.134 1.00 0.00 O ATOM 1272 CB ALA A 94 7.243 3.078 -11.089 1.00 0.00 C ATOM 0 H ALA A 94 5.286 2.281 -9.944 1.00 0.00 H new ATOM 0 HA ALA A 94 7.897 1.200 -10.199 1.00 0.00 H new ATOM 0 HB1 ALA A 94 8.214 3.277 -11.542 1.00 0.00 H new ATOM 0 HB2 ALA A 94 6.586 2.617 -11.827 1.00 0.00 H new ATOM 0 HB3 ALA A 94 6.803 4.015 -10.747 1.00 0.00 H new ATOM 1278 N LEU A 95 9.504 2.307 -8.660 1.00 0.00 N ATOM 1279 CA LEU A 95 10.385 2.898 -7.612 1.00 0.00 C ATOM 1280 C LEU A 95 11.798 3.128 -8.153 1.00 0.00 C ATOM 1281 O LEU A 95 12.156 2.652 -9.212 1.00 0.00 O ATOM 1282 CB LEU A 95 10.406 1.865 -6.488 1.00 0.00 C ATOM 1283 CG LEU A 95 9.073 1.900 -5.742 1.00 0.00 C ATOM 1284 CD1 LEU A 95 8.892 0.600 -4.959 1.00 0.00 C ATOM 1285 CD2 LEU A 95 9.064 3.086 -4.775 1.00 0.00 C ATOM 0 H LEU A 95 9.917 1.548 -9.202 1.00 0.00 H new ATOM 0 HA LEU A 95 10.021 3.869 -7.275 1.00 0.00 H new ATOM 0 HB2 LEU A 95 10.580 0.870 -6.897 1.00 0.00 H new ATOM 0 HB3 LEU A 95 11.226 2.075 -5.801 1.00 0.00 H new ATOM 0 HG LEU A 95 8.257 2.007 -6.457 1.00 0.00 H new ATOM 0 HD11 LEU A 95 7.941 0.625 -4.427 1.00 0.00 H new ATOM 0 HD12 LEU A 95 8.900 -0.244 -5.649 1.00 0.00 H new ATOM 0 HD13 LEU A 95 9.706 0.491 -4.242 1.00 0.00 H new ATOM 0 HD21 LEU A 95 8.114 3.113 -4.241 1.00 0.00 H new ATOM 0 HD22 LEU A 95 9.879 2.978 -4.059 1.00 0.00 H new ATOM 0 HD23 LEU A 95 9.193 4.013 -5.334 1.00 0.00 H new ATOM 1297 N THR A 96 12.603 3.854 -7.426 1.00 0.00 N ATOM 1298 CA THR A 96 13.996 4.119 -7.883 1.00 0.00 C ATOM 1299 C THR A 96 14.829 4.676 -6.723 1.00 0.00 C ATOM 1300 O THR A 96 14.553 4.413 -5.570 1.00 0.00 O ATOM 1301 CB THR A 96 13.857 5.150 -9.007 1.00 0.00 C ATOM 1302 OG1 THR A 96 15.074 5.225 -9.736 1.00 0.00 O ATOM 1303 CG2 THR A 96 13.526 6.523 -8.418 1.00 0.00 C ATOM 0 H THR A 96 12.354 4.276 -6.532 1.00 0.00 H new ATOM 0 HA THR A 96 14.502 3.218 -8.229 1.00 0.00 H new ATOM 0 HB THR A 96 13.051 4.845 -9.675 1.00 0.00 H new ATOM 0 HG1 THR A 96 15.489 4.338 -9.772 1.00 0.00 H new ATOM 0 HG21 THR A 96 13.429 7.251 -9.224 1.00 0.00 H new ATOM 0 HG22 THR A 96 12.588 6.465 -7.866 1.00 0.00 H new ATOM 0 HG23 THR A 96 14.325 6.832 -7.744 1.00 0.00 H new ATOM 1311 N SER A 97 15.844 5.440 -7.015 1.00 0.00 N ATOM 1312 CA SER A 97 16.689 6.004 -5.921 1.00 0.00 C ATOM 1313 C SER A 97 16.084 7.310 -5.399 1.00 0.00 C ATOM 1314 O SER A 97 16.263 7.673 -4.254 1.00 0.00 O ATOM 1315 CB SER A 97 18.052 6.257 -6.564 1.00 0.00 C ATOM 1316 OG SER A 97 18.498 7.565 -6.226 1.00 0.00 O ATOM 0 H SER A 97 16.126 5.699 -7.960 1.00 0.00 H new ATOM 0 HA SER A 97 16.762 5.331 -5.067 1.00 0.00 H new ATOM 0 HB2 SER A 97 18.772 5.515 -6.220 1.00 0.00 H new ATOM 0 HB3 SER A 97 17.981 6.154 -7.647 1.00 0.00 H new ATOM 0 HG SER A 97 19.373 7.729 -6.636 1.00 0.00 H new ATOM 1322 N GLU A 98 15.370 8.018 -6.229 1.00 0.00 N ATOM 1323 CA GLU A 98 14.756 9.298 -5.776 1.00 0.00 C ATOM 1324 C GLU A 98 13.361 9.037 -5.202 1.00 0.00 C ATOM 1325 O GLU A 98 12.881 7.921 -5.222 1.00 0.00 O ATOM 1326 CB GLU A 98 14.667 10.162 -7.034 1.00 0.00 C ATOM 1327 CG GLU A 98 15.734 11.257 -6.978 1.00 0.00 C ATOM 1328 CD GLU A 98 17.014 10.759 -7.652 1.00 0.00 C ATOM 1329 OE1 GLU A 98 17.018 10.653 -8.867 1.00 0.00 O ATOM 1330 OE2 GLU A 98 17.969 10.492 -6.941 1.00 0.00 O ATOM 0 H GLU A 98 15.185 7.767 -7.200 1.00 0.00 H new ATOM 0 HA GLU A 98 15.338 9.782 -4.992 1.00 0.00 H new ATOM 0 HB2 GLU A 98 14.809 9.546 -7.922 1.00 0.00 H new ATOM 0 HB3 GLU A 98 13.676 10.609 -7.112 1.00 0.00 H new ATOM 0 HG2 GLU A 98 15.374 12.156 -7.478 1.00 0.00 H new ATOM 0 HG3 GLU A 98 15.938 11.528 -5.942 1.00 0.00 H new ATOM 1337 N PRO A 99 12.757 10.081 -4.708 1.00 0.00 N ATOM 1338 CA PRO A 99 11.400 9.968 -4.120 1.00 0.00 C ATOM 1339 C PRO A 99 10.359 9.755 -5.222 1.00 0.00 C ATOM 1340 O PRO A 99 10.367 10.428 -6.233 1.00 0.00 O ATOM 1341 CB PRO A 99 11.196 11.314 -3.429 1.00 0.00 C ATOM 1342 CG PRO A 99 12.101 12.260 -4.152 1.00 0.00 C ATOM 1343 CD PRO A 99 13.272 11.453 -4.652 1.00 0.00 C ATOM 0 HA PRO A 99 11.296 9.125 -3.437 1.00 0.00 H new ATOM 0 HB2 PRO A 99 10.157 11.636 -3.491 1.00 0.00 H new ATOM 0 HB3 PRO A 99 11.449 11.257 -2.370 1.00 0.00 H new ATOM 0 HG2 PRO A 99 11.578 12.736 -4.982 1.00 0.00 H new ATOM 0 HG3 PRO A 99 12.437 13.056 -3.488 1.00 0.00 H new ATOM 0 HD2 PRO A 99 13.604 11.795 -5.632 1.00 0.00 H new ATOM 0 HD3 PRO A 99 14.127 11.532 -3.981 1.00 0.00 H new ATOM 1351 N ARG A 100 9.463 8.824 -5.037 1.00 0.00 N ATOM 1352 CA ARG A 100 8.429 8.574 -6.080 1.00 0.00 C ATOM 1353 C ARG A 100 7.030 8.805 -5.504 1.00 0.00 C ATOM 1354 O ARG A 100 6.362 7.884 -5.078 1.00 0.00 O ATOM 1355 CB ARG A 100 8.612 7.109 -6.475 1.00 0.00 C ATOM 1356 CG ARG A 100 9.179 7.030 -7.893 1.00 0.00 C ATOM 1357 CD ARG A 100 8.283 6.137 -8.753 1.00 0.00 C ATOM 1358 NE ARG A 100 7.833 7.009 -9.873 1.00 0.00 N ATOM 1359 CZ ARG A 100 7.176 6.495 -10.876 1.00 0.00 C ATOM 1360 NH1 ARG A 100 6.033 5.899 -10.670 1.00 0.00 N ATOM 1361 NH2 ARG A 100 7.660 6.576 -12.085 1.00 0.00 N ATOM 0 H ARG A 100 9.403 8.228 -4.212 1.00 0.00 H new ATOM 0 HA ARG A 100 8.534 9.242 -6.935 1.00 0.00 H new ATOM 0 HB2 ARG A 100 9.285 6.614 -5.775 1.00 0.00 H new ATOM 0 HB3 ARG A 100 7.657 6.586 -6.424 1.00 0.00 H new ATOM 0 HG2 ARG A 100 9.240 8.028 -8.327 1.00 0.00 H new ATOM 0 HG3 ARG A 100 10.193 6.630 -7.869 1.00 0.00 H new ATOM 0 HD2 ARG A 100 8.829 5.269 -9.123 1.00 0.00 H new ATOM 0 HD3 ARG A 100 7.435 5.760 -8.181 1.00 0.00 H new ATOM 0 HE ARG A 100 8.038 8.008 -9.856 1.00 0.00 H new ATOM 0 HH11 ARG A 100 5.654 5.835 -9.725 1.00 0.00 H new ATOM 0 HH12 ARG A 100 5.519 5.497 -11.454 1.00 0.00 H new ATOM 0 HH21 ARG A 100 8.553 7.042 -12.247 1.00 0.00 H new ATOM 0 HH22 ARG A 100 7.145 6.174 -12.868 1.00 0.00 H new ATOM 1375 N GLN A 101 6.583 10.031 -5.489 1.00 0.00 N ATOM 1376 CA GLN A 101 5.229 10.326 -4.943 1.00 0.00 C ATOM 1377 C GLN A 101 4.152 9.752 -5.867 1.00 0.00 C ATOM 1378 O GLN A 101 4.374 9.548 -7.044 1.00 0.00 O ATOM 1379 CB GLN A 101 5.144 11.851 -4.904 1.00 0.00 C ATOM 1380 CG GLN A 101 6.307 12.406 -4.079 1.00 0.00 C ATOM 1381 CD GLN A 101 6.453 13.905 -4.349 1.00 0.00 C ATOM 1382 OE1 GLN A 101 5.407 14.592 -4.719 1.00 0.00 O flip ATOM 1383 NE2 GLN A 101 7.528 14.455 -4.223 1.00 0.00 N flip ATOM 0 H GLN A 101 7.098 10.842 -5.832 1.00 0.00 H new ATOM 0 HA GLN A 101 5.073 9.883 -3.959 1.00 0.00 H new ATOM 0 HB2 GLN A 101 5.178 12.254 -5.916 1.00 0.00 H new ATOM 0 HB3 GLN A 101 4.194 12.162 -4.469 1.00 0.00 H new ATOM 0 HG2 GLN A 101 6.130 12.232 -3.018 1.00 0.00 H new ATOM 0 HG3 GLN A 101 7.230 11.887 -4.337 1.00 0.00 H new ATOM 0 HE21 GLN A 101 8.345 13.917 -3.934 1.00 0.00 H new ATOM 0 HE22 GLN A 101 7.614 15.455 -4.406 1.00 0.00 H new ATOM 1392 N VAL A 102 2.987 9.490 -5.343 1.00 0.00 N ATOM 1393 CA VAL A 102 1.898 8.930 -6.193 1.00 0.00 C ATOM 1394 C VAL A 102 0.591 9.684 -5.938 1.00 0.00 C ATOM 1395 O VAL A 102 0.213 9.926 -4.810 1.00 0.00 O ATOM 1396 CB VAL A 102 1.768 7.470 -5.760 1.00 0.00 C ATOM 1397 CG1 VAL A 102 0.680 6.787 -6.590 1.00 0.00 C ATOM 1398 CG2 VAL A 102 3.102 6.754 -5.980 1.00 0.00 C ATOM 0 H VAL A 102 2.742 9.639 -4.364 1.00 0.00 H new ATOM 0 HA VAL A 102 2.116 9.021 -7.257 1.00 0.00 H new ATOM 0 HB VAL A 102 1.501 7.426 -4.704 1.00 0.00 H new ATOM 0 HG11 VAL A 102 0.587 5.746 -6.282 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -0.270 7.298 -6.435 1.00 0.00 H new ATOM 0 HG13 VAL A 102 0.947 6.830 -7.646 1.00 0.00 H new ATOM 0 HG21 VAL A 102 3.011 5.712 -5.672 1.00 0.00 H new ATOM 0 HG22 VAL A 102 3.369 6.798 -7.036 1.00 0.00 H new ATOM 0 HG23 VAL A 102 3.878 7.241 -5.389 1.00 0.00 H new ATOM 1408 N THR A 103 -0.101 10.059 -6.979 1.00 0.00 N ATOM 1409 CA THR A 103 -1.382 10.799 -6.795 1.00 0.00 C ATOM 1410 C THR A 103 -2.334 10.500 -7.956 1.00 0.00 C ATOM 1411 O THR A 103 -2.101 10.899 -9.080 1.00 0.00 O ATOM 1412 CB THR A 103 -0.994 12.279 -6.787 1.00 0.00 C ATOM 1413 OG1 THR A 103 0.368 12.418 -7.170 1.00 0.00 O ATOM 1414 CG2 THR A 103 -1.192 12.852 -5.383 1.00 0.00 C ATOM 0 H THR A 103 0.165 9.885 -7.948 1.00 0.00 H new ATOM 0 HA THR A 103 -1.896 10.511 -5.878 1.00 0.00 H new ATOM 0 HB THR A 103 -1.624 12.821 -7.492 1.00 0.00 H new ATOM 0 HG1 THR A 103 0.614 13.367 -7.166 1.00 0.00 H new ATOM 0 HG21 THR A 103 -0.915 13.906 -5.378 1.00 0.00 H new ATOM 0 HG22 THR A 103 -2.238 12.750 -5.092 1.00 0.00 H new ATOM 0 HG23 THR A 103 -0.564 12.309 -4.677 1.00 0.00 H new ATOM 1422 N GLU A 104 -3.405 9.802 -7.696 1.00 0.00 N ATOM 1423 CA GLU A 104 -4.367 9.482 -8.790 1.00 0.00 C ATOM 1424 C GLU A 104 -5.772 9.271 -8.219 1.00 0.00 C ATOM 1425 O GLU A 104 -5.938 8.863 -7.087 1.00 0.00 O ATOM 1426 CB GLU A 104 -3.842 8.189 -9.413 1.00 0.00 C ATOM 1427 CG GLU A 104 -2.739 8.519 -10.421 1.00 0.00 C ATOM 1428 CD GLU A 104 -2.765 7.499 -11.560 1.00 0.00 C ATOM 1429 OE1 GLU A 104 -2.864 6.318 -11.269 1.00 0.00 O ATOM 1430 OE2 GLU A 104 -2.685 7.915 -12.704 1.00 0.00 O ATOM 0 H GLU A 104 -3.656 9.440 -6.776 1.00 0.00 H new ATOM 0 HA GLU A 104 -4.441 10.287 -9.521 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -3.454 7.530 -8.636 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -4.654 7.655 -9.908 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -2.882 9.525 -10.816 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -1.766 8.505 -9.929 1.00 0.00 H new ATOM 1437 N THR A 105 -6.784 9.544 -8.996 1.00 0.00 N ATOM 1438 CA THR A 105 -8.178 9.358 -8.500 1.00 0.00 C ATOM 1439 C THR A 105 -8.823 8.150 -9.186 1.00 0.00 C ATOM 1440 O THR A 105 -8.921 8.090 -10.395 1.00 0.00 O ATOM 1441 CB THR A 105 -8.910 10.646 -8.882 1.00 0.00 C ATOM 1442 OG1 THR A 105 -8.000 11.736 -8.838 1.00 0.00 O ATOM 1443 CG2 THR A 105 -10.056 10.894 -7.901 1.00 0.00 C ATOM 0 H THR A 105 -6.706 9.888 -9.953 1.00 0.00 H new ATOM 0 HA THR A 105 -8.215 9.173 -7.427 1.00 0.00 H new ATOM 0 HB THR A 