USER MOD reduce.3.24.130724 H: found=0, std=0, add=986, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 989 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 117 ASN : amide:sc= 0.066 X(o=0.18,f=0.016) USER MOD Set 1.2: A 122 THR OG1 : rot -76:sc= 0.111 USER MOD Set 2.1: A 80 GLN : amide:sc= 0.318 K(o=0.14,f=-4.5!) USER MOD Set 2.2: A 104 MET CE :methyl -160:sc= -0.175 (180deg=-0.706) USER MOD Set 3.1: A 27 SER OG : rot 103:sc= 0.377 USER MOD Set 3.2: A 31 ASN : amide:sc= 0.348 K(o=0.72,f=-1.3!) USER MOD Set 4.1: A 18 LYS NZ :NH3+ -110:sc= 0.911 (180deg=0) USER MOD Set 4.2: A 24 THR OG1 : rot 180:sc= 0.799 USER MOD Set 5.1: A 7 SER OG : rot 180:sc= 0 USER MOD Set 5.2: A 50 GLN : amide:sc= 0.0477 K(o=0.048,f=-1.3) USER MOD Single : A 2 SER OG : rot -89:sc= 1.06 USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 6 GLN : amide:sc= -1.14 K(o=-1.1,f=-0.14) USER MOD Single : A 8 ASN : amide:sc= -0.871 K(o=-0.87,f=-3.4!) USER MOD Single : A 9 SER OG : rot -140:sc= -2.95! USER MOD Single : A 14 HIS : no HE2:sc= -1.43! C(o=-1.4!,f=-5.9!) USER MOD Single : A 16 THR OG1 : rot -120:sc= -0.742 USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 142:sc= 0.947 USER MOD Single : A 30 ASN : amide:sc= -0.209 K(o=-0.21,f=-1.7) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 SER OG : rot 180:sc= -0.213 USER MOD Single : A 45 SER OG : rot 169:sc= 0.0819 USER MOD Single : A 51 HIS : no HD1:sc= -0.425 X(o=-0.42,f=-0.36) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ -166:sc= 1.21 (180deg=0.963) USER MOD Single : A 61 THR OG1 : rot -83:sc= 0.2 USER MOD Single : A 62 THR OG1 : rot -84:sc= 1.25 USER MOD Single : A 64 SER OG : rot 26:sc= -0.147 USER MOD Single : A 75 SER OG : rot 40:sc= 1.01 USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 130:sc= -0.161 USER MOD Single : A 88 MET CE :methyl 154:sc= -0.131 (180deg=-0.882) USER MOD Single : A 99 MET CE :methyl -168:sc= -1.93 (180deg=-2.31!) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 109 MET CE :methyl 180:sc=-0.00775 (180deg=-0.00775) USER MOD Single : A 120 SER OG : rot -3:sc= -0.416 USER MOD Single : A 126 ASN : amide:sc= 0.28 K(o=0.28,f=-1.5) USER MOD Single : A 133 THR OG1 : rot 29:sc= 0.464 USER MOD Single : A 135 HIS : no HD1:sc= -3.86! C(o=-3.9!,f=-3.5!) USER MOD ----------------------------------------------------------------- ATOM 20 N SER A 2 22.518 -4.641 7.799 1.00 0.00 N ATOM 21 CA SER A 2 22.657 -4.094 6.462 1.00 0.00 C ATOM 22 C SER A 2 22.755 -2.576 6.548 1.00 0.00 C ATOM 23 O SER A 2 21.839 -1.908 7.029 1.00 0.00 O ATOM 24 CB SER A 2 21.471 -4.514 5.588 1.00 0.00 C ATOM 25 OG SER A 2 21.787 -4.401 4.207 1.00 0.00 O ATOM 0 HA SER A 2 23.566 -4.483 6.003 1.00 0.00 H new ATOM 0 HB2 SER A 2 21.193 -5.543 5.817 1.00 0.00 H new ATOM 0 HB3 SER A 2 20.607 -3.891 5.819 1.00 0.00 H new ATOM 0 HG SER A 2 21.568 -3.498 3.894 1.00 0.00 H new ATOM 31 N GLU A 3 23.879 -2.043 6.097 1.00 0.00 N ATOM 32 CA GLU A 3 24.142 -0.615 6.170 1.00 0.00 C ATOM 33 C GLU A 3 23.324 0.133 5.127 1.00 0.00 C ATOM 34 O GLU A 3 22.870 1.257 5.350 1.00 0.00 O ATOM 35 CB GLU A 3 25.637 -0.355 5.968 1.00 0.00 C ATOM 36 CG GLU A 3 26.008 1.110 5.984 1.00 0.00 C ATOM 37 CD GLU A 3 27.478 1.347 5.732 1.00 0.00 C ATOM 38 OE1 GLU A 3 27.873 1.468 4.556 1.00 0.00 O ATOM 39 OE2 GLU A 3 28.247 1.433 6.710 1.00 0.00 O ATOM 0 H GLU A 3 24.631 -2.585 5.672 1.00 0.00 H new ATOM 0 HA GLU A 3 23.849 -0.251 7.155 1.00 0.00 H new ATOM 0 HB2 GLU A 3 26.195 -0.870 6.750 1.00 0.00 H new ATOM 0 HB3 GLU A 3 25.947 -0.788 5.017 1.00 0.00 H new ATOM 0 HG2 GLU A 3 25.426 1.635 5.227 1.00 0.00 H new ATOM 0 HG3 GLU A 3 25.736 1.538 6.949 1.00 0.00 H new ATOM 46 N SER A 4 23.136 -0.508 3.995 1.00 0.00 N ATOM 47 CA SER A 4 22.373 0.062 2.904 1.00 0.00 C ATOM 48 C SER A 4 21.303 -0.930 2.454 1.00 0.00 C ATOM 49 O SER A 4 21.428 -2.133 2.689 1.00 0.00 O ATOM 50 CB SER A 4 23.311 0.403 1.748 1.00 0.00 C ATOM 51 OG SER A 4 24.353 1.254 2.190 1.00 0.00 O ATOM 0 H SER A 4 23.507 -1.439 3.804 1.00 0.00 H new ATOM 0 HA SER A 4 21.882 0.977 3.237 1.00 0.00 H new ATOM 0 HB2 SER A 4 23.732 -0.512 1.332 1.00 0.00 H new ATOM 0 HB3 SER A 4 22.751 0.889 0.949 1.00 0.00 H new ATOM 0 HG SER A 4 24.946 1.462 1.438 1.00 0.00 H new ATOM 57 N VAL A 5 20.251 -0.425 1.829 1.00 0.00 N ATOM 58 CA VAL A 5 19.147 -1.267 1.402 1.00 0.00 C ATOM 59 C VAL A 5 19.466 -1.948 0.076 1.00 0.00 C ATOM 60 O VAL A 5 19.999 -1.330 -0.840 1.00 0.00 O ATOM 61 CB VAL A 5 17.825 -0.469 1.280 1.00 0.00 C ATOM 62 CG1 VAL A 5 17.951 0.677 0.300 1.00 0.00 C ATOM 63 CG2 VAL A 5 16.672 -1.382 0.892 1.00 0.00 C ATOM 0 H VAL A 5 20.139 0.564 1.607 1.00 0.00 H new ATOM 0 HA VAL A 5 19.011 -2.028 2.171 1.00 0.00 H new ATOM 0 HB VAL A 5 17.612 -0.043 2.260 1.00 0.00 H new ATOM 0 HG11 VAL A 5 17.003 1.212 0.242 1.00 0.00 H new ATOM 0 HG12 VAL A 5 18.733 1.358 0.636 1.00 0.00 H new ATOM 0 HG13 VAL A 5 18.208 0.287 -0.685 1.00 0.00 H new ATOM 0 HG21 VAL A 5 15.756 -0.797 0.813 1.00 0.00 H new ATOM 0 HG22 VAL A 5 16.887 -1.851 -0.068 1.00 0.00 H new ATOM 0 HG23 VAL A 5 16.546 -2.153 1.653 1.00 0.00 H new ATOM 73 N GLN A 6 19.155 -3.226 -0.005 1.00 0.00 N ATOM 74 CA GLN A 6 19.361 -3.989 -1.224 1.00 0.00 C ATOM 75 C GLN A 6 18.043 -4.606 -1.670 1.00 0.00 C ATOM 76 O GLN A 6 17.056 -4.567 -0.933 1.00 0.00 O ATOM 77 CB GLN A 6 20.427 -5.065 -1.021 1.00 0.00 C ATOM 78 CG GLN A 6 19.974 -6.191 -0.116 1.00 0.00 C ATOM 79 CD GLN A 6 21.108 -6.886 0.621 1.00 0.00 C ATOM 80 OE1 GLN A 6 21.074 -8.105 0.817 1.00 0.00 O ATOM 81 NE2 GLN A 6 22.087 -6.127 1.096 1.00 0.00 N ATOM 0 H GLN A 6 18.755 -3.763 0.764 1.00 0.00 H new ATOM 0 HA GLN A 6 19.718 -3.317 -2.005 1.00 0.00 H new ATOM 0 HB2 GLN A 6 20.707 -5.477 -1.990 1.00 0.00 H new ATOM 0 HB3 GLN A 6 21.321 -4.606 -0.599 1.00 0.00 H new ATOM 0 HG2 GLN A 6 19.268 -5.795 0.614 1.00 0.00 H new ATOM 0 HG3 GLN A 6 19.436 -6.928 -0.712 1.00 0.00 H new ATOM 0 HE21 GLN A 6 22.087 -5.123 0.917 1.00 0.00 H new ATOM 0 HE22 GLN A 6 22.840 -6.548 1.640 1.00 0.00 H new ATOM 90 N SER A 7 18.018 -5.132 -2.884 1.00 0.00 N ATOM 91 CA SER A 7 16.825 -5.768 -3.415 1.00 0.00 C ATOM 92 C SER A 7 16.328 -6.861 -2.459 1.00 0.00 C ATOM 93 O SER A 7 17.074 -7.780 -2.108 1.00 0.00 O ATOM 94 CB SER A 7 17.122 -6.340 -4.804 1.00 0.00 C ATOM 95 OG SER A 7 15.956 -6.870 -5.410 1.00 0.00 O ATOM 0 H SER A 7 18.814 -5.130 -3.522 1.00 0.00 H new ATOM 0 HA SER A 7 16.032 -5.026 -3.508 1.00 0.00 H new ATOM 0 HB2 SER A 7 17.539 -5.558 -5.439 1.00 0.00 H new ATOM 0 HB3 SER A 7 17.878 -7.121 -4.722 1.00 0.00 H new ATOM 0 HG SER A 7 16.180 -7.225 -6.295 1.00 0.00 H new ATOM 101 N ASN A 8 15.070 -6.716 -2.030 1.00 0.00 N ATOM 102 CA ASN A 8 14.423 -7.617 -1.067 1.00 0.00 C ATOM 103 C ASN A 8 14.962 -7.391 0.349 1.00 0.00 C ATOM 104 O ASN A 8 15.247 -8.336 1.082 1.00 0.00 O ATOM 105 CB ASN A 8 14.566 -9.097 -1.465 1.00 0.00 C ATOM 106 CG ASN A 8 13.522 -9.991 -0.804 1.00 0.00 C ATOM 107 OD1 ASN A 8 12.462 -10.252 -1.372 1.00 0.00 O ATOM 108 ND2 ASN A 8 13.811 -10.463 0.400 1.00 0.00 N ATOM 0 H ASN A 8 14.463 -5.959 -2.346 1.00 0.00 H new ATOM 0 HA ASN A 8 13.360 -7.376 -1.079 1.00 0.00 H new ATOM 0 HB2 ASN A 8 14.481 -9.187 -2.548 1.00 0.00 H new ATOM 0 HB3 ASN A 8 15.562 -9.447 -1.193 1.00 0.00 H new ATOM 0 HD21 ASN A 8 13.145 -11.063 0.886 1.00 0.00 H new ATOM 0 HD22 ASN A 8 14.700 -10.226 0.841 1.00 0.00 H new ATOM 115 N SER A 9 15.156 -6.132 0.714 1.00 0.00 N ATOM 116 CA SER A 9 15.420 -5.774 2.096 1.00 0.00 C ATOM 117 C SER A 9 14.364 -4.790 2.557 1.00 0.00 C ATOM 118 O SER A 9 14.028 -3.855 1.837 1.00 0.00 O ATOM 119 CB SER A 9 16.814 -5.172 2.252 1.00 0.00 C ATOM 120 OG SER A 9 17.801 -6.111 1.878 1.00 0.00 O ATOM 0 H SER A 9 15.135 -5.342 0.070 1.00 0.00 H new ATOM 0 HA SER A 9 15.381 -6.673 2.711 1.00 0.00 H new ATOM 0 HB2 SER A 9 16.902 -4.278 1.635 1.00 0.00 H new ATOM 0 HB3 SER A 9 16.970 -4.863 3.286 1.00 0.00 H new ATOM 0 HG SER A 9 18.559 -6.053 2.496 1.00 0.00 H new ATOM 126 N ALA A 10 13.831 -5.011 3.739 1.00 0.00 N ATOM 127 CA ALA A 10 12.768 -4.175 4.248 1.00 0.00 C ATOM 128 C ALA A 10 13.343 -2.945 4.913 1.00 0.00 C ATOM 129 O ALA A 10 14.427 -2.995 5.481 1.00 0.00 O ATOM 130 CB ALA A 10 11.911 -4.953 5.223 1.00 0.00 C ATOM 0 H ALA A 10 14.117 -5.763 4.365 1.00 0.00 H new ATOM 0 HA ALA A 10 12.142 -3.857 3.414 1.00 0.00 H new ATOM 0 HB1 ALA A 10 11.114 -4.312 5.599 1.00 0.00 H new ATOM 0 HB2 ALA A 10 11.475 -5.815 4.717 1.00 0.00 H new ATOM 0 HB3 ALA A 10 12.526 -5.294 6.056 1.00 0.00 H new ATOM 136 N VAL A 11 12.635 -1.838 4.839 1.00 0.00 N ATOM 137 CA VAL A 11 13.111 -0.613 5.449 1.00 0.00 C ATOM 138 C VAL A 11 11.993 0.056 6.233 1.00 0.00 C ATOM 139 O VAL A 11 10.829 0.003 5.840 1.00 0.00 O ATOM 140 CB VAL A 11 13.682 0.377 4.400 1.00 0.00 C ATOM 141 CG1 VAL A 11 14.740 -0.302 3.544 1.00 0.00 C ATOM 142 CG2 VAL A 11 12.584 0.968 3.524 1.00 0.00 C ATOM 0 H VAL A 11 11.734 -1.760 4.366 1.00 0.00 H new ATOM 0 HA VAL A 11 13.921 -0.884 6.126 1.00 0.00 H new ATOM 0 HB VAL A 11 14.146 1.199 4.945 1.00 0.00 H new ATOM 0 HG11 VAL A 11 15.129 0.408 2.814 1.00 0.00 H new ATOM 0 HG12 VAL A 11 15.554 -0.651 4.180 1.00 0.00 H new ATOM 0 HG13 VAL A 11 14.297 -1.151 3.023 1.00 0.00 H new ATOM 0 HG21 VAL A 11 13.025 1.656 2.803 1.00 0.00 H new ATOM 0 HG22 VAL A 11 12.071 0.166 2.994 1.00 0.00 H new ATOM 0 HG23 VAL A 11 11.870 1.505 4.148 1.00 0.00 H new ATOM 152 N LEU A 12 12.345 0.644 7.360 1.00 0.00 N ATOM 153 CA LEU A 12 11.398 1.411 8.143 1.00 0.00 C ATOM 154 C LEU A 12 11.382 2.831 7.612 1.00 0.00 C ATOM 155 O LEU A 12 12.430 3.476 7.530 1.00 0.00 O ATOM 156 CB LEU A 12 11.791 1.403 9.621 1.00 0.00 C ATOM 157 CG LEU A 12 10.745 1.978 10.576 1.00 0.00 C ATOM 158 CD1 LEU A 12 9.472 1.147 10.527 1.00 0.00 C ATOM 159 CD2 LEU A 12 11.293 2.041 11.994 1.00 0.00 C ATOM 0 H LEU A 12 13.285 0.604 7.755 1.00 0.00 H new ATOM 0 HA LEU A 12 10.406 0.968 8.060 1.00 0.00 H new ATOM 0 HB2 LEU A 12 12.005 0.376 9.918 1.00 0.00 H new ATOM 0 HB3 LEU A 12 12.716 1.968 9.738 1.00 0.00 H new ATOM 0 HG LEU A 12 10.506 2.993 10.259 1.00 0.00 H new ATOM 0 HD11 LEU A 12 8.736 1.568 11.212 1.00 0.00 H new ATOM 0 HD12 LEU A 12 9.071 1.155 9.514 1.00 0.00 H new ATOM 0 HD13 LEU A 12 9.696 0.121 10.820 1.00 0.00 H new ATOM 0 HD21 LEU A 12 10.534 2.453 12.659 1.00 0.00 H new ATOM 0 HD22 LEU A 12 11.560 1.038 12.326 1.00 0.00 H new ATOM 0 HD23 LEU A 12 12.178 2.678 12.014 1.00 0.00 H new ATOM 171 N VAL A 13 10.218 3.311 7.222 1.00 0.00 N ATOM 172 CA VAL A 13 10.135 4.592 6.553 1.00 0.00 C ATOM 173 C VAL A 13 9.055 5.502 7.135 1.00 0.00 C ATOM 174 O VAL A 13 8.087 5.060 7.757 1.00 0.00 O ATOM 175 CB VAL A 13 9.907 4.388 5.030 1.00 0.00 C ATOM 176 CG1 VAL A 13 8.708 3.496 4.763 1.00 0.00 C ATOM 177 CG2 VAL A 13 9.748 5.703 4.288 1.00 0.00 C ATOM 0 H VAL A 13 9.324 2.838 7.356 1.00 0.00 H new ATOM 0 HA VAL A 13 11.088 5.095 6.717 1.00 0.00 H new ATOM 0 HB VAL A 13 10.803 3.897 4.651 1.00 0.00 H new ATOM 0 HG11 VAL A 13 8.577 3.374 3.688 1.00 0.00 H new ATOM 0 HG12 VAL A 13 8.871 2.521 5.221 1.00 0.00 H new ATOM 0 HG13 VAL A 13 7.814 3.952 5.188 1.00 0.00 H new ATOM 0 HG21 VAL A 13 9.591 5.506 3.228 1.00 0.00 H new ATOM 0 HG22 VAL A 13 8.890 6.245 4.687 1.00 0.00 H new ATOM 0 HG23 VAL A 13 10.648 6.304 4.416 1.00 0.00 H new ATOM 187 N HIS A 14 9.274 6.781 6.911 1.00 0.00 N ATOM 188 CA HIS A 14 8.294 7.826 7.165 1.00 0.00 C ATOM 189 C HIS A 14 8.020 8.477 5.827 1.00 0.00 C ATOM 190 O HIS A 14 8.954 8.963 5.191 1.00 0.00 O ATOM 191 CB HIS A 14 8.811 8.881 8.151 1.00 0.00 C ATOM 192 CG HIS A 14 8.342 8.701 9.564 1.00 0.00 C ATOM 193 ND1 HIS A 14 7.024 8.472 9.903 1.00 0.00 N ATOM 194 CD2 HIS A 14 9.024 8.738 10.734 1.00 0.00 C ATOM 195 CE1 HIS A 14 6.921 8.378 11.215 1.00 0.00 C ATOM 196 NE2 HIS A 14 