USER MOD reduce.3.24.130724 H: found=0, std=0, add=943, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 943 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 63 THR OG1 : rot -56:sc= 2.33 USER MOD Set 1.2: A 65 THR OG1 : rot 15:sc= 0.626 USER MOD Set 2.1: A 15 GLN : amide:sc= -0.0432 X(o=-1.4,f=-1.3) USER MOD Set 2.2: A 17 GLN : amide:sc= -1.32 K(o=-1.4,f=-6.7!) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 30:sc= 0.45 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 75:sc= -0.152 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 85:sc= 0.928 USER MOD Single : A 61 TYR OH : rot -48:sc= 0.0351 USER MOD Single : A 69 ASN :FLIP amide:sc= -0.105 F(o=-1.9!,f=-0.1) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot -73:sc= 1.19 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot -104:sc= 1.31 USER MOD Single : A 103 LYS NZ :NH3+ -158:sc= 1.24 (180deg=1.05) USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 ASN : amide:sc= -0.13 K(o=-0.13,f=-0.73) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0.00476 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 SER OG : rot 144:sc= 1.16 USER MOD Single : A 133 HIS : no HE2:sc= 0.379 K(o=0.38,f=-1.8!) USER MOD Single : A 134 THR OG1 : rot 180:sc=-0.00136 USER MOD Single : A 138 SER OG : rot 51:sc= 0.216 USER MOD Single : A 141 ASN : amide:sc= 0.109 K(o=0.11,f=-3.5!) USER MOD ----------------------------------------------------------------- ATOM 31 N GLY A 4 -20.789 9.869 1.232 1.00 0.00 N ATOM 32 CA GLY A 4 -19.460 10.351 1.573 1.00 0.00 C ATOM 33 C GLY A 4 -19.246 11.788 1.094 1.00 0.00 C ATOM 34 O GLY A 4 -20.052 12.336 0.337 1.00 0.00 O ATOM 0 HA2 GLY A 4 -19.320 10.301 2.653 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -18.709 9.701 1.124 1.00 0.00 H new ATOM 38 N GLU A 5 -18.137 12.394 1.508 1.00 0.00 N ATOM 39 CA GLU A 5 -17.738 13.754 1.165 1.00 0.00 C ATOM 40 C GLU A 5 -16.244 13.725 0.794 1.00 0.00 C ATOM 41 O GLU A 5 -15.517 12.938 1.406 1.00 0.00 O ATOM 42 CB GLU A 5 -18.018 14.609 2.408 1.00 0.00 C ATOM 43 CG GLU A 5 -17.761 16.099 2.183 1.00 0.00 C ATOM 44 CD GLU A 5 -18.099 16.961 3.399 1.00 0.00 C ATOM 45 OE1 GLU A 5 -18.827 16.515 4.318 1.00 0.00 O ATOM 46 OE2 GLU A 5 -17.696 18.143 3.405 1.00 0.00 O ATOM 0 H GLU A 5 -17.464 11.930 2.118 1.00 0.00 H new ATOM 0 HA GLU A 5 -18.281 14.170 0.316 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -19.055 14.467 2.713 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -17.394 14.259 3.230 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -16.712 16.245 1.923 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -18.350 16.438 1.331 1.00 0.00 H new ATOM 53 N PRO A 6 -15.752 14.519 -0.179 1.00 0.00 N ATOM 54 CA PRO A 6 -14.341 14.520 -0.545 1.00 0.00 C ATOM 55 C PRO A 6 -13.481 15.312 0.447 1.00 0.00 C ATOM 56 O PRO A 6 -13.909 16.324 1.018 1.00 0.00 O ATOM 57 CB PRO A 6 -14.279 15.215 -1.907 1.00 0.00 C ATOM 58 CG PRO A 6 -15.439 16.207 -1.847 1.00 0.00 C ATOM 59 CD PRO A 6 -16.483 15.472 -1.005 1.00 0.00 C ATOM 0 HA PRO A 6 -13.956 13.500 -0.553 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -13.325 15.720 -2.058 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -14.398 14.506 -2.726 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -15.140 17.149 -1.386 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -15.818 16.444 -2.841 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -17.044 16.172 -0.386 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -17.205 14.960 -1.642 1.00 0.00 H new ATOM 67 N LEU A 7 -12.220 14.908 0.565 1.00 0.00 N ATOM 68 CA LEU A 7 -11.180 15.474 1.396 1.00 0.00 C ATOM 69 C LEU A 7 -10.055 15.757 0.410 1.00 0.00 C ATOM 70 O LEU A 7 -9.671 14.896 -0.386 1.00 0.00 O ATOM 71 CB LEU A 7 -10.827 14.496 2.527 1.00 0.00 C ATOM 72 CG LEU A 7 -9.817 14.998 3.574 1.00 0.00 C ATOM 73 CD1 LEU A 7 -9.765 13.996 4.736 1.00 0.00 C ATOM 74 CD2 LEU A 7 -8.400 15.187 3.025 1.00 0.00 C ATOM 0 H LEU A 7 -11.878 14.108 0.033 1.00 0.00 H new ATOM 0 HA LEU A 7 -11.451 16.388 1.924 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -11.748 14.224 3.043 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -10.431 13.584 2.079 1.00 0.00 H new ATOM 0 HG LEU A 7 -10.164 15.979 3.897 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -9.052 14.343 5.484 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -10.753 13.912 5.188 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -9.453 13.021 4.362 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -7.746 15.542 3.821 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -8.027 14.236 2.646 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -8.418 15.918 2.216 1.00 0.00 H new ATOM 86 N VAL A 8 -9.659 17.016 0.355 1.00 0.00 N ATOM 87 CA VAL A 8 -8.601 17.551 -0.488 1.00 0.00 C ATOM 88 C VAL A 8 -7.397 17.745 0.426 1.00 0.00 C ATOM 89 O VAL A 8 -7.445 18.518 1.385 1.00 0.00 O ATOM 90 CB VAL A 8 -9.024 18.886 -1.139 1.00 0.00 C ATOM 91 CG1 VAL A 8 -7.935 19.389 -2.103 1.00 0.00 C ATOM 92 CG2 VAL A 8 -10.346 18.772 -1.909 1.00 0.00 C ATOM 0 H VAL A 8 -10.093 17.737 0.932 1.00 0.00 H new ATOM 0 HA VAL A 8 -8.372 16.874 -1.311 1.00 0.00 H new ATOM 0 HB VAL A 8 -9.163 19.594 -0.322 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -8.252 20.331 -2.551 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -7.006 19.543 -1.554 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -7.774 18.650 -2.888 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -10.597 19.738 -2.346 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -10.243 18.031 -2.701 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -11.139 18.466 -1.227 1.00 0.00 H new ATOM 102 N GLY A 9 -6.325 17.021 0.144 1.00 0.00 N ATOM 103 CA GLY A 9 -5.105 17.082 0.916 1.00 0.00 C ATOM 104 C GLY A 9 -4.416 18.431 0.810 1.00 0.00 C ATOM 105 O GLY A 9 -4.692 19.230 -0.097 1.00 0.00 O ATOM 0 H GLY A 9 -6.283 16.368 -0.638 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -5.330 16.874 1.962 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -4.424 16.302 0.575 1.00 0.00 H new ATOM 109 N GLY A 10 -3.514 18.656 1.757 1.00 0.00 N ATOM 110 CA GLY A 10 -2.739 19.865 1.897 1.00 0.00 C ATOM 111 C GLY A 10 -1.548 19.981 0.956 1.00 0.00 C ATOM 112 O GLY A 10 -1.397 19.257 -0.028 1.00 0.00 O ATOM 0 H GLY A 10 -3.299 17.965 2.476 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -3.395 20.720 1.734 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -2.379 19.930 2.924 1.00 0.00 H new ATOM 116 N ASP A 11 -0.693 20.940 1.304 1.00 0.00 N ATOM 117 CA ASP A 11 0.535 21.321 0.609 1.00 0.00 C ATOM 118 C ASP A 11 1.812 21.081 1.409 1.00 0.00 C ATOM 119 O ASP A 11 2.928 21.320 0.938 1.00 0.00 O ATOM 120 CB ASP A 11 0.438 22.789 0.237 1.00 0.00 C ATOM 121 CG ASP A 11 0.793 23.777 1.361 1.00 0.00 C ATOM 122 OD1 ASP A 11 0.105 23.796 2.411 1.00 0.00 O ATOM 123 OD2 ASP A 11 1.727 24.599 1.175 1.00 0.00 O ATOM 0 H ASP A 11 -0.850 21.510 2.135 1.00 0.00 H new ATOM 0 HA ASP A 11 0.613 20.681 -0.270 1.00 0.00 H new ATOM 0 HB2 ASP A 11 1.097 22.976 -0.611 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -0.578 22.995 -0.098 1.00 0.00 H new ATOM 128 N THR A 12 1.624 20.656 2.642 1.00 0.00 N ATOM 129 CA THR A 12 2.625 20.303 3.634 1.00 0.00 C ATOM 130 C THR A 12 2.176 18.946 4.162 1.00 0.00 C ATOM 131 O THR A 12 0.971 18.753 4.319 1.00 0.00 O ATOM 132 CB THR A 12 2.775 21.370 4.735 1.00 0.00 C ATOM 133 OG1 THR A 12 1.654 21.503 5.601 1.00 0.00 O ATOM 134 CG2 THR A 12 3.085 22.747 4.157 1.00 0.00 C ATOM 0 H THR A 12 0.680 20.537 3.011 1.00 0.00 H new ATOM 0 HA THR A 12 3.626 20.252 3.206 1.00 0.00 H new ATOM 0 HB THR A 12 3.610 20.998 5.329 1.00 0.00 H new ATOM 0 HG1 THR A 12 1.836 22.198 6.267 1.00 0.00 H new ATOM 0 HG21 THR A 12 3.183 23.469 4.968 1.00 0.00 H new ATOM 0 HG22 THR A 12 4.018 22.704 3.595 1.00 0.00 H new ATOM 0 HG23 THR A 12 2.276 23.054 3.494 1.00 0.00 H new ATOM 142 N ASP A 13 3.119 18.057 4.458 1.00 0.00 N ATOM 143 CA ASP A 13 2.824 16.719 4.947 1.00 0.00 C ATOM 144 C ASP A 13 1.837 16.712 6.104 1.00 0.00 C ATOM 145 O ASP A 13 2.016 17.400 7.118 1.00 0.00 O ATOM 146 CB ASP A 13 4.088 15.952 5.335 1.00 0.00 C ATOM 147 CG ASP A 13 4.830 16.510 6.548 1.00 0.00 C ATOM 148 OD1 ASP A 13 5.670 17.419 6.354 1.00 0.00 O ATOM 149 OD2 ASP A 13 4.654 15.994 7.680 1.00 0.00 O ATOM 0 H ASP A 13 4.116 18.249 4.364 1.00 0.00 H new ATOM 0 HA ASP A 13 2.353 16.208 4.108 1.00 0.00 H new ATOM 0 HB2 ASP A 13 3.819 14.915 5.537 1.00 0.00 H new ATOM 0 HB3 ASP A 13 4.768 15.945 4.483 1.00 0.00 H new ATOM 154 N ASP A 14 0.816 15.881 5.954 1.00 0.00 N ATOM 155 CA ASP A 14 -0.249 15.674 6.918 1.00 0.00 C ATOM 156 C ASP A 14 -0.590 14.191 6.928 1.00 0.00 C ATOM 157 O ASP A 14 -0.132 13.408 6.091 1.00 0.00 O ATOM 158 CB ASP A 14 -1.493 16.539 6.621 1.00 0.00 C ATOM 159 CG ASP A 14 -1.488 17.909 7.313 1.00 0.00 C ATOM 160 OD1 ASP A 14 -1.310 17.928 8.557 1.00 0.00 O ATOM 161 OD2 ASP A 14 -1.796 18.942 6.662 1.00 0.00 O ATOM 0 H ASP A 14 0.705 15.308 5.118 1.00 0.00 H new ATOM 0 HA ASP A 14 0.094 15.989 7.903 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -1.568 16.689 5.544 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -2.384 15.992 6.930 1.00 0.00 H new ATOM 166 N GLN A 15 -1.357 13.810 7.943 1.00 0.00 N ATOM 167 CA GLN A 15 -1.840 12.462 8.190 1.00 0.00 C ATOM 168 C GLN A 15 -3.337 12.600 7.937 1.00 0.00 C ATOM 169 O GLN A 15 -4.047 13.222 8.741 1.00 0.00 O ATOM 170 CB GLN A 15 -1.444 12.000 9.608 1.00 0.00 C ATOM 171 CG GLN A 15 -1.336 10.474 9.769 1.00 0.00 C ATOM 172 CD GLN A 15 -1.983 9.892 11.026 1.00 0.00 C ATOM 173 OE1 GLN A 15 -1.923 10.458 12.119 1.00 0.00 O ATOM 174 NE2 GLN A 15 -2.577 8.715 10.899 1.00 0.00 N ATOM 0 H GLN A 15 -1.674 14.471 8.652 1.00 0.00 H new ATOM 0 HA GLN A 15 -1.414 11.683 7.558 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -0.486 12.450 9.870 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -2.179 12.378 10.319 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -1.790 10.002 8.897 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -0.281 10.201 9.766 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -2.618 8.260 9.987 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -2.994 8.263 11.713 1.00 0.00 H new ATOM 183 N LEU A 16 -3.798 12.104 6.787 1.00 0.00 N ATOM 184 CA LEU A 16 -5.174 12.181 6.316 1.00 0.00 C ATOM 185 C LEU A 16 -5.885 10.852 6.534 1.00 0.00 C ATOM 186 O LEU A 16 -5.394 9.794 6.146 1.00 0.00 O ATOM 187 CB LEU A 16 -5.203 12.679 4.861 1.00 0.00 C ATOM 188 CG LEU A 16 -4.238 13.864 4.590 1.00 0.00 C ATOM 189 CD1 LEU A 16 -3.035 13.393 3.771 1.00 0.00 C ATOM 190 CD2 LEU A 16 -4.899 15.057 3.904 1.00 0.00 C ATOM 0 H LEU A 16 -3.189 11.615 6.131 1.00 0.00 H new ATOM 0 HA LEU A 16 -5.733 12.913 6.899 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -4.946 11.853 4.198 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -6.219 12.984 4.611 1.00 0.00 H new ATOM 0 HG LEU A 16 -3.914 14.215 5.570 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -2.367 14.235 3.589 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -2.501 12.618 4.321 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -3.379 12.990 2.818 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -4.160 15.843 3.749 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -5.304 14.745 2.941 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -5.706 15.436 4.531 1.00 0.00 H new ATOM 202 N GLN A 17 -7.040 10.902 7.193 1.00 0.00 N ATOM 203 CA GLN A 17 -7.841 9.727 7.519 1.00 0.00 C ATOM 204 C GLN A 17 -9.320 9.926 7.200 1.00 0.00 C ATOM 205 O GLN A 17 -9.847 11.028 7.376 1.00 0.00 O ATOM 206 CB GLN A 17 -7.739 9.431 9.028 1.00 0.00 C ATOM 207 CG GLN A 17 -6.357 9.006 9.547 1.00 0.00 C ATOM 208 CD GLN A 17 -5.324 10.119 9.549 1.00 0.00 C ATOM 209 OE1 GLN A 17 -4.274 9.979 8.940 1.00 0.00 O ATOM 210 NE2 GLN A 17 -5.579 11.231 10.219 1.00 0.00 N ATOM 0 H GLN A 17 -7.452 11.776 7.521 1.00 0.00 H new ATOM 0 HA GLN A 17 -7.451 8.907 6.916 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -8.050 10.322 9.573 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -8.453 8.644 9.271 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -6.464 8.623 10.562 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -5.988 8.184 8.934 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -6.460 11.332 10.722 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -4.894 11.987 10.232 1.00 0.00 H new ATOM 219 N GLY A 18 -9.983 8.833 6.823 1.00 0.00 N ATOM 220 CA GLY A 18 -11.402 8.762 6.501 1.00 0.00 C ATOM 221 C GLY A 18 -12.118 7.918 7.558 1.00 0.00 C ATOM 222 O GLY A 18 -13.138 8.333 8.116 1.00 0.00 O ATOM 0 H GLY A 18 -9.519 7.930 6.730 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -11.830 9.764 6.468 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -11.541 8.323 5.513 1.00 0.00 H new ATOM 226 N GLY A 19 -11.533 6.786 7.954 1.00 0.00 N ATOM 227 CA GLY A 19 -12.071 5.857 8.936 1.00 0.00 C ATOM 228 C GLY A 19 -13.054 4.904 8.269 1.00 0.00 C ATOM 229 O GLY A 19 -13.200 4.902 7.048 1.00 0.00 O ATOM 0 H GLY A 19 -10.633 6.483 7.580 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -11.260 5.292 9.397 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -12.570 6.407 9.734 1.00 0.00 H new ATOM 233 N SER A 20 -13.724 4.060 9.046 1.00 0.00 N ATOM 234 CA SER A 20 -14.684 3.118 8.499 1.00 0.00 C ATOM 235 C SER A 20 -15.912 3.860 7.974 1.00 0.00 C ATOM 236 O SER A 20 -16.586 4.546 8.746 1.00 0.00 O ATOM 237 CB SER A 20 -15.107 2.127 9.570 1.00 0.00 C ATOM 238 OG SER A 20 -15.589 2.817 10.708 1.00 0.00 O ATOM 0 H SER A 20 -13.617 4.012 10.059 1.00 0.00 H new ATOM 0 HA SER A 20 -14.214 2.580 7.676 1.00 0.00 H new ATOM 0 HB2 SER A 20 -15.882 1.467 9.180 1.00 0.00 H new ATOM 0 HB3 SER A 20 -14.262 1.497 9.848 1.00 0.00 H new ATOM 0 HG SER A 20 -15.992 3.666 10.430 1.00 0.00 H new ATOM 244 N GLY A 21 -16.267 3.643 6.715 1.00 0.00 N ATOM 245 CA GLY A 21 -17.384 4.267 6.053 1.00 0.00 C ATOM 246 C GLY A 21 -17.150 4.282 4.547 1.00 0.00 C ATOM 247 O GLY A 21 -16.834 3.226 3.986 1.00 0.00 O ATOM 0 H GLY A 21 -15.758 2.999 6.110 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -18.302 3.726 6.282 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -17.513 5.285 6.420 1.00 0.00 H new ATOM 251 N ALA A 22 -17.635 5.332 3.883 1.00 0.00 N ATOM 252 CA ALA A 22 -17.465 5.581 2.462 1.00 0.00 C ATOM 253 C ALA A 22 -16.807 6.959 2.415 1.00 0.00 C ATOM 254 O ALA A 22 -17.534 7.955 2.403 1.00 0.00 O ATOM 255 CB ALA A 22 -18.816 5.520 1.739 1.00 0.00 C ATOM 0 H ALA A 22 -18.179 6.060 4.346 1.00 0.00 H new ATOM 0 HA ALA