105 -9.314 10.550 -9.890 1.00 0.00 H new ATOM 0 HG1 THR A 105 -8.467 12.562 -9.084 1.00 0.00 H new ATOM 0 HG21 THR A 105 -10.577 11.812 -8.174 1.00 0.00 H new ATOM 0 HG22 THR A 105 -10.753 10.057 -7.937 1.00 0.00 H new ATOM 0 HG23 THR A 105 -9.656 10.990 -6.891 1.00 0.00 H new ATOM 1451 N PHE A 106 -9.262 7.187 -8.423 1.00 0.00 N ATOM 1452 CA PHE A 106 -9.898 5.984 -9.034 1.00 0.00 C ATOM 1453 C PHE A 106 -11.262 5.720 -8.391 1.00 0.00 C ATOM 1454 O PHE A 106 -11.504 6.077 -7.255 1.00 0.00 O ATOM 1455 CB PHE A 106 -8.935 4.835 -8.735 1.00 0.00 C ATOM 1456 CG PHE A 106 -8.967 4.523 -7.258 1.00 0.00 C ATOM 1457 CD1 PHE A 106 -9.903 3.611 -6.755 1.00 0.00 C ATOM 1458 CD2 PHE A 106 -8.062 5.148 -6.391 1.00 0.00 C ATOM 1459 CE1 PHE A 106 -9.933 3.323 -5.385 1.00 0.00 C ATOM 1460 CE2 PHE A 106 -8.093 4.859 -5.021 1.00 0.00 C ATOM 1461 CZ PHE A 106 -9.028 3.947 -4.518 1.00 0.00 C ATOM 0 H PHE A 106 -9.208 7.180 -7.404 1.00 0.00 H new ATOM 0 HA PHE A 106 -10.070 6.107 -10.103 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -9.215 3.952 -9.310 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -7.924 5.106 -9.039 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -10.602 3.130 -7.424 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -7.341 5.852 -6.779 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -10.655 2.619 -4.997 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -7.395 5.340 -4.352 1.00 0.00 H new ATOM 0 HZ PHE A 106 -9.051 3.725 -3.461 1.00 0.00 H new ATOM 1471 N THR A 107 -12.154 5.094 -9.109 1.00 0.00 N ATOM 1472 CA THR A 107 -13.500 4.804 -8.538 1.00 0.00 C ATOM 1473 C THR A 107 -13.491 3.443 -7.837 1.00 0.00 C ATOM 1474 O THR A 107 -13.688 2.415 -8.454 1.00 0.00 O ATOM 1475 CB THR A 107 -14.445 4.783 -9.741 1.00 0.00 C ATOM 1476 OG1 THR A 107 -14.106 5.841 -10.626 1.00 0.00 O ATOM 1477 CG2 THR A 107 -15.887 4.957 -9.262 1.00 0.00 C ATOM 0 H THR A 107 -12.009 4.771 -10.066 1.00 0.00 H new ATOM 0 HA THR A 107 -13.804 5.542 -7.796 1.00 0.00 H new ATOM 0 HB THR A 107 -14.350 3.830 -10.261 1.00 0.00 H new ATOM 0 HG1 THR A 107 -14.709 5.828 -11.398 1.00 0.00 H new ATOM 0 HG21 THR A 107 -16.560 4.942 -10.120 1.00 0.00 H new ATOM 0 HG22 THR A 107 -16.146 4.144 -8.584 1.00 0.00 H new ATOM 0 HG23 THR A 107 -15.985 5.909 -8.741 1.00 0.00 H new ATOM 1485 N ALA A 108 -13.261 3.428 -6.553 1.00 0.00 N ATOM 1486 CA ALA A 108 -13.236 2.133 -5.816 1.00 0.00 C ATOM 1487 C ALA A 108 -14.525 1.351 -6.073 1.00 0.00 C ATOM 1488 O ALA A 108 -15.546 1.605 -5.468 1.00 0.00 O ATOM 1489 CB ALA A 108 -13.132 2.517 -4.340 1.00 0.00 C ATOM 0 H ALA A 108 -13.089 4.256 -5.982 1.00 0.00 H new ATOM 0 HA ALA A 108 -12.409 1.497 -6.132 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -13.108 1.614 -3.730 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -12.219 3.090 -4.176 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -13.995 3.122 -4.060 1.00 0.00 H new ATOM 1495 N SER A 109 -14.487 0.399 -6.964 1.00 0.00 N ATOM 1496 CA SER A 109 -15.713 -0.399 -7.253 1.00 0.00 C ATOM 1497 C SER A 109 -15.823 -1.564 -6.265 1.00 0.00 C ATOM 1498 O SER A 109 -15.915 -2.712 -6.652 1.00 0.00 O ATOM 1499 CB SER A 109 -15.522 -0.919 -8.677 1.00 0.00 C ATOM 1500 OG SER A 109 -14.555 -1.961 -8.671 1.00 0.00 O ATOM 0 H SER A 109 -13.662 0.139 -7.504 1.00 0.00 H new ATOM 0 HA SER A 109 -16.625 0.190 -7.156 1.00 0.00 H new ATOM 0 HB2 SER A 109 -16.469 -1.288 -9.072 1.00 0.00 H new ATOM 0 HB3 SER A 109 -15.198 -0.110 -9.331 1.00 0.00 H new ATOM 0 HG SER A 109 -14.899 -2.724 -8.161 1.00 0.00 H new ATOM 1506 N ALA A 110 -15.813 -1.276 -4.992 1.00 0.00 N ATOM 1507 CA ALA A 110 -15.913 -2.367 -3.980 1.00 0.00 C ATOM 1508 C ALA A 110 -16.367 -1.801 -2.632 1.00 0.00 C ATOM 1509 O ALA A 110 -17.066 -0.809 -2.566 1.00 0.00 O ATOM 1510 CB ALA A 110 -14.499 -2.938 -3.872 1.00 0.00 C ATOM 0 H ALA A 110 -15.740 -0.334 -4.609 1.00 0.00 H new ATOM 0 HA ALA A 110 -16.640 -3.128 -4.265 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -14.489 -3.749 -3.144 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -14.185 -3.319 -4.844 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -13.813 -2.154 -3.551 1.00 0.00 H new ATOM 1516 N THR A 111 -15.975 -2.427 -1.557 1.00 0.00 N ATOM 1517 CA THR A 111 -16.384 -1.927 -0.213 1.00 0.00 C ATOM 1518 C THR A 111 -15.420 -2.437 0.863 1.00 0.00 C ATOM 1519 O THR A 111 -15.316 -3.623 1.106 1.00 0.00 O ATOM 1520 CB THR A 111 -17.786 -2.496 0.011 1.00 0.00 C ATOM 1521 OG1 THR A 111 -18.623 -2.125 -1.075 1.00 0.00 O ATOM 1522 CG2 THR A 111 -18.362 -1.942 1.314 1.00 0.00 C ATOM 0 H THR A 111 -15.390 -3.262 -1.550 1.00 0.00 H new ATOM 0 HA THR A 111 -16.370 -0.838 -0.158 1.00 0.00 H new ATOM 0 HB THR A 111 -17.732 -3.583 0.075 1.00 0.00 H new ATOM 0 HG1 THR A 111 -19.522 -2.489 -0.935 1.00 0.00 H new ATOM 0 HG21 THR A 111 -19.361 -2.348 1.472 1.00 0.00 H new ATOM 0 HG22 THR A 111 -17.718 -2.227 2.146 1.00 0.00 H new ATOM 0 HG23 THR A 111 -18.418 -0.855 1.254 1.00 0.00 H new ATOM 1530 N TYR A 112 -14.720 -1.547 1.514 1.00 0.00 N ATOM 1531 CA TYR A 112 -13.769 -1.976 2.580 1.00 0.00 C ATOM 1532 C TYR A 112 -14.275 -1.504 3.947 1.00 0.00 C ATOM 1533 O TYR A 112 -14.270 -0.324 4.237 1.00 0.00 O ATOM 1534 CB TYR A 112 -12.443 -1.292 2.236 1.00 0.00 C ATOM 1535 CG TYR A 112 -12.026 -1.644 0.824 1.00 0.00 C ATOM 1536 CD1 TYR A 112 -12.547 -2.783 0.193 1.00 0.00 C ATOM 1537 CD2 TYR A 112 -11.112 -0.828 0.146 1.00 0.00 C ATOM 1538 CE1 TYR A 112 -12.154 -3.101 -1.114 1.00 0.00 C ATOM 1539 CE2 TYR A 112 -10.722 -1.146 -1.161 1.00 0.00 C ATOM 1540 CZ TYR A 112 -11.243 -2.281 -1.790 1.00 0.00 C ATOM 1541 OH TYR A 112 -10.862 -2.586 -3.080 1.00 0.00 O ATOM 0 H TYR A 112 -14.766 -0.541 1.354 1.00 0.00 H new ATOM 0 HA TYR A 112 -13.663 -3.060 2.629 1.00 0.00 H new ATOM 0 HB2 TYR A 112 -12.546 -0.211 2.334 1.00 0.00 H new ATOM 0 HB3 TYR A 112 -11.671 -1.604 2.940 1.00 0.00 H new ATOM 0 HD1 TYR A 112 -13.251 -3.415 0.714 1.00 0.00 H new ATOM 0 HD2 TYR A 112 -10.707 0.048 0.632 1.00 0.00 H new ATOM 0 HE1 TYR A 112 -12.554 -3.979 -1.600 1.00 0.00 H new ATOM 0 HE2 TYR A 112 -10.019 -0.514 -1.683 1.00 0.00 H new ATOM 0 HH TYR A 112 -11.490 -3.235 -3.462 1.00 0.00 H new ATOM 1551 N PRO A 113 -14.703 -2.447 4.743 1.00 0.00 N ATOM 1552 CA PRO A 113 -15.226 -2.126 6.092 1.00 0.00 C ATOM 1553 C PRO A 113 -14.077 -1.795 7.049 1.00 0.00 C ATOM 1554 O PRO A 113 -13.465 -2.672 7.625 1.00 0.00 O ATOM 1555 CB PRO A 113 -15.932 -3.409 6.516 1.00 0.00 C ATOM 1556 CG PRO A 113 -15.270 -4.499 5.734 1.00 0.00 C ATOM 1557 CD PRO A 113 -14.739 -3.885 4.462 1.00 0.00 C ATOM 0 HA PRO A 113 -15.886 -1.258 6.099 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -15.832 -3.577 7.588 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -16.999 -3.361 6.299 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -14.461 -4.947 6.310 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -15.980 -5.295 5.509 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -13.748 -4.268 4.219 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -15.384 -4.109 3.613 1.00 0.00 H new ATOM 1565 N ALA A 114 -13.782 -0.536 7.225 1.00 0.00 N ATOM 1566 CA ALA A 114 -12.674 -0.153 8.146 1.00 0.00 C ATOM 1567 C ALA A 114 -12.796 -0.921 9.465 1.00 0.00 C ATOM 1568 O ALA A 114 -11.828 -1.114 10.174 1.00 0.00 O ATOM 1569 CB ALA A 114 -12.854 1.347 8.380 1.00 0.00 C ATOM 0 H ALA A 114 -14.259 0.243 6.772 1.00 0.00 H new ATOM 0 HA ALA A 114 -11.693 -0.385 7.732 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -12.074 1.707 9.051 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -12.786 1.874 7.428 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -13.831 1.531 8.828 1.00 0.00 H new ATOM 1661 N GLU A 122 -11.406 -7.012 6.507 1.00 0.00 N ATOM 1662 CA GLU A 122 -12.042 -5.912 5.724 1.00 0.00 C ATOM 1663 C GLU A 122 -11.179 -5.553 4.513 1.00 0.00 C ATOM 1664 O GLU A 122 -10.398 -6.351 4.040 1.00 0.00 O ATOM 1665 CB GLU A 122 -12.121 -4.733 6.694 1.00 0.00 C ATOM 1666 CG GLU A 122 -10.721 -4.409 7.219 1.00 0.00 C ATOM 1667 CD GLU A 122 -10.830 -3.777 8.608 1.00 0.00 C ATOM 1668 OE1 GLU A 122 -11.565 -4.310 9.424 1.00 0.00 O ATOM 1669 OE2 GLU A 122 -10.177 -2.772 8.833 1.00 0.00 O ATOM 0 HA GLU A 122 -13.023 -6.193 5.340 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -12.543 -3.863 6.191 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -12.785 -4.975 7.524 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -10.120 -5.317 7.267 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -10.214 -3.727 6.536 1.00 0.00 H new ATOM 1676 N GLY A 123 -11.314 -4.356 4.008 1.00 0.00 N ATOM 1677 CA GLY A 123 -10.501 -3.950 2.827 1.00 0.00 C ATOM 1678 C GLY A 123 -9.195 -3.310 3.297 1.00 0.00 C ATOM 1679 O GLY A 123 -9.139 -2.680 4.335 1.00 0.00 O ATOM 0 H GLY A 123 -11.952 -3.643 4.362 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -10.288 -4.819 2.204 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -11.062 -3.246 2.212 1.00 0.00 H new ATOM 1683 N GLN A 124 -8.142 -3.470 2.544 1.00 0.00 N ATOM 1684 CA GLN A 124 -6.837 -2.875 2.950 1.00 0.00 C ATOM 1685 C GLN A 124 -5.998 -2.530 1.716 1.00 0.00 C ATOM 1686 O GLN A 124 -6.516 -2.334 0.632 1.00 0.00 O ATOM 1687 CB GLN A 124 -6.152 -3.966 3.773 1.00 0.00 C ATOM 1688 CG GLN A 124 -5.762 -5.126 2.855 1.00 0.00 C ATOM 1689 CD GLN A 124 -5.422 -6.355 3.701 1.00 0.00 C ATOM 1690 OE1 GLN A 124 -6.316 -6.834 4.522 1.00 0.00 O flip ATOM 1691 NE2 GLN A 124 -4.332 -6.884 3.615 1.00 0.00 N flip ATOM 0 H GLN A 124 -8.128 -3.987 1.665 1.00 0.00 H new ATOM 0 HA GLN A 124 -6.963 -1.950 3.513 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -5.266 -3.564 4.265 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -6.821 -4.318 4.558 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -6.581 -5.356 