8.117 8.533 11.741 1.00 0.00 N ATOM 0 H HIS A 14 10.156 7.134 6.539 1.00 0.00 H new ATOM 0 HA HIS A 14 7.399 7.395 7.614 1.00 0.00 H new ATOM 0 HB2 HIS A 14 9.901 8.866 8.140 1.00 0.00 H new ATOM 0 HB3 HIS A 14 8.502 9.867 7.803 1.00 0.00 H new ATOM 0 HD1 HIS A 14 6.251 8.389 9.243 1.00 0.00 H new ATOM 0 HD2 HIS A 14 10.085 8.899 10.851 1.00 0.00 H new ATOM 0 HE1 HIS A 14 6.008 8.203 11.765 1.00 0.00 H new ATOM 205 N PHE A 15 6.780 8.468 5.364 1.00 0.00 N ATOM 206 CA PHE A 15 6.554 8.902 3.984 1.00 0.00 C ATOM 207 C PHE A 15 5.181 9.515 3.746 1.00 0.00 C ATOM 208 O PHE A 15 4.231 9.271 4.479 1.00 0.00 O ATOM 209 CB PHE A 15 6.815 7.750 2.994 1.00 0.00 C ATOM 210 CG PHE A 15 5.706 6.747 2.850 1.00 0.00 C ATOM 211 CD1 PHE A 15 5.590 5.686 3.729 1.00 0.00 C ATOM 212 CD2 PHE A 15 4.789 6.858 1.812 1.00 0.00 C ATOM 213 CE1 PHE A 15 4.579 4.756 3.581 1.00 0.00 C ATOM 214 CE2 PHE A 15 3.780 5.930 1.659 1.00 0.00 C ATOM 215 CZ PHE A 15 3.674 4.877 2.546 1.00 0.00 C ATOM 0 H PHE A 15 5.951 8.183 5.886 1.00 0.00 H new ATOM 0 HA PHE A 15 7.274 9.700 3.805 1.00 0.00 H new ATOM 0 HB2 PHE A 15 7.021 8.179 2.013 1.00 0.00 H new ATOM 0 HB3 PHE A 15 7.717 7.224 3.308 1.00 0.00 H new ATOM 0 HD1 PHE A 15 6.297 5.583 4.539 1.00 0.00 H new ATOM 0 HD2 PHE A 15 4.867 7.681 1.117 1.00 0.00 H new ATOM 0 HE1 PHE A 15 4.497 3.933 4.276 1.00 0.00 H new ATOM 0 HE2 PHE A 15 3.074 6.027 0.847 1.00 0.00 H new ATOM 0 HZ PHE A 15 2.884 4.149 2.430 1.00 0.00 H new ATOM 225 N THR A 16 5.102 10.310 2.690 1.00 0.00 N ATOM 226 CA THR A 16 3.861 10.935 2.262 1.00 0.00 C ATOM 227 C THR A 16 3.688 10.698 0.768 1.00 0.00 C ATOM 228 O THR A 16 4.620 10.925 0.000 1.00 0.00 O ATOM 229 CB THR A 16 3.876 12.450 2.538 1.00 0.00 C ATOM 230 OG1 THR A 16 4.267 12.695 3.895 1.00 0.00 O ATOM 231 CG2 THR A 16 2.506 13.061 2.284 1.00 0.00 C ATOM 0 H THR A 16 5.903 10.541 2.102 1.00 0.00 H new ATOM 0 HA THR A 16 3.035 10.496 2.821 1.00 0.00 H new ATOM 0 HB THR A 16 4.594 12.913 1.861 1.00 0.00 H new ATOM 0 HG1 THR A 16 3.550 13.173 4.361 1.00 0.00 H new ATOM 0 HG21 THR A 16 2.542 14.132 2.486 1.00 0.00 H new ATOM 0 HG22 THR A 16 2.221 12.897 1.245 1.00 0.00 H new ATOM 0 HG23 THR A 16 1.772 12.593 2.939 1.00 0.00 H new ATOM 239 N LEU A 17 2.524 10.230 0.347 1.00 0.00 N ATOM 240 CA LEU A 17 2.332 9.853 -1.036 1.00 0.00 C ATOM 241 C LEU A 17 1.193 10.658 -1.624 1.00 0.00 C ATOM 242 O LEU A 17 0.054 10.555 -1.166 1.00 0.00 O ATOM 243 CB LEU A 17 2.012 8.365 -1.112 1.00 0.00 C ATOM 244 CG LEU A 17 2.475 7.653 -2.378 1.00 0.00 C ATOM 245 CD1 LEU A 17 2.286 6.151 -2.241 1.00 0.00 C ATOM 246 CD2 LEU A 17 1.744 8.171 -3.606 1.00 0.00 C ATOM 0 H LEU A 17 1.705 10.104 0.942 1.00 0.00 H new ATOM 0 HA LEU A 17 3.241 10.054 -1.603 1.00 0.00 H new ATOM 0 HB2 LEU A 17 2.465 7.870 -0.253 1.00 0.00 H new ATOM 0 HB3 LEU A 17 0.933 8.239 -1.020 1.00 0.00 H new ATOM 0 HG LEU A 17 3.536 7.864 -2.510 1.00 0.00 H new ATOM 0 HD11 LEU A 17 2.621 5.657 -3.153 1.00 0.00 H new ATOM 0 HD12 LEU A 17 2.870 5.786 -1.396 1.00 0.00 H new ATOM 0 HD13 LEU A 17 1.231 5.931 -2.076 1.00 0.00 H new ATOM 0 HD21 LEU A 17 2.098 7.642 -4.491 1.00 0.00 H new ATOM 0 HD22 LEU A 17 0.673 8.005 -3.489 1.00 0.00 H new ATOM 0 HD23 LEU A 17 1.936 9.238 -3.720 1.00 0.00 H new ATOM 258 N LYS A 18 1.484 11.451 -2.631 1.00 0.00 N ATOM 259 CA LYS A 18 0.474 12.332 -3.172 1.00 0.00 C ATOM 260 C LYS A 18 0.318 12.144 -4.671 1.00 0.00 C ATOM 261 O LYS A 18 1.230 11.674 -5.352 1.00 0.00 O ATOM 262 CB LYS A 18 0.836 13.779 -2.857 1.00 0.00 C ATOM 263 CG LYS A 18 -0.365 14.643 -2.539 1.00 0.00 C ATOM 264 CD LYS A 18 -0.873 14.390 -1.128 1.00 0.00 C ATOM 265 CE LYS A 18 -0.121 15.227 -0.110 1.00 0.00 C ATOM 266 NZ LYS A 18 -0.797 15.228 1.212 1.00 0.00 N ATOM 0 H LYS A 18 2.396 11.504 -3.085 1.00 0.00 H new ATOM 0 HA LYS A 18 -0.480 12.085 -2.707 1.00 0.00 H new ATOM 0 HB2 LYS A 18 1.522 13.798 -2.011 1.00 0.00 H new ATOM 0 HB3 LYS A 18 1.367 14.206 -3.708 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -0.098 15.694 -2.648 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -1.161 14.440 -3.256 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -1.937 14.621 -1.076 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -0.764 13.333 -0.884 1.00 0.00 H new ATOM 0 HE2 LYS A 18 0.892 14.841 0.000 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -0.034 16.251 -0.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -1.202 16.168 1.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -1.557 14.518 1.214 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -0.107 14.999 1.955 1.00 0.00 H new ATOM 280 N LEU A 19 -0.857 12.495 -5.165 1.00 0.00 N ATOM 281 CA LEU A 19 -1.123 12.502 -6.593 1.00 0.00 C ATOM 282 C LEU A 19 -1.004 13.922 -7.120 1.00 0.00 C ATOM 283 O LEU A 19 -0.879 14.865 -6.334 1.00 0.00 O ATOM 284 CB LEU A 19 -2.524 11.956 -6.919 1.00 0.00 C ATOM 285 CG LEU A 19 -2.762 10.468 -6.647 1.00 0.00 C ATOM 286 CD1 LEU A 19 -1.656 9.646 -7.263 1.00 0.00 C ATOM 287 CD2 LEU A 19 -2.887 10.176 -5.163 1.00 0.00 C ATOM 0 H LEU A 19 -1.650 12.782 -4.591 1.00 0.00 H new ATOM 0 HA LEU A 19 -0.390 11.853 -7.072 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -3.254 12.528 -6.346 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -2.727 12.146 -7.973 1.00 0.00 H new ATOM 0 HG LEU A 19 -3.710 10.192 -7.108 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -1.834 8.589 -7.064 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -1.634 9.814 -8.340 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -0.700 9.940 -6.831 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -3.055 9.109 -5.015 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -1.969 10.473 -4.655 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -3.727 10.736 -4.751 1.00 0.00 H new ATOM 299 N ASP A 20 -1.046 14.081 -8.433 1.00 0.00 N ATOM 300 CA ASP A 20 -1.025 15.410 -9.040 1.00 0.00 C ATOM 301 C ASP A 20 -2.285 16.177 -8.652 1.00 0.00 C ATOM 302 O ASP A 20 -2.295 17.407 -8.596 1.00 0.00 O ATOM 303 CB ASP A 20 -0.917 15.299 -10.564 1.00 0.00 C ATOM 304 CG ASP A 20 -0.809 16.650 -11.241 1.00 0.00 C ATOM 305 OD1 ASP A 20 0.242 17.307 -11.100 1.00 0.00 O ATOM 306 OD2 ASP A 20 -1.764 17.053 -11.934 1.00 0.00 O ATOM 0 H ASP A 20 -1.095 13.311 -9.101 1.00 0.00 H new ATOM 0 HA ASP A 20 -0.154 15.952 -8.672 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -0.044 14.698 -10.820 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -1.790 14.773 -10.949 1.00 0.00 H new ATOM 311 N ASP A 21 -3.339 15.428 -8.345 1.00 0.00 N ATOM 312 CA ASP A 21 -4.615 16.001 -7.921 1.00 0.00 C ATOM 313 C ASP A 21 -4.551 16.451 -6.461 1.00 0.00 C ATOM 314 O ASP A 21 -5.546 16.904 -5.899 1.00 0.00 O ATOM 315 CB ASP A 21 -5.740 14.975 -8.086 1.00 0.00 C ATOM 316 CG ASP A 21 -5.834 14.421 -9.494 1.00 0.00 C ATOM 317 OD1 ASP A 21 -5.045 13.512 -9.830 1.00 0.00 O ATOM 318 OD2 ASP A 21 -6.695 14.885 -10.271 1.00 0.00 O ATOM 0 H ASP A 21 -3.335 14.409 -8.382 1.00 0.00 H new ATOM 0 HA ASP A 21 -4.819 16.868 -8.550 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -5.580 14.153 -7.388 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -6.690 15.439 -7.820 1.00 0.00 H new ATOM 323 N GLY A 22 -3.376 16.315 -5.852 1.00 0.00 N ATOM 324 CA GLY A 22 -3.193 16.706 -4.465 1.00 0.00 C ATOM 325 C GLY A 22 -3.847 15.753 -3.482 1.00 0.00 C ATOM 326 O GLY A 22 -3.922 16.037 -2.288 1.00 0.00 O ATOM 0 H GLY A 22 -2.541 15.938 -6.299 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -2.126 16.764 -4.249 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -3.603 17.705 -4.319 1.00 0.00 H new ATOM 330 N THR A 23 -4.310 14.622 -3.984 1.00 0.00 N ATOM 331 CA THR A 23 -4.902 13.598 -3.140 1.00 0.00 C ATOM 332 C THR A 23 -3.804 12.745 -2.514 1.00 0.00 C ATOM 333 O THR A 23 -2.789 12.473 -3.151 1.00 0.00 O ATOM 334 CB THR A 23 -5.855 12.704 -3.960 1.00 0.00 C ATOM 335 OG1 THR A 23 -6.788 13.525 -4.675 1.00 0.00 O ATOM 336 CG2 THR A 23 -6.617 11.736 -3.062 1.00 0.00 C ATOM 0 H THR A 23 -4.287 14.388 -4.977 1.00 0.00 H new ATOM 0 HA THR A 23 -5.475 14.086 -2.351 1.00 0.00 H new ATOM 0 HB THR A 23 -5.255 12.122 -4.660 1.00 0.00 H new ATOM 0 HG1 THR A 23 -7.392 12.956 -5.197 1.00 0.00 H new ATOM 0 HG21 THR A 23 -7.280 11.120 -3.670 1.00 0.00 H new ATOM 0 HG22 THR A 23 -5.910 11.096 -2.534 1.00 0.00 H new ATOM 0 HG23 THR A 23 -7.207 12.299 -2.338 1.00 0.00 H new ATOM 344 N THR A 24 -3.992 12.349 -1.266 1.00 0.00 N ATOM 345 CA THR A 24 -3.018 11.521 -0.577 1.00 0.00 C ATOM 346 C THR A 24 -3.321 10.043 -0.807 1.00 0.00 C ATOM 347 O THR A 24 -4.341 9.530 -0.345 1.00 0.00 O ATOM 348 CB THR A 24 -3.008 11.812 0.939 1.00 0.00 C ATOM 349 OG1 THR A 24 -2.911 13.225 1.170 1.00 0.00 O ATOM 350 CG2 THR A 24 -1.841 11.113 1.617 1.00 0.00 C ATOM 0 H THR A 24 -4.812 12.589 -0.709 1.00 0.00 H new ATOM 0 HA THR A 24 -2.035 11.760 -0.984 1.00 0.00 H new ATOM 0 HB THR A 24 -3.940 11.434 1.360 1.00 0.00 H new ATOM 0 HG1 THR A 24 -2.907 13.399 2.134 1.00 0.00 H new ATOM 0 HG21 THR A 24 -1.855 11.333 2.684 1.00 0.00 H new ATOM 0 HG22 THR A 24 -1.925 10.037 1.467 1.00 0.00 H new ATOM 0 HG23 THR A 24 -0.905 11.467 1.186 1.00 0.00 H new ATOM 358 N ALA A 25 -2.439 9.366 -1.533 1.00 0.00 N ATOM 359 CA ALA A 25 -2.600 7.943 -1.795 1.00 0.00 C ATOM 360 C ALA A 25 -2.310 7.144 -0.536 1.00 0.00 C ATOM 361 O ALA A 25 -2.970 6.145 -0.250 1.00 0.00 O ATOM 362 CB ALA A 25 -1.687 7.490 -2.925 1.00 0.00 C ATOM 0 H ALA A 25 -1.606 9.780 -1.950 1.00 0.00 H new ATOM 0 HA ALA A 25 -3.632 7.767 -2.100 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -1.827 6.423 -3.100 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -1.930 8.042 -3.833 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -0.649 7.680 -2.652 1.00 0.00 H new ATOM 368 N GLU A 26 -1.313 7.594 0.215 1.00 0.00 N ATOM 369 CA GLU A 26 -0.947 6.947 1.455 1.00 0.00 C ATOM 370 C GLU A 26 -0.206 7.928 2.361 1.00 0.00 C ATOM 371 O GLU A 26 0.588 8.744 1.888 1.00 0.00 O ATOM 372 CB GLU A 26 -0.083 5.720 1.163 1.00 0.00 C ATOM 373 CG GLU A 26 0.214 4.888 2.393 1.00 0.00 C ATOM 374 CD GLU A 26 -1.046 4.436 3.105 1.00 0.00 C ATOM 375 OE1 GLU A 26 -1.612 5.230 3.884 1.00 0.00 O ATOM 376 OE2 GLU A 26 -1.478 3.288 2.882 1.00 0.00 O ATOM 0 H GLU A 26 -0.745 8.408 -0.020 1.00 0.00 H new ATOM 0 HA GLU A 26 -1.850 6.621 1.971 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -0.588 5.097 0.425 1.00 0.00 H new ATOM 0 HB3 GLU A 26 0.857 6.044 0.717 1.00 0.00 H new ATOM 0 HG2 GLU A 26 0.798 4.014 2.104 1.00 0.00 H new ATOM 0 HG3 GLU A 26 0.828 5.469 3.081 1.00 0.00 H new ATOM 383 N SER A 27 -0.482 7.857 3.654 1.00 0.00 N ATOM 384 CA SER A 27 0.137 8.752 4.619 1.00 0.00 C ATOM 385 C SER A 27 0.838 7.963 5.724 1.00 0.00 C ATOM 386 O SER A 27 0.222 7.160 6.419 1.00 0.00 O ATOM 387 CB SER A 27 -0.915 9.696 5.214 1.00 0.00 C ATOM 388 OG SER A 27 -2.018 8.978 5.743 1.00 0.00 O ATOM 0 H SER A 27 -1.134 7.186 4.060 1.00 0.00 H new ATOM 0 HA SER A 27 0.890 9.347 4.103 1.00 0.00 H new ATOM 0 HB2 SER A 27 -0.461 10.299 6.000 1.00 0.00 H new ATOM 0 HB3 SER A 27 -1.263 10.385 4.445 1.00 0.00 H new ATOM 0 HG SER A 27 -1.950 8.948 6.720 1.00 0.00 H new ATOM 394 N THR A 28 2.140 8.162 5.847 1.00 0.00 N ATOM 395 CA THR A 28 2.922 7.524 6.893 1.00 0.00 C ATOM 396 C THR A 28 3.959 8.513 7.476 1.00 0.00 C ATOM 397 O THR A 28 4.919 8.159 8.163 1.00 0.00 O ATOM 398 CB THR A 28 3.588 6.266 6.315 1.00 0.00 C ATOM 399 OG1 THR A 28 2.577 5.358 5.856 1.00 0.00 O ATOM 400 CG2 THR A 28 4.451 5.584 7.339 1.00 0.00 C ATOM 0 H THR A 28 2.682 8.766 5.229 1.00 0.00 H new ATOM 0 HA THR A 28 2.273 7.227 7.717 1.00 0.00 H new ATOM 0 HB THR A 28 4.224 6.568 5.483 1.00 0.00 H new ATOM 0 HG1 THR A 28 2.877 4.926 5.029 1.00 0.00 H new ATOM 0 HG21 THR A 28 