A 22 -16.854 4.838 1.950 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -18.668 5.709 0.676 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -19.257 4.532 1.874 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -19.484 6.275 2.152 1.00 0.00 H new ATOM 261 N ASP A 23 -15.484 7.051 2.344 1.00 0.00 N ATOM 262 CA ASP A 23 -14.782 8.334 2.309 1.00 0.00 C ATOM 263 C ASP A 23 -13.906 8.391 1.057 1.00 0.00 C ATOM 264 O ASP A 23 -13.684 7.361 0.408 1.00 0.00 O ATOM 265 CB ASP A 23 -14.049 8.583 3.637 1.00 0.00 C ATOM 266 CG ASP A 23 -13.838 10.076 3.866 1.00 0.00 C ATOM 267 OD1 ASP A 23 -14.813 10.852 3.735 1.00 0.00 O ATOM 268 OD2 ASP A 23 -12.697 10.515 4.118 1.00 0.00 O ATOM 0 H ASP A 23 -14.866 6.240 2.309 1.00 0.00 H new ATOM 0 HA ASP A 23 -15.481 9.166 2.224 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -14.626 8.162 4.461 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -13.086 8.072 3.628 1.00 0.00 H new ATOM 273 N ARG A 24 -13.437 9.563 0.629 1.00 0.00 N ATOM 274 CA ARG A 24 -12.613 9.670 -0.570 1.00 0.00 C ATOM 275 C ARG A 24 -11.672 10.836 -0.347 1.00 0.00 C ATOM 276 O ARG A 24 -12.008 11.993 -0.616 1.00 0.00 O ATOM 277 CB ARG A 24 -13.532 9.812 -1.790 1.00 0.00 C ATOM 278 CG ARG A 24 -12.825 10.399 -3.012 1.00 0.00 C ATOM 279 CD ARG A 24 -13.354 9.745 -4.287 1.00 0.00 C ATOM 280 NE ARG A 24 -13.002 10.486 -5.505 1.00 0.00 N ATOM 281 CZ ARG A 24 -11.783 10.870 -5.891 1.00 0.00 C ATOM 282 NH1 ARG A 24 -10.692 10.498 -5.227 1.00 0.00 N ATOM 283 NH2 ARG A 24 -11.680 11.619 -6.976 1.00 0.00 N ATOM 0 H ARG A 24 -13.615 10.452 1.097 1.00 0.00 H new ATOM 0 HA ARG A 24 -12.005 8.786 -0.765 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -13.937 8.833 -2.048 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -14.378 10.448 -1.528 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -12.986 11.476 -3.053 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -11.750 10.240 -2.931 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -12.959 8.732 -4.359 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -14.439 9.660 -4.221 1.00 0.00 H new ATOM 0 HE ARG A 24 -13.774 10.735 -6.124 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -10.775 9.905 -4.401 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -9.773 10.806 -5.544 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -12.518 11.887 -7.492 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -10.763 11.929 -7.297 1.00 0.00 H new ATOM 297 N LEU A 25 -10.457 10.479 0.046 1.00 0.00 N ATOM 298 CA LEU A 25 -9.410 11.427 0.347 1.00 0.00 C ATOM 299 C LEU A 25 -8.316 11.383 -0.704 1.00 0.00 C ATOM 300 O LEU A 25 -7.979 10.324 -1.247 1.00 0.00 O ATOM 301 CB LEU A 25 -8.919 11.215 1.790 1.00 0.00 C ATOM 302 CG LEU A 25 -7.914 10.078 2.051 1.00 0.00 C ATOM 303 CD1 LEU A 25 -7.622 10.047 3.556 1.00 0.00 C ATOM 304 CD2 LEU A 25 -8.392 8.683 1.649 1.00 0.00 C ATOM 0 H LEU A 25 -10.174 9.506 0.164 1.00 0.00 H new ATOM 0 HA LEU A 25 -9.799 12.444 0.302 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -8.465 12.146 2.129 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -9.793 11.039 2.418 1.00 0.00 H new ATOM 0 HG LEU A 25 -7.043 10.297 1.434 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -6.911 9.249 3.772 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -7.199 11.003 3.864 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -8.548 9.866 4.103 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -7.614 7.953 1.873 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -9.295 8.433 2.206 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -8.609 8.666 0.581 1.00 0.00 H new ATOM 316 N ASP A 26 -7.781 12.563 -0.989 1.00 0.00 N ATOM 317 CA ASP A 26 -6.713 12.763 -1.947 1.00 0.00 C ATOM 318 C ASP A 26 -5.563 13.347 -1.156 1.00 0.00 C ATOM 319 O ASP A 26 -5.756 14.311 -0.419 1.00 0.00 O ATOM 320 CB ASP A 26 -7.169 13.665 -3.121 1.00 0.00 C ATOM 321 CG ASP A 26 -7.907 13.011 -4.313 1.00 0.00 C ATOM 322 OD1 ASP A 26 -8.726 12.072 -4.169 1.00 0.00 O ATOM 323 OD2 ASP A 26 -7.766 13.506 -5.462 1.00 0.00 O ATOM 0 H ASP A 26 -8.090 13.428 -0.546 1.00 0.00 H new ATOM 0 HA ASP A 26 -6.408 11.832 -2.425 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -7.820 14.437 -2.712 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -6.286 14.168 -3.514 1.00 0.00 H new ATOM 328 N GLY A 27 -4.406 12.690 -1.239 1.00 0.00 N ATOM 329 CA GLY A 27 -3.135 12.986 -0.580 1.00 0.00 C ATOM 330 C GLY A 27 -2.800 14.453 -0.523 1.00 0.00 C ATOM 331 O GLY A 27 -2.635 14.975 0.577 1.00 0.00 O ATOM 0 H GLY A 27 -4.329 11.859 -1.825 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -3.164 12.591 0.435 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -2.336 12.462 -1.104 1.00 0.00 H new ATOM 335 N GLY A 28 -2.824 15.120 -1.679 1.00 0.00 N ATOM 336 CA GLY A 28 -2.520 16.546 -1.750 1.00 0.00 C ATOM 337 C GLY A 28 -1.282 16.794 -2.598 1.00 0.00 C ATOM 338 O GLY A 28 -1.343 16.588 -3.820 1.00 0.00 O ATOM 0 H GLY A 28 -3.051 14.693 -2.577 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -3.369 17.083 -2.173 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -2.363 16.939 -0.746 1.00 0.00 H new ATOM 342 N ALA A 29 -0.208 17.334 -2.008 1.00 0.00 N ATOM 343 CA ALA A 29 1.044 17.608 -2.702 1.00 0.00 C ATOM 344 C ALA A 29 2.205 17.669 -1.710 1.00 0.00 C ATOM 345 O ALA A 29 2.661 18.765 -1.350 1.00 0.00 O ATOM 346 CB ALA A 29 0.936 18.928 -3.464 1.00 0.00 C ATOM 0 H ALA A 29 -0.190 17.594 -1.022 1.00 0.00 H new ATOM 0 HA ALA A 29 1.236 16.801 -3.409 1.00 0.00 H new ATOM 0 HB1 ALA A 29 1.875 19.128 -3.981 1.00 0.00 H new ATOM 0 HB2 ALA A 29 0.128 18.863 -4.192 1.00 0.00 H new ATOM 0 HB3 ALA A 29 0.728 19.737 -2.763 1.00 0.00 H new ATOM 352 N GLY A 30 2.741 16.515 -1.334 1.00 0.00 N ATOM 353 CA GLY A 30 3.838 16.417 -0.391 1.00 0.00 C ATOM 354 C GLY A 30 4.184 14.975 -0.084 1.00 0.00 C ATOM 355 O GLY A 30 4.068 14.097 -0.942 1.00 0.00 O ATOM 0 H GLY A 30 2.419 15.612 -1.682 1.00 0.00 H new ATOM 0 HA2 GLY A 30 4.714 16.923 -0.797 1.00 0.00 H new ATOM 0 HA3 GLY A 30 3.572 16.932 0.532 1.00 0.00 H new ATOM 359 N ASP A 31 4.743 14.798 1.108 1.00 0.00 N ATOM 360 CA ASP A 31 5.149 13.556 1.722 1.00 0.00 C ATOM 361 C ASP A 31 4.051 13.206 2.721 1.00 0.00 C ATOM 362 O ASP A 31 4.281 13.057 3.923 1.00 0.00 O ATOM 363 CB ASP A 31 6.531 13.714 2.355 1.00 0.00 C ATOM 364 CG ASP A 31 6.989 12.459 3.102 1.00 0.00 C ATOM 365 OD1 ASP A 31 6.963 11.349 2.529 1.00 0.00 O ATOM 366 OD2 ASP A 31 7.435 12.541 4.268 1.00 0.00 O ATOM 0 H ASP A 31 4.937 15.594 1.715 1.00 0.00 H new ATOM 0 HA ASP A 31 5.257 12.741 1.007 1.00 0.00 H new ATOM 0 HB2 ASP A 31 7.256 13.953 1.577 1.00 0.00 H new ATOM 0 HB3 ASP A 31 6.515 14.557 3.046 1.00 0.00 H new ATOM 371 N ASP A 32 2.818 13.180 2.220 1.00 0.00 N ATOM 372 CA ASP A 32 1.635 12.898 3.009 1.00 0.00 C ATOM 373 C ASP A 32 1.527 11.418 3.271 1.00 0.00 C ATOM 374 O ASP A 32 2.205 10.580 2.663 1.00 0.00 O ATOM 375 CB ASP A 32 0.347 13.462 2.426 1.00 0.00 C ATOM 376 CG ASP A 32 0.460 14.947 2.103 1.00 0.00 C ATOM 377 OD1 ASP A 32 0.282 15.731 3.061 1.00 0.00 O ATOM 378 OD2 ASP A 32 0.859 15.283 0.960 1.00 0.00 O ATOM 0 H ASP A 32 2.616 13.358 1.236 1.00 0.00 H new ATOM 0 HA ASP A 32 1.763 13.422 3.956 1.00 0.00 H new ATOM 0 HB2 ASP A 32 0.091 12.914 1.519 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -0.468 13.307 3.133 1.00 0.00 H new ATOM 383 N ILE A 33 0.689 11.124 4.257 1.00 0.00 N ATOM 384 CA ILE A 33 0.430 9.785 4.717 1.00 0.00 C ATOM 385 C ILE A 33 -1.088 9.622 4.910 1.00 0.00 C ATOM 386 O ILE A 33 -1.650 9.964 5.955 1.00 0.00 O ATOM 387 CB ILE A 33 1.353 9.503 5.939 1.00 0.00 C ATOM 388 CG1 ILE A 33 1.037 10.295 7.227 1.00 0.00 C ATOM 389 CG2 ILE A 33 2.850 9.745 5.641 1.00 0.00 C ATOM 390 CD1 ILE A 33 2.060 10.207 8.371 1.00 0.00 C ATOM 0 H ILE A 33 0.163 11.835 4.765 1.00 0.00 H new ATOM 0 HA ILE A 33 0.689 9.005 4.001 1.00 0.00 H new ATOM 0 HB ILE A 33 1.141 8.449 6.117 1.00 0.00 H new ATOM 0 HG12 ILE A 33 0.919 11.345 6.958 1.00 0.00 H new ATOM 0 HG13 ILE A 33 0.074 9.953 7.607 1.00 0.00 H new ATOM 0 HG21 ILE A 33 3.438 9.530 6.533 1.00 0.00 H new ATOM 0 HG22 ILE A 33 3.170 9.091 4.830 1.00 0.00 H new ATOM 0 HG23 ILE A 33 3.000 10.785 5.349 1.00 0.00 H new ATOM 0 HD11 ILE A 33 1.717 10.808 9.213 1.00 0.00 H new ATOM 0 HD12 ILE A 33 2.166 9.169 8.685 1.00 0.00 H new ATOM 0 HD13 ILE A 33 3.024 10.582 8.027 1.00 0.00 H new ATOM 402 N LEU A 34 -1.789 9.107 3.899 1.00 0.00 N ATOM 403 CA LEU A 34 -3.242 8.910 3.924 1.00 0.00 C ATOM 404 C LEU A 34 -3.627 7.445 4.203 1.00 0.00 C ATOM 405 O LEU A 34 -2.910 6.512 3.843 1.00 0.00 O ATOM 406 CB LEU A 34 -3.898 9.552 2.683 1.00 0.00 C ATOM 407 CG LEU A 34 -3.469 8.842 1.408 1.00 0.00 C ATOM 408 CD1 LEU A 34 -4.585 7.913 0.934 1.00 0.00 C ATOM 409 CD2 LEU A 34 -3.150 9.883 0.348 1.00 0.00 C ATOM 0 H LEU A 34 -1.357 8.809 3.024 1.00 0.00 H new ATOM 0 HA LEU A 34 -3.663 9.444 4.776 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -4.983 9.510 2.779 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -3.623 10.605 2.626 1.00 0.00 H new ATOM 0 HG LEU A 34 -2.580 8.240 1.596 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -4.273 7.407 0.020 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -4.795 7.173 1.706 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -5.485 8.496 0.737 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -2.841 9.384 -0.571 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -4.036 10.487 0.153 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -2.343 10.526 0.700 1.00 0.00 H new ATOM 421 N ASP A 35 -4.792 7.234 4.820 1.00 0.00 N ATOM 422 CA ASP A 35 -5.382 5.946 5.213 1.00 0.00 C ATOM 423 C ASP A 35 -6.890 6.048 5.039 1.00 0.00 C ATOM 424 O ASP A 35 -7.544 6.810 5.749 1.00 0.00 O ATOM 425 CB ASP A 35 -4.988 5.629 6.667 1.00 0.00 C ATOM 426 CG ASP A 35 -5.883 4.632 7.416 1.00 0.00 C ATOM 427 OD1 ASP A 35 -6.005 3.455 7.024 1.00 0.00 O ATOM 428 OD2 ASP A 35 -6.409 5.005 8.495 1.00 0.00 O ATOM 0 H ASP A 35 -5.395 8.015 5.078 1.00 0.00 H new ATOM 0 HA ASP A 35 -5.013 5.131 4.591 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -3.969 5.241 6.668 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -4.974 6.563 7.228 1.00 0.00 H new ATOM 433 N GLY A 36 -7.439 5.319 4.064 1.00 0.00 N ATOM 434 CA GLY A 36 -8.865 5.314 3.764 1.00 0.00 C ATOM 435 C GLY A 36 -9.669 4.854 4.974 1.00 0.00 C ATOM 436 O GLY A 36 -10.344 5.661 5.612 1.00 0.00 O ATOM 0 H GLY A 36 -6.894 4.709 3.455 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -9.183 6.314 3.469 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -9.061 4.655 2.919 1.00 0.00 H new ATOM 440 N GLY A 37 -9.539 3.575 5.325 1.00 0.00 N ATOM 441 CA GLY A 37 -10.220 2.930 6.434 1.00 0.00 C ATOM 442 C GLY A 37 -11.038 1.723 5.971 1.00 0.00 C ATOM 443 O GLY A 37 -11.020 1.363 4.796 1.00 0.00 O ATOM 0 H GLY A 37 -8.927 2.936 4.817 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -9.487 2.610 7.175 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -10.877 3.648 6.925 1.00 0.00 H new ATOM 447 N ALA A 38 -11.753 1.072 6.895 1.00 0.00 N ATOM 448 CA ALA A 38 -12.573 -0.098 6.597 1.00 0.00 C ATOM 449 C ALA A 38 -13.749 0.250 5.674 1.00 0.00 C ATOM 450 O ALA A 38 -14.773 0.785 6.118 1.00 0.00 O ATOM 451 CB ALA A 38 -13.126 -0.653 7.910 1.00 0.00 C ATOM 0 H ALA A 38 -11.776 1.348 7.877 1.00 0.00 H new ATOM 0 HA ALA A 38 -11.949 -0.832 6.088 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -13.742 -1.529 7.704 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -12.300 -0.936 8.562 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -13.731 0.109 8.401 1.00 0.00 H new ATOM 457 N GLY A 39 -13.688 -0.184 4.421 1.00 0.00 N ATOM 458 CA GLY A 39 -14.695 0.027 3.419 1.00 0.00 C ATOM 459 C GLY A 39 -14.074 0.055 2.037 1.00 0.00 C ATOM 460 O GLY A 39 -12.855 -0.021 1.903 1.00 0.00 O ATOM 0 H GLY A 39 -12.892 -0.717 4.071 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -15.441 -0.766 3.473 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -15.214 0.966 3.609 1.00 0.00 H new ATOM 464 N ARG A 40 -14.922 0.043 1.003 1.00 0.00 N ATOM 465 CA ARG A 40 -14.445 0.115 -0.359 1.00 0.00 C ATOM 466 C ARG A 40 -14.370 1.611 -0.611 1.00 0.00 C ATOM 467 O ARG A 40 -15.358 2.235 -0.997 1.00 0.00 O ATOM 468 CB ARG A 40 -15.355 -0.668 -1.319 1.00 0.00 C ATOM 469 CG ARG A 40 -16.859 -0.351 -1.424 1.00 0.00 C ATOM 470 CD ARG A 40 -17.667 -1.162 -0.422 1.00 0.00 C ATOM 471 NE ARG A 40 -19.102 -0.961 -0.634 1.00 0.00 N ATOM 472 CZ ARG A 40 -20.038 -1.907 -0.618 1.00 0.00 C ATOM 473 NH1 ARG A 40 -19.745 -3.133 -0.208 1.00 0.00 N ATOM 474 NH2 ARG A 40 -21.255 -1.610 -1.038 1.00 0.00 N ATOM 0 H ARG A 40 -15.936 -0.016 1.095 1.00 0.00 H new ATOM 0 HA ARG A 40 -13.477 -0.357 -0.528 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -14.935 -0.557 -2.319 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -15.269 -1.721 -1.052 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -17.022 0.713 -1.249 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -17.208 -0.565 -2.434 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -17.424 -2.220 -0.522 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -17.399 -0.868 0.593 1.00 0.00 H new ATOM 0 HE ARG A 40 -19.414 -0.006 -0.811 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -18.798 -3.356 0.098 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -20.467 -3.854 -0.198 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -21.465 -0.668 -1.368 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -21.985 -2.323 -1.033 1.00 0.00 H new ATOM 488 N ASP A 41 -13.190 2.181 -0.460 1.00 0.00 N ATOM 489 CA ASP A 41 -12.954 3.602 -0.630 1.00 0.00 C ATOM 490 C ASP A 41 -12.113 3.826 -1.880 1.00 0.00 C ATOM 491 O ASP A 41 -11.589 2.880 -2.485 1.00 0.00 O ATOM 492 CB ASP A 41 -12.360 4.221 0.646 1.00 0.00 C ATOM 493 CG ASP A 41 -13.422 4.558 1.695 1.00 0.00 C ATOM 494 OD1 ASP A 41 -14.629 4.345 1.435 1.00 0.00 O ATOM 495 OD2 ASP A 41 -13.059 5.153 2.733 1.00 0.00 O ATOM 0 H ASP A 41 -12.351 1.658 -0.210 1.00 0.00 H new ATOM 0 HA ASP A 41 -13.898 4.125 -0.784 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -11.638 3.528 1.077 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -11.815 5.128 0.384 1.00 0.00 H new ATOM 500 N ARG A 42 -12.110 5.064 -2.376 1.00 0.00 N ATOM 501 CA ARG A 42 -11.372 5.480 -3.545 1.00 0.00 C ATOM 502 C ARG A 42 -10.415 6.595 -3.151 1.00 0.00 C ATOM 503 O ARG A 42 -10.863 7.724 -2.926 1.00 0.00 O ATOM 504 CB ARG A 42 -12.389 5.951 -4.574 1.00 0.00 C ATOM 505 CG ARG A 42 -11.693 6.532 -5.821 1.00 0.00 C ATOM 506 CD ARG A 42 -12.692 