2.174 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -4.906 -4.846 2.241 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -3.633 -6.510 2.973 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -4.116 -7.702 4.184 1.00 0.00 H new ATOM 1700 N ILE A 125 -4.703 -2.471 1.875 1.00 0.00 N ATOM 1701 CA ILE A 125 -3.815 -2.151 0.721 1.00 0.00 C ATOM 1702 C ILE A 125 -2.879 -3.331 0.463 1.00 0.00 C ATOM 1703 O ILE A 125 -2.407 -3.972 1.383 1.00 0.00 O ATOM 1704 CB ILE A 125 -3.019 -0.915 1.155 1.00 0.00 C ATOM 1705 CG1 ILE A 125 -3.877 0.336 0.956 1.00 0.00 C ATOM 1706 CG2 ILE A 125 -1.741 -0.794 0.315 1.00 0.00 C ATOM 1707 CD1 ILE A 125 -3.488 1.392 1.992 1.00 0.00 C ATOM 0 H ILE A 125 -4.220 -2.632 2.759 1.00 0.00 H new ATOM 0 HA ILE A 125 -4.370 -1.964 -0.198 1.00 0.00 H new ATOM 0 HB ILE A 125 -2.749 -1.014 2.206 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -3.737 0.730 -0.051 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -4.933 0.085 1.056 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -1.181 0.087 0.629 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -1.127 -1.684 0.456 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -2.005 -0.699 -0.738 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -4.099 2.283 1.850 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -3.651 0.996 2.994 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -2.436 1.650 1.871 1.00 0.00 H new ATOM 1719 N ALA A 126 -2.620 -3.634 -0.778 1.00 0.00 N ATOM 1720 CA ALA A 126 -1.731 -4.787 -1.084 1.00 0.00 C ATOM 1721 C ALA A 126 -0.469 -4.335 -1.823 1.00 0.00 C ATOM 1722 O ALA A 126 -0.527 -3.771 -2.897 1.00 0.00 O ATOM 1723 CB ALA A 126 -2.571 -5.702 -1.976 1.00 0.00 C ATOM 0 H ALA A 126 -2.984 -3.135 -1.590 1.00 0.00 H new ATOM 0 HA ALA A 126 -1.391 -5.285 -0.176 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -1.987 -6.581 -2.248 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -3.466 -6.014 -1.437 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -2.860 -5.164 -2.879 1.00 0.00 H new ATOM 1729 N PHE A 127 0.672 -4.616 -1.259 1.00 0.00 N ATOM 1730 CA PHE A 127 1.958 -4.250 -1.916 1.00 0.00 C ATOM 1731 C PHE A 127 2.731 -5.545 -2.174 1.00 0.00 C ATOM 1732 O PHE A 127 3.448 -6.030 -1.327 1.00 0.00 O ATOM 1733 CB PHE A 127 2.695 -3.366 -0.904 1.00 0.00 C ATOM 1734 CG PHE A 127 2.338 -1.913 -1.132 1.00 0.00 C ATOM 1735 CD1 PHE A 127 0.995 -1.515 -1.172 1.00 0.00 C ATOM 1736 CD2 PHE A 127 3.352 -0.962 -1.307 1.00 0.00 C ATOM 1737 CE1 PHE A 127 0.668 -0.171 -1.387 1.00 0.00 C ATOM 1738 CE2 PHE A 127 3.024 0.382 -1.520 1.00 0.00 C ATOM 1739 CZ PHE A 127 1.683 0.777 -1.561 1.00 0.00 C ATOM 0 H PHE A 127 0.770 -5.089 -0.361 1.00 0.00 H new ATOM 0 HA PHE A 127 1.833 -3.726 -2.864 1.00 0.00 H new ATOM 0 HB2 PHE A 127 2.428 -3.660 0.111 1.00 0.00 H new ATOM 0 HB3 PHE A 127 3.772 -3.505 -1.003 1.00 0.00 H new ATOM 0 HD1 PHE A 127 0.211 -2.246 -1.037 1.00 0.00 H new ATOM 0 HD2 PHE A 127 4.388 -1.266 -1.278 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -0.367 0.134 -1.419 1.00 0.00 H new ATOM 0 HE2 PHE A 127 3.807 1.114 -1.653 1.00 0.00 H new ATOM 0 HZ PHE A 127 1.431 1.814 -1.727 1.00 0.00 H new ATOM 1749 N GLN A 128 2.553 -6.137 -3.319 1.00 0.00 N ATOM 1750 CA GLN A 128 3.237 -7.432 -3.593 1.00 0.00 C ATOM 1751 C GLN A 128 4.627 -7.241 -4.201 1.00 0.00 C ATOM 1752 O GLN A 128 4.786 -7.151 -5.402 1.00 0.00 O ATOM 1753 CB GLN A 128 2.322 -8.150 -4.585 1.00 0.00 C ATOM 1754 CG GLN A 128 1.159 -8.798 -3.831 1.00 0.00 C ATOM 1755 CD GLN A 128 0.304 -9.607 -4.808 1.00 0.00 C ATOM 1756 OE1 GLN A 128 -0.170 -9.083 -5.796 1.00 0.00 O ATOM 1757 NE2 GLN A 128 0.084 -10.872 -4.572 1.00 0.00 N ATOM 0 H GLN A 128 1.967 -5.784 -4.075 1.00 0.00 H new ATOM 0 HA GLN A 128 3.396 -7.992 -2.672 1.00 0.00 H new ATOM 0 HB2 GLN A 128 1.942 -7.443 -5.323 1.00 0.00 H new ATOM 0 HB3 GLN A 128 2.883 -8.909 -5.130 1.00 0.00 H new ATOM 0 HG2 GLN A 128 1.540 -9.446 -3.042 1.00 0.00 H new ATOM 0 HG3 GLN A 128 0.552 -8.031 -3.349 1.00 0.00 H new ATOM 0 HE21 GLN A 128 0.482 -11.313 -3.743 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -0.486 -11.420 -5.217 1.00 0.00 H new ATOM 1766 N LEU A 129 5.641 -7.226 -3.378 1.00 0.00 N ATOM 1767 CA LEU A 129 7.028 -7.098 -3.905 1.00 0.00 C ATOM 1768 C LEU A 129 7.582 -8.507 -4.149 1.00 0.00 C ATOM 1769 O LEU A 129 8.699 -8.825 -3.791 1.00 0.00 O ATOM 1770 CB LEU A 129 7.831 -6.391 -2.809 1.00 0.00 C ATOM 1771 CG LEU A 129 7.015 -5.244 -2.213 1.00 0.00 C ATOM 1772 CD1 LEU A 129 7.727 -4.718 -0.964 1.00 0.00 C ATOM 1773 CD2 LEU A 129 6.888 -4.116 -3.238 1.00 0.00 C ATOM 0 H LEU A 129 5.567 -7.297 -2.363 1.00 0.00 H new ATOM 0 HA LEU A 129 7.075 -6.540 -4.840 1.00 0.00 H new ATOM 0 HB2 LEU A 129 8.097 -7.102 -2.027 1.00 0.00 H new ATOM 0 HB3 LEU A 129 8.764 -6.007 -3.222 1.00 0.00 H new ATOM 0 HG LEU A 129 6.021 -5.603 -1.948 1.00 0.00 H new ATOM 0 HD11 LEU A 129 