4.907 4.698 6.898 1.00 0.00 H new ATOM 0 HG22 THR A 28 5.232 6.268 7.670 1.00 0.00 H new ATOM 0 HG23 THR A 28 3.840 5.291 8.193 1.00 0.00 H new ATOM 408 N ARG A 29 3.801 9.760 7.114 1.00 0.00 N ATOM 409 CA ARG A 29 4.514 10.842 7.776 1.00 0.00 C ATOM 410 C ARG A 29 3.570 11.593 8.706 1.00 0.00 C ATOM 411 O ARG A 29 3.842 11.730 9.895 1.00 0.00 O ATOM 412 CB ARG A 29 5.143 11.785 6.743 1.00 0.00 C ATOM 413 CG ARG A 29 5.951 12.932 7.343 1.00 0.00 C ATOM 414 CD ARG A 29 5.121 14.202 7.473 1.00 0.00 C ATOM 415 NE ARG A 29 4.625 14.661 6.176 1.00 0.00 N ATOM 416 CZ ARG A 29 3.577 15.467 6.017 1.00 0.00 C ATOM 417 NH1 ARG A 29 2.927 15.947 7.072 1.00 0.00 N ATOM 418 NH2 ARG A 29 3.183 15.804 4.795 1.00 0.00 N ATOM 0 H ARG A 29 3.183 10.061 6.361 1.00 0.00 H new ATOM 0 HA ARG A 29 5.322 10.421 8.374 1.00 0.00 H new ATOM 0 HB2 ARG A 29 5.792 11.204 6.087 1.00 0.00 H new ATOM 0 HB3 ARG A 29 4.351 12.202 6.120 1.00 0.00 H new ATOM 0 HG2 ARG A 29 6.324 12.639 8.325 1.00 0.00 H new ATOM 0 HG3 ARG A 29 6.822 13.129 6.717 1.00 0.00 H new ATOM 0 HD2 ARG A 29 4.279 14.019 8.140 1.00 0.00 H new ATOM 0 HD3 ARG A 29 5.725 14.986 7.929 1.00 0.00 H new ATOM 0 HE ARG A 29 5.114 14.343 5.339 1.00 0.00 H new ATOM 0 HH11 ARG A 29 3.230 15.699 8.014 1.00 0.00 H new ATOM 0 HH12 ARG A 29 2.125 16.564 6.940 1.00 0.00 H new ATOM 0 HH21 ARG A 29 3.683 15.446 3.981 1.00 0.00 H new ATOM 0 HH22 ARG A 29 2.381 16.421 4.670 1.00 0.00 H new ATOM 432 N ASN A 30 2.440 12.031 8.168 1.00 0.00 N ATOM 433 CA ASN A 30 1.456 12.788 8.943 1.00 0.00 C ATOM 434 C ASN A 30 0.548 11.861 9.753 1.00 0.00 C ATOM 435 O ASN A 30 -0.635 12.145 9.954 1.00 0.00 O ATOM 436 CB ASN A 30 0.618 13.672 8.007 1.00 0.00 C ATOM 437 CG ASN A 30 -0.097 12.875 6.932 1.00 0.00 C ATOM 438 OD1 ASN A 30 0.476 12.580 5.881 1.00 0.00 O ATOM 439 ND2 ASN A 30 -1.351 12.530 7.176 1.00 0.00 N ATOM 0 H ASN A 30 2.178 11.876 7.194 1.00 0.00 H new ATOM 0 HA ASN A 30 1.996 13.421 9.647 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -0.117 14.222 8.595 1.00 0.00 H new ATOM 0 HB3 ASN A 30 1.266 14.411 7.535 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -1.879 12.001 6.482 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -1.790 12.793 8.058 1.00 0.00 H new ATOM 446 N ASN A 31 1.111 10.761 10.237 1.00 0.00 N ATOM 447 CA ASN A 31 0.346 9.783 11.004 1.00 0.00 C ATOM 448 C ASN A 31 0.914 9.601 12.405 1.00 0.00 C ATOM 449 O ASN A 31 0.210 9.165 13.315 1.00 0.00 O ATOM 450 CB ASN A 31 0.324 8.426 10.291 1.00 0.00 C ATOM 451 CG ASN A 31 -0.723 8.346 9.200 1.00 0.00 C ATOM 452 OD1 ASN A 31 -1.024 9.331 8.524 1.00 0.00 O ATOM 453 ND2 ASN A 31 -1.293 7.169 9.024 1.00 0.00 N ATOM 0 H ASN A 31 2.095 10.523 10.113 1.00 0.00 H new ATOM 0 HA ASN A 31 -0.670 10.168 11.085 1.00 0.00 H new ATOM 0 HB2 ASN A 31 1.306 8.233 9.859 1.00 0.00 H new ATOM 0 HB3 ASN A 31 0.138 7.640 11.023 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -2.010 7.051 8.308 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -1.017 6.377 9.604 1.00 0.00 H new ATOM 460 N GLY A 32 2.192 9.922 12.577 1.00 0.00 N ATOM 461 CA GLY A 32 2.851 9.665 13.846 1.00 0.00 C ATOM 462 C GLY A 32 3.370 8.245 13.907 1.00 0.00 C ATOM 463 O GLY A 32 4.154 7.882 14.785 1.00 0.00 O ATOM 0 H GLY A 32 2.781 10.353 11.865 1.00 0.00 H new ATOM 0 HA2 GLY A 32 3.676 10.364 13.980 1.00 0.00 H new ATOM 0 HA3 GLY A 32 2.152 9.836 14.665 1.00 0.00 H new ATOM 467 N LYS A 33 2.935 7.452 12.944 1.00 0.00 N ATOM 468 CA LYS A 33 3.290 6.051 12.864 1.00 0.00 C ATOM 469 C LYS A 33 4.005 5.767 11.547 1.00 0.00 C ATOM 470 O LYS A 33 3.445 5.983 10.473 1.00 0.00 O ATOM 471 CB LYS A 33 2.021 5.197 12.979 1.00 0.00 C ATOM 472 CG LYS A 33 2.245 3.712 12.757 1.00 0.00 C ATOM 473 CD LYS A 33 3.090 3.096 13.858 1.00 0.00 C ATOM 474 CE LYS A 33 3.379 1.629 13.586 1.00 0.00 C ATOM 475 NZ LYS A 33 4.236 1.025 14.640 1.00 0.00 N ATOM 0 H LYS A 33 2.322 7.766 12.192 1.00 0.00 H new ATOM 0 HA LYS A 33 3.964 5.800 13.683 1.00 0.00 H new ATOM 0 HB2 LYS A 33 1.587 5.343 13.968 1.00 0.00 H new ATOM 0 HB3 LYS A 33 1.290 5.555 12.254 1.00 0.00 H new ATOM 0 HG2 LYS A 33 1.282 3.203 12.710 1.00 0.00 H new ATOM 0 HG3 LYS A 33 2.734 3.558 11.795 1.00 0.00 H new ATOM 0 HD2 LYS A 33 4.029 3.642 13.946 1.00 0.00 H new ATOM 0 HD3 LYS A 33 2.573 3.195 14.813 1.00 0.00 H new ATOM 0 HE2 LYS A 33 2.439 1.080 13.524 1.00 0.00 H new ATOM 0 HE3 LYS A 33 3.871 1.530 12.618 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 4.409 0.024 14.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 5.143 1.532 14.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 3.756 1.096 15.560 1.00 0.00 H new ATOM 489 N PRO A 34 5.267 5.319 11.605 1.00 0.00 N ATOM 490 CA PRO A 34 6.003 4.897 10.421 1.00 0.00 C ATOM 491 C PRO A 34 5.626 3.487 10.004 1.00 0.00 C ATOM 492 O PRO A 34 4.934 2.771 10.730 1.00 0.00 O ATOM 493 CB PRO A 34 7.449 4.949 10.877 1.00 0.00 C ATOM 494 CG PRO A 34 7.373 4.575 12.307 1.00 0.00 C ATOM 495 CD PRO A 34 6.096 5.196 12.821 1.00 0.00 C ATOM 0 HA PRO A 34 5.797 5.523 9.553 1.00 0.00 H new ATOM 0 HB2 PRO A 34 8.073 4.256 10.313 1.00 0.00 H new ATOM 0 HB3 PRO A 34 7.876 5.943 10.744 1.00 0.00 H new ATOM 0 HG2 PRO A 34 7.359 3.492 12.429 1.00 0.00 H new ATOM 0 HG3 PRO A 34 8.238 4.946 12.856 1.00 0.00 H new ATOM 0 HD2 PRO A 34 5.617 4.568 13.573 1.00 0.00 H new ATOM 0 HD3 PRO A 34 6.278 6.166 13.284 1.00 0.00 H new ATOM 503 N ALA A 35 6.095 3.093 8.845 1.00 0.00 N ATOM 504 CA ALA A 35 5.739 1.808 8.277 1.00 0.00 C ATOM 505 C ALA A 35 6.959 1.134 7.687 1.00 0.00 C ATOM 506 O ALA A 35 7.913 1.801 7.289 1.00 0.00 O ATOM 507 CB ALA A 35 4.662 1.980 7.214 1.00 0.00 C ATOM 0 H ALA A 35 6.730 3.647 8.270 1.00 0.00 H new ATOM 0 HA ALA A 35 5.345 1.175 9.072 1.00 0.00 H new ATOM 0 HB1 ALA A 35 4.405 1.007 6.796 1.00 0.00 H new ATOM 0 HB2 ALA A 35 3.776 2.428 7.663 1.00 0.00 H new ATOM 0 HB3 ALA A 35 5.034 2.629 6.421 1.00 0.00 H new ATOM 513 N LEU A 36 6.939 -0.183 7.659 1.00 0.00 N ATOM 514 CA LEU A 36 7.996 -0.940 7.025 1.00 0.00 C ATOM 515 C LEU A 36 7.641 -1.181 5.572 1.00 0.00 C ATOM 516 O LEU A 36 6.493 -1.488 5.254 1.00 0.00 O ATOM 517 CB LEU A 36 8.198 -2.283 7.725 1.00 0.00 C ATOM 518 CG LEU A 36 9.311 -3.148 7.138 1.00 0.00 C ATOM 519 CD1 LEU A 36 10.572 -3.042 7.984 1.00 0.00 C ATOM 520 CD2 LEU A 36 8.850 -4.590 7.012 1.00 0.00 C ATOM 0 H LEU A 36 6.199 -0.752 8.070 1.00 0.00 H new ATOM 0 HA LEU A 36 8.921 -0.368 7.095 1.00 0.00 H new ATOM 0 HB2 LEU A 36 8.416 -2.100 8.777 1.00 0.00 H new ATOM 0 HB3 LEU A 36 7.263 -2.842 7.686 1.00 0.00 H new ATOM 0 HG LEU A 36 9.549 -2.783 6.139 1.00 0.00 H new ATOM 0 HD11 LEU A 36 11.354 -3.665 7.551 1.00 0.00 H new ATOM 0 HD12 LEU A 36 10.907 -2.005 8.010 1.00 0.00 H new ATOM 0 HD13 LEU A 36 10.359 -3.380 8.998 1.00 0.00 H new ATOM 0 HD21 LEU A 36 9.654 -5.194 6.592 1.00 0.00 H new ATOM 0 HD22 LEU A 36 8.584 -4.974 7.997 1.00 0.00 H new ATOM 0 HD23 LEU A 36 7.980 -4.638 6.357 1.00 0.00 H new ATOM 532 N PHE A 37 8.615 -1.045 4.696 1.00 0.00 N ATOM 533 CA PHE A 37 8.419 -1.342 3.294 1.00 0.00 C ATOM 534 C PHE A 37 9.070 -2.674 2.985 1.00 0.00 C ATOM 535 O PHE A 37 10.296 -2.776 2.948 1.00 0.00 O ATOM 536 CB PHE A 37 9.041 -0.249 2.416 1.00 0.00 C ATOM 537 CG PHE A 37 8.102 0.863 2.037 1.00 0.00 C ATOM 538 CD1 PHE A 37 6.864 0.996 2.646 1.00 0.00 C ATOM 539 CD2 PHE A 37 8.464 1.775 1.056 1.00 0.00 C ATOM 540 CE1 PHE A 37 6.007 2.013 2.282 1.00 0.00 C ATOM 541 CE2 PHE A 37 7.610 2.795 0.691 1.00 0.00 C ATOM 542 CZ PHE A 37 6.380 2.915 1.304 1.00 0.00 C ATOM 0 H PHE A 37 9.555 -0.729 4.933 1.00 0.00 H new ATOM 0 HA PHE A 37 7.351 -1.384 3.082 1.00 0.00 H new ATOM 0 HB2 PHE A 37 9.895 0.178 2.942 1.00 0.00 H new ATOM 0 HB3 PHE A 37 9.425 -0.708 1.505 1.00 0.00 H new ATOM 0 HD1 PHE A 37 6.568 0.296 3.413 1.00 0.00 H new ATOM 0 HD2 PHE A 37 9.426 1.685 0.573 1.00 0.00 H new ATOM 0 HE1 PHE A 37 5.044 2.105 2.762 1.00 0.00 H new ATOM 0 HE2 PHE A 37 7.904 3.499 -0.074 1.00 0.00 H new ATOM 0 HZ PHE A 37 5.710 3.713 1.020 1.00 0.00 H new ATOM 552 N ARG A 38 8.261 -3.702 2.788 1.00 0.00 N ATOM 553 CA ARG A 38 8.802 -5.013 2.493 1.00 0.00 C ATOM 554 C ARG A 38 9.041 -5.128 0.991 1.00 0.00 C ATOM 555 O ARG A 38 8.100 -5.266 0.201 1.00 0.00 O ATOM 556 CB ARG A 38 7.852 -6.111 2.976 1.00 0.00 C ATOM 557 CG ARG A 38 8.559 -7.415 3.298 1.00 0.00 C ATOM 558 CD ARG A 38 9.302 -7.333 4.624 1.00 0.00 C ATOM 559 NE ARG A 38 8.440 -7.643 5.764 1.00 0.00 N ATOM 560 CZ ARG A 38 8.891 -8.056 6.953 1.00 0.00 C ATOM 561 NH1 ARG A 38 10.193 -8.210 7.166 1.00 0.00 N ATOM 562 NH2 ARG A 38 8.032 -8.312 7.932 1.00 0.00 N ATOM 0 H ARG A 38 7.243 -3.654 2.827 1.00 0.00 H new ATOM 0 HA ARG A 38 9.748 -5.140 3.019 1.00 0.00 H new ATOM 0 HB2 ARG A 38 7.325 -5.762 3.864 1.00 0.00 H new ATOM 0 HB3 ARG A 38 7.099 -6.293 2.210 1.00 0.00 H new ATOM 0 HG2 ARG A 38 7.831 -8.225 3.337 1.00 0.00 H new ATOM 0 HG3 ARG A 38 9.261 -7.656 2.500 1.00 0.00 H new ATOM 0 HD2 ARG A 38 10.144 -8.025 4.609 1.00 0.00 H new ATOM 0 HD3 ARG A 38 9.715 -6.331 4.745 1.00 0.00 H new ATOM 0 HE ARG A 38 7.432 -7.538 5.645 1.00 0.00 H new ATOM 0 HH11 ARG A 38 10.859 -8.013 6.419 1.00 0.00 H new ATOM 0 HH12 ARG A 38 10.527 -8.526 8.077 1.00 0.00 H new ATOM 0 HH21 ARG A 38 7.031 -8.194 7.776 1.00 0.00 H new ATOM 0 HH22 ARG A 38 8.373 -8.627 8.840 1.00 0.00 H new ATOM 576 N LEU A 39 10.306 -5.061 0.612 1.00 0.00 N ATOM 577 CA LEU A 39 10.695 -5.063 -0.789 1.00 0.00 C ATOM 578 C LEU A 39 10.936 -6.472 -1.302 1.00 0.00 C ATOM 579 O LEU A 39 11.217 -7.390 -0.531 1.00 0.00 O ATOM 580 CB LEU A 39 11.942 -4.213 -0.980 1.00 0.00 C ATOM 581 CG LEU A 39 11.855 -2.819 -0.364 1.00 0.00 C ATOM 582 CD1 LEU A 39 13.182 -2.105 -0.499 1.00 0.00 C ATOM 583 CD2 LEU A 39 10.740 -2.004 -1.003 1.00 0.00 C ATOM 0 H LEU A 39 11.089 -5.004 1.263 1.00 0.00 H new ATOM 0 HA LEU A 39 9.874 -4.638 -1.367 1.00 0.00 H new ATOM 0 HB2 LEU A 39 12.794 -4.736 -0.546 1.00 0.00 H new ATOM 0 HB3 LEU A 39 12.139 -4.114 -2.047 1.00 0.00 H new ATOM 0 HG LEU A 39 11.621 -2.928 0.695 1.00 0.00 H new ATOM 0 HD11 LEU A 39 13.108 -1.112 -0.056 1.00 0.00 H new ATOM 0 HD12 LEU A 39 13.956 -2.675 0.016 1.00 0.00 H new ATOM 0 HD13 LEU A 39 13.440 -2.013 -1.554 1.00 0.00 H new ATOM 0 HD21 LEU A 39 10.702 -1.016 -0.544 1.00 0.00 H new ATOM 0 HD22 LEU A 39 10.931 -1.901 -2.071 1.00 0.00 H new ATOM 0 HD23 LEU A 39 9.787 -2.511 -0.852 1.00 0.00 H new ATOM 595 N GLY A 40 10.812 -6.627 -2.608 1.00 0.00 N ATOM 596 CA GLY A 40 10.968 -7.924 -3.237 1.00 0.00 C ATOM 597 C GLY A 40 9.634 -8.543 -3.599 1.00 0.00 C ATOM 598 O GLY A 40 9.452 -9.757 -3.475 1.00 0.00 O ATOM 0 H GLY A 40 10.603 -5.867 -3.255 1.00 0.00 H new ATOM 0 HA2 GLY A 40 11.575 -7.820 -4.136 1.00 0.00 H new ATOM 0 HA3 GLY A 40 11.506 -8.591 -2.564 1.00 0.00 H new ATOM 602 N ASP A 41 8.704 -7.690 -4.048 1.00 0.00 N ATOM 603 CA ASP A 41 7.351 -8.103 -4.454 1.00 0.00 C ATOM 604 C ASP A 41 6.537 -8.637 -3.270 1.00 0.00 C ATOM 605 O ASP A 41 5.373 -9.010 -3.411 1.00 0.00 O ATOM 606 CB ASP A 41 7.431 -9.136 -5.588 1.00 0.00 C ATOM 607 CG ASP A 41 6.075 -9.610 -6.078 1.00 0.00 C ATOM 608 OD1 ASP A 41 5.391 -8.848 -6.792 1.00 0.00 O ATOM 609 OD2 ASP A 41 5.697 -10.756 -5.765 1.00 0.00 O ATOM 0 H ASP A 41 8.869 -6.688 -4.141 1.00 0.00 H new ATOM 0 HA ASP A 41 6.827 -7.222 -4.823 1.00 0.00 H new ATOM 0 HB2 ASP A 41 7.979 -8.702 -6.425 1.00 0.00 H new ATOM 0 HB3 ASP A 41 8.004 -9.997 -5.244 1.00 0.00 H new ATOM 614 N ALA A 42 7.145 -8.638 -2.095 1.00 0.00 N ATOM 615 CA ALA A 42 6.488 -9.122 -0.893 1.00 0.00 C ATOM 616 C ALA A 42 5.312 -8.227 -0.522 1.00 0.00 C ATOM 617 O ALA A 42 4.212 -8.707 -0.254 1.00 0.00 O ATOM 618 CB ALA A 42 7.485 -9.191 0.248 1.00 0.00 C ATOM 0 H ALA A 42 8.098 -8.307 -1.948 1.00 0.00 H new ATOM 0 HA ALA A 42 6.102 -10.123 -1.086 1.00 0.00 H new ATOM 0 HB1 ALA A 42 6.986 -9.555 1.146 1.00 0.00 H new ATOM 0 HB2 ALA A 42 8.295 -9.870 -0.017 1.00 0.00 H new ATOM 0 HB3 ALA A 42 7.892 -8.197 0.436 1.00 0.00 H new ATOM 624 N SER A 43 5.553 -6.924 -0.510 1.00 0.00 N ATOM 625 CA SER A 43 4.503 -5.961 -0.211 1.00 0.00 C ATOM 626 C SER A 43 4.531 -4.804 -1.204 1.00 0.00 C ATOM 627 O SER A 43 3.486 -4.321 -1.636 1.00 0.00 O ATOM 628 CB SER A 43 4.660 -5.430 1.216 1.00 0.00 C ATOM 629 OG SER A 43 4.694 -6.493 2.156 1.00 0.00 O ATOM 0 H SER A 43 6.465 -6.510 -0.703 1.00 0.00 H new ATOM 0 HA SER A 43 3.542 -6.468 -0.297 1.00 0.00 H new ATOM 0 HB2 SER A 43 5.577 -4.845 1.291 1.00 0.00 H new ATOM 0 HB3 SER A 43 3.834 -4.759 1.451 1.00 0.00 H new ATOM 0 HG SER A 43 4.796 -6.128 3.060 1.00 0.00 H new ATOM 635 N LEU A 44 5.728 -4.361 -1.559 1.00 0.00 N ATOM 636 CA LEU A 44 5.883 -3.243 -2.482 1.00 0.00 C ATOM 637 C LEU A 44 5.922 -3.723 -3.926 1.00 0.00 C ATOM 638 O LEU A 44 6.136 -4.907 -4.197 1.00 0.00 O ATOM 639 CB LEU A 44 7.153 -2.448 -2.158 1.00 0.00 C ATOM 640 CG LEU A 44 7.006 -1.379 -1.066 1.00 0.00 C ATOM 641 CD1 LEU A 44 6.008 -0.312 -1.490 1.00 0.00 C ATOM 642 CD2 LEU A 44 6.584 -2.000 0.256 1.00 0.00 C ATOM 0 H LEU A 44 6.606 -4.757 -1.223 1.00 0.00 H new ATOM 0 HA LEU A 44 5.018 -2.591 -2.361 1.00 0.00 H new ATOM 0 HB2 LEU A 44 7.931 -3.148 -1.853 1.00 0.00 H new ATOM 0 HB3 LEU A 44 7.500 -1.964 -3.071 1.00 0.00 H new ATOM 0 HG LEU A 44 7.980 -0.910 -0.926 1.00 0.00 H new ATOM 0 HD11 LEU A 44 5.918 0.436 -0.702 1.00 0.00 H new ATOM 0 HD12 LEU A 44 6.354 0.166 -2.407 1.00 0.00 H new ATOM 0 HD13 LEU A 44 5.036 -0.772 -1.665 1.00 0.00 H new ATOM 0 HD21 LEU A 44 6.488 -1.219 1.010 1.00 0.00 H new ATOM 0 HD22 LEU A 44 5.626 -2.504 0.132 1.00 0.00 H new ATOM 0 HD23 LEU A 44 7.335 -2.722 0.575 1.00 0.00 H new ATOM 654 N SER A 45 5.702 -2.790 -4.840 1.00 0.00 N ATOM 655 CA SER A 45 5.684 -3.088 -6.260 1.00 0.00 C ATOM 656 C SER A 45 7.093 -3.013 -6.831 1.00 0.00 C ATOM 657 O SER A 45 7.934 -2.290 -6.285 1.00 0.00 O ATOM 658 CB SER A 45 4.763 -2.101 -6.980 1.00 0.00 C ATOM 659 OG SER A 45 4.631 -2.410 -8.357 1.00 0.00 O ATOM 0 H SER A 45 5.532 -1.809 -4.617 1.00 0.00 H new ATOM 0 HA SER A 45 5.306 -4.099 -6.409 1.00 0.00 H new ATOM 0 HB2 SER A 45 3.780 -2.112 -6.509 1.00 0.00 H new ATOM 0 HB3 SER A 45 5.157 -1.091 -6.871 1.00 0.00 H new ATOM 0 HG SER A 45 3.904 -1.878 -8.743 1.00 0.00 H new ATOM 665 N GLU A 46 7.348 -3.743 -7.911 1.00 0.00 N ATOM 666 CA GLU A 46 8.695 -3.856 -8.470 1.00 0.00 C ATOM 667 C GLU A 46 9.336 -2.490 -8.721 1.00 0.00 C ATOM 668 O GLU A 46 10.503 -2.275 -8.393 1.00 0.00 O ATOM 669 CB GLU A 46 8.675 -4.661 -9.769 1.00 0.00 C ATOM 670 CG GLU A 46 8.286 -6.121 -9.587 1.00 0.00 C ATOM 671 CD GLU A 46 8.537 -6.947 -10.831 1.00 0.00 C ATOM 672 OE1 GLU A 46 7.765 -6.819 -11.803 1.00 0.00 O ATOM 673 OE2 GLU A 46 9.521 -7.722 -10.853 1.00 0.00 O ATOM 0 H GLU A 46 6.638 -4.269 -8.421 1.00 0.00 H new ATOM 0 HA GLU A 46 9.300 -4.377 -7.728 1.00 0.00 H new ATOM 0 HB2 GLU A 46 7.977 -4.194 -10.463 1.00 0.00 H new ATOM 0 HB3 GLU A 46 9.662 -4.613 -10.229 1.00 0.00 H new ATOM 0 HG2 GLU A 46 8.850 -6.543 -8.755 1.00 0.00 H new ATOM 0 HG3 GLU A 46 7.231 -6.182 -9.321 1.00 0.00 H new ATOM 680 N GLY A 47 8.568 -1.557 -9.263 1.00 0.00 N ATOM 681 CA GLY A 47 9.126 -0.276 -9.638 1.00 0.00 C ATOM 682 C GLY A 47 9.620 0.520 -8.447 1.00 0.00 C ATOM 683 O GLY A 47 10.655 1.183 -8.520 1.00 0.00 O ATOM 0 H GLY A 47 7.571 -1.664 -9.449 1.00 0.00 H new ATOM 0 HA2 GLY A 47 9.952 -0.434 -10.332 1.00 0.00 H new ATOM 0 HA3 GLY A 47 8.370 0.303 -10.168 1.00 0.00 H new ATOM 687 N LEU A 48 8.894 0.442 -7.338 1.00 0.00 N ATOM 688 CA LEU A 48 9.233 1.214 -6.151 1.00 0.00 C ATOM 689 C LEU A 48 10.512 0.673 -5.522 1.00 0.00 C ATOM 690 O LEU A 48 11.477 1.408 -5.316 1.00 0.00 O ATOM 691 CB LEU A 48 8.052 1.161 -5.158 1.00 0.00 C ATOM 692 CG LEU A 48 8.171 2.011 -3.881 1.00 0.00 C ATOM 693 CD1 LEU A 48 9.065 1.344 -2.853 1.00 0.00 C ATOM 694 CD2 LEU A 48 8.706 3.390 -4.209 1.00 0.00 C ATOM 0 H LEU A 48 8.068 -0.148 -7.237 1.00 0.00 H new ATOM 0 HA LEU A 48 9.413 2.254 -6.423 1.00 0.00 H new ATOM 0 HB2 LEU A 48 7.151 1.470 -5.687 1.00 0.00 H new ATOM 0 HB3 LEU A 48 7.906 0.122 -4.861 1.00 0.00 H new ATOM 0 HG LEU A 48 7.172 2.106 -3.455 1.00 0.00 H new ATOM 0 HD11 LEU A 48 9.127 1.971 -1.964 1.00 0.00 H new ATOM 0 HD12 LEU A 48 8.649 0.373 -2.584 1.00 0.00 H new ATOM 0 HD13 LEU A 48 10.062 1.208 -3.272 1.00 0.00 H new ATOM 0 HD21 LEU A 48 8.784 3.977 -3.294 1.00 0.00 H new ATOM 0 HD22 LEU A 48 9.691 3.299 -4.666 1.00 0.00 H new ATOM 0 HD23 LEU A 48 8.029 3.887 -4.903 1.00 0.00 H new ATOM 706 N GLU A 49 10.516 -0.623 -5.253 1.00 0.00 N ATOM 707 CA GLU A 49 11.650 -1.281 -4.608 1.00 0.00 C ATOM 708 C GLU A 49 12.941 -1.113 -5.405 1.00 0.00 C ATOM 709 O GLU A 49 13.996 -0.845 -4.834 1.00 0.00 O ATOM 710 CB GLU A 49 11.358 -2.769 -4.406 1.00 0.00 C ATOM 711 CG GLU A 49 11.030 -3.501 -5.691 1.00 0.00 C ATOM 712 CD GLU A 49 10.875 -4.988 -5.495 1.00 0.00 C ATOM 713 OE1 GLU A 49 9.909 -5.402 -4.828 1.00 0.00 O ATOM 714 OE2 GLU A 49 11.718 -5.752 -6.016 1.00 0.00 O ATOM 0 H GLU A 49 9.741 -1.248 -5.472 1.00 0.00 H new ATOM 0 HA GLU A 49 11.791 -0.801 -3.640 1.00 0.00 H new ATOM 0 HB2 GLU A 49 12.223 -3.241 -3.939 1.00 0.00 H new ATOM 0 HB3 GLU A 49 10.524 -2.876 -3.713 1.00 0.00 H new ATOM 0 HG2 GLU A 49 10.108 -3.096 -6.109 1.00 0.00 H new ATOM 0 HG3 GLU A 49 11.819 -3.316 -6.420 1.00 0.00 H new ATOM 721 N GLN A 50 12.844 -1.224 -6.722 1.00 0.00 N ATOM 722 CA GLN A 50 14.022 -1.233 -7.572 1.00 0.00 C ATOM 723 C GLN A 50 14.635 0.158 -7.685 1.00 0.00 C ATOM 724 O GLN A 50 15.782 0.309 -8.103 1.00 0.00 O ATOM 725 CB GLN A 50 13.671 -1.784 -8.954 1.00 0.00 C ATOM 726 CG GLN A 50 13.299 -3.259 -8.931 1.00 0.00 C ATOM 727 CD GLN A 50 14.440 -4.142 -8.470 1.00 0.00 C ATOM 728 OE1 GLN A 50 15.605 -3.866 -8.750 1.00 0.00 O ATOM 729 NE2 GLN A 50 14.115 -5.192 -7.731 1.00 0.00 N ATOM 0 H GLN A 50 11.960 -1.309 -7.224 1.00 0.00 H new ATOM 0 HA GLN A 50 14.766 -1.884 -7.114 1.00 0.00 H new ATOM 0 HB2 GLN A 50 12.840 -1.212 -9.366 1.00 0.00 H new ATOM 0 HB3 GLN A 50 14.520 -1.640 -9.622 1.00 0.00 H new ATOM 0 HG2 GLN A 50 12.444 -3.404 -8.271 1.00 0.00 H new ATOM 0 HG3 GLN A 50 12.987 -3.567 -9.929 1.00 0.00 H new ATOM 0 HE21 GLN A 50 13.135 -5.385 -7.522 1.00 0.00 H new ATOM 0 HE22 GLN A 50 14.844 -5.808 -7.371 1.00 0.00 H new ATOM 738 N HIS A 51 13.878 1.169 -7.290 1.00 0.00 N ATOM 739 CA HIS A 51 14.366 2.538 -7.338 1.00 0.00 C ATOM 740 C HIS A 51 14.658 3.048 -5.934 1.00 0.00 C ATOM 741 O HIS A 51 15.251 4.110 -5.758 1.00 0.00 O ATOM 742 CB HIS A 51 13.355 3.451 -8.042 1.00 0.00 C ATOM 743 CG HIS A 51 13.209 3.166 -9.508 1.00 0.00 C ATOM 744 ND1 HIS A 51 13.301 4.138 -10.479 1.00 0.00 N ATOM 745 CD2 HIS A 51 12.960 2.008 -10.167 1.00 0.00 C ATOM 746 CE1 HIS A 51 13.112 3.592 -11.667 1.00 0.00 C ATOM 747 NE2 HIS A 51 12.904 2.302 -11.503 1.00 0.00 N ATOM 0 H HIS A 51 12.927 1.069 -6.934 1.00 0.00 H new ATOM 0 HA HIS A 51 15.293 2.551 -7.911 1.00 0.00 H new ATOM 0 HB2 HIS A 51 12.383 3.343 -7.561 1.00 0.00 H new ATOM 0 HB3 HIS A 51 13.662 4.489 -7.911 1.00 0.00 H new ATOM 0 HD2 HIS A 51 12.830 1.033 -9.721 1.00 0.00 H new ATOM 0 HE1 HIS A 51 13.126 4.115 -12.612 1.00 0.00 H new ATOM 0 HE2 HIS A 51 12.729 1.630 -12.251 1.00 0.00 H new ATOM 756 N LEU A 52 14.251 2.276 -4.935 1.00 0.00 N ATOM 757 CA LEU A 52 14.483 2.643 -3.546 1.00 0.00 C ATOM 758 C LEU A 52 15.707 1.911 -3.003 1.00 0.00 C ATOM 759 O LEU A 52 16.409 2.421 -2.132 1.00 0.00 O ATOM 760 CB LEU A 52 13.255 2.312 -2.690 1.00 0.00 C ATOM 761 CG LEU A 52 12.792 3.419 -1.734 1.00 0.00 C ATOM 762 CD1 LEU A 52 11.627 2.925 -0.898 1.00 0.00 C ATOM 763 CD2 LEU A 52 13.927 3.888 -0.834 1.00 0.00 C ATOM 0 H LEU A 52 13.759 1.392 -5.062 1.00 0.00 H new ATOM 0 HA LEU A 52 14.662 3.717 -3.500 1.00 0.00 H new ATOM 0 HB2 LEU A 52 12.428 2.062 -3.355 1.00 0.00 H new ATOM 0 HB3 LEU A 52 13.473 1.419 -2.104 1.00 0.00 H new ATOM 0 HG LEU A 52 12.470 4.271 -2.333 1.00 0.00 H new ATOM 0 HD11 LEU A 52 11.303 3.716 -0.221 1.00 0.00 H new ATOM 0 HD12 LEU A 52 10.801 2.647 -1.553 1.00 0.00 H new ATOM 0 HD13 LEU A 52 11.938 2.056 -0.318 1.00 0.00 H new ATOM 0 HD21 LEU A 52 13.564 4.672 -0.170 1.00 0.00 H new ATOM 0 HD22 LEU A 52 14.291 3.049 -0.241 1.00 0.00 H new ATOM 0 HD23 LEU A 52 14.739 4.279 -1.447 1.00 0.00 H new ATOM 775 N LEU A 53 15.963 0.711 -3.520 1.00 0.00 N ATOM 776 CA LEU A 53 17.110 -0.062 -3.077 1.00 0.00 C ATOM 777 C LEU A 53 18.399 0.640 -3.497 1.00 0.00 C ATOM 778 O LEU A 53 18.425 1.356 -4.502 1.00 0.00 O ATOM 779 CB LEU A 53 17.048 -1.497 -3.621 1.00 0.00 C ATOM 780 CG LEU A 53 17.283 -1.666 -5.120 1.00 0.00 C ATOM 781 CD1 LEU A 53 18.736 -2.001 -5.408 1.00 0.00 C ATOM 782 CD2 LEU A 53 16.380 -2.755 -5.650 1.00 0.00 C ATOM 0 H LEU A 53 15.396 0.261 -4.238 1.00 0.00 H new ATOM 0 HA LEU A 53 17.093 -0.129 -1.989 1.00 0.00 H new ATOM 0 HB2 LEU A 53 17.788 -2.096 -3.090 1.00 0.00 H new ATOM 0 HB3 LEU A 53 16.069 -1.912 -3.380 1.00 0.00 H new ATOM 0 HG LEU A 53 17.051 -0.726 -5.620 1.00 0.00 H new ATOM 0 HD11 LEU A 53 18.877 -2.116 -6.483 1.00 0.00 H new ATOM 0 HD12 LEU A 53 19.374 -1.196 -5.043 1.00 0.00 H new ATOM 0 HD13 LEU A 53 19.001 -2.931 -4.906 1.00 0.00 H new ATOM 0 HD21 LEU A 53 16.547 -2.877 -6.720 1.00 0.00 H new ATOM 0 HD22 LEU A 53 16.602 -3.692 -5.139 1.00 0.00 H new ATOM 0 HD23 LEU A 53 15.339 -2.483 -5.473 1.00 0.00 H new ATOM 794 N GLY A 54 19.461 0.427 -2.739 1.00 0.00 N ATOM 795 CA GLY A 54 20.702 1.125 -2.988 1.00 0.00 C ATOM 796 C GLY A 54 20.836 2.398 -2.171 1.00 0.00 C ATOM 797 O GLY A 54 21.816 3.131 -2.322 1.00 0.00 O ATOM 0 H GLY A 54 19.485 -0.221 -1.951 1.00 0.00 H new ATOM 0 HA2 GLY A 54 21.538 0.463 -2.760 1.00 0.00 H new ATOM 0 HA3 GLY A 54 20.769 1.370 -4.048 1.00 0.00 H new ATOM 801 N LEU A 55 19.863 2.675 -1.303 1.00 0.00 N ATOM 802 CA LEU A 55 19.923 3.848 -0.438 1.00 0.00 C ATOM 803 C LEU A 55 20.480 3.479 0.933 1.00 0.00 C ATOM 804 O LEU A 55 20.554 2.302 1.294 1.00 0.00 O ATOM 805 CB LEU A 55 18.532 4.476 -0.276 1.00 0.00 C ATOM 806 CG LEU A 55 18.195 5.632 -1.230 1.00 0.00 C ATOM 807 CD1 LEU A 55 19.114 6.822 -0.979 1.00 0.00 C ATOM 808 CD2 LEU A 55 18.283 5.185 -2.684 1.00 0.00 C ATOM 0 H LEU A 55 19.027 2.103 -1.182 1.00 0.00 H new ATOM 0 HA LEU A 55 20.587 4.574 -0.907 1.00 0.00 H new ATOM 0 HB2 LEU A 55 17.785 3.693 -0.409 1.00 0.00 H new ATOM 0 HB3 LEU A 55 18.436 4.838 0.748 1.00 0.00 H new ATOM 0 HG LEU A 55 17.168 5.941 -1.033 1.00 0.00 H new ATOM 0 HD11 LEU A 55 18.859 7.630 -1.665 1.00 0.00 H new ATOM 0 HD12 LEU A 55 18.992 7.166 0.048 1.00 0.00 H new ATOM 0 HD13 LEU A 55 20.150 6.522 -1.141 1.00 0.00 H new ATOM 0 HD21 LEU A 55 18.040 6.023 -3.338 1.00 0.00 H new ATOM 0 HD22 LEU A 55 19.295 4.840 -2.898 1.00 0.00 H new ATOM 0 HD23 LEU A 55 17.578 4.372 -2.858 1.00 0.00 H new ATOM 820 N LYS A 56 20.863 4.493 1.693 1.00 0.00 N ATOM 821 CA LYS A 56 21.454 4.301 3.007 1.00 0.00 C ATOM 822 C LYS A 56 20.548 4.942 4.060 1.00 0.00 C ATOM 823 O LYS A 56 19.816 5.881 3.760 1.00 0.00 O ATOM 824 CB LYS A 56 22.855 4.939 3.007 1.00 0.00 C ATOM 825 CG LYS A 56 23.850 4.309 3.973 1.00 0.00 C ATOM 826 CD LYS A 56 23.637 4.765 5.404 1.00 0.00 C ATOM 827 CE LYS A 56 24.665 4.151 6.337 1.00 0.00 C ATOM 828 NZ LYS A 56 24.484 4.585 7.744 1.00 0.00 N ATOM 0 H LYS A 56 20.773 5.471 1.416 1.00 0.00 H new ATOM 0 HA LYS A 56 21.551 3.241 3.244 1.00 0.00 H new ATOM 0 HB2 LYS A 56 23.264 4.881 1.998 1.00 0.00 H new ATOM 0 HB3 LYS A 56 22.756 5.997 3.250 1.00 0.00 H new ATOM 0 HG2 LYS A 56 23.762 3.224 3.924 1.00 0.00 H new ATOM 0 HG3 LYS A 56 24.864 4.561 3.662 1.00 0.00 H new ATOM 0 HD2 LYS A 56 23.700 5.852 5.455 1.00 0.00 H new ATOM 0 HD3 LYS A 56 22.635 4.488 5.731 1.00 0.00 H new ATOM 0 HE2 LYS A 56 24.597 3.064 6.283 1.00 0.00 H new ATOM 0 HE3 LYS A 56 25.665 4.425 6.