6.976 -6.888 1.00 0.00 C ATOM 507 NE ARG A 42 -12.125 8.029 -7.750 1.00 0.00 N ATOM 508 CZ ARG A 42 -12.722 8.539 -8.835 1.00 0.00 C ATOM 509 NH1 ARG A 42 -13.801 7.982 -9.359 1.00 0.00 N ATOM 510 NH2 ARG A 42 -12.254 9.629 -9.423 1.00 0.00 N ATOM 0 H ARG A 42 -12.643 5.823 -1.952 1.00 0.00 H new ATOM 0 HA ARG A 42 -10.780 4.668 -3.967 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -13.027 5.117 -4.866 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -13.036 6.708 -4.130 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -11.076 7.382 -5.528 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -11.023 5.783 -6.243 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -12.980 6.120 -7.498 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -13.599 7.345 -6.409 1.00 0.00 H new ATOM 0 HE ARG A 42 -11.207 8.398 -7.501 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -14.198 7.143 -8.936 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -14.236 8.391 -10.186 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -11.426 10.094 -9.050 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -12.721 10.004 -10.249 1.00 0.00 H new ATOM 524 N LEU A 43 -9.123 6.297 -3.105 1.00 0.00 N ATOM 525 CA LEU A 43 -8.065 7.237 -2.754 1.00 0.00 C ATOM 526 C LEU A 43 -7.283 7.592 -4.021 1.00 0.00 C ATOM 527 O LEU A 43 -7.249 6.803 -4.969 1.00 0.00 O ATOM 528 CB LEU A 43 -7.116 6.666 -1.672 1.00 0.00 C ATOM 529 CG LEU A 43 -7.192 5.157 -1.347 1.00 0.00 C ATOM 530 CD1 LEU A 43 -5.918 4.723 -0.614 1.00 0.00 C ATOM 531 CD2 LEU A 43 -8.369 4.838 -0.406 1.00 0.00 C ATOM 0 H LEU A 43 -8.771 5.364 -3.318 1.00 0.00 H new ATOM 0 HA LEU A 43 -8.521 8.132 -2.331 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -6.093 6.888 -1.977 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -7.299 7.214 -0.748 1.00 0.00 H new ATOM 0 HG LEU A 43 -7.317 4.633 -2.294 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -5.974 3.659 -0.386 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -5.051 4.913 -1.247 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -5.821 5.288 0.313 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -8.390 3.768 -0.200 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -8.246 5.385 0.529 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -9.305 5.135 -0.880 1.00 0.00 H new ATOM 543 N SER A 44 -6.694 8.787 -4.048 1.00 0.00 N ATOM 544 CA SER A 44 -5.889 9.313 -5.145 1.00 0.00 C ATOM 545 C SER A 44 -4.864 10.239 -4.484 1.00 0.00 C ATOM 546 O SER A 44 -5.212 11.375 -4.181 1.00 0.00 O ATOM 547 CB SER A 44 -6.807 10.031 -6.147 1.00 0.00 C ATOM 548 OG SER A 44 -6.189 10.298 -7.393 1.00 0.00 O ATOM 0 H SER A 44 -6.770 9.442 -3.270 1.00 0.00 H new ATOM 0 HA SER A 44 -5.371 8.545 -5.719 1.00 0.00 H new ATOM 0 HB2 SER A 44 -7.695 9.421 -6.315 1.00 0.00 H new ATOM 0 HB3 SER A 44 -7.144 10.971 -5.709 1.00 0.00 H new ATOM 0 HG SER A 44 -6.826 10.753 -7.983 1.00 0.00 H new ATOM 554 N GLY A 45 -3.649 9.775 -4.174 1.00 0.00 N ATOM 555 CA GLY A 45 -2.600 10.559 -3.522 1.00 0.00 C ATOM 556 C GLY A 45 -2.432 11.888 -4.233 1.00 0.00 C ATOM 557 O GLY A 45 -2.741 12.955 -3.695 1.00 0.00 O ATOM 0 H GLY A 45 -3.362 8.817 -4.376 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -2.856 10.726 -2.476 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -1.660 10.008 -3.536 1.00 0.00 H new ATOM 561 N GLY A 46 -2.125 11.785 -5.520 1.00 0.00 N ATOM 562 CA GLY A 46 -1.911 12.945 -6.363 1.00 0.00 C ATOM 563 C GLY A 46 -0.430 13.067 -6.689 1.00 0.00 C ATOM 564 O GLY A 46 0.325 12.125 -6.467 1.00 0.00 O ATOM 0 H GLY A 46 -2.018 10.894 -6.005 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -2.490 12.852 -7.282 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -2.258 13.845 -5.856 1.00 0.00 H new ATOM 568 N ALA A 47 -0.024 14.182 -7.300 1.00 0.00 N ATOM 569 CA ALA A 47 1.380 14.393 -7.619 1.00 0.00 C ATOM 570 C ALA A 47 2.051 14.768 -6.294 1.00 0.00 C ATOM 571 O ALA A 47 1.905 15.902 -5.819 1.00 0.00 O ATOM 572 CB ALA A 47 1.526 15.460 -8.708 1.00 0.00 C ATOM 0 H ALA A 47 -0.644 14.942 -7.579 1.00 0.00 H new ATOM 0 HA ALA A 47 1.860 13.507 -8.034 1.00 0.00 H new ATOM 0 HB1 ALA A 47 2.582 15.606 -8.935 1.00 0.00 H new ATOM 0 HB2 ALA A 47 1.003 15.136 -9.608 1.00 0.00 H new ATOM 0 HB3 ALA A 47 1.097 16.399 -8.357 1.00 0.00 H new ATOM 578 N GLY A 48 2.780 13.820 -5.717 1.00 0.00 N ATOM 579 CA GLY A 48 3.504 13.880 -4.461 1.00 0.00 C ATOM 580 C GLY A 48 4.372 12.636 -4.369 1.00 0.00 C ATOM 581 O GLY A 48 4.721 12.038 -5.387 1.00 0.00 O ATOM 0 H GLY A 48 2.886 12.908 -6.161 1.00 0.00 H new ATOM 0 HA2 GLY A 48 4.118 14.779 -4.416 1.00 0.00 H new ATOM 0 HA3 GLY A 48 2.810 13.926 -3.621 1.00 0.00 H new ATOM 585 N ALA A 49 4.801 12.329 -3.154 1.00 0.00 N ATOM 586 CA ALA A 49 5.611 11.184 -2.760 1.00 0.00 C ATOM 587 C ALA A 49 4.890 10.717 -1.483 1.00 0.00 C ATOM 588 O ALA A 49 5.435 10.829 -0.385 1.00 0.00 O ATOM 589 CB ALA A 49 7.059 11.648 -2.528 1.00 0.00 C ATOM 0 H ALA A 49 4.574 12.920 -2.354 1.00 0.00 H new ATOM 0 HA ALA A 49 5.696 10.379 -3.489 1.00 0.00 H new ATOM 0 HB1 ALA A 49 7.671 10.796 -2.233 1.00 0.00 H new ATOM 0 HB2 ALA A 49 7.455 12.078 -3.448 1.00 0.00 H new ATOM 0 HB3 ALA A 49 7.078 12.399 -1.739 1.00 0.00 H new ATOM 595 N ASP A 50 3.650 10.255 -1.662 1.00 0.00 N ATOM 596 CA ASP A 50 2.668 9.825 -0.663 1.00 0.00 C ATOM 597 C ASP A 50 2.919 8.470 -0.035 1.00 0.00 C ATOM 598 O ASP A 50 3.874 7.772 -0.344 1.00 0.00 O ATOM 599 CB ASP A 50 1.258 9.847 -1.246 1.00 0.00 C ATOM 600 CG ASP A 50 0.190 10.288 -0.251 1.00 0.00 C ATOM 601 OD1 ASP A 50 -0.188 9.456 0.605 1.00 0.00 O ATOM 602 OD2 ASP A 50 -0.277 11.442 -0.397 1.00 0.00 O ATOM 0 H ASP A 50 3.271 10.164 -2.605 1.00 0.00 H new ATOM 0 HA ASP A 50 2.777 10.552 0.141 1.00 0.00 H new ATOM 0 HB2 ASP A 50 1.240 10.517 -2.105 1.00 0.00 H new ATOM 0 HB3 ASP A 50 1.011 8.851 -1.613 1.00 0.00 H new ATOM 607 N THR A 51 2.168 8.209 1.018 1.00 0.00 N ATOM 608 CA THR A 51 2.194 6.996 1.830 1.00 0.00 C ATOM 609 C THR A 51 0.784 6.446 2.072 1.00 0.00 C ATOM 610 O THR A 51 0.056 6.935 2.932 1.00 0.00 O ATOM 611 CB THR A 51 2.957 7.229 3.131 1.00 0.00 C ATOM 612 OG1 THR A 51 4.076 8.063 2.902 1.00 0.00 O ATOM 613 CG2 THR A 51 3.439 5.917 3.759 1.00 0.00 C ATOM 0 H THR A 51 1.477 8.879 1.355 1.00 0.00 H new ATOM 0 HA THR A 51 2.732 6.229 1.272 1.00 0.00 H new ATOM 0 HB THR A 51 2.264 7.708 3.822 1.00 0.00 H new ATOM 0 HG1 THR A 51 3.775 8.988 2.779 1.00 0.00 H new ATOM 0 HG21 THR A 51 3.977 6.132 4.683 1.00 0.00 H new ATOM 0 HG22 THR A 51 2.581 5.282 3.978 1.00 0.00 H new ATOM 0 HG23 THR A 51 4.103 5.403 3.064 1.00 0.00 H new ATOM 621 N PHE A 52 0.386 5.402 1.340 1.00 0.00 N ATOM 622 CA PHE A 52 -0.927 4.784 1.482 1.00 0.00 C ATOM 623 C PHE A 52 -0.785 3.784 2.630 1.00 0.00 C ATOM 624 O PHE A 52 -0.175 2.723 2.472 1.00 0.00 O ATOM 625 CB PHE A 52 -1.378 4.116 0.170 1.00 0.00 C ATOM 626 CG PHE A 52 -1.274 4.921 -1.120 1.00 0.00 C ATOM 627 CD1 PHE A 52 -1.244 6.332 -1.131 1.00 0.00 C ATOM 628 CD2 PHE A 52 -1.191 4.224 -2.342 1.00 0.00 C ATOM 629 CE1 PHE A 52 -1.062 7.021 -2.343 1.00 0.00 C ATOM 630 CE2 PHE A 52 -1.011 4.915 -3.553 1.00 0.00 C ATOM 631 CZ PHE A 52 -0.915 6.317 -3.549 1.00 0.00 C ATOM 0 H PHE A 52 0.971 4.962 0.630 1.00 0.00 H new ATOM 0 HA PHE A 52 -1.702 5.518 1.702 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -0.794 3.205 0.042 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -2.418 3.813 0.291 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -1.361 6.882 -0.209 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -1.267 3.147 -2.348 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -1.035 8.101 -2.346 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -0.947 4.370 -4.483 1.00 0.00 H new ATOM 0 HZ PHE A 52 -0.729 6.851 -4.469 1.00 0.00 H new ATOM 641 N VAL A 53 -1.253 4.132 3.823 1.00 0.00 N ATOM 642 CA VAL A 53 -1.161 3.289 5.009 1.00 0.00 C ATOM 643 C VAL A 53 -2.450 2.478 5.207 1.00 0.00 C ATOM 644 O VAL A 53 -3.543 3.011 5.022 1.00 0.00 O ATOM 645 CB VAL A 53 -0.926 4.217 6.226 1.00 0.00 C ATOM 646 CG1 VAL A 53 -0.828 3.431 7.545 1.00 0.00 C ATOM 647 CG2 VAL A 53 0.343 5.075 6.081 1.00 0.00 C ATOM 0 H VAL A 53 -1.716 5.024 3.996 1.00 0.00 H new ATOM 0 HA VAL A 53 -0.341 2.580 4.898 1.00 0.00 H new ATOM 0 HB VAL A 53 -1.798 4.871 6.253 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -0.663 4.124 8.370 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -1.755 2.883 7.712 1.00 0.00 H new ATOM 0 HG13 VAL A 53 0.004 2.729 7.489 1.00 0.00 H new ATOM 0 HG21 VAL A 53 0.458 5.706 6.962 1.00 0.00 H new ATOM 0 HG22 VAL A 53 1.213 4.425 5.984 1.00 0.00 H new ATOM 0 HG23 VAL A 53 0.258 5.703 5.194 1.00 0.00 H new ATOM 657 N PHE A 54 -2.334 1.204 5.597 1.00 0.00 N ATOM 658 CA PHE A 54 -3.465 0.303 5.903 1.00 0.00 C ATOM 659 C PHE A 54 -3.030 -0.638 7.028 1.00 0.00 C ATOM 660 O PHE A 54 -1.823 -0.878 7.178 1.00 0.00 O ATOM 661 CB PHE A 54 -3.977 -0.493 4.697 1.00 0.00 C ATOM 662 CG PHE A 54 -4.936 0.198 3.746 1.00 0.00 C ATOM 663 CD1 PHE A 54 -5.922 1.107 4.193 1.00 0.00 C ATOM 664 CD2 PHE A 54 -4.921 -0.184 2.393 1.00 0.00 C ATOM 665 CE1 PHE A 54 -6.867 1.625 3.291 1.00 0.00 C ATOM 666 CE2 PHE A 54 -5.886 0.313 1.506 1.00 0.00 C ATOM 667 CZ PHE A 54 -6.857 1.223 1.946 1.00 0.00 C ATOM 0 H PHE A 54 -1.427 0.752 5.714 1.00 0.00 H new ATOM 0 HA PHE A 54 -4.309 0.922 6.208 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -3.112 -0.820 4.120 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -4.468 -1.391 5.073 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -5.949 1.404 5.231 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -4.162 -0.864 2.035 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -7.604 2.336 3.634 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -5.881 -0.008 0.475 1.00 0.00 H new ATOM 0 HZ PHE A 54 -7.591 1.612 1.256 1.00 0.00 H new ATOM 677 N SER A 55 -3.976 -1.147 7.841 1.00 0.00 N ATOM 678 CA SER A 55 -3.643 -2.028 8.958 1.00 0.00 C ATOM 679 C SER A 55 -4.780 -2.723 9.750 1.00 0.00 C ATOM 680 O SER A 55 -4.414 -3.297 10.784 1.00 0.00 O ATOM 681 CB SER A 55 -2.830 -1.179 9.963 1.00 0.00 C ATOM 682 OG SER A 55 -3.546 -0.042 10.428 1.00 0.00 O ATOM 0 H SER A 55 -4.973 -0.959 7.739 1.00 0.00 H new ATOM 0 HA SER A 55 -3.125 -2.864 8.487 1.00 0.00 H new ATOM 0 HB2 SER A 55 -2.551 -1.800 10.814 1.00 0.00 H new ATOM 0 HB3 SER A 55 -1.904 -0.851 9.490 1.00 0.00 H new ATOM 0 HG SER A 55 -2.990 0.459 11.061 1.00 0.00 H new ATOM 688 N ALA A 56 -6.086 -2.743 9.400 1.00 0.00 N ATOM 689 CA ALA A 56 -7.068 -3.395 10.275 1.00 0.00 C ATOM 690 C ALA A 56 -7.799 -4.575 9.636 1.00 0.00 C ATOM 691 O ALA A 56 -7.731 -4.832 8.437 1.00 0.00 O ATOM 692 CB ALA A 56 -7.937 -2.316 10.927 1.00 0.00 C ATOM 0 H ALA A 56 -6.468 -2.330 8.549 1.00 0.00 H new ATOM 0 HA ALA A 56 -6.550 -3.912 11.083 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -8.672 -2.786 11.580 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -7.307 -1.646 11.512 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -8.452 -1.746 10.153 1.00 0.00 H new ATOM 698 N ARG A 57 -8.482 -5.341 10.494 1.00 0.00 N ATOM 699 CA ARG A 57 -9.214 -6.552 10.130 1.00 0.00 C ATOM 700 C ARG A 57 -10.395 -6.381 9.181 1.00 0.00 C ATOM 701 O ARG A 57 -10.823 -7.411 8.664 1.00 0.00 O ATOM 702 CB ARG A 57 -9.629 -7.333 11.387 1.00 0.00 C ATOM 703 CG ARG A 57 -8.432 -7.802 12.232 1.00 0.00 C ATOM 704 CD ARG A 57 -8.860 -8.806 13.311 1.00 0.00 C ATOM 705 NE ARG A 57 -9.838 -8.210 14.228 1.00 0.00 N ATOM 706 CZ ARG A 57 -10.931 -8.763 14.758 1.00 0.00 C ATOM 707 NH1 ARG A 57 -11.267 -10.025 14.522 1.00 0.00 N ATOM 708 NH2 ARG A 57 -11.726 -8.011 15.501 1.00 0.00 N ATOM 0 H ARG A 57 -8.540 -5.126 11.489 1.00 0.00 H new ATOM 0 HA ARG A 57 -8.496 -7.124 9.543 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -10.275 -6.705 12.001 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -10.218 -8.201 11.090 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -7.686 -8.260 11.583 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -7.959 -6.940 12.703 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -9.290 -9.690 12.840 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -7.986 -9.137 13.872 1.00 0.00 H new ATOM 0 HE ARG A 57 -9.658 -7.243 14.497 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -10.683 -10.604 13.919 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -12.110 -10.416 14.944 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -11.498 -7.029 15.659 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -12.567 -8.413 15.916 1.00 0.00 H new ATOM 722 N GLU A 58 -11.015 -5.207 9.018 1.00 0.00 N ATOM 723 CA GLU A 58 -12.106 -5.109 8.055 1.00 0.00 C ATOM 724 C GLU A 58 -11.470 -4.753 6.715 1.00 0.00 C ATOM 725 O GLU A 58 -11.915 -5.311 5.710 1.00 0.00 O ATOM 726 CB GLU A 58 -13.178 -4.079 8.427 1.00 0.00 C ATOM 727 CG GLU A 58 -14.381 -4.628 9.208 1.00 0.00 C ATOM 728 CD GLU A 58 -14.312 -4.274 10.690 1.00 0.00 C ATOM 729 OE1 GLU A 58 -14.458 -3.088 11.057 1.00 0.00 O ATOM 730 OE2 GLU A 58 -14.145 -5.193 11.529 1.00 0.00 O ATOM 0 H GLU A 58 -10.790 -4.347 9.519 1.00 0.00 H new ATOM 0 HA GLU A 58 -12.635 -6.062 8.027 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -12.711 -3.292 9.020 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -13.543 -3.614 7.511 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -15.302 -4.229 8.783 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -14.422 -5.711 9.096 1.00 0.00 H new ATOM 737 N ASP A 59 -10.432 -3.895 6.664 1.00 0.00 N ATOM 738 CA ASP A 59 -9.812 -3.589 5.381 1.00 0.00 C ATOM 739 C ASP A 59 -8.745 -4.671 5.235 1.00 0.00 C ATOM 740 O ASP A 59 -7.556 -4.474 5.486 1.00 0.00 O ATOM 741 CB ASP A 59 -9.251 -2.173 5.247 1.00 0.00 C ATOM 742 CG ASP A 59 -8.374 -2.139 3.986 1.00 0.00 C ATOM 743 OD1 ASP A 59 -8.894 -2.467 2.886 1.00 0.00 O ATOM 744 OD2 ASP A 59 -7.145 -1.961 4.119 1.00 0.00 O ATOM 0 H ASP A 59 -10.024 -3.422 7.470 1.00 0.00 H new ATOM 0 HA ASP A 59 -10.549 -3.598 4.578 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -10.060 -1.446 5.171 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -8.666 -1.908 6.128 1.00 0.00 H new ATOM 749 N SER A 60 -9.180 -5.878 4.900 1.00 0.00 N ATOM 750 CA SER A 60 -8.339 -7.027 4.739 1.00 0.00 C ATOM 751 C SER A 60 -8.889 -8.017 3.718 1.00 0.00 C ATOM 752 O SER A 60 -8.107 -8.789 3.167 1.00 0.00 O ATOM 753 CB SER A 60 -8.315 -7.687 6.113 1.00 0.00 C ATOM 754 OG SER A 60 -7.267 -7.165 6.915 1.00 0.00 O ATOM 0 H SER A 60 -10.166 -6.077 4.730 1.00 0.00 H new ATOM 0 HA SER A 60 -7.355 -6.731 4.376 1.00 0.00 H new ATOM 0 HB2 SER A 60 -9.271 -7.529 6.612 1.00 0.00 H new ATOM 0 HB3 SER A 60 -8.188 -8.764 6.000 1.00 0.00 H new ATOM 0 HG SER A 60 -7.574 -6.350 7.365 1.00 0.00 H new ATOM 760 N TYR A 61 -10.205 -8.092 3.523 1.00 0.00 N ATOM 761 CA TYR A 61 -10.840 -9.022 2.597 1.00 0.00 C ATOM 762 C TYR A 61 -12.287 -8.595 2.376 1.00 0.00 C ATOM 763 O TYR A 61 -12.764 -7.649 3.003 1.00 0.00 O ATOM 764 CB TYR A 61 -10.783 -10.441 3.225 1.00 0.00 C ATOM 765 CG TYR A 61 -10.779 -10.518 4.747 1.00 0.00 C ATOM 766 CD1 TYR A 61 -11.708 -9.792 5.521 1.00 0.00 C ATOM 767 CD2 TYR A 61 -9.791 -11.284 5.391 1.00 0.00 C ATOM 768 CE1 TYR A 61 -11.615 -9.788 6.921 1.00 0.00 C ATOM 769 CE2 TYR A 61 -9.702 -11.296 6.791 1.00 0.00 C ATOM 770 CZ TYR A 61 -10.589 -10.517 7.560 1.00 0.00 C ATOM 771 OH TYR A 61 -10.490 -10.531 8.913 1.00 0.00 O ATOM 0 H TYR A 61 -10.870 -7.495 4.015 1.00 0.00 H new ATOM 0 HA TYR A 61 -10.327 -9.026 1.635 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -11.637 -11.010 2.858 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -9.886 -10.940 2.857 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -12.495 -9.236 5.033 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -9.096 -11.867 4.804 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -12.327 -9.228 7.509 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -8.954 -11.902 7.279 1.00 0.00 H new ATOM 0 HH TYR A 61 -10.557 -9.615 9.255 1.00 0.00 H new ATOM 781 N ARG A 62 -13.016 -9.349 1.552 1.00 0.00 N ATOM 782 CA ARG A 62 -14.430 -9.118 1.285 1.00 0.00 C ATOM 783 C ARG A 62 -15.182 -10.308 1.832 1.00 0.00 C ATOM 784 O ARG A 62 -14.602 -11.364 2.106 1.00 0.00 O ATOM 785 CB ARG A 62 -14.767 -8.893 -0.198 1.00 0.00 C ATOM 786 CG ARG A 62 -14.929 -10.086 -1.156 1.00 0.00 C ATOM 787 CD ARG A 62 -13.683 -10.949 -1.288 1.00 0.00 C ATOM 788 NE ARG A 62 -13.854 -12.003 -2.297 1.00 0.00 N ATOM 789 CZ ARG A 62 -13.421 -11.962 -3.561 1.00 0.00 C ATOM 790 NH1 ARG A 62 -13.014 -10.822 -4.099 1.00 0.00 N ATOM 791 NH2 ARG A 62 -13.404 -13.064 -4.296 1.00 0.00 N ATOM 0 H ARG A 62 -12.632 -10.147 1.046 1.00 0.00 H new ATOM 0 HA ARG A 62 -14.724 -8.188 1.772 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -15.697 -8.325 -0.233 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -13.987 -8.254 -0.611 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -15.754 -10.708 -0.809 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -15.205 -9.712 -2.142 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -12.833 -10.322 -1.558 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -13.451 -11.402 -0.324 1.00 0.00 H new ATOM 0 HE ARG A 62 -14.350 -12.845 -2.006 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -13.029 -9.964 -3.548 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -12.686 -10.802 -5.064 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -13.722 -13.948 -3.898 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -13.073 -13.029 -5.260 1.00 0.00 H new ATOM 805 N THR A 63 -16.474 -10.107 2.006 1.00 0.00 N ATOM 806 CA THR A 63 -17.378 -11.126 2.503 1.00 0.00 C ATOM 807 C THR A 63 -18.548 -11.168 1.529 1.00 0.00 C ATOM 808 O THR A 63 -18.766 -10.199 0.792 1.00 0.00 O ATOM 809 CB THR A 63 -17.850 -10.822 3.946 1.00 0.00 C ATOM 810 OG1 THR A 63 -18.637 -9.655 4.029 1.00 0.00 O ATOM 811 CG2 THR A 63 -16.751 -10.680 5.003 1.00 0.00 C ATOM 0 H THR A 63 -16.932 -9.218 1.803 1.00 0.00 H new ATOM 0 HA THR A 63 -16.879 -12.093 2.559 1.00 0.00 H new ATOM 0 HB THR A 63 -18.426 -11.719 4.173 1.00 0.00 H new ATOM 0 HG1 THR A 63 -18.136 -8.896 3.665 1.00 0.00 H new ATOM 0 HG21 THR A 63 -17.203 -10.468 5.972 1.00 0.00 H new ATOM 0 HG22 THR A 63 -16.182 -11.608 5.063 1.00 0.00 H new ATOM 0 HG23 THR A 63 -16.085 -9.863 4.727 1.00 0.00 H new ATOM 819 N ASP A 64 -19.310 -12.261 1.519 1.00 0.00 N ATOM 820 CA ASP A 64 -20.475 -12.341 0.639 1.00 0.00 C ATOM 821 C ASP A 64 -21.474 -11.268 1.081 1.00 0.00 C ATOM 822 O ASP A 64 -22.064 -10.560 0.268 1.00 0.00 O ATOM 823 CB ASP A 64 -21.134 -13.717 0.699 1.00 0.00 C ATOM 824 CG ASP A 64 -22.303 -13.738 -0.279 1.00 0.00 C ATOM 825 OD1 ASP A 64 -22.022 -13.762 -1.501 1.00 0.00 O ATOM 826 OD2 ASP A 64 -23.476 -13.727 0.156 1.00 0.00 O ATOM 0 H ASP A 64 -19.148 -13.086 2.096 1.00 0.00 H new ATOM 0 HA ASP A 64 -20.157 -12.180 -0.391 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -20.413 -14.493 0.444 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -21.483 -13.926 1.710 1.00 0.00 H new ATOM 831 N THR A 65 -21.580 -11.094 2.398 1.00 0.00 N ATOM 832 CA THR A 65 -22.447 -10.143 3.059 1.00 0.00 C ATOM 833 C THR A 65 -22.063 -8.678 2.804 1.00 0.00 C ATOM 834 O THR A 65 -22.945 -7.819 2.761 1.00 0.00 O ATOM 835 CB THR A 65 -22.446 -10.462 4.562 1.00 0.00 C ATOM 836 OG1 THR A 65 -21.128 -10.537 5.097 1.00 0.00 O ATOM 837 CG2 THR A 65 -23.081 -11.821 4.877 1.00 0.00 C ATOM 0 H THR A 65 -21.032 -11.645 3.059 1.00 0.00 H new ATOM 0 HA THR A 65 -23.448 -10.248 2.641 1.00 0.00 H new ATOM 0 HB THR A 65 -23.016 -9.645 5.005 1.00 0.00 H new ATOM 0 HG1 THR A 65 -20.495 -10.137 4.465 1.00 0.00 H new ATOM 0 HG21 THR A 65 -23.053 -11.995 5.953 1.00 0.00 H new ATOM 0 HG22 THR A 65 -24.116 -11.827 4.535 1.00 0.00 H new ATOM 0 HG23 THR A 65 -22.526 -12.609 4.368 1.00 0.00 H new ATOM 845 N ALA A 66 -20.770 -8.354 2.675 1.00 0.00 N ATOM 846 CA ALA A 66 -20.295 -6.996 2.455 1.00 0.00 C ATOM 847 C ALA A 66 -18.862 -6.992 1.921 1.00 0.00 C ATOM 848 O ALA A 66 -17.963 -7.623 2.487 1.00 0.00 O ATOM 849 CB ALA A 66 -20.283 -6.234 3.793 1.00 0.00 C ATOM 0 H ALA A 66 -20.019 -9.043 2.722 1.00 0.00 H new ATOM 0 HA ALA A 66 -20.962 -6.526 1.732 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -19.927 -5.217 3.629 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -21.292 -6.204 4.204 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -19.621 -6.741 4.495 1.00 0.00 H new ATOM 855 N VAL A 67 -18.619 -6.215 0.874 1.00 0.00 N ATOM 856 CA VAL A 67 -17.308 -6.067 0.258 1.00 0.00 C ATOM 857 C VAL A 67 -16.655 -4.801 0.811 1.00 0.00 C ATOM 858 O VAL A 67 -17.356 -3.827 1.097 1.00 0.00 O ATOM 859 CB VAL A 67 -17.451 -6.048 -1.280 1.00 0.00 C ATOM 860 CG1 VAL A 67 -16.120 -5.869 -2.021 1.00 0.00 C ATOM 861 CG2 VAL A 67 -18.134 -7.326 -1.804 1.00 0.00 C ATOM 0 H VAL A 67 -19.343 -5.658 0.420 1.00 0.00 H new ATOM 0 HA VAL A 67 -16.662 -6.911 0.499 1.00 0.00 H new ATOM 0 HB VAL A 67 -18.072 -5.177 -1.487 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -16.300 -5.865 -3.096 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -15.664 -4.924 -1.726 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -15.449 -6.690 -1.768 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -18.217 -7.275 -2.890 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -17.540 -8.196 -1.525 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -19.129 -7.412 -1.368 1.00 0.00 H new ATOM 871 N PHE A 68 -15.324 -4.802 0.903 1.00 0.00 N ATOM 872 CA PHE A 68 -14.489 -3.706 1.388 1.00 0.00 C ATOM 873 C PHE A 68 -13.277 -3.526 0.450 1.00 0.00 C ATOM 874 O PHE A 68 -12.249 -3.005 0.860 1.00 0.00 O ATOM 875 CB PHE A 68 -14.057 -3.979 2.844 1.00 0.00 C ATOM 876 CG PHE A 68 -15.163 -4.373 3.819 1.00 0.00 C ATOM 877 CD1 PHE A 68 -16.316 -3.577 3.970 1.00 0.00 C ATOM 878 CD2 PHE A 68 -15.032 -5.543 4.593 1.00 0.00 C ATOM 879 CE1 PHE A 68 -17.329 -3.953 4.871 1.00 0.00 C ATOM 880 CE2 PHE A 68 -16.043 -5.921 5.493 1.00 0.00 C ATOM 881 CZ PHE A 68 -17.194 -5.126 5.632 1.00 0.00 C ATOM 0 H PHE A 68 -14.771 -5.613 0.625 1.00 0.00 H new ATOM 0 HA PHE A 68 -15.056 -2.775 1.384 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -13.311 -4.773 2.835 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -13.566 -3.085 3.228 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -16.423 -2.672 3.390 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -14.147 -6.154 4.494 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -18.211 -3.339 4.978 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -15.936 -6.822 6.078 1.00 0.00 H new ATOM 0 HZ PHE A 68 -17.972 -5.416 6.322 1.00 0.00 H new ATOM 891 N ASN A 69 -13.379 -4.008 -0.799 1.00 0.00 N ATOM 892 CA ASN A 69 -12.325 -3.938 -1.806 1.00 0.00 C ATOM 893 C ASN A 69 -11.896 -2.497 -2.115 1.00 0.00 C ATOM 894 O ASN A 69 -12.672 -1.721 -2.675 1.00 0.00 O ATOM 895 CB ASN A 69 -12.723 -4.734 -3.071 1.00 0.00 C ATOM 896 CG ASN A 69 -12.229 -4.143 -4.381 1.00 0.00 C ATOM 897 OD1 ASN A 69 -10.937 -4.168 -4.603 1.00 0.00 O flip ATOM 898 ND2 ASN A 69 -13.020 -3.740 -5.230 1.00 0.00 N flip ATOM 0 H ASN A 69 -14.223 -4.469 -1.139 1.00 0.00 H new ATOM 0 HA ASN A 69 -11.438 -4.415 -1.389 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -12.338 -5.750 -2.979 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -13.810 -4.807 -3.109 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -14.020 -3.731 -5.032 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -12.676 -3.414 -6.133 1.00 0.00 H new ATOM 905 N ASP A 70 -10.636 -2.185 -1.821 1.00 0.00 N ATOM 906 CA ASP A 70 -10.017 -0.878 -2.045 1.00 0.00 C ATOM 907 C ASP A 70 -9.788 -0.664 -3.538 1.00 0.00 C ATOM 908 O ASP A 70 -9.661 -1.628 -4.315 1.00 0.00 O ATOM 909 CB ASP A 70 -8.681 -0.824 -1.291 1.00 0.00 C ATOM 910 CG ASP A 70 -7.760 0.336 -1.668 1.00 0.00 C ATOM 911 OD1 ASP A 70 -8.236 1.491 -1.685 1.00 0.00 O ATOM 912 OD2 ASP A 70 -6.560 0.080 -1.912 1.00 0.00 O ATOM 0 H ASP A 70 -9.993 -2.859 -1.405 1.00 0.00 H new ATOM 0 HA ASP A 70 -10.674 -0.089 -1.678 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -8.889 -0.768 -0.222 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -8.148 -1.759 -1.463 1.00 0.00 H new ATOM 917 N LEU A 71 -9.809 0.603 -3.950 1.00 0.00 N ATOM 918 CA LEU A 71 -9.625 1.015 -5.323 1.00 0.00 C ATOM 919 C LEU A 71 -8.742 2.245 -5.293 1.00 0.00 C ATOM 920 O LEU A 71 -9.166 3.317 -4.863 1.00 0.00 O ATOM 921 CB LEU A 71 -10.991 1.261 -5.969 1.00 0.00 C ATOM 922 CG LEU A 71 -10.957 1.669 -7.447 1.00 0.00 C ATOM 923 CD1 LEU A 71 -10.793 3.176 -7.673 1.00 0.00 C ATOM 924 CD2 LEU A 71 -9.959 0.864 -8.287 1.00 0.00 C ATOM 0 H LEU A 71 -9.959 1.385 -3.313 1.00 0.00 H new ATOM 0 HA LEU A 71 -9.140 0.251 -5.931 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -11.587 0.354 -5.874 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -11.505 2.040 -5.406 1.00 0.00 H new ATOM 0 HG LEU A 71 -11.952 1.409 -7.810 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -10.778 3.384 -8.743 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -11.627 3.706 -7.212 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -9.858 3.511 -7.225 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -9.992 1.209 -9.320 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -8.954 1.003 -7.890 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -10.221 -0.193 -8.249 1.00 0.00 H new ATOM 936 N ILE A 72 -7.517 2.102 -5.777 1.00 0.00 N ATOM 937 CA ILE A 72 -6.563 3.186 -5.769 1.00 0.00 C ATOM 938 C ILE A 72 -6.522 3.792 -7.156 1.00 0.00 C ATOM 939 O ILE A 72 -6.684 3.099 -8.175 1.00 0.00 O ATOM 940 CB ILE A 72 -5.177 2.667 -5.343 1.00 0.00 C ATOM 941 CG1 ILE A 72 -5.250 1.727 -4.121 1.00 0.00 C ATOM 942 CG2 ILE A 72 -4.227 3.841 -5.057 1.00 0.00 C ATOM 943 CD1 ILE A 72 -3.995 0.886 -3.890 1.00 0.00 C ATOM 0 H ILE A 72 -7.164 1.235 -6.182 1.00 0.00 H new ATOM 0 HA ILE A 72 -6.859 3.951 -5.051 1.00 0.00 H new ATOM 0 HB ILE A 72 -4.786 2.083 -6.176 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -5.440 2.325 -3.230 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -6.102 1.058 -4.244 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -3.252 3.456 -4.757 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -4.117 4.447 -5.956 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -4.637 4.454 -4.254 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -4.136 0.256 -3.011 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -3.813 0.257 -4.762 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -3.140 1.544 -3.732 1.00 0.00 H new ATOM 955 N LEU A 73 -6.458 5.113 -7.176 1.00 0.00 N ATOM 956 CA LEU A 73 -6.351 5.911 -8.375 1.00 0.00 C ATOM 957 C LEU A 73 -4.944 6.510 -8.421 1.00 0.00 C ATOM 958 O LEU A 73 -4.319 6.726 -7.385 1.00 0.00 O ATOM 959 CB LEU A 73 -7.457 6.972 -8.355 1.00 0.00 C ATOM 960 CG LEU A 73 -7.591 7.861 -9.603 1.00 0.00 C ATOM 961 CD1 LEU A 73 -7.793 7.043 -10.886 1.00 0.00 C ATOM 962 CD2 LEU A 73 -8.811 8.773 -9.424 1.00 0.00 C ATOM 0 H LEU A 73 -6.480 5.674 -6.325 1.00 0.00 H new ATOM 0 HA LEU A 73 -6.489 5.320 -9.280 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -8.409 6.466 -8.195 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -7.291 7.619 -7.494 1.00 0.00 H new ATOM 0 HG LEU A 73 -6.666 8.429 -9.705 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -7.882 7.718 -11.737 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -6.939 6.382 -11.034 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -8.702 6.447 -10.799 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -8.920 9.411 -10.301 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -9.707 8.163 -9.305 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -8.674 9.394 -8.539 1.00 0.00 H new ATOM 974 N ASP A 74 -4.501 6.783 -9.641 1.00 0.00 N ATOM 975 CA ASP A 74 -3.257 7.407 -10.103 1.00 0.00 C ATOM 976 C ASP A 74 -2.077 7.246 -9.129 1.00 0.00 C ATOM 977 O ASP A 74 -1.740 8.167 -8.393 1.00 0.00 O ATOM 978 CB ASP A 74 -3.624 8.867 -10.407 1.00 0.00 C ATOM 979 CG ASP A 74 -2.933 9.536 -11.591 1.00 0.00 C ATOM 980 OD1 ASP A 74 -2.709 8.837 -12.608 1.00 0.00 O ATOM 981 OD2 ASP A 74 -2.971 10.788 -11.660 1.00 0.00 O ATOM 0 H ASP A 74 -5.083 6.540 -10.443 1.00 0.00 H new ATOM 0 HA ASP A 74 -2.877 6.908 -10.994 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -4.700 8.915 -10.575 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -3.413 9.459 -9.516 1.00 0.00 H new ATOM 986 N PHE A 75 -1.517 6.032 -9.062 1.00 0.00 N ATOM 987 CA PHE A 75 -0.385 5.704 -8.183 1.00 0.00 C ATOM 988 C PHE A 75 0.934 6.048 -8.864 1.00 0.00 C ATOM 989 O PHE A 75 1.204 5.591 -9.981 1.00 0.00 O ATOM 990 CB PHE A 75 -0.420 4.211 -7.820 1.00 0.00 C ATOM 991 CG PHE A 75 0.813 3.610 -7.151 1.00 0.00 C ATOM 992 CD1 PHE A 75 1.382 4.183 -5.996 1.00 0.00 C ATOM 993 CD2 PHE A 75 1.335 2.395 -7.636 1.00 0.00 C ATOM 994 CE1 PHE A 75 2.442 3.533 -5.334 1.00 0.00 C ATOM 995 CE2 PHE A 75 2.406 1.757 -6.986 1.00 0.00 C ATOM 996 CZ PHE A 75 2.959 2.325 -5.829 1.00 0.00 C ATOM 0 H PHE A 75 -1.839 5.242 -9.621 1.00 0.00 H new ATOM 0 HA PHE A 75 -0.467 6.294 -7.270 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -1.272 4.047 -7.160 