7.150 -3.899 -0.534 1.00 0.00 H new ATOM 0 HD12 LEU A 129 7.819 -5.521 -0.232 1.00 0.00 H new ATOM 0 HD13 LEU A 129 8.720 -4.359 -1.235 1.00 0.00 H new ATOM 0 HD21 LEU A 129 6.306 -3.300 -2.810 1.00 0.00 H new ATOM 0 HD22 LEU A 129 7.881 -3.753 -3.504 1.00 0.00 H new ATOM 0 HD23 LEU A 129 6.387 -4.490 -4.131 1.00 0.00 H new ATOM 1785 N GLY A 130 6.787 -9.362 -4.733 1.00 0.00 N ATOM 1786 CA GLY A 130 7.241 -10.760 -4.988 1.00 0.00 C ATOM 1787 C GLY A 130 8.078 -10.820 -6.266 1.00 0.00 C ATOM 1788 O GLY A 130 7.590 -10.575 -7.352 1.00 0.00 O ATOM 0 H GLY A 130 5.839 -9.152 -5.046 1.00 0.00 H new ATOM 0 HA2 GLY A 130 7.829 -11.119 -4.143 1.00 0.00 H new ATOM 0 HA3 GLY A 130 6.378 -11.419 -5.079 1.00 0.00 H new ATOM 1792 N GLY A 131 9.335 -11.157 -6.142 1.00 0.00 N ATOM 1793 CA GLY A 131 10.216 -11.250 -7.341 1.00 0.00 C ATOM 1794 C GLY A 131 9.913 -10.097 -8.302 1.00 0.00 C ATOM 1795 O GLY A 131 9.038 -10.191 -9.140 1.00 0.00 O ATOM 0 H GLY A 131 9.791 -11.373 -5.255 1.00 0.00 H new ATOM 0 HA2 GLY A 131 11.262 -11.216 -7.038 1.00 0.00 H new ATOM 0 HA3 GLY A 131 10.061 -12.204 -7.844 1.00 0.00 H new ATOM 1799 N PHE A 132 10.628 -9.009 -8.192 1.00 0.00 N ATOM 1800 CA PHE A 132 10.372 -7.857 -9.105 1.00 0.00 C ATOM 1801 C PHE A 132 11.684 -7.157 -9.475 1.00 0.00 C ATOM 1802 O PHE A 132 11.981 -6.958 -10.637 1.00 0.00 O ATOM 1803 CB PHE A 132 9.460 -6.918 -8.316 1.00 0.00 C ATOM 1804 CG PHE A 132 8.017 -7.273 -8.589 1.00 0.00 C ATOM 1805 CD1 PHE A 132 7.497 -7.138 -9.883 1.00 0.00 C ATOM 1806 CD2 PHE A 132 7.200 -7.737 -7.551 1.00 0.00 C ATOM 1807 CE1 PHE A 132 6.160 -7.467 -10.137 1.00 0.00 C ATOM 1808 CE2 PHE A 132 5.863 -8.066 -7.807 1.00 0.00 C ATOM 1809 CZ PHE A 132 5.343 -7.930 -9.099 1.00 0.00 C ATOM 0 H PHE A 132 11.375 -8.868 -7.512 1.00 0.00 H new ATOM 0 HA PHE A 132 9.916 -8.173 -10.043 1.00 0.00 H new ATOM 0 HB2 PHE A 132 9.671 -7.000 -7.250 1.00 0.00 H new ATOM 0 HB3 PHE A 132 9.651 -5.883 -8.600 1.00 0.00 H new ATOM 0 HD1 PHE A 132 8.127 -6.780 -10.684 1.00 0.00 H new ATOM 0 HD2 PHE A 132 7.601 -7.841 -6.553 1.00 0.00 H new ATOM 0 HE1 PHE A 132 5.759 -7.363 -11.134 1.00 0.00 H new ATOM 0 HE2 PHE A 132 5.233 -8.425 -7.007 1.00 0.00 H new ATOM 0 HZ PHE A 132 4.311 -8.182 -9.295 1.00 0.00 H new ATOM 1819 N SER A 133 12.474 -6.780 -8.505 1.00 0.00 N ATOM 1820 CA SER A 133 13.761 -6.093 -8.825 1.00 0.00 C ATOM 1821 C SER A 133 14.883 -7.119 -9.006 1.00 0.00 C ATOM 1822 O SER A 133 14.694 -8.302 -8.809 1.00 0.00 O ATOM 1823 CB SER A 133 14.046 -5.199 -7.619 1.00 0.00 C ATOM 1824 OG SER A 133 15.452 -5.060 -7.460 1.00 0.00 O ATOM 0 H SER A 133 12.287 -6.916 -7.512 1.00 0.00 H new ATOM 0 HA SER A 133 13.701 -5.522 -9.752 1.00 0.00 H new ATOM 0 HB2 SER A 133 13.586 -4.221 -7.760 1.00 0.00 H new ATOM 0 HB3 SER A 133 13.608 -5.631 -6.720 1.00 0.00 H new ATOM 0 HG SER A 133 15.712 -5.369 -6.567 1.00 0.00 H new ATOM 1830 N ALA A 134 16.051 -6.673 -9.383 1.00 0.00 N ATOM 1831 CA ALA A 134 17.187 -7.621 -9.578 1.00 0.00 C ATOM 1832 C ALA A 134 17.826 -7.958 -8.229 1.00 0.00 C ATOM 1833 O ALA A 134 17.458 -8.916 -7.580 1.00 0.00 O ATOM 1834 CB ALA A 134 18.178 -6.875 -10.471 1.00 0.00 C ATOM 0 H ALA A 134 16.268 -5.693 -9.565 1.00 0.00 H new ATOM 0 HA ALA A 134 16.869 -8.563 -10.024 1.00 0.00 H new ATOM 0 HB1 ALA A 134 19.045 -7.508 -10.661 1.00 0.00 H new ATOM 0 HB2 ALA A 134 17.698 -6.624 -11.417 1.00 0.00 H new ATOM 0 HB3 ALA A 134 18.499 -5.960 -9.973 1.00 0.00 H new ATOM 1840 N ASP A 135 18.778 -7.175 -7.800 1.00 0.00 N ATOM 1841 CA ASP A 135 19.434 -7.450 -6.490 1.00 0.00 C ATOM 1842 C ASP A 135 18.433 -7.229 -5.353 1.00 0.00 C ATOM 1843 O ASP A 135 17.264 -7.000 -5.584 1.00 0.00 O ATOM 1844 CB ASP A 135 20.580 -6.443 -6.402 1.00 0.00 C ATOM 1845 CG ASP A 135 21.348 -6.425 -7.724 1.00 0.00 C ATOM 1846 OD1 ASP A 135 21.150 -7.334 -8.514 1.00 0.00 O ATOM 1847 OD2 ASP A 135 22.122 -5.503 -7.925 1.00 0.00 O ATOM 0 H ASP A 135 19.130 -6.358 -8.299 1.00 0.00 H new ATOM 0 HA ASP A 135 19.791 -8.476 -6.408 1.00 0.00 H new ATOM 0 HB2 ASP A 135 20.189 -5.449 -6.183 1.00 0.00 H new ATOM 0 HB3 ASP A 135 21.250 -6.709 -5.584 1.00 0.00 H new ATOM 1852 N ALA A 136 18.880 -7.299 -4.128 1.00 0.00 N ATOM 1853 CA ALA A 136 17.947 -7.094 -2.981 1.00 0.00 C ATOM 1854 C ALA A 136 17.684 -5.599 -2.772 1.00 0.00 C ATOM 1855 O ALA A 136 18.528 -4.769 -3.043 1.00 0.00 O ATOM 1856 CB ALA A 136 18.671 -7.685 -1.772 1.00 0.00 C ATOM 0 H ALA A 136 19.849 -7.489 -3.871 1.00 0.00 H new ATOM 0 HA ALA A 136 16.979 -7.566 -3.147 1.00 0.00 H new ATOM 0 HB1 ALA A 136 18.048 -7.573 -0.884 1.00 0.00 H new ATOM 0 HB2 ALA A 136 18.867 -8.743 -1.947 1.00 0.00 H new ATOM 0 HB3 ALA A 136 19.615 -7.161 -1.621 1.00 0.00 H new ATOM 1862 N TRP A 137 16.520 -5.248 -2.293 1.00 0.00 N ATOM 1863 CA TRP A 137 16.215 -3.805 -2.072 1.00 0.00 C ATOM 1864 C TRP A 137 15.206 -3.622 -0.942 1.00 0.00 C ATOM 1865 O TRP A 137 15.033 -4.478 -0.098 