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 25.209 4.139 8.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 24.575 5.619 7.803 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 23.540 4.301 8.076 1.00 0.00 H new ATOM 842 N VAL A 57 20.569 4.407 5.277 1.00 0.00 N ATOM 843 CA VAL A 57 19.800 4.979 6.379 1.00 0.00 C ATOM 844 C VAL A 57 20.192 6.432 6.640 1.00 0.00 C ATOM 845 O VAL A 57 21.374 6.780 6.656 1.00 0.00 O ATOM 846 CB VAL A 57 19.981 4.176 7.685 1.00 0.00 C ATOM 847 CG1 VAL A 57 19.437 4.947 8.875 1.00 0.00 C ATOM 848 CG2 VAL A 57 19.297 2.831 7.593 1.00 0.00 C ATOM 0 H VAL A 57 21.110 3.579 5.526 1.00 0.00 H new ATOM 0 HA VAL A 57 18.754 4.933 6.074 1.00 0.00 H new ATOM 0 HB VAL A 57 21.050 4.017 7.827 1.00 0.00 H new ATOM 0 HG11 VAL A 57 19.576 4.360 9.783 1.00 0.00 H new ATOM 0 HG12 VAL A 57 19.969 5.894 8.969 1.00 0.00 H new ATOM 0 HG13 VAL A 57 18.375 5.141 8.728 1.00 0.00 H new ATOM 0 HG21 VAL A 57 19.440 2.286 8.526 1.00 0.00 H new ATOM 0 HG22 VAL A 57 18.231 2.976 7.417 1.00 0.00 H new ATOM 0 HG23 VAL A 57 19.726 2.260 6.770 1.00 0.00 H new ATOM 858 N GLY A 58 19.178 7.258 6.858 1.00 0.00 N ATOM 859 CA GLY A 58 19.385 8.669 7.099 1.00 0.00 C ATOM 860 C GLY A 58 19.548 9.444 5.813 1.00 0.00 C ATOM 861 O GLY A 58 19.889 10.627 5.825 1.00 0.00 O ATOM 0 H GLY A 58 18.200 6.968 6.872 1.00 0.00 H new ATOM 0 HA2 GLY A 58 18.540 9.069 7.659 1.00 0.00 H new ATOM 0 HA3 GLY A 58 20.271 8.805 7.719 1.00 0.00 H new ATOM 865 N ASP A 59 19.296 8.772 4.701 1.00 0.00 N ATOM 866 CA ASP A 59 19.239 9.424 3.408 1.00 0.00 C ATOM 867 C ASP A 59 17.787 9.664 3.042 1.00 0.00 C ATOM 868 O ASP A 59 16.939 8.786 3.214 1.00 0.00 O ATOM 869 CB ASP A 59 19.935 8.587 2.330 1.00 0.00 C ATOM 870 CG ASP A 59 21.448 8.718 2.369 1.00 0.00 C ATOM 871 OD1 ASP A 59 22.072 8.286 3.361 1.00 0.00 O ATOM 872 OD2 ASP A 59 22.022 9.272 1.407 1.00 0.00 O ATOM 0 H ASP A 59 19.127 7.767 4.672 1.00 0.00 H new ATOM 0 HA ASP A 59 19.766 10.376 3.468 1.00 0.00 H new ATOM 0 HB2 ASP A 59 19.662 7.539 2.457 1.00 0.00 H new ATOM 0 HB3 ASP A 59 19.573 8.894 1.348 1.00 0.00 H new ATOM 877 N LYS A 60 17.491 10.861 2.574 1.00 0.00 N ATOM 878 CA LYS A 60 16.119 11.234 2.277 1.00 0.00 C ATOM 879 C LYS A 60 15.924 11.267 0.772 1.00 0.00 C ATOM 880 O LYS A 60 16.697 11.910 0.056 1.00 0.00 O ATOM 881 CB LYS A 60 15.793 12.606 2.875 1.00 0.00 C ATOM 882 CG LYS A 60 16.581 12.940 4.137 1.00 0.00 C ATOM 883 CD LYS A 60 16.277 12.006 5.297 1.00 0.00 C ATOM 884 CE LYS A 60 14.841 12.120 5.763 1.00 0.00 C ATOM 885 NZ LYS A 60 14.493 13.491 6.225 1.00 0.00 N ATOM 0 H LYS A 60 18.179 11.591 2.391 1.00 0.00 H new ATOM 0 HA LYS A 60 15.447 10.498 2.719 1.00 0.00 H new ATOM 0 HB2 LYS A 60 15.988 13.373 2.125 1.00 0.00 H new ATOM 0 HB3 LYS A 60 14.728 12.647 3.103 1.00 0.00 H new ATOM 0 HG2 LYS A 60 17.647 12.897 3.914 1.00 0.00 H new ATOM 0 HG3 LYS A 60 16.359 13.964 4.436 1.00 0.00 H new ATOM 0 HD2 LYS A 60 16.479 10.978 4.996 1.00 0.00 H new ATOM 0 HD3 LYS A 60 16.946 12.232 6.128 1.00 0.00 H new ATOM 0 HE2 LYS A 60 14.175 11.836 4.948 1.00 0.00 H new ATOM 0 HE3 LYS A 60 14.670 11.413 6.575 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 13.594 13.464 6.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 15.245 13.848 6.849 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 14.397 14.121 5.403 1.00 0.00 H new ATOM 899 N THR A 61 14.903 10.581 0.293 1.00 0.00 N ATOM 900 CA THR A 61 14.674 10.487 -1.133 1.00 0.00 C ATOM 901 C THR A 61 13.198 10.666 -1.476 1.00 0.00 C ATOM 902 O THR A 61 12.341 9.866 -1.097 1.00 0.00 O ATOM 903 CB THR A 61 15.206 9.146 -1.702 1.00 0.00 C ATOM 904 OG1 THR A 61 14.872 9.021 -3.091 1.00 0.00 O ATOM 905 CG2 THR A 61 14.656 7.952 -0.929 1.00 0.00 C ATOM 0 H THR A 61 14.223 10.084 0.869 1.00 0.00 H new ATOM 0 HA THR A 61 15.229 11.300 -1.602 1.00 0.00 H new ATOM 0 HB THR A 61 16.290 9.152 -1.592 1.00 0.00 H new ATOM 0 HG1 THR A 61 13.958 8.679 -3.178 1.00 0.00 H new ATOM 0 HG21 THR A 61 15.050 7.030 -1.356 1.00 0.00 H new ATOM 0 HG22 THR A 61 14.956 8.026 0.116 1.00 0.00 H new ATOM 0 HG23 THR A 61 13.568 7.946 -0.994 1.00 0.00 H new ATOM 913 N THR A 62 12.910 11.751 -2.164 1.00 0.00 N ATOM 914 CA THR A 62 11.591 11.975 -2.707 1.00 0.00 C ATOM 915 C THR A 62 11.618 11.619 -4.184 1.00 0.00 C ATOM 916 O THR A 62 12.508 12.066 -4.912 1.00 0.00 O ATOM 917 CB THR A 62 11.194 13.452 -2.547 1.00 0.00 C ATOM 918 OG1 THR A 62 11.541 13.914 -1.230 1.00 0.00 O ATOM 919 CG2 THR A 62 9.708 13.658 -2.787 1.00 0.00 C ATOM 0 H THR A 62 13.579 12.496 -2.360 1.00 0.00 H new ATOM 0 HA THR A 62 10.865 11.359 -2.176 1.00 0.00 H new ATOM 0 HB THR A 62 11.741 14.027 -3.294 1.00 0.00 H new ATOM 0 HG1 THR A 62 10.825 13.682 -0.603 1.00 0.00 H new ATOM 0 HG21 THR A 62 9.463 14.713 -2.666 1.00 0.00 H new ATOM 0 HG22 THR A 62 9.455 13.341 -3.799 1.00 0.00 H new ATOM 0 HG23 THR A 62 9.138 13.068 -2.069 1.00 0.00 H new ATOM 927 N PHE A 63 10.656 10.839 -4.643 1.00 0.00 N ATOM 928 CA PHE A 63 10.653 10.430 -6.040 1.00 0.00 C ATOM 929 C PHE A 63 9.270 10.021 -6.504 1.00 0.00 C ATOM 930 O PHE A 63 8.364 9.816 -5.702 1.00 0.00 O ATOM 931 CB PHE A 63 11.687 9.312 -6.309 1.00 0.00 C ATOM 932 CG PHE A 63 11.502 8.026 -5.536 1.00 0.00 C ATOM 933 CD1 PHE A 63 11.755 7.969 -4.172 1.00 0.00 C ATOM 934 CD2 PHE A 63 11.109 6.861 -6.185 1.00 0.00 C ATOM 935 CE1 PHE A 63 11.616 6.786 -3.475 1.00 0.00 C ATOM 936 CE2 PHE A 63 10.967 5.675 -5.487 1.00 0.00 C ATOM 937 CZ PHE A 63 11.221 5.640 -4.132 1.00 0.00 C ATOM 0 H PHE A 63 9.881 10.481 -4.085 1.00 0.00 H new ATOM 0 HA PHE A 63 10.949 11.300 -6.626 1.00 0.00 H new ATOM 0 HB2 PHE A 63 11.667 9.077 -7.373 1.00 0.00 H new ATOM 0 HB3 PHE A 63 12.680 9.704 -6.088 1.00 0.00 H new ATOM 0 HD1 PHE A 63 12.065 8.862 -3.650 1.00 0.00 H new ATOM 0 HD2 PHE A 63 10.912 6.882 -7.247 1.00 0.00 H new ATOM 0 HE1 PHE A 63 11.817 6.758 -2.414 1.00 0.00 H new ATOM 0 HE2 PHE A 63 10.658 4.778 -6.003 1.00 0.00 H new ATOM 0 HZ PHE A 63 11.111 4.715 -3.586 1.00 0.00 H new ATOM 947 N SER A 64 9.113 9.957 -7.811 1.00 0.00 N ATOM 948 CA SER A 64 7.854 9.578 -8.417 1.00 0.00 C ATOM 949 C SER A 64 8.083 8.469 -9.431 1.00 0.00 C ATOM 950 O SER A 64 9.162 8.367 -10.018 1.00 0.00 O ATOM 951 CB SER A 64 7.210 10.798 -9.079 1.00 0.00 C ATOM 952 OG SER A 64 5.914 10.503 -9.572 1.00 0.00 O ATOM 0 H SER A 64 9.853 10.166 -8.481 1.00 0.00 H new ATOM 0 HA SER A 64 7.177 9.206 -7.648 1.00 0.00 H new ATOM 0 HB2 SER A 64 7.148 11.613 -8.358 1.00 0.00 H new ATOM 0 HB3 SER A 64 7.841 11.143 -9.898 1.00 0.00 H new ATOM 0 HG SER A 64 5.531 9.760 -9.061 1.00 0.00 H new ATOM 958 N LEU A 65 7.070 7.644 -9.633 1.00 0.00 N ATOM 959 CA LEU A 65 7.170 6.502 -10.522 1.00 0.00 C ATOM 960 C LEU A 65 5.927 6.409 -11.389 1.00 0.00 C ATOM 961 O LEU A 65 4.845 6.844 -10.981 1.00 0.00 O ATOM 962 CB LEU A 65 7.346 5.213 -9.717 1.00 0.00 C ATOM 963 CG LEU A 65 8.753 4.971 -9.172 1.00 0.00 C ATOM 964 CD1 LEU A 65 8.740 3.856 -8.147 1.00 0.00 C ATOM 965 CD2 LEU A 65 9.707 4.620 -10.301 1.00 0.00 C ATOM 0 H LEU A 65 6.159 7.747 -9.187 1.00 0.00 H new ATOM 0 HA LEU A 65 8.042 6.634 -11.163 1.00 0.00 H new ATOM 0 HB2 LEU A 65 6.648 5.228 -8.880 1.00 0.00 H new ATOM 0 HB3 LEU A 65 7.068 4.369 -10.348 1.00 0.00 H new ATOM 0 HG LEU A 65 9.095 5.888 -8.692 1.00 0.00 H new ATOM 0 HD11 LEU A 65 9.750 3.697 -7.769 1.00 0.00 H new ATOM 0 HD12 LEU A 65 8.083 4.128 -7.321 1.00 0.00 H new ATOM 0 HD13 LEU A 65 8.378 2.939 -8.612 1.00 0.00 H new ATOM 0 HD21 LEU A 65 10.704 4.451 -9.895 1.00 0.00 H new ATOM 0 HD22 LEU A 65 9.361 3.716 -10.802 1.00 0.00 H new ATOM 0 HD23 LEU A 65 9.741 5.441 -11.017 1.00 0.00 H new ATOM 977 N GLU A 66 6.090 5.856 -12.587 1.00 0.00 N ATOM 978 CA GLU A 66 4.978 5.680 -13.510 1.00 0.00 C ATOM 979 C GLU A 66 3.951 4.717 -12.931 1.00 0.00 C ATOM 980 O GLU A 66 4.292 3.868 -12.107 1.00 0.00 O ATOM 981 CB GLU A 66 5.471 5.153 -14.859 1.00 0.00 C ATOM 982 CG GLU A 66 6.392 6.103 -15.595 1.00 0.00 C ATOM 983 CD GLU A 66 6.721 5.607 -16.984 1.00 0.00 C ATOM 984 OE1 GLU A 66 7.503 4.639 -17.103 1.00 0.00 O ATOM 985 OE2 GLU A 66 6.197 6.179 -17.963 1.00 0.00 O ATOM 0 H GLU A 66 6.986 5.521 -12.941 1.00 0.00 H new ATOM 0 HA GLU A 66 4.510 6.653 -13.661 1.00 0.00 H new ATOM 0 HB2 GLU A 66 5.992 4.209 -14.700 1.00 0.00 H new ATOM 0 HB3 GLU A 66 4.609 4.938 -15.490 1.00 0.00 H new ATOM 0 HG2 GLU A 66 5.923 7.085 -15.662 1.00 0.00 H new ATOM 0 HG3 GLU A 66 7.314 6.228 -15.027 1.00 0.00 H new ATOM 992 N PRO A 67 2.681 4.843 -13.347 1.00 0.00 N ATOM 993 CA PRO A 67 1.579 4.044 -12.806 1.00 0.00 C ATOM 994 C PRO A 67 1.900 2.555 -12.700 1.00 0.00 C ATOM 995 O PRO A 67 1.770 1.965 -11.625 1.00 0.00 O ATOM 996 CB PRO A 67 0.462 4.271 -13.822 1.00 0.00 C ATOM 997 CG PRO A 67 0.722 5.629 -14.368 1.00 0.00 C ATOM 998 CD PRO A 67 2.216 5.795 -14.378 1.00 0.00 C ATOM 0 HA PRO A 67 1.335 4.341 -11.786 1.00 0.00 H new ATOM 0 HB2 PRO A 67 0.482 3.517 -14.609 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -0.520 4.214 -13.351 1.00 0.00 H new ATOM 0 HG2 PRO A 67 0.312 5.730 -15.373 1.00 0.00 H new ATOM 0 HG3 PRO A 67 0.249 6.394 -13.752 1.00 0.00 H new ATOM 0 HD2 PRO A 67 2.638 5.564 -15.356 1.00 0.00 H new ATOM 0 HD3 PRO A 67 2.507 6.818 -14.139 1.00 0.00 H new ATOM 1006 N ASP A 68 2.359 1.964 -13.800 1.00 0.00 N ATOM 1007 CA ASP A 68 2.597 0.521 -13.861 1.00 0.00 C ATOM 1008 C ASP A 68 3.732 0.114 -12.931 1.00 0.00 C ATOM 1009 O ASP A 68 3.792 -1.024 -12.467 1.00 0.00 O ATOM 1010 CB ASP A 68 2.918 0.076 -15.295 1.00 0.00 C ATOM 1011 CG ASP A 68 4.361 0.326 -15.697 1.00 0.00 C ATOM 1012 OD1 ASP A 68 4.730 1.501 -15.928 1.00 0.00 O ATOM 1013 OD2 ASP A 68 5.128 -0.655 -15.807 1.00 0.00 O ATOM 0 H ASP A 68 2.575 2.462 -14.664 1.00 0.00 H new ATOM 0 HA ASP A 68 1.682 0.026 -13.536 1.00 0.00 H new ATOM 0 HB2 ASP A 68 2.700 -0.987 -15.395 1.00 0.00 H new ATOM 0 HB3 ASP A 68 2.260 0.602 -15.986 1.00 0.00 H new ATOM 1018 N ALA A 69 4.616 1.058 -12.647 1.00 0.00 N ATOM 1019 CA ALA A 69 5.765 0.800 -11.798 1.00 0.00 C ATOM 1020 C ALA A 69 5.372 0.829 -10.328 1.00 0.00 C ATOM 1021 O ALA A 69 6.087 0.311 -9.471 1.00 0.00 O ATOM 1022 CB ALA A 69 6.861 1.818 -12.080 1.00 0.00 C ATOM 0 H ALA A 69 4.557 2.015 -12.995 1.00 0.00 H new ATOM 0 HA ALA A 69 6.145 -0.197 -12.023 1.00 0.00 H new ATOM 0 HB1 ALA A 69 7.719 1.616 -11.438 1.00 0.00 H new ATOM 0 HB2 ALA A 69 7.164 1.746 -13.124 1.00 0.00 H new ATOM 0 HB3 ALA A 69 6.486 2.822 -11.879 1.00 0.00 H new ATOM 1028 N ALA A 70 4.228 1.433 -10.033 1.00 0.00 N ATOM 1029 CA ALA A 70 3.777 1.555 -8.661 1.00 0.00 C ATOM 1030 C ALA A 70 2.453 0.828 -8.428 1.00 0.00 C ATOM 1031 O ALA A 70 2.439 -0.334 -8.025 1.00 0.00 O ATOM 1032 CB ALA A 70 3.658 3.021 -8.280 1.00 0.00 C ATOM 0 H ALA A 70 3.601 1.843 -10.725 1.00 0.00 H new ATOM 0 HA ALA A 70 4.521 1.079 -8.023 1.00 0.00 H new ATOM 0 HB1 ALA A 70 3.318 3.102 -7.247 1.00 0.00 H new ATOM 0 HB2 ALA A 70 4.630 3.503 -8.381 1.00 0.00 H new ATOM 0 HB3 ALA A 70 2.940 3.511 -8.938 1.00 0.00 H new ATOM 1095 N SER A 75 -8.059 0.336 -16.514 1.00 0.00 N ATOM 1096 CA SER A 75 -8.539 0.371 -17.871 1.00 0.00 C ATOM 1097 C SER A 75 -9.984 0.858 -17.898 1.00 0.00 C ATOM 1098 O SER A 75 -10.910 0.092 -17.647 1.00 0.00 O ATOM 1099 CB SER A 75 -8.402 -1.016 -18.496 1.00 0.00 C ATOM 1100 OG SER A 75 -8.918 -1.054 -19.815 1.00 0.00 O ATOM 0 HA SER A 75 -7.942 1.069 -18.458 1.00 0.00 H new ATOM 0 HB2 SER A 75 -7.351 -1.306 -18.509 1.00 0.00 H new ATOM 0 HB3 SER A 75 -8.927 -1.746 -17.879 1.00 0.00 H new ATOM 0 HG SER A 75 -8.671 -0.231 -20.287 1.00 0.00 H new ATOM 1106 N PRO A 76 -10.207 2.151 -18.164 