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -0.612 3.649 -8.734 1.00 0.00 H new ATOM 0 HD1 PHE A 75 1.005 5.122 -5.618 1.00 0.00 H new ATOM 0 HD2 PHE A 75 0.906 1.947 -8.520 1.00 0.00 H new ATOM 0 HE1 PHE A 75 2.861 3.967 -4.438 1.00 0.00 H new ATOM 0 HE2 PHE A 75 2.802 0.831 -7.377 1.00 0.00 H new ATOM 0 HZ PHE A 75 3.778 1.836 -5.322 1.00 0.00 H new ATOM 1006 N GLU A 76 1.784 6.808 -8.181 1.00 0.00 N ATOM 1007 CA GLU A 76 3.071 7.210 -8.694 1.00 0.00 C ATOM 1008 C GLU A 76 4.167 6.385 -8.018 1.00 0.00 C ATOM 1009 O GLU A 76 4.871 6.915 -7.172 1.00 0.00 O ATOM 1010 CB GLU A 76 3.247 8.733 -8.556 1.00 0.00 C ATOM 1011 CG GLU A 76 4.482 9.218 -9.330 1.00 0.00 C ATOM 1012 CD GLU A 76 4.345 8.959 -10.832 1.00 0.00 C ATOM 1013 OE1 GLU A 76 3.698 9.784 -11.521 1.00 0.00 O ATOM 1014 OE2 GLU A 76 4.852 7.914 -11.307 1.00 0.00 O ATOM 0 H GLU A 76 1.588 7.162 -7.245 1.00 0.00 H new ATOM 0 HA GLU A 76 3.145 7.004 -9.762 1.00 0.00 H new ATOM 0 HB2 GLU A 76 2.357 9.241 -8.929 1.00 0.00 H new ATOM 0 HB3 GLU A 76 3.347 8.997 -7.503 1.00 0.00 H new ATOM 0 HG2 GLU A 76 4.625 10.284 -9.156 1.00 0.00 H new ATOM 0 HG3 GLU A 76 5.370 8.711 -8.953 1.00 0.00 H new ATOM 1021 N ALA A 77 4.372 5.112 -8.390 1.00 0.00 N ATOM 1022 CA ALA A 77 5.402 4.238 -7.798 1.00 0.00 C ATOM 1023 C ALA A 77 6.790 4.893 -7.736 1.00 0.00 C ATOM 1024 O ALA A 77 7.598 4.541 -6.872 1.00 0.00 O ATOM 1025 CB ALA A 77 5.512 2.929 -8.586 1.00 0.00 C ATOM 0 H ALA A 77 3.823 4.654 -9.117 1.00 0.00 H new ATOM 0 HA ALA A 77 5.078 4.046 -6.775 1.00 0.00 H new ATOM 0 HB1 ALA A 77 6.277 2.296 -8.135 1.00 0.00 H new ATOM 0 HB2 ALA A 77 4.553 2.410 -8.566 1.00 0.00 H new ATOM 0 HB3 ALA A 77 5.784 3.148 -9.619 1.00 0.00 H new ATOM 1031 N SER A 78 7.078 5.815 -8.662 1.00 0.00 N ATOM 1032 CA SER A 78 8.330 6.549 -8.730 1.00 0.00 C ATOM 1033 C SER A 78 8.555 7.392 -7.455 1.00 0.00 C ATOM 1034 O SER A 78 9.703 7.615 -7.056 1.00 0.00 O ATOM 1035 CB SER A 78 8.253 7.457 -9.975 1.00 0.00 C ATOM 1036 OG SER A 78 9.517 7.976 -10.351 1.00 0.00 O ATOM 0 H SER A 78 6.424 6.072 -9.401 1.00 0.00 H new ATOM 0 HA SER A 78 9.171 5.859 -8.801 1.00 0.00 H new ATOM 0 HB2 SER A 78 7.835 6.891 -10.807 1.00 0.00 H new ATOM 0 HB3 SER A 78 7.570 8.283 -9.776 1.00 0.00 H new ATOM 0 HG SER A 78 9.415 8.542 -11.144 1.00 0.00 H new ATOM 1042 N GLU A 79 7.498 7.804 -6.745 1.00 0.00 N ATOM 1043 CA GLU A 79 7.572 8.647 -5.549 1.00 0.00 C ATOM 1044 C GLU A 79 6.762 8.136 -4.359 1.00 0.00 C ATOM 1045 O GLU A 79 7.229 8.230 -3.220 1.00 0.00 O ATOM 1046 CB GLU A 79 7.080 10.055 -5.925 1.00 0.00 C ATOM 1047 CG GLU A 79 7.589 10.577 -7.276 1.00 0.00 C ATOM 1048 CD GLU A 79 7.797 12.085 -7.312 1.00 0.00 C ATOM 1049 OE1 GLU A 79 8.846 12.533 -6.784 1.00 0.00 O ATOM 1050 OE2 GLU A 79 7.081 12.818 -8.034 1.00 0.00 O ATOM 0 H GLU A 79 6.542 7.552 -6.995 1.00 0.00 H new ATOM 0 HA GLU A 79 8.612 8.641 -5.224 1.00 0.00 H new ATOM 0 HB2 GLU A 79 5.990 10.051 -5.940 1.00 0.00 H new ATOM 0 HB3 GLU A 79 7.385 10.752 -5.144 1.00 0.00 H new ATOM 0 HG2 GLU A 79 8.531 10.084 -7.514 1.00 0.00 H new ATOM 0 HG3 GLU A 79 6.878 10.299 -8.054 1.00 0.00 H new ATOM 1057 N ASP A 80 5.569 7.617 -4.621 1.00 0.00 N ATOM 1058 CA ASP A 80 4.640 7.102 -3.632 1.00 0.00 C ATOM 1059 C ASP A 80 5.200 5.883 -2.914 1.00 0.00 C ATOM 1060 O ASP A 80 6.055 5.133 -3.401 1.00 0.00 O ATOM 1061 CB ASP A 80 3.284 6.741 -4.268 1.00 0.00 C ATOM 1062 CG ASP A 80 2.399 7.926 -4.650 1.00 0.00 C ATOM 1063 OD1 ASP A 80 2.601 9.026 -4.083 1.00 0.00 O ATOM 1064 OD2 ASP A 80 1.495 7.686 -5.483 1.00 0.00 O ATOM 0 H ASP A 80 5.210 7.542 -5.573 1.00 0.00 H new ATOM 0 HA ASP A 80 4.490 7.899 -2.903 1.00 0.00 H new ATOM 0 HB2 ASP A 80 3.469 6.145 -5.162 1.00 0.00 H new ATOM 0 HB3 ASP A 80 2.733 6.108 -3.572 1.00 0.00 H new ATOM 1069 N ARG A 81 4.619 5.656 -1.745 1.00 0.00 N ATOM 1070 CA ARG A 81 4.899 4.605 -0.794 1.00 0.00 C ATOM 1071 C ARG A 81 3.592 3.994 -0.339 1.00 0.00 C ATOM 1072 O ARG A 81 2.508 4.564 -0.472 1.00 0.00 O ATOM 1073 CB ARG A 81 5.701 5.196 0.353 1.00 0.00 C ATOM 1074 CG ARG A 81 6.415 4.197 1.265 1.00 0.00 C ATOM 1075 CD ARG A 81 7.577 4.965 1.896 1.00 0.00 C ATOM 1076 NE ARG A 81 8.495 4.101 2.640 1.00 0.00 N ATOM 1077 CZ ARG A 81 9.597 4.540 3.252 1.00 0.00 C ATOM 1078 NH1 ARG A 81 9.974 5.814 3.205 1.00 0.00 N ATOM 1079 NH2 ARG A 81 10.357 3.680 3.911 1.00 0.00 N ATOM 0 H ARG A 81 3.870 6.264 -1.413 1.00 0.00 H new ATOM 0 HA ARG A 81 5.493 3.807 -1.239 1.00 0.00 H new ATOM 0 HB2 ARG A 81 6.447 5.873 -0.064 1.00 0.00 H new ATOM 0 HB3 ARG A 81 5.030 5.799 0.965 1.00 0.00 H new ATOM 0 HG2 ARG A 81 5.739 3.813 2.029 1.00 0.00 H new ATOM 0 HG3 ARG A 81 6.776 3.339 0.698 1.00 0.00 H new ATOM 0 HD2 ARG A 81 8.130 5.485 1.113 1.00 0.00 H new ATOM 0 HD3 ARG A 81 7.180 5.727 2.566 1.00 0.00 H new ATOM 0 HE ARG A 81 8.280 3.105 2.694 1.00 0.00 H new ATOM 0 HH11 ARG A 81 9.414 6.493 2.689 1.00 0.00 H new ATOM 0 HH12 ARG A 81 10.823 6.113 3.685 1.00 0.00 H new ATOM 0 HH21 ARG A 81 10.098 2.694 3.947 1.00 0.00 H new ATOM 0 HH22 ARG A 81 11.202 4.003 4.383 1.00 0.00 H new ATOM 1093 N ILE A 82 3.717 2.836 0.284 1.00 0.00 N ATOM 1094 CA ILE A 82 2.593 2.041 0.764 1.00 0.00 C ATOM 1095 C ILE A 82 2.973 1.337 2.075 1.00 0.00 C ATOM 1096 O ILE A 82 3.962 0.603 2.091 1.00 0.00 O ATOM 1097 CB ILE A 82 2.235 1.054 -0.391 1.00 0.00 C ATOM 1098 CG1 ILE A 82 1.712 1.797 -1.653 1.00 0.00 C ATOM 1099 CG2 ILE A 82 1.224 -0.001 0.059 1.00 0.00 C ATOM 1100 CD1 ILE A 82 1.192 0.932 -2.807 1.00 0.00 C ATOM 0 H ILE A 82 4.623 2.409 0.476 1.00 0.00 H new ATOM 0 HA ILE A 82 1.718 2.646 1.003 1.00 0.00 H new ATOM 0 HB ILE A 82 3.162 0.547 -0.660 1.00 0.00 H new ATOM 0 HG12 ILE A 82 0.909 2.466 -1.343 1.00 0.00 H new ATOM 0 HG13 ILE A 82 2.518 2.423 -2.036 1.00 0.00 H new ATOM 0 HG21 ILE A 82 1.000 -0.669 -0.773 1.00 0.00 H new ATOM 0 HG22 ILE A 82 1.642 -0.577 0.885 1.00 0.00 H new ATOM 0 HG23 ILE A 82 0.308 0.490 0.387 1.00 0.00 H new ATOM 0 HD11 ILE A 82 0.859 1.575 -3.622 1.00 0.00 H new ATOM 0 HD12 ILE A 82 1.991 0.281 -3.162 1.00 0.00 H new ATOM 0 HD13 ILE A 82 0.356 0.325 -2.459 1.00 0.00 H new ATOM 1112 N ASP A 83 2.273 1.548 3.200 1.00 0.00 N ATOM 1113 CA ASP A 83 2.607 0.856 4.456 1.00 0.00 C ATOM 1114 C ASP A 83 1.550 -0.210 4.712 1.00 0.00 C ATOM 1115 O ASP A 83 0.519 0.043 5.341 1.00 0.00 O ATOM 1116 CB ASP A 83 2.706 1.768 5.683 1.00 0.00 C ATOM 1117 CG ASP A 83 3.282 1.006 6.903 1.00 0.00 C ATOM 1118 OD1 ASP A 83 3.188 -0.246 7.001 1.00 0.00 O ATOM 1119 OD2 ASP A 83 3.845 1.662 7.811 1.00 0.00 O ATOM 0 H ASP A 83 1.480 2.186 3.267 1.00 0.00 H new ATOM 0 HA ASP A 83 3.602 0.432 4.321 1.00 0.00 H new ATOM 0 HB2 ASP A 83 3.341 2.624 5.453 1.00 0.00 H new ATOM 0 HB3 ASP A 83 1.719 2.160 5.929 1.00 0.00 H new ATOM 1124 N LEU A 84 1.856 -1.430 4.280 1.00 0.00 N ATOM 1125 CA LEU A 84 1.004 -2.611 4.415 1.00 0.00 C ATOM 1126 C LEU A 84 1.681 -3.649 5.311 1.00 0.00 C ATOM 1127 O LEU A 84 1.311 -4.825 5.299 1.00 0.00 O ATOM 1128 CB LEU A 84 0.666 -3.148 3.005 1.00 0.00 C ATOM 1129 CG LEU A 84 -0.705 -2.702 2.459 1.00 0.00 C ATOM 1130 CD1 LEU A 84 -1.844 -3.461 3.139 1.00 0.00 C ATOM 1131 CD2 LEU A 84 -0.950 -1.200 2.592 1.00 0.00 C ATOM 0 H LEU A 84 2.737 -1.632 3.808 1.00 0.00 H new ATOM 0 HA LEU A 84 0.063 -2.356 4.903 1.00 0.00 H new ATOM 0 HB2 LEU A 84 1.442 -2.823 2.311 1.00 0.00 H new ATOM 0 HB3 LEU A 84 0.696 -4.237 3.029 1.00 0.00 H new ATOM 0 HG LEU A 84 -0.685 -2.939 1.395 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -2.798 -3.125 2.733 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -1.729 -4.530 2.957 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -1.819 -3.270 4.212 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -1.932 -0.954 2.189 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -0.908 -0.916 3.644 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -0.184 -0.656 2.039 1.00 0.00 H new ATOM 1143 N SER A 85 2.686 -3.238 6.093 1.00 0.00 N ATOM 1144 CA SER A 85 3.418 -4.132 6.979 1.00 0.00 C ATOM 1145 C SER A 85 2.471 -4.914 7.900 1.00 0.00 C ATOM 1146 O SER A 85 2.589 -6.127 8.016 1.00 0.00 O ATOM 1147 CB SER A 85 4.487 -3.345 7.742 1.00 0.00 C ATOM 1148 OG SER A 85 3.944 -2.264 8.481 1.00 0.00 O ATOM 0 H SER A 85 3.011 -2.272 6.125 1.00 0.00 H new ATOM 0 HA SER A 85 3.932 -4.886 6.382 1.00 0.00 H new ATOM 0 HB2 SER A 85 5.012 -4.017 8.421 1.00 0.00 H new ATOM 0 HB3 SER A 85 5.225 -2.964 7.036 1.00 0.00 H new ATOM 0 HG SER A 85 3.684 -1.546 7.867 1.00 0.00 H new ATOM 1154 N ALA A 86 1.491 -4.238 8.509 1.00 0.00 N ATOM 1155 CA ALA A 86 0.523 -4.844 9.418 1.00 0.00 C ATOM 1156 C ALA A 86 -0.412 -5.889 8.782 1.00 0.00 C ATOM 1157 O ALA A 86 -1.113 -6.579 9.522 1.00 0.00 O ATOM 1158 CB ALA A 86 -0.306 -3.723 10.050 1.00 0.00 C ATOM 0 H ALA A 86 1.349 -3.236 8.379 1.00 0.00 H new ATOM 0 HA ALA A 86 1.099 -5.400 10.157 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -1.037 -4.153 10.734 1.00 0.00 H new ATOM 0 HB2 ALA A 86 0.352 -3.049 10.599 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -0.824 -3.168 9.268 1.00 0.00 H new ATOM 1164 N LEU A 87 -0.472 -6.016 7.452 1.00 0.00 N ATOM 1165 CA LEU A 87 -1.331 -6.966 6.761 1.00 0.00 C ATOM 1166 C LEU A 87 -0.466 -7.951 5.969 1.00 0.00 C ATOM 1167 O LEU A 87 -0.466 -7.898 4.736 1.00 0.00 O ATOM 1168 CB LEU A 87 -2.310 -6.242 5.822 1.00 0.00 C ATOM 1169 CG LEU A 87 -3.256 -5.159 6.366 1.00 0.00 C ATOM 1170 CD1 LEU A 87 -4.310 -4.882 5.291 1.00 0.00 C ATOM 1171 CD2 LEU A 87 -3.993 -5.534 7.652 1.00 0.00 C ATOM 0 H LEU A 87 0.089 -5.447 6.819 1.00 0.00 H new ATOM 0 HA LEU A 87 -1.918 -7.510 7.501 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -1.717 -5.783 5.031 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -2.931 -7.006 5.353 1.00 0.00 H new ATOM 0 HG LEU A 87 -2.634 -4.297 6.607 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -4.999 -4.116 5.646 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -3.820 -4.536 4.381 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -4.863 -5.797 5.079 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -4.635 -4.708 7.957 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -4.601 -6.421 7.477 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -3.268 -5.740 8.440 1.00 0.00 H new ATOM 1183 N GLY A 88 0.291 -8.839 6.622 1.00 0.00 N ATOM 1184 CA GLY A 88 1.114 -9.785 5.883 1.00 0.00 C ATOM 1185 C GLY A 88 2.455 -10.151 6.499 1.00 0.00 C ATOM 1186 O GLY A 88 3.477 -9.552 6.154 1.00 0.00 O ATOM 0 H GLY A 88 0.347 -8.918 7.637 1.00 0.00 H new ATOM 0 HA2 GLY A 88 0.540 -10.702 5.748 1.00 0.00 H new ATOM 0 HA3 GLY A 88 1.297 -9.374 4.890 1.00 0.00 H new ATOM 1190 N PHE A 89 2.444 -11.106 7.427 1.00 0.00 N ATOM 1191 CA PHE A 89 3.607 -11.677 8.088 1.00 0.00 C ATOM 1192 C PHE A 89 3.256 -13.127 8.447 1.00 0.00 C ATOM 1193 O PHE A 89 2.130 -13.575 8.214 1.00 0.00 O ATOM 1194 CB PHE A 89 4.134 -10.982 9.345 1.00 0.00 C ATOM 1195 CG PHE A 89 4.620 -9.548 9.266 1.00 0.00 C ATOM 1196 CD1 PHE A 89 5.830 -9.248 8.610 1.00 0.00 C ATOM 1197 CD2 PHE A 89 3.943 -8.532 9.968 1.00 0.00 C ATOM 1198 CE1 PHE A 89 6.342 -7.939 8.634 1.00 0.00 C ATOM 1199 CE2 PHE A 89 4.470 -7.229 10.012 1.00 0.00 C ATOM 1200 CZ PHE A 89 5.663 -6.928 9.335 1.00 0.00 C ATOM 0 H PHE A 89 1.572 -11.523 7.753 1.00 0.00 H new ATOM 0 HA PHE A 89 4.421 -11.560 7.373 1.00 0.00 H new ATOM 0 HB2 PHE A 89 3.341 -11.016 10.092 1.00 0.00 H new ATOM 0 HB3 PHE A 89 4.958 -11.584 9.728 1.00 0.00 H new ATOM 0 HD1 PHE A 89 6.366 -10.026 8.087 1.00 0.00 H new ATOM 0 HD2 PHE A 89 3.015 -8.754 10.475 1.00 0.00 H new ATOM 0 HE1 PHE A 89 7.259 -7.710 8.112 1.00 0.00 H new ATOM 0 HE2 PHE A 89 3.956 -6.458 10.567 1.00 0.00 H new ATOM 0 HZ PHE A 89 6.057 -5.923 9.353 1.00 0.00 H new ATOM 1210 N SER A 90 4.260 -13.811 9.011 1.00 0.00 N ATOM 1211 CA SER A 90 4.472 -15.161 9.494 1.00 0.00 C ATOM 1212 C SER A 90 5.440 -15.860 8.515 1.00 0.00 C ATOM 1213 O SER A 90 5.933 -16.952 8.802 1.00 0.00 O ATOM 1214 CB SER A 90 3.121 -15.795 9.686 1.00 0.00 C ATOM 1215 OG SER A 90 3.103 -17.053 10.325 1.00 0.00 O ATOM 0 H SER A 90 5.127 -13.295 9.164 1.00 0.00 H new ATOM 0 HA SER A 90 4.956 -15.228 10.468 1.00 0.00 H new ATOM 0 HB2 SER A 90 2.501 -15.110 10.264 1.00 0.00 H new ATOM 0 HB3 SER A 90 2.652 -15.902 8.708 1.00 0.00 H new ATOM 0 HG SER A 90 2.178 -17.369 10.398 1.00 0.00 H new ATOM 1221 N GLY A 91 5.835 -15.156 7.444 1.00 0.00 N ATOM 1222 CA GLY A 91 6.737 -15.617 6.384 1.00 0.00 C ATOM 1223 C GLY A 91 6.205 -15.195 5.014 1.00 0.00 C ATOM 1224 O GLY A 91 5.204 -14.483 4.951 1.00 0.00 O ATOM 0 H GLY A 91 5.516 -14.200 7.288 1.00 0.00 H new ATOM 0 HA2 GLY A 91 7.733 -15.202 6.539 1.00 0.00 H new ATOM 0 HA3 GLY A 91 6.834 -16.702 6.426 1.00 0.00 H new ATOM 1228 N LEU A 92 6.858 -15.585 3.915 1.00 0.00 N ATOM 1229 CA LEU A 92 6.437 -15.268 2.551 1.00 0.00 C ATOM 1230 C LEU A 92 5.826 -16.490 1.875 1.00 0.00 C ATOM 1231 O LEU A 92 6.006 -17.623 2.330 1.00 0.00 O ATOM 1232 CB LEU A 92 7.582 -14.672 1.713 1.00 0.00 C ATOM 1233 CG LEU A 92 8.947 -15.397 1.662 1.00 0.00 C ATOM 1234 CD1 LEU A 92 8.911 -16.742 0.930 1.00 0.00 C ATOM 1235 CD2 LEU A 92 9.996 -14.527 0.963 1.00 0.00 C ATOM 0 H LEU A 92 7.712 -16.142 3.952 1.00 0.00 H new ATOM 0 HA LEU A 92 5.668 -14.499 2.618 1.00 0.00 H new ATOM 0 HB2 LEU A 92 7.223 -14.580 0.688 1.00 0.00 H new ATOM 0 HB3 LEU A 92 7.763 -13.661 2.079 1.00 0.00 H new ATOM 0 HG LEU A 92 9.203 -15.581 2.705 1.00 0.00 H new ATOM 0 HD11 LEU A 92 9.906 -17.187 0.938 1.00 0.00 H new ATOM 0 HD12 LEU A 92 8.211 -17.410 1.431 1.00 0.00 H new ATOM 0 HD13 LEU A 92 8.591 -16.587 -0.100 1.00 0.00 H new ATOM 0 HD21 LEU A 92 10.949 -15.056 0.938 1.00 0.00 H new ATOM 0 HD22 LEU A 92 9.672 -14.314 -0.056 1.00 0.00 H new ATOM 0 HD23 LEU A 92 10.115 -13.591 1.509 1.00 0.00 H new ATOM 1247 N GLY A 93 5.101 -16.239 0.782 1.00 0.00 N ATOM 1248 CA GLY A 93 4.441 -17.274 -0.016 1.00 0.00 C ATOM 1249 C GLY A 93 3.753 -16.631 -1.213 1.00 0.00 C ATOM 1250 O GLY A 93 4.245 -16.758 -2.334 1.00 0.00 O ATOM 0 H GLY A 93 4.954 -15.296 0.421 1.00 0.00 H new ATOM 0 HA2 GLY A 93 5.172 -18.008 -0.354 1.00 0.00 H new ATOM 0 HA3 GLY A 93 3.711 -17.808 0.593 1.00 0.00 H new ATOM 1254 N ASP A 94 2.691 -15.864 -0.940 1.00 0.00 N ATOM 1255 CA ASP A 94 1.819 -15.093 -1.829 1.00 0.00 C ATOM 1256 C ASP A 94 0.403 -15.042 -1.282 1.00 0.00 C ATOM 1257 O ASP A 94 -0.498 -15.720 -1.779 1.00 0.00 O ATOM 1258 CB ASP A 94 1.841 -15.492 -3.311 1.00 0.00 C ATOM 1259 CG ASP A 94 0.851 -14.704 -4.189 1.00 0.00 C ATOM 1260 OD1 ASP A 94 0.511 -13.549 -3.874 1.00 0.00 O ATOM 1261 OD2 ASP A 94 0.453 -15.235 -5.253 1.00 0.00 O ATOM 0 H ASP A 94 2.388 -15.758 0.028 1.00 0.00 H new ATOM 0 