1.00 0.00 O ATOM 1866 CB TRP A 137 15.644 -3.306 -3.398 1.00 0.00 C ATOM 1867 CG TRP A 137 14.279 -3.878 -3.631 1.00 0.00 C ATOM 1868 CD1 TRP A 137 13.117 -3.205 -3.467 1.00 0.00 C ATOM 1869 CD2 TRP A 137 13.914 -5.216 -4.080 1.00 0.00 C ATOM 1870 NE1 TRP A 137 12.065 -4.045 -3.790 1.00 0.00 N ATOM 1871 CE2 TRP A 137 12.504 -5.292 -4.172 1.00 0.00 C ATOM 1872 CE3 TRP A 137 14.658 -6.359 -4.413 1.00 0.00 C ATOM 1873 CZ2 TRP A 137 11.857 -6.456 -4.582 1.00 0.00 C ATOM 1874 CZ3 TRP A 137 14.009 -7.535 -4.825 1.00 0.00 C ATOM 1875 CH2 TRP A 137 12.611 -7.582 -4.909 1.00 0.00 C ATOM 0 H TRP A 137 15.771 -5.895 -2.046 1.00 0.00 H new ATOM 0 HA TRP A 137 17.104 -3.247 -1.777 1.00 0.00 H new ATOM 0 HB2 TRP A 137 15.592 -2.217 -3.391 1.00 0.00 H new ATOM 0 HB3 TRP A 137 16.307 -3.589 -4.215 1.00 0.00 H new ATOM 0 HD1 TRP A 137 13.025 -2.180 -3.138 1.00 0.00 H new ATOM 0 HE1 TRP A 137 11.083 -3.772 -3.750 1.00 0.00 H new ATOM 0 HE3 TRP A 137 15.736 -6.334 -4.352 1.00 0.00 H new ATOM 0 HZ2 TRP A 137 10.779 -6.486 -4.646 1.00 0.00 H new ATOM 0 HZ3 TRP A 137 14.591 -8.408 -5.079 1.00 0.00 H new ATOM 0 HH2 TRP A 137 12.118 -8.489 -5.227 1.00 0.00 H new ATOM 1886 N THR A 138 14.563 -2.493 -0.912 1.00 0.00 N ATOM 1887 CA THR A 138 13.584 -2.213 0.169 1.00 0.00 C ATOM 1888 C THR A 138 12.632 -1.099 -0.294 1.00 0.00 C ATOM 1889 O THR A 138 12.768 -0.579 -1.384 1.00 0.00 O ATOM 1890 CB THR A 138 14.479 -1.777 1.341 1.00 0.00 C ATOM 1891 OG1 THR A 138 14.544 -2.829 2.293 1.00 0.00 O ATOM 1892 CG2 THR A 138 13.934 -0.513 2.018 1.00 0.00 C ATOM 0 H THR A 138 14.675 -1.745 -1.596 1.00 0.00 H new ATOM 0 HA THR A 138 12.946 -3.054 0.443 1.00 0.00 H new ATOM 0 HB THR A 138 15.472 -1.554 0.952 1.00 0.00 H new ATOM 0 HG1 THR A 138 13.726 -2.833 2.833 1.00 0.00 H new ATOM 0 HG21 THR A 138 14.589 -0.231 2.842 1.00 0.00 H new ATOM 0 HG22 THR A 138 13.893 0.299 1.292 1.00 0.00 H new ATOM 0 HG23 THR A 138 12.932 -0.708 2.401 1.00 0.00 H new ATOM 1900 N LEU A 139 11.672 -0.725 0.510 1.00 0.00 N ATOM 1901 CA LEU A 139 10.736 0.357 0.070 1.00 0.00 C ATOM 1902 C LEU A 139 10.394 1.319 1.208 1.00 0.00 C ATOM 1903 O LEU A 139 9.751 0.957 2.171 1.00 0.00 O ATOM 1904 CB LEU A 139 9.475 -0.356 -0.398 1.00 0.00 C ATOM 1905 CG LEU A 139 9.577 -0.634 -1.893 1.00 0.00 C ATOM 1906 CD1 LEU A 139 10.183 -2.019 -2.124 1.00 0.00 C ATOM 1907 CD2 LEU A 139 8.180 -0.562 -2.504 1.00 0.00 C ATOM 0 H LEU A 139 11.495 -1.112 1.437 1.00 0.00 H new ATOM 0 HA LEU A 139 11.194 0.960 -0.714 1.00 0.00 H new ATOM 0 HB2 LEU A 139 9.348 -1.290 0.149 1.00 0.00 H new ATOM 0 HB3 LEU A 139 8.598 0.257 -0.190 1.00 0.00 H new ATOM 0 HG LEU A 139 10.220 0.109 -2.365 1.00 0.00 H new ATOM 0 HD11 LEU A 139 10.253 -2.212 -3.195 1.00 0.00 H new ATOM 0 HD12 LEU A 139 11.179 -2.059 -1.682 1.00 0.00 H new ATOM 0 HD13 LEU A 139 9.550 -2.775 -1.660 1.00 0.00 H new ATOM 0 HD21 LEU A 139 8.240 -0.759 -3.574 1.00 0.00 H new ATOM 0 HD22 LEU A 139 7.538 -1.307 -2.033 1.00 0.00 H new ATOM 0 HD23 LEU A 139 7.762 0.432 -2.341 1.00 0.00 H new ATOM 1919 N CYS A 140 10.789 2.555 1.072 1.00 0.00 N ATOM 1920 CA CYS A 140 10.471 3.575 2.118 1.00 0.00 C ATOM 1921 C CYS A 140 9.327 4.480 1.659 1.00 0.00 C ATOM 1922 O CYS A 140 9.512 5.365 0.847 1.00 0.00 O ATOM 1923 CB CYS A 140 11.747 4.403 2.297 1.00 0.00 C ATOM 1924 SG CYS A 140 12.583 3.928 3.832 1.00 0.00 S ATOM 0 H CYS A 140 11.322 2.907 0.277 1.00 0.00 H new ATOM 0 HA CYS A 140 10.157 3.101 3.048 1.00 0.00 H new ATOM 0 HB2 CYS A 140 12.413 4.249 1.448 1.00 0.00 H new ATOM 0 HB3 CYS A 140 11.501 5.465 2.320 1.00 0.00 H new ATOM 1929 N LEU A 141 8.151 4.280 2.184 1.00 0.00 N ATOM 1930 CA LEU A 141 7.009 5.148 1.787 1.00 0.00 C ATOM 1931 C LEU A 141 6.940 6.354 2.726 1.00 0.00 C ATOM 1932 O LEU A 141 7.756 6.503 3.614 1.00 0.00 O ATOM 1933 CB LEU A 141 5.763 4.275 1.934 1.00 0.00 C ATOM 1934 CG LEU A 141 5.850 3.090 0.969 1.00 0.00 C ATOM 1935 CD1 LEU A 141 5.596 1.796 1.738 1.00 0.00 C ATOM 1936 CD2 LEU A 141 4.795 3.236 -0.132 1.00 0.00 C ATOM 0 H LEU A 141 7.932 3.556 2.868 1.00 0.00 H new ATOM 0 HA LEU A 141 7.106 5.529 0.770 1.00 0.00 H new ATOM 0 HB2 LEU A 141 5.677 3.916 2.960 1.00 0.00 H new ATOM 0 HB3 LEU A 141 4.869 4.862 1.725 1.00 0.00 H new ATOM 0 HG LEU A 141 6.842 3.066 0.517 1.00 0.00 H new ATOM 0 HD11 LEU A 141 5.657 0.949 1.055 1.00 0.00 H new ATOM 0 HD12 LEU A 141 6.346 1.685 2.521 1.00 0.00 H new ATOM 0 HD13 LEU A 141 4.604 1.829 2.188 1.00 0.00 H new ATOM 0 HD21 LEU A 141 4.863 2.389 -0.815 1.00 0.00 H new ATOM 0 HD22 LEU A 141 3.802 3.262 0.317 1.00 0.00 H new ATOM 0 HD23 LEU A 141 4.969 4.161 -0.682 1.00 0.00 H new ATOM 1948 N ASP A 142 5.977 7.213 2.541 1.00 0.00 N ATOM 1949 CA ASP A 142 5.859 8.414 3.429 1.00 0.00 C ATOM 1950 C ASP A 142 4.876 9.421 2.827 1.00 0.00 C ATOM 1951 O ASP A 142 5.256 10.494 2.402 1.00 0.00 O ATOM 1952 CB ASP A 142 7.264 9.025 3.498 1.00 0.00 C ATOM 1953 CG ASP A 142 7.937 