1.00 0.00 N ATOM 1107 CA PRO A 76 -11.558 2.684 -18.302 1.00 0.00 C ATOM 1108 C PRO A 76 -12.258 2.090 -19.518 1.00 0.00 C ATOM 1109 O PRO A 76 -13.484 1.996 -19.565 1.00 0.00 O ATOM 1110 CB PRO A 76 -11.353 4.192 -18.467 1.00 0.00 C ATOM 1111 CG PRO A 76 -9.939 4.349 -18.912 1.00 0.00 C ATOM 1112 CD PRO A 76 -9.177 3.192 -18.329 1.00 0.00 C ATOM 0 HA PRO A 76 -12.190 2.442 -17.448 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -12.045 4.605 -19.201 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -11.531 4.718 -17.529 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -9.872 4.349 -20.000 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -9.527 5.298 -18.568 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -8.377 2.863 -18.992 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -8.715 3.454 -17.377 1.00 0.00 H new ATOM 1120 N ASP A 77 -11.460 1.671 -20.495 1.00 0.00 N ATOM 1121 CA ASP A 77 -11.976 1.012 -21.690 1.00 0.00 C ATOM 1122 C ASP A 77 -12.337 -0.442 -21.393 1.00 0.00 C ATOM 1123 O ASP A 77 -12.935 -1.124 -22.225 1.00 0.00 O ATOM 1124 CB ASP A 77 -10.961 1.086 -22.836 1.00 0.00 C ATOM 1125 CG ASP A 77 -9.678 0.333 -22.541 1.00 0.00 C ATOM 1126 OD1 ASP A 77 -8.873 0.819 -21.713 1.00 0.00 O ATOM 1127 OD2 ASP A 77 -9.467 -0.747 -23.135 1.00 0.00 O ATOM 0 H ASP A 77 -10.446 1.777 -20.482 1.00 0.00 H new ATOM 0 HA ASP A 77 -12.880 1.536 -21.998 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -11.413 0.681 -23.741 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -10.724 2.131 -23.038 1.00 0.00 H new ATOM 1132 N LEU A 78 -11.966 -0.914 -20.203 1.00 0.00 N ATOM 1133 CA LEU A 78 -12.312 -2.257 -19.769 1.00 0.00 C ATOM 1134 C LEU A 78 -13.783 -2.304 -19.428 1.00 0.00 C ATOM 1135 O LEU A 78 -14.414 -3.360 -19.440 1.00 0.00 O ATOM 1136 CB LEU A 78 -11.500 -2.620 -18.528 1.00 0.00 C ATOM 1137 CG LEU A 78 -10.964 -4.047 -18.445 1.00 0.00 C ATOM 1138 CD1 LEU A 78 -10.406 -4.513 -19.776 1.00 0.00 C ATOM 1139 CD2 LEU A 78 -9.890 -4.132 -17.373 1.00 0.00 C ATOM 0 H LEU A 78 -11.424 -0.380 -19.524 1.00 0.00 H new ATOM 0 HA LEU A 78 -12.092 -2.965 -20.568 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -10.654 -1.936 -18.464 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -12.122 -2.440 -17.651 1.00 0.00 H new ATOM 0 HG LEU A 78 -11.795 -4.703 -18.185 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -10.034 -5.533 -19.678 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -11.192 -4.485 -20.530 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -9.590 -3.857 -20.078 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -9.511 -5.152 -17.318 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -9.073 -3.454 -17.622 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -10.315 -3.850 -16.409 1.00 0.00 H new ATOM 1151 N ILE A 79 -14.316 -1.135 -19.122 1.00 0.00 N ATOM 1152 CA ILE A 79 -15.722 -0.984 -18.827 1.00 0.00 C ATOM 1153 C ILE A 79 -16.553 -1.219 -20.067 1.00 0.00 C ATOM 1154 O ILE A 79 -16.370 -0.561 -21.091 1.00 0.00 O ATOM 1155 CB ILE A 79 -16.014 0.417 -18.256 1.00 0.00 C ATOM 1156 CG1 ILE A 79 -15.200 0.610 -16.973 1.00 0.00 C ATOM 1157 CG2 ILE A 79 -17.507 0.617 -18.010 1.00 0.00 C ATOM 1158 CD1 ILE A 79 -15.672 1.746 -16.103 1.00 0.00 C ATOM 0 H ILE A 79 -13.784 -0.266 -19.072 1.00 0.00 H new ATOM 0 HA ILE A 79 -15.990 -1.728 -18.077 1.00 0.00 H new ATOM 0 HB ILE A 79 -15.716 1.172 -18.983 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -15.232 -0.313 -16.394 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -14.157 0.782 -17.241 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -17.679 1.615 -17.607 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -18.049 0.507 -18.949 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -17.861 -0.128 -17.297 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -15.041 1.812 -15.217 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -15.613 2.680 -16.661 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -16.704 1.569 -15.801 1.00 0.00 H new ATOM 1170 N GLN A 80 -17.476 -2.152 -19.950 1.00 0.00 N ATOM 1171 CA GLN A 80 -18.300 -2.554 -21.068 1.00 0.00 C ATOM 1172 C GLN A 80 -19.639 -3.009 -20.562 1.00 0.00 C ATOM 1173 O GLN A 80 -19.736 -3.942 -19.765 1.00 0.00 O ATOM 1174 CB GLN A 80 -17.655 -3.695 -21.833 1.00 0.00 C ATOM 1175 CG GLN A 80 -16.313 -3.345 -22.444 1.00 0.00 C ATOM 1176 CD GLN A 80 -15.531 -4.568 -22.877 1.00 0.00 C ATOM 1177 OE1 GLN A 80 -15.657 -5.033 -24.007 1.00 0.00 O ATOM 1178 NE2 GLN A 80 -14.713 -5.091 -21.978 1.00 0.00 N ATOM 0 H GLN A 80 -17.674 -2.649 -19.082 1.00 0.00 H new ATOM 0 HA GLN A 80 -18.414 -1.699 -21.735 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -17.527 -4.543 -21.161 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -18.331 -4.016 -22.625 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -16.469 -2.695 -23.305 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -15.725 -2.780 -21.720 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -14.639 -4.672 -21.051 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -14.156 -5.913 -22.212 1.00 0.00 H new ATOM 1187 N TYR A 81 -20.664 -2.325 -20.997 1.00 0.00 N ATOM 1188 CA TYR A 81 -21.999 -2.768 -20.644 1.00 0.00 C ATOM 1189 C TYR A 81 -22.467 -3.908 -21.524 1.00 0.00 C ATOM 1190 O TYR A 81 -22.645 -3.769 -22.736 1.00 0.00 O ATOM 1191 CB TYR A 81 -22.981 -1.599 -20.795 1.00 0.00 C ATOM 1192 CG TYR A 81 -22.428 -0.254 -20.371 1.00 0.00 C ATOM 1193 CD1 TYR A 81 -21.656 0.506 -21.242 1.00 0.00 C ATOM 1194 CD2 TYR A 81 -22.682 0.259 -19.108 1.00 0.00 C ATOM 1195 CE1 TYR A 81 -21.152 1.735 -20.864 1.00 0.00 C ATOM 1196 CE2 TYR A 81 -22.182 1.490 -18.724 1.00 0.00 C ATOM 1197 CZ TYR A 81 -21.417 2.221 -19.605 1.00 0.00 C ATOM 1198 OH TYR A 81 -20.915 3.447 -19.222 1.00 0.00 O ATOM 0 H TYR A 81 -20.613 -1.487 -21.576 1.00 0.00 H new ATOM 0 HA TYR A 81 -21.967 -3.120 -19.613 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -23.294 -1.537 -21.837 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -23.873 -1.812 -20.206 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -21.447 0.129 -22.232 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -23.280 -0.312 -18.413 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -20.553 2.311 -21.553 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -22.391 1.876 -17.737 1.00 0.00 H new ATOM 0 HH TYR A 81 -21.195 3.643 -18.304 1.00 0.00 H new ATOM 1208 N PHE A 82 -22.644 -5.045 -20.874 1.00 0.00 N ATOM 1209 CA PHE A 82 -23.239 -6.218 -21.485 1.00 0.00 C ATOM 1210 C PHE A 82 -24.696 -6.335 -21.081 1.00 0.00 C ATOM 1211 O PHE A 82 -25.178 -5.571 -20.240 1.00 0.00 O ATOM 1212 CB PHE A 82 -22.477 -7.485 -21.082 1.00 0.00 C ATOM 1213 CG PHE A 82 -21.166 -7.666 -21.799 1.00 0.00 C ATOM 1214 CD1 PHE A 82 -20.094 -6.820 -21.557 1.00 0.00 C ATOM 1215 CD2 PHE A 82 -21.005 -8.696 -22.711 1.00 0.00 C ATOM 1216 CE1 PHE A 82 -18.890 -6.999 -22.211 1.00 0.00 C ATOM 1217 CE2 PHE A 82 -19.804 -8.879 -23.371 1.00 0.00 C ATOM 1218 CZ PHE A 82 -18.745 -8.029 -23.119 1.00 0.00 C ATOM 0 H PHE A 82 -22.376 -5.180 -19.899 1.00 0.00 H new ATOM 0 HA PHE A 82 -23.178 -6.110 -22.568 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -22.291 -7.459 -20.008 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -23.108 -8.353 -21.275 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -20.202 -6.012 -20.849 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -21.829 -9.365 -22.909 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -18.063 -6.334 -22.012 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -19.694 -9.685 -24.082 1.00 0.00 H new ATOM 0 HZ PHE A 82 -17.805 -8.170 -23.631 1.00 0.00 H new ATOM 1228 N SER A 83 -25.393 -7.278 -21.689 1.00 0.00 N ATOM 1229 CA SER A 83 -26.838 -7.341 -21.598 1.00 0.00 C ATOM 1230 C SER A 83 -27.322 -7.579 -20.174 1.00 0.00 C ATOM 1231 O SER A 83 -26.620 -8.105 -19.309 1.00 0.00 O ATOM 1232 CB SER A 83 -27.387 -8.444 -22.515 1.00 0.00 C ATOM 1233 OG SER A 83 -28.801 -8.414 -22.569 1.00 0.00 O ATOM 0 H SER A 83 -24.976 -8.016 -22.256 1.00 0.00 H new ATOM 0 HA SER A 83 -27.214 -6.370 -21.920 1.00 0.00 H new ATOM 0 HB2 SER A 83 -26.980 -8.321 -23.519 1.00 0.00 H new ATOM 0 HB3 SER A 83 -27.056 -9.418 -22.154 1.00 0.00 H new ATOM 0 HG SER A 83 -29.093 -8.425 -23.504 1.00 0.00 H new ATOM 1239 N ARG A 84 -28.573 -7.215 -19.998 1.00 0.00 N ATOM 1240 CA ARG A 84 -29.230 -7.339 -18.720 1.00 0.00 C ATOM 1241 C ARG A 84 -29.611 -8.801 -18.523 1.00 0.00 C ATOM 1242 O ARG A 84 -29.677 -9.308 -17.406 1.00 0.00 O ATOM 1243 CB ARG A 84 -30.441 -6.419 -18.638 1.00 0.00 C ATOM 1244 CG ARG A 84 -31.540 -6.770 -19.613 1.00 0.00 C ATOM 1245 CD ARG A 84 -32.660 -5.759 -19.562 1.00 0.00 C ATOM 1246 NE ARG A 84 -33.852 -6.263 -20.233 1.00 0.00 N ATOM 1247 CZ ARG A 84 -34.992 -5.583 -20.346 1.00 0.00 C ATOM 1248 NH1 ARG A 84 -35.092 -4.355 -19.850 1.00 0.00 N ATOM 1249 NH2 ARG A 84 -36.039 -6.142 -20.943 1.00 0.00 N ATOM 0 H ARG A 84 -29.160 -6.826 -20.736 1.00 0.00 H new ATOM 0 HA ARG A 84 -28.558 -7.032 -17.919 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -30.842 -6.452 -17.625 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -30.120 -5.394 -18.821 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -31.133 -6.815 -20.623 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -31.931 -7.761 -19.383 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -32.895 -5.524 -18.524 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -32.338 -4.831 -20.034 1.00 0.00 H new ATOM 0 HE ARG A 84 -33.811 -7.196 -20.642 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -34.294 -3.928 -19.380 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -35.967 -3.839 -19.939 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -35.969 -7.090 -21.314 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -36.913 -5.623 -21.031 1.00 0.00 H new ATOM 1263 N ARG A 85 -29.830 -9.469 -19.658 1.00 0.00 N ATOM 1264 CA ARG A 85 -30.267 -10.860 -19.688 1.00 0.00 C ATOM 1265 C ARG A 85 -29.154 -11.791 -19.263 1.00 0.00 C ATOM 1266 O ARG A 85 -29.385 -12.766 -18.544 1.00 0.00 O ATOM 1267 CB ARG A 85 -30.733 -11.264 -21.089 1.00 0.00 C ATOM 1268 CG ARG A 85 -32.001 -10.572 -21.544 1.00 0.00 C ATOM 1269 CD ARG A 85 -31.724 -9.230 -22.204 1.00 0.00 C ATOM 1270 NE ARG A 85 -32.957 -8.618 -22.702 1.00 0.00 N ATOM 1271 CZ ARG A 85 -33.006 -7.509 -23.443 1.00 0.00 C ATOM 1272 NH1 ARG A 85 -31.891 -6.883 -23.792 1.00 0.00 N ATOM 1273 NH2 ARG A 85 -34.174 -7.030 -23.840 1.00 0.00 N ATOM 0 H ARG A 85 -29.708 -9.056 -20.583 1.00 0.00 H new ATOM 0 HA ARG A 85 -31.100 -10.944 -18.990 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -29.937 -11.046 -21.801 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -30.893 -12.342 -21.110 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -32.532 -11.216 -22.245 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -32.658 -10.424 -20.687 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -31.247 -8.561 -21.487 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -31.024 -9.365 -23.028 1.00 0.00 H new ATOM 0 HE ARG A 85 -33.840 -9.071 -22.466 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -30.986 -7.248 -23.494 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -31.938 -6.036 -24.358 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -35.036 -7.508 -23.580 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -34.212 -6.182 -24.406 1.00 0.00 H new ATOM 1287 N GLU A 86 -27.949 -11.475 -19.712 1.00 0.00 N ATOM 1288 CA GLU A 86 -26.788 -12.313 -19.467 1.00 0.00 C ATOM 1289 C GLU A 86 -26.593 -12.547 -17.978 1.00 0.00 C ATOM 1290 O GLU A 86 -26.212 -13.641 -17.557 1.00 0.00 O ATOM 1291 