HA ASP A 94 2.248 -14.091 -1.831 1.00 0.00 H new ATOM 0 HB2 ASP A 94 2.849 -15.348 -3.700 1.00 0.00 H new ATOM 0 HB3 ASP A 94 1.616 -16.555 -3.393 1.00 0.00 H new ATOM 1266 N GLY A 95 0.231 -14.287 -0.198 1.00 0.00 N ATOM 1267 CA GLY A 95 -1.084 -14.090 0.388 1.00 0.00 C ATOM 1268 C GLY A 95 -1.823 -15.331 0.849 1.00 0.00 C ATOM 1269 O GLY A 95 -3.023 -15.441 0.607 1.00 0.00 O ATOM 0 H GLY A 95 0.987 -13.805 0.288 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -0.978 -13.422 1.242 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -1.708 -13.576 -0.343 1.00 0.00 H new ATOM 1273 N TYR A 96 -1.130 -16.254 1.499 1.00 0.00 N ATOM 1274 CA TYR A 96 -1.677 -17.495 2.026 1.00 0.00 C ATOM 1275 C TYR A 96 -1.558 -17.472 3.545 1.00 0.00 C ATOM 1276 O TYR A 96 -1.467 -16.394 4.125 1.00 0.00 O ATOM 1277 CB TYR A 96 -0.992 -18.700 1.365 1.00 0.00 C ATOM 1278 CG TYR A 96 -1.854 -19.944 1.282 1.00 0.00 C ATOM 1279 CD1 TYR A 96 -3.102 -19.872 0.633 1.00 0.00 C ATOM 1280 CD2 TYR A 96 -1.394 -21.176 1.783 1.00 0.00 C ATOM 1281 CE1 TYR A 96 -3.889 -21.022 0.472 1.00 0.00 C ATOM 1282 CE2 TYR A 96 -2.179 -22.332 1.627 1.00 0.00 C ATOM 1283 CZ TYR A 96 -3.423 -22.261 0.962 1.00 0.00 C ATOM 1284 OH TYR A 96 -4.180 -23.379 0.818 1.00 0.00 O ATOM 0 H TYR A 96 -0.131 -16.155 1.681 1.00 0.00 H new ATOM 0 HA TYR A 96 -2.736 -17.593 1.786 1.00 0.00 H new ATOM 0 HB2 TYR A 96 -0.683 -18.419 0.358 1.00 0.00 H new ATOM 0 HB3 TYR A 96 -0.086 -18.938 1.922 1.00 0.00 H new ATOM 0 HD1 TYR A 96 -3.456 -18.924 0.256 1.00 0.00 H new ATOM 0 HD2 TYR A 96 -0.440 -21.233 2.286 1.00 0.00 H new ATOM 0 HE1 TYR A 96 -4.846 -20.960 -0.024 1.00 0.00 H new ATOM 0 HE2 TYR A 96 -1.830 -23.277 2.017 1.00 0.00 H new ATOM 0 HH TYR A 96 -3.710 -24.145 1.210 1.00 0.00 H new ATOM 1294 N GLY A 97 -1.628 -18.644 4.175 1.00 0.00 N ATOM 1295 CA GLY A 97 -1.560 -18.951 5.598 1.00 0.00 C ATOM 1296 C GLY A 97 -0.300 -18.404 6.245 1.00 0.00 C ATOM 1297 O GLY A 97 0.625 -19.131 6.604 1.00 0.00 O ATOM 0 H GLY A 97 -1.748 -19.500 3.633 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -2.434 -18.535 6.100 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -1.598 -20.031 5.737 1.00 0.00 H new ATOM 1301 N GLY A 98 -0.343 -17.097 6.422 1.00 0.00 N ATOM 1302 CA GLY A 98 0.679 -16.267 7.009 1.00 0.00 C ATOM 1303 C GLY A 98 1.641 -15.705 5.965 1.00 0.00 C ATOM 1304 O GLY A 98 2.834 -15.632 6.246 1.00 0.00 O ATOM 0 H GLY A 98 -1.156 -16.552 6.136 1.00 0.00 H new ATOM 0 HA2 GLY A 98 0.210 -15.444 7.548 1.00 0.00 H new ATOM 0 HA3 GLY A 98 1.240 -16.848 7.741 1.00 0.00 H new ATOM 1308 N THR A 99 1.171 -15.365 4.756 1.00 0.00 N ATOM 1309 CA THR A 99 2.031 -14.824 3.707 1.00 0.00 C ATOM 1310 C THR A 99 1.398 -13.618 3.000 1.00 0.00 C ATOM 1311 O THR A 99 0.203 -13.368 3.177 1.00 0.00 O ATOM 1312 CB THR A 99 2.569 -15.947 2.808 1.00 0.00 C ATOM 1313 OG1 THR A 99 1.664 -16.404 1.834 1.00 0.00 O ATOM 1314 CG2 THR A 99 3.069 -17.202 3.544 1.00 0.00 C ATOM 0 H THR A 99 0.192 -15.458 4.485 1.00 0.00 H new ATOM 0 HA THR A 99 2.924 -14.391 4.157 1.00 0.00 H new ATOM 0 HB THR A 99 3.409 -15.432 2.342 1.00 0.00 H new ATOM 0 HG1 THR A 99 1.295 -17.269 2.110 1.00 0.00 H new ATOM 0 HG21 THR A 99 3.427 -17.932 2.817 1.00 0.00 H new ATOM 0 HG22 THR A 99 3.883 -16.930 4.216 1.00 0.00 H new ATOM 0 HG23 THR A 99 2.252 -17.635 4.121 1.00 0.00 H new ATOM 1322 N LEU A 100 2.166 -12.894 2.164 1.00 0.00 N ATOM 1323 CA LEU A 100 1.726 -11.695 1.442 1.00 0.00 C ATOM 1324 C LEU A 100 2.662 -11.356 0.292 1.00 0.00 C ATOM 1325 O LEU A 100 3.881 -11.322 0.489 1.00 0.00 O ATOM 1326 CB LEU A 100 1.738 -10.531 2.450 1.00 0.00 C ATOM 1327 CG LEU A 100 1.589 -9.055 1.989 1.00 0.00 C ATOM 1328 CD1 LEU A 100 2.931 -8.380 1.702 1.00 0.00 C ATOM 1329 CD2 LEU A 100 0.656 -8.776 0.812 1.00 0.00 C ATOM 0 H LEU A 100 3.137 -13.138 1.970 1.00 0.00 H new ATOM 0 HA LEU A 100 0.735 -11.868 1.023 1.00 0.00 H new ATOM 0 HB2 LEU A 100 0.937 -10.722 3.164 1.00 0.00 H new ATOM 0 HB3 LEU A 100 2.677 -10.598 2.999 1.00 0.00 H new ATOM 0 HG LEU A 100 1.108 -8.622 2.866 1.00 0.00 H new ATOM 0 HD11 LEU A 100 2.760 -7.351 1.384 1.00 0.00 H new ATOM 0 HD12 LEU A 100 3.541 -8.384 2.605 1.00 0.00 H new ATOM 0 HD13 LEU A 100 3.449 -8.923 0.911 1.00 0.00 H new ATOM 0 HD21 LEU A 100 0.648 -7.707 0.599 1.00 0.00 H new ATOM 0 HD22 LEU A 100 1.006 -9.318 -0.066 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -0.353 -9.103 1.062 1.00 0.00 H new ATOM 1341 N LEU A 101 2.124 -11.189 -0.920 1.00 0.00 N ATOM 1342 CA LEU A 101 2.903 -10.800 -2.092 1.00 0.00 C ATOM 1343 C LEU A 101 2.069 -9.914 -3.035 1.00 0.00 C ATOM 1344 O LEU A 101 0.843 -9.903 -2.973 1.00 0.00 O ATOM 1345 CB LEU A 101 3.462 -12.046 -2.771 1.00 0.00 C ATOM 1346 CG LEU A 101 4.610 -11.801 -3.762 1.00 0.00 C ATOM 1347 CD1 LEU A 101 5.838 -11.158 -3.107 1.00 0.00 C ATOM 1348 CD2 LEU A 101 5.008 -13.135 -4.405 1.00 0.00 C ATOM 0 H LEU A 101 1.131 -11.321 -1.113 1.00 0.00 H new ATOM 0 HA LEU A 101 3.753 -10.191 -1.786 1.00 0.00 H new ATOM 0 HB2 LEU A 101 3.811 -12.733 -2.000 1.00 0.00 H new ATOM 0 HB3 LEU A 101 2.650 -12.546 -3.299 1.00 0.00 H new ATOM 0 HG LEU A 101 4.249 -11.099 -4.514 1.00 0.00 H new ATOM 0 HD11 LEU A 101 6.615 -11.010 -3.857 1.00 0.00 H new ATOM 0 HD12 LEU A 101 5.559 -10.195 -2.678 1.00 0.00 H new ATOM 0 HD13 LEU A 101 6.214 -11.811 -2.319 1.00 0.00 H new ATOM 0 HD21 LEU A 101 5.823 -12.970 -5.110 1.00 0.00 H new ATOM 0 HD22 LEU A 101 5.333 -13.829 -3.630 1.00 0.00 H new ATOM 0 HD23 LEU A 101 4.151 -13.555 -4.932 1.00 0.00 H new ATOM 1360 N LEU A 102 2.723 -9.080 -3.846 1.00 0.00 N ATOM 1361 CA LEU A 102 2.104 -8.190 -4.827 1.00 0.00 C ATOM 1362 C LEU A 102 2.011 -8.990 -6.136 1.00 0.00 C ATOM 1363 O LEU A 102 2.797 -9.930 -6.324 1.00 0.00 O ATOM 1364 CB LEU A 102 2.911 -6.889 -4.992 1.00 0.00 C ATOM 1365 CG LEU A 102 3.480 -6.245 -3.714 1.00 0.00 C ATOM 1366 CD1 LEU A 102 4.175 -4.929 -4.074 1.00 0.00 C ATOM 1367 CD2 LEU A 102 2.404 -5.961 -2.660 1.00 0.00 C ATOM 0 H LEU A 102 3.740 -9.004 -3.836 1.00 0.00 H new ATOM 0 HA LEU A 102 1.112 -7.872 -4.505 1.00 0.00 H new ATOM 0 HB2 LEU A 102 3.743 -7.091 -5.667 1.00 0.00 H new ATOM 0 HB3 LEU A 102 2.272 -6.156 -5.484 1.00 0.00 H new ATOM 0 HG LEU A 102 4.183 -6.958 -3.284 1.00 0.00 H new ATOM 0 HD11 LEU A 102 4.578 -4.472 -3.171 1.00 0.00 H new ATOM 0 HD12 LEU A 102 4.987 -5.126 -4.775 1.00 0.00 H new ATOM 0 HD13 LEU A 102 3.455 -4.251 -4.534 1.00 0.00 H new ATOM 0 HD21 LEU A 102 2.865 -5.508 -1.782 1.00 0.00 H new ATOM 0 HD22 LEU A 102 1.661 -5.279 -3.073 1.00 0.00 H new ATOM 0 HD23 LEU A 102 1.920 -6.895 -2.374 1.00 0.00 H new ATOM 1379 N LYS A 103 1.081 -8.673 -7.044 1.00 0.00 N ATOM 1380 CA LYS A 103 0.926 -9.413 -8.303 1.00 0.00 C ATOM 1381 C LYS A 103 0.334 -8.543 -9.411 1.00 0.00 C ATOM 1382 O LYS A 103 -0.182 -7.456 -9.153 1.00 0.00 O ATOM 1383 CB LYS A 103 0.029 -10.645 -8.049 1.00 0.00 C ATOM 1384 CG LYS A 103 0.509 -11.956 -8.634 1.00 0.00 C ATOM 1385 CD LYS A 103 1.686 -12.460 -7.830 1.00 0.00 C ATOM 1386 CE LYS A 103 2.036 -13.852 -8.299 1.00 0.00 C ATOM 1387 NZ LYS A 103 1.080 -14.889 -7.863 1.00 0.00 N ATOM 0 H LYS A 103 0.420 -7.904 -6.930 1.00 0.00 H new ATOM 0 HA LYS A 103 1.913 -9.729 -8.642 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -0.082 -10.771 -6.972 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -0.963 -10.434 -8.449 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -0.297 -12.690 -8.621 1.00 0.00 H new ATOM 0 HG3 LYS A 103 0.798 -11.819 -9.676 1.00 0.00 H new ATOM 0 HD2 LYS A 103 2.540 -11.794 -7.954 1.00 0.00 H new ATOM 0 HD3 LYS A 103 1.441 -12.470 -6.768 1.00 0.00 H new ATOM 0 HE2 LYS A 103 2.089 -13.855 -9.388 1.00 0.00 H new ATOM 0 HE3 LYS A 103 3.029 -14.110 -7.931 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 1.544 -15.820 -7.883 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 0.761 -14.682 -6.895 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 0.261 -14.897 -8.503 1.00 0.00 H new ATOM 1401 N THR A 104 0.315 -9.047 -10.645 1.00 0.00 N ATOM 1402 CA THR A 104 -0.205 -8.313 -11.792 1.00 0.00 C ATOM 1403 C THR A 104 -1.303 -9.083 -12.533 1.00 0.00 C ATOM 1404 O THR A 104 -1.533 -10.277 -12.298 1.00 0.00 O ATOM 1405 CB THR A 104 0.974 -7.948 -12.717 1.00 0.00 C ATOM 1406 OG1 THR A 104 1.597 -9.117 -13.200 1.00 0.00 O ATOM 1407 CG2 THR A 104 2.043 -7.116 -12.008 1.00 0.00 C ATOM 0 H THR A 104 0.661 -9.978 -10.875 1.00 0.00 H new ATOM 0 HA THR A 104 -0.685 -7.400 -11.440 1.00 0.00 H new ATOM 0 HB THR A 104 0.549 -7.360 -13.530 1.00 0.00 H new ATOM 0 HG1 THR A 104 2.342 -8.872 -13.787 1.00 0.00 H new ATOM 0 HG21 THR A 104 2.849 -6.888 -12.706 1.00 0.00 H new ATOM 0 HG22 THR A 104 1.601 -6.187 -11.648 1.00 0.00 H new ATOM 0 HG23 THR A 104 2.442 -7.679 -11.164 1.00 0.00 H new ATOM 1415 N ASN A 105 -2.023 -8.362 -13.396 1.00 0.00 N ATOM 1416 CA ASN A 105 -3.096 -8.874 -14.259 1.00 0.00 C ATOM 1417 C ASN A 105 -2.468 -9.725 -15.374 1.00 0.00 C ATOM 1418 O ASN A 105 -1.245 -9.711 -15.516 1.00 0.00 O ATOM 1419 CB ASN A 105 -3.887 -7.725 -14.868 1.00 0.00 C ATOM 1420 CG ASN A 105 -5.328 -7.587 -14.402 1.00 0.00 C ATOM 1421 OD1 ASN A 105 -5.699 -8.006 -13.313 1.00 0.00 O ATOM 1422 ND2 ASN A 105 -6.146 -6.926 -15.196 1.00 0.00 N ATOM 0 H ASN A 105 -1.869 -7.361 -13.519 1.00 0.00 H new ATOM 0 HA ASN A 105 -3.780 -9.481 -13.665 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -3.364 -6.794 -14.649 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -3.886 -7.844 -15.952 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -7.109 -6.755 -14.907 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -5.816 -6.586 -16.099 1.00 0.00 H new ATOM 1429 N ALA A 106 -3.257 -10.396 -16.226 1.00 0.00 N ATOM 1430 CA ALA A 106 -2.706 -11.206 -17.325 1.00 0.00 C ATOM 1431 C ALA A 106 -1.844 -10.321 -18.245 1.00 0.00 C ATOM 1432 O ALA A 106 -0.687 -10.627 -18.535 1.00 0.00 O ATOM 1433 CB ALA A 106 -3.835 -11.890 -18.102 1.00 0.00 C ATOM 0 H ALA A 106 -4.276 -10.395 -16.176 1.00 0.00 H new ATOM 0 HA ALA A 106 -2.069 -11.988 -16.912 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -3.411 -12.485 -18.911 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -4.398 -12.539 -17.431 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -4.501 -11.134 -18.518 1.00 0.00 H new ATOM 1439 N GLU A 107 -2.385 -9.173 -18.658 1.00 0.00 N ATOM 1440 CA GLU A 107 -1.675 -8.213 -19.505 1.00 0.00 C ATOM 1441 C GLU A 107 -0.720 -7.366 -18.656 1.00 0.00 C ATOM 1442 O GLU A 107 0.215 -6.755 -19.175 1.00 0.00 O ATOM 1443 CB GLU A 107 -2.673 -7.241 -20.139 1.00 0.00 C ATOM 1444 CG GLU A 107 -3.626 -7.896 -21.135 1.00 0.00 C ATOM 1445 CD GLU A 107 -4.934 -7.121 -21.182 1.00 0.00 C ATOM 1446 OE1 GLU A 107 -5.792 -7.336 -20.298 1.00 0.00 O ATOM 1447 OE2 GLU A 107 -5.128 -6.262 -22.072 1.00 0.00 O ATOM 0 H GLU A 107 -3.332 -8.882 -18.413 1.00 0.00 H new ATOM 0 HA GLU A 107 -1.131 -8.775 -20.264 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -3.257 -6.768 -19.349 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -2.122 -6.449 -20.645 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -3.171 -7.920 -22.125 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -3.815 -8.930 -20.846 1.00 0.00 H new ATOM 1454 N GLY A 108 -0.960 -7.303 -17.345 1.00 0.00 N ATOM 1455 CA GLY A 108 -0.165 -6.523 -16.418 1.00 0.00 C ATOM 1456 C GLY A 108 -0.538 -5.042 -16.475 1.00 0.00 C ATOM 1457 O GLY A 108 0.193 -4.224 -15.913 1.00 0.00 O ATOM 0 H GLY A 108 -1.728 -7.804 -16.898 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -0.311 -6.898 -15.405 1.00 0.00 H new ATOM 0 HA3 GLY A 108 0.893 -6.643 -16.653 1.00 0.00 H new ATOM 1461 N THR A 109 -1.650 -4.673 -17.125 1.00 0.00 N ATOM 1462 CA THR A 109 -2.080 -3.279 -17.216 1.00 0.00 C ATOM 1463 C THR A 109 -2.532 -2.804 -15.829 1.00 0.00 C ATOM 1464 O THR A 109 -2.466 -1.612 -15.517 1.00 0.00 O ATOM 1465 CB THR A 109 -3.209 -3.156 -18.249 1.00 0.00 C ATOM 1466 OG1 THR A 109 -2.943 -4.009 -19.350 1.00 0.00 O ATOM 1467 CG2 THR A 109 -3.362 -1.724 -18.746 1.00 0.00 C ATOM 0 H THR A 109 -2.270 -5.330 -17.598 1.00 0.00 H new ATOM 0 HA THR A 109 -1.255 -2.647 -17.545 1.00 0.00 H new ATOM 0 HB THR A 109 -4.140 -3.448 -17.763 1.00 0.00 H new ATOM 0 HG1 THR A 109 -3.666 -3.930 -20.007 1.00 0.00 H new ATOM 0 HG21 THR A 109 -4.170 -1.676 -19.476 1.00 0.00 H new ATOM 0 HG22 THR A 109 -3.593 -1.070 -17.905 1.00 0.00 H new ATOM 0 HG23 THR A 109 -2.432 -1.400 -19.213 1.00 0.00 H new ATOM 1475 N ARG A 110 -2.996 -3.756 -15.013 1.00 0.00 N ATOM 1476 CA ARG A 110 -3.452 -3.578 -13.653 1.00 0.00 C ATOM 1477 C ARG A 110 -2.573 -4.429 -12.742 1.00 0.00 C ATOM 1478 O ARG A 110 -2.026 -5.460 -13.147 1.00 0.00 O ATOM 1479 CB ARG A 110 -4.942 -3.938 -13.497 1.00 0.00 C ATOM 1480 CG ARG A 110 -5.855 -2.703 -13.523 1.00 0.00 C ATOM 1481 CD ARG A 110 -7.267 -3.082 -13.062 1.00 0.00 C ATOM 1482 NE ARG A 110 -8.147 -1.909 -12.955 1.00 0.00 N ATOM 1483 CZ ARG A 110 -9.178 -1.768 -12.112 1.00 0.00 C ATOM 1484 NH1 ARG A 110 -9.499 -2.730 -11.253 1.00 0.00 N ATOM 1485 NH2 ARG A 110 -9.893 -0.649 -12.150 1.00 0.00 N ATOM 0 H ARG A 110 -3.063 -4.728 -15.315 1.00 0.00 H new ATOM 0 HA ARG A 110 -3.366 -2.528 -13.375 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -5.233 -4.617 -14.298 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -5.086 -4.472 -12.558 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -5.448 -1.927 -12.875 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -5.892 -2.289 -14.531 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -7.698 -3.795 -13.765 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -7.210 -3.582 -12.095 1.00 0.00 H new ATOM 0 HE ARG A 110 -7.954 -1.128 -13.583 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -8.957 -3.594 -11.228 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -10.288 -2.605 -10.618 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -9.654 0.087 -12.814 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -10.681 -0.526 -11.515 1.00 0.00 H new ATOM 1499 N THR A 111 -2.581 -4.084 -11.468 1.00 0.00 N ATOM 1500 CA THR A 111 -1.836 -4.708 -10.398 1.00 0.00 C ATOM 1501 C THR A 111 -2.821 -5.071 -9.275 1.00 0.00 C ATOM 1502 O THR A 111 -3.649 -4.237 -8.886 1.00 0.00 O ATOM 1503 CB THR A 111 -0.762 -3.687 -9.993 1.00 0.00 C ATOM 1504 OG1 THR A 111 0.155 -3.370 -11.032 1.00 0.00 O ATOM 1505 CG2 THR A 111 0.066 -4.145 -8.816 1.00 0.00 C ATOM 0 H THR A 111 -3.149 -3.306 -11.134 1.00 0.00 H new ATOM 0 HA THR A 111 -1.341 -5.639 -10.673 1.00 0.00 H new ATOM 0 HB THR A 111 -1.348 -2.804 -9.738 1.00 0.00 H new ATOM 0 HG1 THR A 111 0.807 -2.715 -10.705 1.00 0.00 H new ATOM 0 HG21 THR