8.940 2.125 1.00 0.00 C ATOM 1954 OD1 ASP A 142 7.223 8.800 1.146 1.00 0.00 O ATOM 1955 OD2 ASP A 142 9.153 9.017 2.077 1.00 0.00 O ATOM 0 H ASP A 142 5.264 7.140 1.815 1.00 0.00 H new ATOM 0 HA ASP A 142 5.488 8.146 4.418 1.00 0.00 H new ATOM 0 HB2 ASP A 142 7.202 10.065 3.819 1.00 0.00 H new ATOM 0 HB3 ASP A 142 7.863 8.497 4.240 1.00 0.00 H new ATOM 1960 N ASP A 143 3.616 9.075 2.791 1.00 0.00 N ATOM 1961 CA ASP A 143 2.578 9.990 2.219 1.00 0.00 C ATOM 1962 C ASP A 143 1.325 9.179 1.897 1.00 0.00 C ATOM 1963 O ASP A 143 0.720 9.336 0.856 1.00 0.00 O ATOM 1964 CB ASP A 143 3.183 10.559 0.933 1.00 0.00 C ATOM 1965 CG ASP A 143 3.555 12.027 1.149 1.00 0.00 C ATOM 1966 OD1 ASP A 143 2.664 12.806 1.448 1.00 0.00 O ATOM 1967 OD2 ASP A 143 4.724 12.348 1.012 1.00 0.00 O ATOM 0 H ASP A 143 3.255 8.186 3.138 1.00 0.00 H new ATOM 0 HA ASP A 143 2.301 10.786 2.910 1.00 0.00 H new ATOM 0 HB2 ASP A 143 4.067 9.987 0.650 1.00 0.00 H new ATOM 0 HB3 ASP A 143 2.470 10.470 0.113 1.00 0.00 H new ATOM 1972 N VAL A 144 0.944 8.297 2.778 1.00 0.00 N ATOM 1973 CA VAL A 144 -0.257 7.451 2.516 1.00 0.00 C ATOM 1974 C VAL A 144 -1.523 8.135 3.034 1.00 0.00 C ATOM 1975 O VAL A 144 -1.689 8.346 4.219 1.00 0.00 O ATOM 1976 CB VAL A 144 -0.013 6.136 3.268 1.00 0.00 C ATOM 1977 CG1 VAL A 144 -0.765 5.009 2.561 1.00 0.00 C ATOM 1978 CG2 VAL A 144 1.484 5.803 3.285 1.00 0.00 C ATOM 0 H VAL A 144 1.411 8.124 3.668 1.00 0.00 H new ATOM 0 HA VAL A 144 -0.402 7.284 1.449 1.00 0.00 H new ATOM 0 HB VAL A 144 -0.367 6.242 4.293 1.00 0.00 H new ATOM 0 HG11 VAL A 144 -0.596 4.071 3.090 1.00 0.00 H new ATOM 0 HG12 VAL A 144 -1.832 5.233 2.551 1.00 0.00 H new ATOM 0 HG13 VAL A 144 -0.404 4.918 1.536 1.00 0.00 H new ATOM 0 HG21 VAL A 144 1.643 4.868 3.822 1.00 0.00 H new ATOM 0 HG22 VAL A 144 1.845 5.700 2.262 1.00 0.00 H new ATOM 0 HG23 VAL A 144 2.029 6.604 3.784 1.00 0.00 H new ATOM 1988 N ALA A 145 -2.420 8.474 2.150 1.00 0.00 N ATOM 1989 CA ALA A 145 -3.683 9.137 2.578 1.00 0.00 C ATOM 1990 C ALA A 145 -4.824 8.742 1.637 1.00 0.00 C ATOM 1991 O ALA A 145 -4.647 8.648 0.438 1.00 0.00 O ATOM 1992 CB ALA A 145 -3.399 10.636 2.480 1.00 0.00 C ATOM 0 H ALA A 145 -2.332 8.320 1.146 1.00 0.00 H new ATOM 0 HA ALA A 145 -3.984 8.848 3.585 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -4.285 11.195 2.780 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -2.568 10.893 3.137 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -3.140 10.891 1.452 1.00 0.00 H new ATOM 1998 N LEU A 146 -5.991 8.504 2.171 1.00 0.00 N ATOM 1999 CA LEU A 146 -7.139 8.110 1.306 1.00 0.00 C ATOM 2000 C LEU A 146 -8.363 8.976 1.619 1.00 0.00 C ATOM 2001 O LEU A 146 -8.521 9.471 2.718 1.00 0.00 O ATOM 2002 CB LEU A 146 -7.412 6.647 1.655 1.00 0.00 C ATOM 2003 CG LEU A 146 -8.655 6.167 0.905 1.00 0.00 C ATOM 2004 CD1 LEU A 146 -8.322 5.997 -0.578 1.00 0.00 C ATOM 2005 CD2 LEU A 146 -9.111 4.825 1.482 1.00 0.00 C ATOM 0 H LEU A 146 -6.199 8.565 3.168 1.00 0.00 H new ATOM 0 HA LEU A 146 -6.922 8.243 0.246 1.00 0.00 H new ATOM 0 HB2 LEU A 146 -6.553 6.032 1.388 1.00 0.00 H new ATOM 0 HB3 LEU A 146 -7.559 6.540 2.730 1.00 0.00 H new ATOM 0 HG LEU A 146 -9.453 6.901 1.016 1.00 0.00 H new ATOM 0 HD11 LEU A 146 -9.208 5.655 -1.113 1.00 0.00 H new ATOM 0 HD12 LEU A 146 -7.996 6.952 -0.990 1.00 0.00 H new ATOM 0 HD13 LEU A 146 -7.524 5.263 -0.690 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -9.997 4.482 0.948 1.00 0.00 H new ATOM 0 HD22 LEU A 146 -8.313 4.091 1.370 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -9.348 4.945 2.539 1.00 0.00 H new ATOM 2017 N ASP A 147 -9.230 9.163 0.661 1.00 0.00 N ATOM 2018 CA ASP A 147 -10.443 9.996 0.903 1.00 0.00 C ATOM 2019 C ASP A 147 -11.501 9.710 -0.166 1.00 0.00 C ATOM 2020 O ASP A 147 -11.331 8.850 -1.007 1.00 0.00 O ATOM 2021 CB ASP A 147 -9.956 11.442 0.803 1.00 0.00 C ATOM 2022 CG ASP A 147 -10.216 12.162 2.128 1.00 0.00 C ATOM 2023 OD1 ASP A 147 -9.540 11.846 3.093 1.00 0.00 O ATOM 2024 OD2 ASP A 147 -11.087 13.016 2.154 1.00 0.00 O ATOM 0 H ASP A 147 -9.151 8.775 -0.279 1.00 0.00 H new ATOM 0 HA ASP A 147 -10.903 9.787 1.869 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -8.892 11.463 0.568 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -10.471 11.955 -0.009 1.00 0.00 H new ATOM 2029 N SER A 148 -12.593 10.425 -0.141 1.00 0.00 N ATOM 2030 CA SER A 148 -13.661 10.191 -1.157 1.00 0.00 C ATOM 2031 C SER A 148 -14.053 11.512 -1.825 1.00 0.00 C ATOM 2032 O SER A 148 -14.686 12.358 -1.225 1.00 0.00 O ATOM 2033 CB SER A 148 -14.838 9.618 -0.369 1.00 0.00 C ATOM 2034 OG SER A 148 -15.595 10.685 0.186 1.00 0.00 O ATOM 0 H SER A 148 -12.792 11.160 0.537 1.00 0.00 H new ATOM 0 HA SER A 148 -13.337 9.518 -1.951 1.00 0.00 H new ATOM 0 HB2 SER A 148 -15.467 9.012 -1.021 1.00 0.00 H new ATOM 0 HB3 SER A 148 -14.476 8.963 0.423 1.00 0.00 H new ATOM 0 HG SER A 148 -15.044 11.495 0.218 1.00 0.00 H new