A 111 0.808 -3.384 -8.575 1.00 0.00 H new ATOM 0 HG22 THR A 111 -0.583 -4.305 -7.955 1.00 0.00 H new ATOM 0 HG23 THR A 111 0.571 -5.077 -9.067 1.00 0.00 H new ATOM 1513 N TYR A 112 -2.765 -6.306 -8.771 1.00 0.00 N ATOM 1514 CA TYR A 112 -3.614 -6.836 -7.703 1.00 0.00 C ATOM 1515 C TYR A 112 -2.705 -7.594 -6.723 1.00 0.00 C ATOM 1516 O TYR A 112 -2.119 -8.609 -7.092 1.00 0.00 O ATOM 1517 CB TYR A 112 -4.669 -7.783 -8.308 1.00 0.00 C ATOM 1518 CG TYR A 112 -5.967 -7.159 -8.808 1.00 0.00 C ATOM 1519 CD1 TYR A 112 -6.076 -6.643 -10.115 1.00 0.00 C ATOM 1520 CD2 TYR A 112 -7.108 -7.180 -7.985 1.00 0.00 C ATOM 1521 CE1 TYR A 112 -7.308 -6.141 -10.580 1.00 0.00 C ATOM 1522 CE2 TYR A 112 -8.335 -6.666 -8.431 1.00 0.00 C ATOM 1523 CZ TYR A 112 -8.442 -6.140 -9.734 1.00 0.00 C ATOM 1524 OH TYR A 112 -9.643 -5.654 -10.163 1.00 0.00 O ATOM 0 H TYR A 112 -2.095 -6.995 -9.113 1.00 0.00 H new ATOM 0 HA TYR A 112 -4.138 -6.034 -7.182 1.00 0.00 H new ATOM 0 HB2 TYR A 112 -4.207 -8.313 -9.141 1.00 0.00 H new ATOM 0 HB3 TYR A 112 -4.922 -8.530 -7.556 1.00 0.00 H new ATOM 0 HD1 TYR A 112 -5.212 -6.632 -10.763 1.00 0.00 H new ATOM 0 HD2 TYR A 112 -7.038 -7.599 -6.992 1.00 0.00 H new ATOM 0 HE1 TYR A 112 -7.387 -5.756 -11.586 1.00 0.00 H new ATOM 0 HE2 TYR A 112 -9.195 -6.673 -7.778 1.00 0.00 H new ATOM 0 HH TYR A 112 -10.305 -5.737 -9.445 1.00 0.00 H new ATOM 1534 N LEU A 113 -2.617 -7.166 -5.462 1.00 0.00 N ATOM 1535 CA LEU A 113 -1.789 -7.812 -4.430 1.00 0.00 C ATOM 1536 C LEU A 113 -2.631 -8.838 -3.684 1.00 0.00 C ATOM 1537 O LEU A 113 -3.860 -8.831 -3.790 1.00 0.00 O ATOM 1538 CB LEU A 113 -1.146 -6.820 -3.446 1.00 0.00 C ATOM 1539 CG LEU A 113 -2.050 -6.000 -2.512 1.00 0.00 C ATOM 1540 CD1 LEU A 113 -1.142 -5.459 -1.402 1.00 0.00 C ATOM 1541 CD2 LEU A 113 -2.725 -4.809 -3.196 1.00 0.00 C ATOM 0 H LEU A 113 -3.124 -6.350 -5.120 1.00 0.00 H new ATOM 0 HA LEU A 113 -0.959 -8.300 -4.941 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -0.451 -7.381 -2.821 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -0.553 -6.116 -4.030 1.00 0.00 H new ATOM 0 HG LEU A 113 -2.851 -6.647 -2.154 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -1.734 -4.865 -0.705 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -0.682 -6.292 -0.870 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -0.364 -4.835 -1.841 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -3.346 -4.279 -2.474 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -1.963 -4.133 -3.585 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -3.347 -5.166 -4.017 1.00 0.00 H new ATOM 1553 N LYS A 114 -1.987 -9.730 -2.938 1.00 0.00 N ATOM 1554 CA LYS A 114 -2.649 -10.777 -2.185 1.00 0.00 C ATOM 1555 C LYS A 114 -2.010 -10.947 -0.815 1.00 0.00 C ATOM 1556 O LYS A 114 -0.813 -11.210 -0.716 1.00 0.00 O ATOM 1557 CB LYS A 114 -2.532 -12.090 -2.987 1.00 0.00 C ATOM 1558 CG LYS A 114 -3.765 -12.369 -3.863 1.00 0.00 C ATOM 1559 CD LYS A 114 -3.782 -13.828 -4.345 1.00 0.00 C ATOM 1560 CE LYS A 114 -2.659 -14.146 -5.343 1.00 0.00 C ATOM 1561 NZ LYS A 114 -3.012 -13.751 -6.724 1.00 0.00 N ATOM 0 H LYS A 114 -0.972 -9.741 -2.841 1.00 0.00 H new ATOM 0 HA LYS A 114 -3.695 -10.513 -2.033 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -1.646 -12.045 -3.620 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -2.388 -12.920 -2.296 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -4.672 -12.159 -3.297 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -3.764 -11.699 -4.723 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -3.693 -14.490 -3.484 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -4.745 -14.039 -4.811 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -1.749 -13.629 -5.040 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -2.443 -15.214 -5.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -2.226 -13.984 -7.363 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -3.866 -14.263 -7.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -3.193 -12.727 -6.757 1.00 0.00 H new ATOM 1575 N SER A 115 -2.810 -10.809 0.240 1.00 0.00 N ATOM 1576 CA SER A 115 -2.441 -10.985 1.638 1.00 0.00 C ATOM 1577 C SER A 115 -3.436 -12.024 2.136 1.00 0.00 C ATOM 1578 O SER A 115 -4.588 -12.039 1.697 1.00 0.00 O ATOM 1579 CB SER A 115 -2.485 -9.708 2.486 1.00 0.00 C ATOM 1580 OG SER A 115 -1.880 -9.969 3.735 1.00 0.00 O ATOM 0 H SER A 115 -3.792 -10.556 0.132 1.00 0.00 H new ATOM 0 HA SER A 115 -1.398 -11.287 1.727 1.00 0.00 H new ATOM 0 HB2 SER A 115 -1.963 -8.898 1.976 1.00 0.00 H new ATOM 0 HB3 SER A 115 -3.516 -9.384 2.627 1.00 0.00 H new ATOM 0 HG SER A 115 -1.386 -9.176 4.031 1.00 0.00 H new ATOM 1586 N PHE A 116 -2.957 -12.933 2.977 1.00 0.00 N ATOM 1587 CA PHE A 116 -3.645 -14.045 3.613 1.00 0.00 C ATOM 1588 C PHE A 116 -5.122 -14.261 3.207 1.00 0.00 C ATOM 1589 O PHE A 116 -6.024 -13.786 3.904 1.00 0.00 O ATOM 1590 CB PHE A 116 -3.462 -13.870 5.135 1.00 0.00 C ATOM 1591 CG PHE A 116 -4.220 -14.841 6.029 1.00 0.00 C ATOM 1592 CD1 PHE A 116 -4.237 -16.224 5.767 1.00 0.00 C ATOM 1593 CD2 PHE A 116 -4.902 -14.352 7.158 1.00 0.00 C ATOM 1594 CE1 PHE A 116 -4.868 -17.108 6.656 1.00 0.00 C ATOM 1595 CE2 PHE A 116 -5.541 -15.233 8.046 1.00 0.00 C ATOM 1596 CZ PHE A 116 -5.511 -16.615 7.802 1.00 0.00 C ATOM 0 H PHE A 116 -1.977 -12.904 3.257 1.00 0.00 H new ATOM 0 HA PHE A 116 -3.191 -14.969 3.255 1.00 0.00 H new ATOM 0 HB2 PHE A 116 -2.399 -13.956 5.362 1.00 0.00 H new ATOM 0 HB3 PHE A 116 -3.764 -12.857 5.400 1.00 0.00 H new ATOM 0 HD1 PHE A 116 -3.761 -16.607 4.876 1.00 0.00 H new ATOM 0 HD2 PHE A 116 -4.935 -13.289 7.344 1.00 0.00 H new ATOM 0 HE1 PHE A 116 -4.859 -18.170 6.458 1.00 0.00 H new ATOM 0 HE2 PHE A 116 -6.054 -14.848 8.915 1.00 0.00 H new ATOM 0 HZ PHE A 116 -5.982 -17.297 8.494 1.00 0.00 H new ATOM 1606 N GLU A 117 -5.387 -14.948 2.084 1.00 0.00 N ATOM 1607 CA GLU A 117 -6.751 -15.232 1.619 1.00 0.00 C ATOM 1608 C GLU A 117 -7.232 -16.579 2.174 1.00 0.00 C ATOM 1609 O GLU A 117 -6.451 -17.342 2.757 1.00 0.00 O ATOM 1610 CB GLU A 117 -6.916 -15.189 0.080 1.00 0.00 C ATOM 1611 CG GLU A 117 -6.224 -16.319 -0.718 1.00 0.00 C ATOM 1612 CD GLU A 117 -6.606 -16.382 -2.212 1.00 0.00 C ATOM 1613 OE1 GLU A 117 -7.321 -15.492 -2.727 1.00 0.00 O ATOM 1614 OE2 GLU A 117 -6.156 -17.335 -2.905 1.00 0.00 O ATOM 0 H GLU A 117 -4.660 -15.322 1.474 1.00 0.00 H new ATOM 0 HA GLU A 117 -7.375 -14.426 2.006 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -7.981 -15.211 -0.150 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -6.532 -14.234 -0.278 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -5.144 -16.193 -0.638 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -6.468 -17.275 -0.254 1.00 0.00 H new ATOM 1621 N ALA A 118 -8.518 -16.878 1.978 1.00 0.00 N ATOM 1622 CA ALA A 118 -9.183 -18.100 2.396 1.00 0.00 C ATOM 1623 C ALA A 118 -10.175 -18.506 1.300 1.00 0.00 C ATOM 1624 O ALA A 118 -9.875 -18.380 0.111 1.00 0.00 O ATOM 1625 CB ALA A 118 -9.817 -17.916 3.785 1.00 0.00 C ATOM 0 H ALA A 118 -9.150 -16.237 1.498 1.00 0.00 H new ATOM 0 HA ALA A 118 -8.474 -18.920 2.513 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -10.312 -18.840 4.085 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -9.041 -17.668 4.509 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -10.549 -17.109 3.747 1.00 0.00 H new ATOM 1631 N ASP A 119 -11.299 -19.093 1.691 1.00 0.00 N ATOM 1632 CA ASP A 119 -12.381 -19.549 0.837 1.00 0.00 C ATOM 1633 C ASP A 119 -13.332 -18.377 0.599 1.00 0.00 C ATOM 1634 O ASP A 119 -13.516 -17.527 1.471 1.00 0.00 O ATOM 1635 CB ASP A 119 -13.099 -20.723 1.513 1.00 0.00 C ATOM 1636 CG ASP A 119 -13.734 -20.331 2.848 1.00 0.00 C ATOM 1637 OD1 ASP A 119 -12.967 -20.032 3.796 1.00 0.00 O ATOM 1638 OD2 ASP A 119 -14.975 -20.349 2.933 1.00 0.00 O ATOM 0 H ASP A 119 -11.488 -19.273 2.677 1.00 0.00 H new ATOM 0 HA ASP A 119 -12.001 -19.896 -0.124 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -13.871 -21.105 0.845 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -12.389 -21.534 1.676 1.00 0.00 H new ATOM 1643 N ALA A 120 -13.963 -18.333 -0.577 1.00 0.00 N ATOM 1644 CA ALA A 120 -14.879 -17.261 -0.959 1.00 0.00 C ATOM 1645 C ALA A 120 -16.160 -17.184 -0.120 1.00 0.00 C ATOM 1646 O ALA A 120 -16.925 -16.231 -0.288 1.00 0.00 O ATOM 1647 CB ALA A 120 -15.221 -17.393 -2.445 1.00 0.00 C ATOM 0 H ALA A 120 -13.850 -19.048 -1.296 1.00 0.00 H new ATOM 0 HA ALA A 120 -14.354 -16.326 -0.762 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -15.905 -16.594 -2.733 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -14.308 -17.321 -3.036 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -15.694 -18.358 -2.625 1.00 0.00 H new ATOM 1653 N GLU A 121 -16.438 -18.175 0.724 1.00 0.00 N ATOM 1654 CA GLU A 121 -17.607 -18.229 1.586 1.00 0.00 C ATOM 1655 C GLU A 121 -17.262 -17.596 2.934 1.00 0.00 C ATOM 1656 O GLU A 121 -18.077 -16.862 3.502 1.00 0.00 O ATOM 1657 CB GLU A 121 -17.998 -19.698 1.711 1.00 0.00 C ATOM 1658 CG GLU A 121 -19.068 -19.966 2.764 1.00 0.00 C ATOM 1659 CD GLU A 121 -19.342 -21.457 2.813 1.00 0.00 C ATOM 1660 OE1 GLU A 121 -19.948 -21.966 1.838 1.00 0.00 O ATOM 1661 OE2 GLU A 121 -18.926 -22.094 3.805 1.00 0.00 O ATOM 0 H GLU A 121 -15.832 -18.989 0.827 1.00 0.00 H new ATOM 0 HA GLU A 121 -18.451 -17.670 1.182 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -18.357 -20.052 0.744 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -17.109 -20.281 1.954 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -18.735 -19.611 3.739 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -19.981 -19.422 2.521 1.00 0.00 H new ATOM 1668 N GLY A 122 -16.041 -17.838 3.406 1.00 0.00 N ATOM 1669 CA GLY A 122 -15.478 -17.342 4.635 1.00 0.00 C ATOM 1670 C GLY A 122 -15.089 -15.895 4.402 1.00 0.00 C ATOM 1671 O GLY A 122 -15.762 -15.005 4.931 1.00 0.00 O ATOM 0 H GLY A 122 -15.383 -18.428 2.896 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -16.201 -17.419 5.447 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -14.608 -17.932 4.925 1.00 0.00 H new ATOM 1675 N ARG A 123 -14.016 -15.652 3.639 1.00 0.00 N ATOM 1676 CA ARG A 123 -13.490 -14.320 3.300 1.00 0.00 C ATOM 1677 C ARG A 123 -12.343 -14.462 2.314 1.00 0.00 C ATOM 1678 O ARG A 123 -11.561 -15.409 2.425 1.00 0.00 O ATOM 1679 CB ARG A 123 -12.927 -13.618 4.560 1.00 0.00 C ATOM 1680 CG ARG A 123 -13.898 -12.585 5.152 1.00 0.00 C ATOM 1681 CD ARG A 123 -14.111 -12.719 6.667 1.00 0.00 C ATOM 1682 NE ARG A 123 -12.840 -12.735 7.407 1.00 0.00 N ATOM 1683 CZ ARG A 123 -12.639 -13.316 8.594 1.00 0.00 C ATOM 1684 NH1 ARG A 123 -13.650 -13.769 9.326 1.00 0.00 N ATOM 1685 NH2 ARG A 123 -11.411 -13.471 9.058 1.00 0.00 N ATOM 0 H ARG A 123 -13.468 -16.406 3.224 1.00 0.00 H new ATOM 0 HA ARG A 123 -14.306 -13.735 2.876 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -12.697 -14.369 5.316 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -11.989 -13.124 4.306 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -13.523 -11.585 4.936 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -14.861 -12.679 4.651 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -14.725 -11.891 7.021 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -14.662 -13.636 6.875 1.00 0.00 H new ATOM 0 HE ARG A 123 -12.044 -12.263 6.978 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -14.607 -13.678 8.986 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -13.469 -14.208 10.229 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -10.614 -13.147 8.510 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -11.260 -13.915 9.964 1.00 0.00 H new ATOM 1699 N ARG A 124 -12.195 -13.532 1.367 1.00 0.00 N ATOM 1700 CA ARG A 124 -11.094 -13.578 0.399 1.00 0.00 C ATOM 1701 C ARG A 124 -10.500 -12.195 0.174 1.00 0.00 C ATOM 1702 O ARG A 124 -11.211 -11.208 0.331 1.00 0.00 O ATOM 1703 CB ARG A 124 -11.553 -14.294 -0.875 1.00 0.00 C ATOM 1704 CG ARG A 124 -10.593 -15.439 -1.225 1.00 0.00 C ATOM 1705 CD ARG A 124 -11.339 -16.511 -2.013 1.00 0.00 C ATOM 1706 NE ARG A 124 -10.485 -17.198 -2.987 1.00 0.00 N ATOM 1707 CZ ARG A 124 -10.477 -16.892 -4.288 1.00 0.00 C ATOM 1708 NH1 ARG A 124 -10.890 -15.702 -4.709 1.00 0.00 N ATOM 1709 NH2 ARG A 124 -10.093 -17.786 -5.185 1.00 0.00 N ATOM 0 H ARG A 124 -12.824 -12.737 1.249 1.00 0.00 H new ATOM 0 HA ARG A 124 -10.269 -14.169 0.798 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -12.560 -14.686 -0.736 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -11.599 -13.585 -1.701 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -9.756 -15.059 -1.811 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -10.175 -15.868 -0.314 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -11.753 -17.243 -1.320 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -12.180 -16.053 -2.533 1.00 0.00 H new ATOM 0 HE ARG A 124 -9.870 -17.942 -2.657 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -11.218 -15.009 -4.037 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -10.879 -15.481 -5.705 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -9.800 -18.716 -4.885 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -10.090 -17.545 -6.176 1.00 0.00 H new ATOM 1723 N PHE A 125 -9.224 -12.111 -0.196 1.00 0.00 N ATOM 1724 CA PHE A 125 -8.549 -10.838 -0.419 1.00 0.00 C ATOM 1725 C PHE A 125 -8.753 -10.325 -1.843 1.00 0.00 C ATOM 1726 O PHE A 125 -8.621 -11.111 -2.785 1.00 0.00 O ATOM 1727 CB PHE A 125 -7.040 -11.021 -0.173 1.00 0.00 C ATOM 1728 CG PHE A 125 -6.293 -9.699 -0.168 1.00 0.00 C ATOM 1729 CD1 PHE A 125 -5.993 -9.035 -1.371 1.00 0.00 C ATOM 1730 CD2 PHE A 125 -6.011 -9.067 1.053 1.00 0.00 C ATOM 1731 CE1 PHE A 125 -5.542 -7.707 -1.349 1.00 0.00 C ATOM 1732 CE2 PHE A 125 -5.578 -7.731 1.079 1.00 0.00 C ATOM 1733 CZ PHE A 125 -5.381 -7.036 -0.125 1.00 0.00 C ATOM 0 H PHE A 125 -8.630 -12.926 -0.349 1.00 0.00 H new ATOM 0 HA PHE A 125 -8.975 -10.109 0.270 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -6.888 -11.525 0.781 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -6.624 -11.668 -0.945 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -6.110 -9.549 -2.314 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -6.128 -9.611 1.978 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -5.318 -7.199 -2.275 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -5.397 -7.239 2.023 1.00 0.00 H new ATOM 0 HZ PHE A 125 -5.107 -5.991 -0.110 1.00 0.00 H new ATOM 1743 N GLU A 126 -9.058 -9.036 -2.010 1.00 0.00 N ATOM 1744 CA GLU A 126 -9.210 -8.410 -3.324 1.00 0.00 C ATOM 1745 C GLU A 126 -9.089 -6.889 -3.224 1.00 0.00 C ATOM 1746 O GLU A 126 -9.947 -6.231 -2.635 1.00 0.00 O ATOM 1747 CB GLU A 126 -10.503 -8.807 -4.038 1.00 0.00 C ATOM 1748 CG GLU A 126 -10.513 -8.319 -5.499 1.00 0.00 C ATOM 1749 CD GLU A 126 -11.770 -8.767 -6.249 1.00 0.00 C ATOM 1750 OE1 GLU A 126 -11.901 -9.982 -6.544 1.00 0.00 O ATOM 1751 OE2 GLU A 126 -12.646 -7.909 -6.525 1.00 0.00 O ATOM 0 H GLU A 126 -9.207 -8.394 -1.232 1.00 0.00 H new ATOM 0 HA GLU A 126 -8.392 -8.789 -3.937 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -10.615 -9.891 -4.014 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -11.357 -8.387 -3.507 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -10.449 -7.231 -5.517 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -9.630 -8.699 -6.013 1.00 0.00 H new ATOM 1758 N VAL A 127 -8.030 -6.323 -3.795 1.00 0.00 N ATOM 1759 CA VAL A 127 -7.765 -4.881 -3.825 1.00 0.00 C ATOM 1760 C VAL A 127 -7.235 -4.564 -5.218 1.00 0.00 C ATOM 1761 O VAL A 127 -6.486 -5.355 -5.792 1.00 0.00 O ATOM 1762 CB VAL A 127 -6.764 -4.447 -2.744 1.00 0.00 C ATOM 1763 CG1 VAL A 127 -6.214 -3.027 -2.950 1.00 0.00 C ATOM 1764 CG2 VAL A 127 -7.413 -4.576 -1.362 1.00 0.00 C ATOM 0 H VAL A 127 -7.308 -6.869 -4.265 1.00 0.00 H new ATOM 0 HA VAL A 127 -8.681 -4.330 -3.613 1.00 0.00 H new ATOM 0 HB VAL A 127 -5.905 -5.114 -2.821 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -5.514 -2.788 -2.150 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -5.701 -2.971 -3.910 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -7.037 -2.313 -2.937 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -6.702 -4.268 -0.596 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -8.297 -3.939 -1.314 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -7.703 -5.613 -1.192 1.00 0.00 H new ATOM 1774 N ALA A 128 -7.622 -3.412 -5.757 1.00 0.00 N ATOM 1775 CA ALA A 128 -7.235 -2.958 -7.084 1.00 0.00 C ATOM 1776 C ALA A 128 -6.475 -1.639 -7.009 1.00 0.00 C ATOM 1777 O ALA A 128 -6.930 -0.671 -6.408 1.00 0.00 O ATOM 1778 CB ALA A 128 -8.483 -2.814 -7.955 1.00 0.00 C ATOM 0 H ALA A 128 -8.229 -2.753 -5.269 1.00 0.00 H new ATOM 0 HA ALA A 128 -6.569 -3.697 -7.531 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -8.195 -2.474 -8.950 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -8.986 -3.778 -8.032 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -9.159 -2.087 -7.505 1.00 0.00 H new ATOM 1784 N LEU A 129 -5.304 -1.611 -7.633 1.00 0.00 N ATOM 1785 CA LEU A 129 -4.402 -0.469 -7.718 1.00 0.00 C ATOM 1786 C LEU A 129 -4.398 -0.014 -9.171 1.00 0.00 C ATOM 1787 O LEU A 129 -4.359 -0.899 -10.030 1.00 0.00 O ATOM 1788 CB LEU A 129 -2.993 -0.973 -7.337 1.00 0.00 C ATOM 1789 CG LEU A 129 -1.807 0.007 -7.469 1.00 0.00 C ATOM 1790 CD1 LEU A 129 -1.812 1.092 -6.402 1.00 0.00 C ATOM 1791 CD2 LEU A 129 -0.521 -0.801 -7.277 1.00 0.00 C ATOM 0 H LEU A 129 -4.938 -2.429 -8.120 1.00 0.00 H new ATOM 0 HA LEU A 129 -4.701 0.349 -7.063 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -3.030 -1.314 -6.302 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -2.774 -1.846 -7.952 1.00 0.00 H new ATOM 0 HG LEU A 129 -1.880 0.488 -8.445 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -0.955 1.749 -6.547 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -2.731 1.673 -6.478 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -1.753 0.632 -5.415 1.00 0.00 H new ATOM 0 HD21 LEU A 129 0.341 -0.139 -7.364 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -0.526 -1.263 -6.290 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -0.461 -1.577 -8.040 1.00 0.00 H new ATOM 1803 N ASP A 130 -4.530 1.271 -9.498 1.00 0.00 N ATOM 1804 CA ASP A 130 -4.466 1.686 -10.909 1.00 0.00 C ATOM 1805 C ASP A 130 -2.995 1.824 -11.310 1.00 0.00 C ATOM 1806 O ASP A 130 -2.215 2.387 -10.542 1.00 0.00 O ATOM 1807 CB ASP A 130 -5.185 3.002 -11.240 1.00 0.00 C ATOM 1808 CG ASP A 130 -5.358 3.159 -12.759 1.00 0.00 C ATOM 1809 OD1 ASP A 130 -5.362 2.133 -13.485 1.00 0.00 O ATOM 1810 OD2 ASP A 130 -5.647 4.291 -13.210 1.00 0.00 O ATOM 0 H ASP A 130 -4.678 2.028 -8.830 1.00 0.00 H new ATOM 0 HA ASP A 130 -4.989 0.911 -11.469 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -6.160 3.022 -10.754 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -4.615 3.843 -10.845 1.00 0.00 H new ATOM 1815 N GLY A 131 -2.677 1.325 -12.507 1.00 0.00 N ATOM 1816 CA GLY A 131 -1.388 1.269 -13.190 1.00 0.00 C ATOM 1817 C GLY A 131 -0.416 2.402 -12.898 1.00 0.00 C ATOM 1818 O GLY A 131 -0.752 3.578 -13.015 1.00 0.00 O ATOM 0 H GLY A 131 -3.403 0.902 -13.085 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -0.904 0.328 -12.929 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -1.572 1.245 -14.264 1.00 0.00 H new ATOM 1822 N ASP A 132 0.812 2.000 -12.587 1.00 0.00 N ATOM 1823 CA ASP A 132 1.979 2.760 -12.265 1.00 0.00 C ATOM 1824 C ASP A 132 2.959 2.702 -13.441 1.00 0.00 C ATOM 1825 O ASP A 132 2.912 1.798 -14.280 1.00 0.00 O ATOM 1826 CB ASP A 132 2.636 2.076 -11.051 1.00 0.00 C ATOM 1827 CG ASP A 132 2.604 0.538 -10.988 1.00 0.00 C ATOM 1828 OD1 ASP A 132 2.647 -0.143 -12.039 1.00 0.00 O ATOM 1829 OD2 ASP A 132 2.355 -0.036 -9.902 1.00 0.00 O ATOM 0 H ASP A 132 1.020 1.002 -12.556 1.00 0.00 H new ATOM 0 HA ASP A 132 1.723 3.799 -12.055 1.00 0.00 H new ATOM 0 HB2 ASP A 132 3.679 2.391 -11.013 1.00 0.00 H new ATOM 0 HB3 ASP A 132 2.155 2.458 -10.151 1.00 0.00 H new ATOM 1834 N HIS A 133 3.871 3.668 -13.482 1.00 0.00 N ATOM 1835 CA HIS A 133 4.939 3.858 -14.447 1.00 0.00 C ATOM 1836 C HIS A 133 6.028 2.802 -14.268 1.00 0.00 C ATOM 1837 O HIS A 133 6.688 2.426 -15.235 1.00 0.00 O ATOM 1838 CB HIS A 133 5.505 5.272 -14.233 1.00 0.00 C ATOM 1839 CG HIS A 133 4.515 6.359 -14.578 1.00 0.00 C ATOM 1840 ND1 HIS A 133 4.445 7.622 -14.036 1.00 0.00 N ATOM 1841 CD2 HIS A 133 3.489 6.244 -15.470 1.00 0.00 C ATOM 1842 CE1 HIS A 133 3.432 8.269 -14.634 1.00 0.00 C ATOM 1843 NE2 HIS A 133 2.831 7.477 -15.549 1.00 0.00 N ATOM 0 H HIS A 133 3.878 4.403 -12.774 1.00 0.00 H new ATOM 0 HA HIS A 133 4.558 3.751 -15.463 1.00 0.00 H new ATOM 0 HB2 HIS A 133 5.810 5.382 -13.192 1.00 0.00 H new ATOM 0 HB3 HIS A 133 6.400 5.396 -14.843 1.00 0.00 H new ATOM 0 HD1 HIS A 133 5.054 7.999 -13.310 1.00 0.00 H new ATOM 0 HD2 HIS A 133 3.229 5.353 -16.022 1.00 0.00 H new ATOM 0 HE1 HIS A 133 3.138 9.284 -14.414 1.00 0.00 H new ATOM 1851 N THR A 134 6.229 2.320 -13.048 1.00 0.00 N ATOM 1852 CA THR A 134 7.195 1.308 -12.687 1.00 0.00 C ATOM 1853 C THR A 134 6.453 0.422 -11.693 1.00 0.00 C ATOM 1854 O THR A 134 5.854 0.930 -10.753 1.00 0.00 O ATOM 1855 CB THR A 134 8.490 1.974 -12.176 1.00 0.00 C ATOM 1856 OG1 THR A 134 9.466 0.987 -11.931 1.00 0.00 O ATOM 1857 CG2 THR A 134 8.357 2.844 -10.922 1.00 0.00 C ATOM 0 H THR A 134 5.690 2.647 -12.246 1.00 0.00 H new ATOM 0 HA THR A 134 7.550 0.689 -13.511 1.00 0.00 H new ATOM 0 HB THR A 134 8.773 2.657 -12.977 1.00 0.00 H new ATOM 0 HG1 THR A 134 10.288 1.412 -11.608 1.00 0.00 H new ATOM 0 HG21 THR A 134 9.331 3.257 -10.660 1.00 0.00 H new ATOM 0 HG22 THR A 134 7.658 3.658 -11.116 1.00 0.00 H new ATOM 0 HG23 THR A 134 7.986 2.237 -10.096 1.00 0.00 H new ATOM 1865 N GLY A 135 6.384 -0.886 -11.931 1.00 0.00 N ATOM 1866 CA GLY A 135 5.696 -1.807 -11.031 1.00 0.00 C ATOM 1867 C GLY A 135 6.694 -2.395 -10.043 1.00 0.00 C ATOM 1868 O GLY A 135 6.588 -3.573 -9.688 1.00 0.00 O ATOM 0 H GLY A 135 6.800 -1.334 -12.747 1.00 0.00 H new ATOM 0 HA2 GLY A 135 4.903 -1.284 -10.496 1.00 0.00 H new ATOM 0 HA3 GLY A 135 5.222 -2.605 -11.603 1.00 0.00 H new ATOM 1872 N ASP A 136 7.689 -1.605 -9.652 1.00 0.00 N ATOM 1873 CA ASP A 136 8.767 -1.978 -8.757 1.00 0.00 C ATOM 1874 C ASP A 136 8.440 -1.843 -7.284 1.00 0.00 C ATOM 1875 O ASP A 136 7.787 -0.885 -6.872 1.00 0.00 O ATOM 1876 CB ASP A 136 9.954 -1.066 -9.059 1.00 0.00 C ATOM 1877 CG ASP A 136 11.277 -1.771 -8.782 1.00 0.00 C ATOM 1878 OD1 ASP A 136 11.460 -2.931 -9.230 1.00 0.00 O ATOM 1879 OD2 ASP A 136 12.158 -1.124 -8.174 1.00 0.00 O ATOM 0 H ASP A 136 7.764 -0.639 -9.970 1.00 0.00 H new ATOM 0 HA ASP A 136 8.971 -3.034 -8.933 1.00 0.00 H new ATOM 0 HB2 ASP A 136 9.918 -0.752 -10.102 1.00 0.00 H new ATOM 0 HB3 ASP A 136 9.886 -0.163 -8.452 1.00 0.00 H new ATOM 1884 N LEU A 137 8.993 -2.753 -6.483 1.00 0.00 N ATOM 1885 CA LEU A 137 8.836 -2.825 -5.053 1.00 0.00 C ATOM 1886 C LEU A 137 10.173 -2.966 -4.328 1.00 0.00 C ATOM 1887 O LEU A 137 11.036 -3.740 -4.741 1.00 0.00 O ATOM 1888 CB LEU A 137 7.910 -4.022 -4.784 1.00 0.00 C ATOM 1889 CG LEU A 137 8.516 -5.445 -4.734 1.00 0.00 C ATOM 1890 CD1 LEU A 137 7.437 -6.457 -4.333 1.00 0.00 C ATOM 1891 CD2 LEU A 137 9.079 -5.895 -6.091 1.00 0.00 C ATOM 0 H LEU A 137 9.593 -3.494 -6.846 1.00 0.00 H new ATOM 0 HA LEU A 137 8.406 -1.901 -4.667 1.00 0.00 H new ATOM 0 HB2 LEU A 137 7.411 -3.844 -3.832 1.00 0.00 H new ATOM 0 HB3 LEU A 137 7.138 -4.020 -5.554 1.00 0.00 H new ATOM 0 HG LEU A 137 9.327 -5.408 -4.007 1.00 0.00 H new ATOM 0 HD11 LEU A 137 7.870 -7.457 -4.300 1.00 0.00 H new ATOM 0 HD12 LEU A 137 7.044 -6.199 -3.350 1.00 0.00 H new ATOM 0 HD13 LEU A 137 6.629 -6.436 -5.064 1.00 0.00 H new ATOM 0 HD21 LEU A 137 9.491 -6.900 -5.999 1.00 0.00 H new ATOM 0 HD22 LEU A 137 8.281 -5.897 -6.833 1.00 0.00 H new ATOM 0 HD23 LEU A 137 9.865 -5.208 -6.405 1.00 0.00 H new ATOM 1903 N SER A 138 10.321 -2.256 -3.218 1.00 0.00 N ATOM 1904 CA SER A 138 11.442 -2.220 -2.314 1.00 0.00 C ATOM 1905 C SER A 138 10.995 -1.320 -1.160 1.00 0.00 C ATOM 1906 O SER A 138 9.842 -0.893 -1.070 1.00 0.00 O ATOM 1907 CB SER A 138 12.734 -1.737 -2.981 1.00 0.00 C ATOM 1908 OG SER A 138 13.546 -2.812 -3.415 1.00 0.00 O ATOM 0 H SER A 138 9.578 -1.631 -2.905 1.00 0.00 H new ATOM 0 HA SER A 138 11.700 -3.219 -1.963 1.00 0.00 H new ATOM 0 HB2 SER A 138 12.486 -1.104 -3.833 1.00 0.00 H new ATOM 0 HB3 SER A 138 13.295 -1.121 -2.279 1.00 0.00 H new ATOM 0 HG SER A 138 13.007 -3.436 -3.945 1.00 0.00 H new ATOM 1914 N ALA A 139 11.936 -1.047 -0.271 1.00 0.00 N ATOM 1915 CA ALA A 139 11.781 -0.238 0.939 1.00 0.00 C ATOM 1916 C ALA A 139 11.322 1.195 0.652 1.00 0.00 C ATOM 1917 O ALA A 139 10.870 1.893 1.561 1.00 0.00 O ATOM 1918 CB ALA A 139 13.091 -0.244 1.729 1.00 0.00 C ATOM 0 H ALA A 139 12.886 -1.402 -0.376 1.00 0.00 H new ATOM 0 HA ALA A 139 10.988 -0.691 1.534 1.00 0.00 H new ATOM 0 HB1 ALA A 139 12.975 0.359 2.630 1.00 0.00 H new ATOM 0 HB2 ALA A 139 13.344 -1.267 2.007 1.00 0.00 H new ATOM 0 HB3 ALA A 139 13.889 0.173 1.114 1.00 0.00 H new ATOM 1924 N ALA A 140 11.501 1.661 -0.583 1.00 0.00 N ATOM 1925 CA ALA A 140 11.093 2.981 -1.008 1.00 0.00 C ATOM 1926 C ALA A 140 9.594 2.957 -1.316 1.00 0.00 C ATOM 1927 O ALA A 140 8.836 3.740 -0.761 1.00 0.00 O ATOM 1928 CB ALA A 140 11.919 3.381 -2.238 1.00 0.00 C ATOM 0 H ALA A 140 11.942 1.115 -1.323 1.00 0.00 H new ATOM 0 HA ALA A 140 11.269 3.719 -0.225 1.00 0.00 H new ATOM 0 HB1 ALA A 140 11.621 4.376 -2.569 1.00 0.00 H new ATOM 0 HB2 ALA A 140 12.978 3.387 -1.979 1.00 0.00 H new ATOM 0 HB3 ALA A 140 11.746 2.665 -3.041 1.00 0.00 H new ATOM 1934 N ASN A 141 9.168 1.999 -2.145 1.00 0.00 N ATOM 1935 CA ASN A 141 7.784 1.846 -2.591 1.00 0.00 C ATOM 1936 C ASN A 141 6.827 1.264 -1.566 1.00 0.00 C ATOM 1937 O ASN A 141 5.638 1.569 -1.575 1.00 0.00 O ATOM 1938 CB ASN A 141 7.707 0.954 -3.849 1.00 0.00 C ATOM 1939 CG ASN A 141 8.935 0.992 -4.739 1.00 0.00 C ATOM 1940 OD1 ASN A 141 9.947 0.359 -4.433 1.00 0.00 O ATOM 1941 ND2 ASN A 141 8.916 1.738 -5.818 1.00 0.00 N ATOM 0 H ASN A 141 9.793 1.292 -2.533 1.00 0.00 H new ATOM 0 HA ASN A 141 7.466 2.870 -2.789 1.00 0.00 H new ATOM 0 HB2 ASN A 141 7.536 -0.076 -3.536 1.00 0.00 H new ATOM 0 HB3 ASN A 141 6.841 1.256 -4.438 1.00 0.00 H new ATOM 0 HD21 ASN A 141 9.743 1.798 -6.412 1.00 0.00 H new ATOM 0 HD22 ASN A 141 8.074 2.258 -6.063 1.00 0.00 H new ATOM 1948 N VAL A 142 7.326 0.430 -0.667 1.00 0.00 N ATOM 1949 CA VAL A 142 6.515 -0.224 0.348 1.00 0.00 C ATOM 1950 C VAL A 142 7.263 -0.300 1.680 1.00 0.00 C ATOM 1951 O VAL A 142 8.492 -0.407 1.702 1.00 0.00 O ATOM 1952 CB VAL A 142 6.159 -1.645 -0.157 1.00 0.00 C ATOM 1953 CG1 VAL A 142 5.126 -2.351 0.744 1.00 0.00 C ATOM 1954 CG2 VAL A 142 5.597 -1.705 -1.589 1.00 0.00 C ATOM 0 H VAL A 142 8.315 0.186 -0.621 1.00 0.00 H new ATOM 0 HA VAL A 142 5.605 0.352 0.518 1.00 0.00 H new ATOM 0 HB VAL A 142 7.125 -2.149 -0.133 1.00 0.00 H new ATOM 0 HG11 VAL A 142 4.912 -3.343 0.345 1.00 0.00 H new ATOM 0 HG12 VAL A 142 5.527 -2.445 1.753 1.00 0.00 H new ATOM 0 HG13 VAL A 142 4.207 -1.765 0.772 1.00 0.00 H new ATOM 0 HG21 VAL A 142 5.379 -2.740 -1.851 1.00 0.00 H new ATOM 0 HG22 VAL A 142 4.682 -1.116 -1.646 1.00 0.00 H new ATOM 0 HG23 VAL A 142 6.332 -1.302 -2.286 1.00 0.00 H new ATOM 1964 N VAL A 143 6.528 -0.263 2.795 1.00 0.00 N ATOM 1965 CA VAL A 143 7.080 -0.370 4.135 1.00 0.00 C ATOM 1966 C VAL A 143 7.008 -1.856 4.484 1.00 0.00 C ATOM 1967 O VAL A 143 5.926 -2.383 4.757 1.00 0.00 O ATOM 1968 CB VAL A 143 6.366 0.511 5.171 1.00 0.00 C ATOM 1969 CG1 VAL A 143 7.087 0.471 6.529 1.00 0.00 C ATOM 1970 CG2 VAL A 143 6.254 1.973 4.711 1.00 0.00 C ATOM 0 H VAL A 143 5.514 -0.156 2.784 1.00 0.00 H new ATOM 0 HA VAL A 143 8.104 0.003 4.157 1.00 0.00 H new ATOM 0 HB VAL A 143 5.362 0.101 5.277 1.00 0.00 H new ATOM 0 HG11 VAL A 143 6.558 1.104 7.241 1.00 0.00 H new ATOM 0 HG12 VAL A 143 7.107 -0.554 6.900 1.00 0.00 H new ATOM 0 HG13 VAL A 143 8.108 0.834 6.410 1.00 0.00 H new ATOM 0 HG21 VAL A 143 5.742 2.557 5.476 1.00 0.00 H new ATOM 0 HG22 VAL A 143 7.252 2.381 4.550 1.00 0.00 H new ATOM 0 HG23 VAL A 143 5.688 2.019 3.780 1.00 0.00 H new ATOM 1980 N PHE A 144 8.146 -2.551 4.455 1.00 0.00 N ATOM 1981 CA PHE A 144 8.204 -3.979 4.775 1.00 0.00 C ATOM 1982 C PHE A 144 7.870 -4.171 6.257 1.00 0.00 C ATOM 1983 O PHE A 144 6.985 -4.949 6.612 1.00 0.00 O ATOM 1984 CB PHE A 144 9.586 -4.575 4.438 1.00 0.00 C ATOM 1985 CG PHE A 144 9.522 -5.911 3.722 1.00 0.00 C ATOM 1986 CD1 PHE A 144 9.057 -7.067 4.376 1.00 0.00 C ATOM 1987 CD2 PHE A 144 9.905 -5.992 2.374 1.00 0.00 C ATOM 1988 CE1 PHE A 144 8.959 -8.278 3.666 1.00 0.00 C ATOM 1989 CE2 PHE A 144 9.801 -7.193 1.663 1.00 0.00 C ATOM 1990 CZ PHE A 144 9.320 -8.336 2.309 1.00 0.00 C ATOM 0 H PHE A 144 9.049 -2.144 4.211 1.00 0.00 H new ATOM 0 HA PHE A 144 7.472 -4.510 4.166 1.00 0.00 H new ATOM 0 HB2 PHE A 144 10.134 -3.867 3.817 1.00 0.00 H new ATOM 0 HB3 PHE A 144 10.154 -4.695 5.361 1.00 0.00 H new ATOM 0 HD1 PHE A 144 8.777 -7.025 5.418 1.00 0.00 H new ATOM 0 HD2 PHE A 144 10.287 -5.112 1.877 1.00 0.00 H new ATOM 0 HE1 PHE A 144 8.605 -9.167 4.166 1.00 0.00 H new ATOM 0 HE2 PHE A 144 10.090 -7.237 0.623 1.00 0.00 H new ATOM 0 HZ PHE A 144 9.226 -9.264 1.765 1.00 0.00 H new