CB GLU A 86 -25.535 -11.682 -20.083 1.00 0.00 C ATOM 1292 CG GLU A 86 -25.557 -11.666 -21.603 1.00 0.00 C ATOM 1293 CD GLU A 86 -24.380 -10.923 -22.211 1.00 0.00 C ATOM 1294 OE1 GLU A 86 -23.283 -11.508 -22.301 1.00 0.00 O ATOM 1295 OE2 GLU A 86 -24.551 -9.756 -22.620 1.00 0.00 O ATOM 0 H GLU A 86 -27.750 -10.634 -20.254 1.00 0.00 H new ATOM 0 HA GLU A 86 -26.958 -13.280 -19.941 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -25.433 -10.660 -19.717 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -24.656 -12.231 -19.745 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -25.560 -12.692 -21.971 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -26.484 -11.204 -21.942 1.00 0.00 H new ATOM 1302 N PHE A 87 -26.872 -11.526 -17.177 1.00 0.00 N ATOM 1303 CA PHE A 87 -26.712 -11.639 -15.735 1.00 0.00 C ATOM 1304 C PHE A 87 -28.000 -12.059 -15.056 1.00 0.00 C ATOM 1305 O PHE A 87 -27.980 -12.831 -14.102 1.00 0.00 O ATOM 1306 CB PHE A 87 -26.260 -10.304 -15.144 1.00 0.00 C ATOM 1307 CG PHE A 87 -24.918 -9.828 -15.618 1.00 0.00 C ATOM 1308 CD1 PHE A 87 -24.727 -9.424 -16.930 1.00 0.00 C ATOM 1309 CD2 PHE A 87 -23.850 -9.764 -14.742 1.00 0.00 C ATOM 1310 CE1 PHE A 87 -23.496 -8.970 -17.359 1.00 0.00 C ATOM 1311 CE2 PHE A 87 -22.618 -9.315 -15.163 1.00 0.00 C ATOM 1312 CZ PHE A 87 -22.440 -8.915 -16.474 1.00 0.00 C ATOM 0 H PHE A 87 -27.207 -10.618 -17.499 1.00 0.00 H new ATOM 0 HA PHE A 87 -25.957 -12.405 -15.558 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -27.005 -9.545 -15.385 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -26.235 -10.393 -14.058 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -25.552 -9.465 -17.626 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -23.984 -10.070 -13.715 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -23.360 -8.659 -18.384 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -21.791 -9.275 -14.469 1.00 0.00 H new ATOM 0 HZ PHE A 87 -21.475 -8.560 -16.805 1.00 0.00 H new ATOM 1322 N MET A 88 -29.116 -11.553 -15.557 1.00 0.00 N ATOM 1323 CA MET A 88 -30.409 -11.759 -14.916 1.00 0.00 C ATOM 1324 C MET A 88 -30.742 -13.238 -14.790 1.00 0.00 C ATOM 1325 O MET A 88 -31.407 -13.652 -13.841 1.00 0.00 O ATOM 1326 CB MET A 88 -31.514 -11.047 -15.684 1.00 0.00 C ATOM 1327 CG MET A 88 -32.896 -11.283 -15.105 1.00 0.00 C ATOM 1328 SD MET A 88 -34.197 -10.475 -16.056 1.00 0.00 S ATOM 1329 CE MET A 88 -34.054 -11.337 -17.623 1.00 0.00 C ATOM 0 H MET A 88 -29.154 -10.994 -16.409 1.00 0.00 H new ATOM 0 HA MET A 88 -30.342 -11.336 -13.914 1.00 0.00 H new ATOM 0 HB2 MET A 88 -31.309 -9.976 -15.692 1.00 0.00 H new ATOM 0 HB3 MET A 88 -31.500 -11.382 -16.721 1.00 0.00 H new ATOM 0 HG2 MET A 88 -33.091 -12.355 -15.068 1.00 0.00 H new ATOM 0 HG3 MET A 88 -32.922 -10.918 -14.078 1.00 0.00 H new ATOM 0 HE1 MET A 88 -35.013 -11.314 -18.140 1.00 0.00 H new ATOM 0 HE2 MET A 88 -33.298 -10.850 -18.239 1.00 0.00 H new ATOM 0 HE3 MET A 88 -33.763 -12.372 -17.444 1.00 0.00 H new ATOM 1339 N ASP A 89 -30.276 -14.032 -15.744 1.00 0.00 N ATOM 1340 CA ASP A 89 -30.479 -15.477 -15.710 1.00 0.00 C ATOM 1341 C ASP A 89 -29.907 -16.079 -14.424 1.00 0.00 C ATOM 1342 O ASP A 89 -30.397 -17.094 -13.927 1.00 0.00 O ATOM 1343 CB ASP A 89 -29.832 -16.119 -16.934 1.00 0.00 C ATOM 1344 CG ASP A 89 -30.210 -17.576 -17.101 1.00 0.00 C ATOM 1345 OD1 ASP A 89 -31.412 -17.866 -17.287 1.00 0.00 O ATOM 1346 OD2 ASP A 89 -29.309 -18.437 -17.054 1.00 0.00 O ATOM 0 H ASP A 89 -29.753 -13.700 -16.554 1.00 0.00 H new ATOM 0 HA ASP A 89 -31.550 -15.678 -15.727 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -30.127 -15.567 -17.827 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -28.748 -16.037 -16.852 1.00 0.00 H new ATOM 1351 N ALA A 90 -28.881 -15.433 -13.884 1.00 0.00 N ATOM 1352 CA ALA A 90 -28.278 -15.855 -12.625 1.00 0.00 C ATOM 1353 C ALA A 90 -28.732 -14.952 -11.478 1.00 0.00 C ATOM 1354 O ALA A 90 -28.383 -15.176 -10.319 1.00 0.00 O ATOM 1355 CB ALA A 90 -26.760 -15.842 -12.735 1.00 0.00 C ATOM 0 H ALA A 90 -28.447 -14.610 -14.301 1.00 0.00 H new ATOM 0 HA ALA A 90 -28.606 -16.872 -12.413 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -26.324 -16.159 -11.788 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -26.447 -16.524 -13.525 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -26.421 -14.833 -12.971 1.00 0.00 H new ATOM 1361 N GLY A 91 -29.518 -13.937 -11.812 1.00 0.00 N ATOM 1362 CA GLY A 91 -29.978 -12.991 -10.818 1.00 0.00 C ATOM 1363 C GLY A 91 -29.524 -11.581 -11.121 1.00 0.00 C ATOM 1364 O GLY A 91 -28.392 -11.367 -11.561 1.00 0.00 O ATOM 0 H GLY A 91 -29.846 -13.753 -12.760 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -31.067 -13.018 -10.769 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -29.607 -13.288 -9.837 1.00 0.00 H new ATOM 1368 N GLU A 92 -30.410 -10.620 -10.893 1.00 0.00 N ATOM 1369 CA GLU A 92 -30.097 -9.214 -11.109 1.00 0.00 C ATOM 1370 C GLU A 92 -28.940 -8.769 -10.213 1.00 0.00 C ATOM 1371 O GLU A 92 -29.020 -8.861 -8.986 1.00 0.00 O ATOM 1372 CB GLU A 92 -31.332 -8.349 -10.860 1.00 0.00 C ATOM 1373 CG GLU A 92 -32.409 -8.524 -11.918 1.00 0.00 C ATOM 1374 CD GLU A 92 -33.636 -7.673 -11.660 1.00 0.00 C ATOM 1375 OE1 GLU A 92 -33.538 -6.434 -11.772 1.00 0.00 O ATOM 1376 OE2 GLU A 92 -34.707 -8.240 -11.350 1.00 0.00 O ATOM 0 H GLU A 92 -31.357 -10.791 -10.556 1.00 0.00 H new ATOM 0 HA GLU A 92 -29.789 -9.089 -12.147 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -31.748 -8.594 -9.883 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -31.033 -7.301 -10.825 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -31.996 -8.270 -12.894 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -32.703 -9.573 -11.959 1.00 0.00 H new ATOM 1383 N PRO A 93 -27.847 -8.286 -10.828 1.00 0.00 N ATOM 1384 CA PRO A 93 -26.634 -7.883 -10.113 1.00 0.00 C ATOM 1385 C PRO A 93 -26.812 -6.597 -9.326 1.00 0.00 C ATOM 1386 O PRO A 93 -27.803 -5.881 -9.486 1.00 0.00 O ATOM 1387 CB PRO A 93 -25.583 -7.686 -11.210 1.00 0.00 C ATOM 1388 CG PRO A 93 -26.235 -8.011 -12.509 1.00 0.00 C ATOM 1389 CD PRO A 93 -27.718 -8.080 -12.277 1.00 0.00 C ATOM 0 HA PRO A 93 -26.355 -8.636 -9.376 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -25.215 -6.660 -11.210 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -24.723 -8.333 -11.039 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -26.000 -7.251 -13.254 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -25.865 -8.961 -12.895 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -28.214 -7.163 -12.595 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -28.171 -8.898 -12.837 1.00 0.00 H new ATOM 1397 N GLU A 94 -25.846 -6.330 -8.465 1.00 0.00 N ATOM 1398 CA GLU A 94 -25.907 -5.208 -7.551 1.00 0.00 C ATOM 1399 C GLU A 94 -24.810 -4.194 -7.855 1.00 0.00 C ATOM 1400 O GLU A 94 -23.774 -4.535 -8.429 1.00 0.00 O ATOM 1401 CB GLU A 94 -25.750 -5.712 -6.119 1.00 0.00 C ATOM 1402 CG GLU A 94 -26.274 -7.125 -5.903 1.00 0.00 C ATOM 1403 CD GLU A 94 -25.231 -8.204 -6.120 1.00 0.00 C ATOM 1404 OE1 GLU A 94 -24.917 -8.528 -7.285 1.00 0.00 O ATOM 1405 OE2 GLU A 94 -24.728 -8.747 -5.113 1.00 0.00 O ATOM 0 H GLU A 94 -24.996 -6.888 -8.381 1.00 0.00 H new ATOM 0 HA GLU A 94 -26.873 -4.717 -7.671 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -24.695 -5.680 -5.846 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -26.274 -5.034 -5.446 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -26.663 -7.207 -4.888 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -27.110 -7.300 -6.580 1.00 0.00 H new ATOM 1412 N ILE A 95 -25.042 -2.952 -7.454 1.00 0.00 N ATOM 1413 CA ILE A 95 -24.098 -1.876 -7.700 1.00 0.00 C ATOM 1414 C ILE A 95 -22.984 -1.882 -6.659 1.00 0.00 C ATOM 1415 O ILE A 95 -23.240 -1.941 -5.454 1.00 0.00 O ATOM 1416 CB ILE A 95 -24.808 -0.505 -7.704 1.00 0.00 C ATOM 1417 CG1 ILE A 95 -25.917 -0.514 -8.750 1.00 0.00 C ATOM 1418 CG2 ILE A 95 -23.821 0.619 -7.980 1.00 0.00 C ATOM 1419 CD1 ILE A 95 -26.563 0.829 -8.982 1.00 0.00 C ATOM 0 H ILE A 95 -25.883 -2.665 -6.953 1.00 0.00 H new ATOM 0 HA ILE A 95 -23.659 -2.042 -8.684 1.00 0.00 H new ATOM 0 HB ILE A 95 -25.242 -0.329 -6.720 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -25.507 -0.875 -9.693 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -26.684 -1.225 -8.443 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -24.347 1.574 -7.977 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -23.052 0.626 -7.207 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -23.356 0.464 -8.953 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -27.340 0.733 -9.740 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -27.006 1.185 -8.052 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -25.811 1.541 -9.322 1.00 0.00 H new ATOM 1431 N GLY A 96 -21.750 -1.808 -7.137 1.00 0.00 N ATOM 1432 CA GLY A 96 -20.591 -1.862 -6.269 1.00 0.00 C ATOM 1433 C GLY A 96 -20.344 -3.252 -5.721 1.00 0.00 C ATOM 1434 O GLY A 96 -19.627 -3.422 -4.732 1.00 0.00 O ATOM 0 H GLY A 96 -21.529 -1.710 -8.128 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -19.711 -1.530 -6.821 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -20.728 -1.167 -5.441 1.00 0.00 H new ATOM 1438 N ALA A 97 -20.925 -4.248 -6.372 1.00 0.00 N ATOM 1439 CA ALA A 97 -20.722 -5.631 -5.982 1.00 0.00 C ATOM 1440 C ALA A 97 -19.665 -6.266 -6.876 1.00 0.00 C ATOM 1441 O ALA A 97 -19.728 -6.151 -8.094 1.00 0.00 O ATOM 1442 CB ALA A 97 -22.030 -6.414 -6.050 1.00 0.00 C ATOM 0 H ALA A 97 -21.542 -4.122 -7.174 1.00 0.00 H new ATOM 0 HA ALA A 97 -20.374 -5.657 -4.949 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -21.851 -7.447 -5.753 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -22.759 -5.964 -5.376 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -22.415 -6.391 -7.069 1.00 0.00 H new ATOM 1448 N ILE A 98 -18.682 -6.905 -6.271 1.00 0.00 N ATOM 1449 CA ILE A 98 -17.629 -7.574 -7.026 1.00 0.00 C ATOM 1450 C ILE A 98 -17.960 -9.047 -7.126 1.00 0.00 C ATOM 1451 O ILE A 98 -18.278 -9.669 -6.112 1.00 0.00 O ATOM 1452 CB ILE A 98 -16.250 -7.418 -6.343 1.00 0.00 C ATOM 1453 CG1 ILE A 98 -16.021 -5.961 -5.933 1.00 0.00 C ATOM 1454 CG2 ILE A 98 -15.137 -7.904 -7.271 1.00 0.00 C ATOM 1455 CD1 ILE A 98 -14.677 -5.708 -5.285 1.00 0.00 C ATOM 0 H ILE A 98 -18.587 -6.977 -5.258 1.00 0.00 H new ATOM 0 HA ILE A 98 -17.574 -7.116 -8.014 1.00 0.00 H new ATOM 0 HB ILE A 98 -16.234 -8.032 -5.443 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -16.113 -5.327 -6.815 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -16.808 -5.661 -5.242 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -14.173 -7.787 -6.775 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -15.297 -8.955 -7.511 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -15.146 -7.317 -8.189 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -14.592 -4.653 -5.024 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -14.588 -6.313 -4.383 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -13.882 -5.975 -5.981 1.00 0.00 H new ATOM 1467 N MET A 99 -17.917 -9.630 -8.320 1.00 0.00 N ATOM 1468 CA MET A 99 -18.229 -11.034 -8.480 1.00 0.00 C ATOM 1469 C MET A 99 -17.197 -11.630 -9.429 1.00 0.00 C ATOM 1470 O MET A 99 -16.525 -10.900 -10.158 1.00 0.00 O ATOM 1471 CB MET A 99 -19.625 -11.219 -9.089 1.00 0.00 C ATOM 1472 CG MET A 99 -20.656 -10.192 -8.641 1.00 0.00 C ATOM 1473 SD MET A 99 -22.332 -10.607 -9.172 1.00 0.00 S ATOM 1474 CE MET A 99 -22.100 -10.824 -10.936 1.00 0.00 C ATOM 0 H MET A 99 -17.669 -9.148 -9.184 1.00 0.00 H new ATOM 0 HA MET A 99 -18.211 -11.525 -7.507 1.00 0.00 H new ATOM 0 HB2 MET A 99 -19.541 -11.179 -10.175 1.00 0.00 H new ATOM 0 HB3 MET A 99 -19.989 -12.214 -8.834 1.00 0.00 H new ATOM 0 HG2 MET A 99 -20.633 -10.111 -7.554 1.00 0.00 H new ATOM 0 HG3 MET A 99 -20.385 -9.214 -9.039 1.00 0.00 H new ATOM 0 HE1 MET A 99 -23.072 -10.872 -11.428 1.00 0.00 H new ATOM 0 HE2 MET A 99 -21.533 -9.983 -11.335 1.00 0.00 H new ATOM 0 HE3 MET A 99 -21.554 -11.749 -11.120 1.00 0.00 H new ATOM 1484 N LEU A 100 -17.052 -12.939 -9.402 1.00 0.00 N ATOM 1485 CA LEU A 100 -16.158 -13.591 -10.353 1.00 0.00 C ATOM 1486 C LEU A 100 -16.723 -13.528 -11.767 1.00 0.00 C ATOM 1487 O LEU A 100 -17.644 -14.255 -12.141 1.00 0.00 O ATOM 1488 CB LEU A 100 -15.866 -15.029 -9.928 1.00 0.00 C ATOM 1489 CG LEU A 100 -14.542 -15.210 -9.186 1.00 0.00 C ATOM 1490 CD1 LEU A 100 -13.376 -15.100 -10.155 1.00 0.00 C ATOM 1491 CD2 LEU A 100 -14.408 -14.170 -8.089 1.00 0.00 C ATOM 0 H LEU A 100 -17.526 -13.565 -8.751 1.00 0.00 H new ATOM 0 HA LEU A 100 -15.212 -13.050 -10.356 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -16.677 -15.378 -9.290 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -15.862 -15.664 -10.814 1.00 0.00 H new ATOM 0 HG LEU A 100 -14.530 -16.201 -8.733 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -12.439 -15.231 -9.613 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -13.464 -15.872 -10.919 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -13.387 -14.118 -10.628 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -13.461 -14.310 -7.568 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -14.437 -13.173 -8.528 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -15.230 -14.279 -7.382 1.00 0.00 H new ATOM 1503 N PHE A 101 -16.126 -12.620 -12.527 1.00 0.00 N ATOM 1504 CA PHE A 101 -16.562 -12.251 -13.861 1.00 0.00 C ATOM 1505 C PHE A 101 -15.841 -13.028 -14.946 1.00 0.00 C ATOM 1506 O PHE A 101 -14.880 -13.744 -14.696 1.00 0.00 O ATOM 1507 CB PHE A 101 -16.344 -10.756 -14.086 1.00 0.00 C ATOM 1508 CG PHE A 101 -17.569 -9.926 -13.872 1.00 0.00 C ATOM 1509 CD1 PHE A 101 -18.159 -9.833 -12.625 1.00 0.00 C ATOM 1510 CD2 PHE A 101 -18.129 -9.236 -14.929 1.00 0.00 C ATOM 1511 CE1 PHE A 101 -19.289 -9.063 -12.436 1.00 0.00 C ATOM 1512 CE2 PHE A 101 -19.259 -8.466 -14.747 1.00 0.00 C ATOM 1513 CZ PHE A 101 -19.839 -8.377 -13.499 1.00 0.00 C ATOM 0 H PHE A 101 -15.300 -12.106 -12.220 1.00 0.00 H new ATOM 0 HA PHE A 101 -17.622 -12.496 -13.926 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -15.559 -10.408 -13.414 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -15.985 -10.600 -15.103 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -17.731 -10.368 -11.790 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -17.678 -9.300 -15.908 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -19.742 -8.998 -11.458 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -19.689 -7.933 -15.582 1.00 0.00 H new ATOM 0 HZ PHE A 101 -20.722 -7.772 -13.354 1.00 0.00 H new ATOM 1523 N THR A 102 -16.325 -12.851 -16.154 1.00 0.00 N ATOM 1524 CA THR A 102 -15.777 -13.547 -17.295 1.00 0.00 C ATOM 1525 C THR A 102 -15.371 -12.534 -18.358 1.00 0.00 C ATOM 1526 O THR A 102 -16.111 -11.589 -18.640 1.00 0.00 O ATOM 1527 CB THR A 102 -16.766 -14.567 -17.885 1.00 0.00 C ATOM 1528 OG1 THR A 102 -17.475 -15.230 -16.827 1.00 0.00 O ATOM 1529 CG2 THR A 102 -16.016 -15.603 -18.704 1.00 0.00 C ATOM 0 H THR A 102 -17.102 -12.227 -16.372 1.00 0.00 H new ATOM 0 HA THR A 102 -14.904 -14.106 -16.958 1.00 0.00 H new ATOM 0 HB THR A 102 -17.473 -14.038 -18.524 1.00 0.00 H new ATOM 0 HG1 THR A 102 -18.104 -15.877 -17.210 1.00 0.00 H new ATOM 0 HG21 THR A 102 -16.724 -16.321 -19.118 1.00 0.00 H new ATOM 0 HG22 THR A 102 -15.483 -15.109 -19.516 1.00 0.00 H new ATOM 0 HG23 THR A 102 -15.302 -16.124 -18.066 1.00 0.00 H new ATOM 1537 N ALA A 103 -14.199 -12.730 -18.933 1.00 0.00 N ATOM 1538 CA ALA A 103 -13.672 -11.816 -19.929 1.00 0.00 C ATOM 1539 C ALA A 103 -13.832 -12.430 -21.309 1.00 0.00 C ATOM 1540 O ALA A 103 -13.976 -13.646 -21.441 1.00 0.00 O ATOM 1541 CB ALA A 103 -12.211 -11.506 -19.641 1.00 0.00 C ATOM 0 H ALA A 103 -13.590 -13.521 -18.725 1.00 0.00 H new ATOM 0 HA ALA A 103 -14.227 -10.879 -19.892 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -11.829 -10.819 -20.396 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -12.124 -11.047 -18.656 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -11.632 -12.429 -19.664 1.00 0.00 H new ATOM 1547 N MET A 104 -13.799 -11.583 -22.332 1.00 0.00 N ATOM 1548 CA MET A 104 -14.058 -12.014 -23.703 1.00 0.00 C ATOM 1549 C MET A 104 -12.973 -12.958 -24.215 1.00 0.00 C ATOM 1550 O MET A 104 -13.142 -13.598 -25.252 1.00 0.00 O ATOM 1551 CB MET A 104 -14.186 -10.801 -24.627 1.00 0.00 C ATOM 1552 CG MET A 104 -15.389 -9.924 -24.311 1.00 0.00 C ATOM 1553 SD MET A 104 -15.539 -8.511 -25.422 1.00 0.00 S ATOM 1554 CE MET A 104 -14.013 -7.648 -25.061 1.00 0.00 C ATOM 0 H MET A 104 -13.594 -10.588 -22.238 1.00 0.00 H new ATOM 0 HA MET A 104 -14.999 -12.563 -23.703 1.00 0.00 H new ATOM 0 HB2 MET A 104 -13.279 -10.201 -24.554 1.00 0.00 H new ATOM 0 HB3 MET A 104 -14.258 -11.146 -25.659 1.00 0.00 H new ATOM 0 HG2 MET A 104 -16.296 -10.525 -24.371 1.00 0.00 H new ATOM 0 HG3 MET A 104 -15.312 -9.566 -23.284 1.00 0.00 H new ATOM 0 HE1 MET A 104 -14.100 -6.608 -25.376 1.00 0.00 H new ATOM 0 HE2 MET A 104 -13.817 -7.688 -23.989 1.00 0.00 H new ATOM 0 HE3 MET A 104 -13.191 -8.122 -25.598 1.00 0.00 H new ATOM 1564 N ASP A 105 -11.865 -13.045 -23.488 1.00 0.00 N ATOM 1565 CA ASP A 105 -10.783 -13.954 -23.852 1.00 0.00 C ATOM 1566 C ASP A 105 -10.930 -15.290 -23.130 1.00 0.00 C ATOM 1567 O ASP A 105 -10.079 -16.172 -23.254 1.00 0.00 O ATOM 1568 CB ASP A 105 -9.424 -13.340 -23.523 1.00 0.00 C ATOM 1569 CG ASP A 105 -9.147 -13.305 -22.034 1.00 0.00 C ATOM 1570 OD1 ASP A 105 -9.659 -12.393 -21.354 1.00 0.00 O ATOM 1571 OD2 ASP A 105 -8.415 -14.187 -21.539 1.00 0.00 O ATOM 0 H ASP A 105 -11.692 -12.498 -22.644 1.00 0.00 H new ATOM 0 HA ASP A 105 -10.843 -14.125 -24.927 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -8.641 -13.911 -24.021 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -9.381 -12.326 -23.921 1.00 0.00 H new ATOM 1576 N GLY A 106 -12.018 -15.440 -22.382 1.00 0.00 N ATOM 1577 CA GLY A 106 -12.262 -16.676 -21.676 1.00 0.00 C ATOM 1578 C GLY A 106 -11.724 -16.684 -20.256 1.00 0.00 C ATOM 1579 O GLY A 106 -12.035 -17.591 -19.483 1.00 0.00 O ATOM 0 H GLY A 106 -12.734 -14.725 -22.254 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -13.335 -16.863 -21.650 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -11.809 -17.497 -22.232 1.00 0.00 H new ATOM 1583 N SER A 107 -10.922 -15.689 -19.902 1.00 0.00 N ATOM 1584 CA SER A 107 -10.355 -15.628 -18.565 1.00 0.00 C ATOM 1585 C SER A 107 -11.375 -15.126 -17.563 1.00 0.00 C ATOM 1586 O SER A 107 -12.177 -14.235 -17.851 1.00 0.00 O ATOM 1587 CB SER A 107 -9.120 -14.739 -18.525 1.00 0.00 C ATOM 1588 OG SER A 107 -8.529 -14.733 -17.235 1.00 0.00 O ATOM 0 H SER A 107 -10.652 -14.921 -20.516 1.00 0.00 H new ATOM 0 HA SER A 107 -10.062 -16.643 -18.295 1.00 0.00 H new ATOM 0 HB2 SER A 107 -8.394 -15.089 -19.258 1.00 0.00 H new ATOM 0 HB3 SER A 107 -9.392 -13.722 -18.807 1.00 0.00 H new ATOM 0 HG SER A 107 -7.737 -14.155 -17.240 1.00 0.00 H new ATOM 1594 N GLU A 108 -11.358 -15.729 -16.396 1.00 0.00 N ATOM 1595 CA GLU A 108 -12.253 -15.331 -15.329 1.00 0.00 C ATOM 1596 C GLU A 108 -11.558 -14.333 -14.399 1.00 0.00 C ATOM 1597 O GLU A 108 -10.758 -14.705 -13.537 1.00 0.00 O ATOM 1598 CB GLU A 108 -12.697 -16.579 -14.565 1.00 0.00 C ATOM 1599 CG GLU A 108 -13.963 -16.386 -13.765 1.00 0.00 C ATOM 1600 CD GLU A 108 -14.409 -17.649 -13.060 1.00 0.00 C ATOM 1601 OE1 GLU A 108 -13.624 -18.209 -12.264 1.00 0.00 O ATOM 1602 OE2 GLU A 108 -15.553 -18.089 -13.298 1.00 0.00 O ATOM 0 H GLU A 108 -10.733 -16.499 -16.159 1.00 0.00 H new ATOM 0 HA GLU A 108 -13.131 -14.838 -15.745 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -12.847 -17.393 -15.274 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -11.896 -16.886 -13.892 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -13.805 -15.600 -13.027 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -14.758 -16.045 -14.428 1.00 0.00 H new ATOM 1609 N MET A 109 -11.849 -13.058 -14.620 1.00 0.00 N ATOM 1610 CA MET A 109 -11.321 -11.983 -13.777 1.00 0.00 C ATOM 1611 C MET A 109 -12.370 -11.520 -12.782 1.00 0.00 C ATOM 1612 O MET A 109 -13.556 -11.511 -13.093 1.00 0.00 O ATOM 1613 CB MET A 109 -10.879 -10.779 -14.625 1.00 0.00 C ATOM 1614 CG MET A 109 -10.535 -11.119 -16.065 1.00 0.00 C ATOM 1615 SD MET A 109 -9.487 -9.881 -16.857 1.00 0.00 S ATOM 1616 CE MET A 109 -10.585 -8.468 -16.900 1.00 0.00 C ATOM 0 H MET A 109 -12.451 -12.738 -15.379 1.00 0.00 H new ATOM 0 HA MET A 109 -10.458 -12.383 -13.244 1.00 0.00 H new ATOM 0 HB2 MET A 109 -11.675 -10.035 -14.620 1.00 0.00 H new ATOM 0 HB3 MET A 109 -10.010 -10.319 -14.155 1.00 0.00 H new ATOM 0 HG2 MET A 109 -10.030 -12.085 -16.093 1.00 0.00 H new ATOM 0 HG3 MET A 109 -11.457 -11.225 -16.637 1.00 0.00 H new ATOM 0 HE1 MET A 109 -10.074 -7.624 -17.364 1.00 0.00 H new ATOM 0 HE2 MET A 109 -11.475 -8.716 -17.479 1.00 0.00 H new ATOM 0 HE3 MET A 109 -10.876 -8.202 -15.884 1.00 0.00 H new ATOM 1626 N PRO A 110 -11.962 -11.136 -11.564 1.00 0.00 N ATOM 1627 CA PRO A 110 -12.886 -10.544 -10.608 1.00 0.00 C ATOM 1628 C PRO A 110 -13.369 -9.186 -11.099 1.00 0.00 C ATOM 1629 O PRO A 110 -12.582 -8.250 -11.262 1.00 0.00 O ATOM 1630 CB PRO A 110 -12.064 -10.398 -9.326 1.00 0.00 C ATOM 1631 CG PRO A 110 -10.637 -10.447 -9.763 1.00 0.00 C ATOM 1632 CD PRO A 110 -10.597 -11.263 -11.029 1.00 0.00 C ATOM 0 HA PRO A 110 -13.779 -11.151 -10.460 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -12.288 -9.459 -8.820 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -12.287 -11.200 -8.622 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -10.252 -9.443 -9.938 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -10.012 -10.898 -8.992 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -9.854 -10.881 -11.729 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -10.340 -12.303 -10.828 1.00 0.00 H new ATOM 1640 N GLY A 111 -14.659 -9.098 -11.345 1.00 0.00 N ATOM 1641 CA GLY A 111 -15.235 -7.883 -11.874 1.00 0.00 C ATOM 1642 C GLY A 111 -16.118 -7.191 -10.875 1.00 0.00 C ATOM 1643 O GLY A 111 -16.960 -7.829 -10.241 1.00 0.00 O ATOM 0 H GLY A 111 -15.327 -9.853 -11.187 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -14.436 -7.207 -12.179 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -15.814 -8.117 -12.768 1.00 0.00 H new ATOM 1647 N VAL A 112 -15.934 -5.894 -10.721 1.00 0.00 N ATOM 1648 CA VAL A 112 -16.816 -5.120 -9.877 1.00 0.00 C ATOM 1649 C VAL A 112 -17.901 -4.511 -10.736 1.00 0.00 C ATOM 1650 O VAL A 112 -17.634 -3.974 -11.811 1.00 0.00 O ATOM 1651 CB VAL A 112 -16.086 -4.026 -9.047 1.00 0.00 C ATOM 1652 CG1 VAL A 112 -15.197 -3.154 -9.910 1.00 0.00 C ATOM 1653 CG2 VAL A 112 -17.096 -3.165 -8.298 1.00 0.00 C ATOM 0 H VAL A 112 -15.188 -5.360 -11.166 1.00 0.00 H new ATOM 0 HA VAL A 112 -17.247 -5.799 -9.141 1.00 0.00 H new ATOM 0 HB VAL A 112 -15.446 -4.539 -8.329 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -14.708 -2.405 -9.288 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -14.442 -3.772 -10.395 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -15.801 -2.657 -10.669 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -16.569 -2.404 -7.722 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -17.763 -2.682 -9.012 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -17.679 -3.792 -7.623 1.00 0.00 H new ATOM 1663 N ILE A 113 -19.128 -4.628 -10.283 1.00 0.00 N ATOM 1664 CA ILE A 113 -20.240 -4.116 -11.034 1.00 0.00 C ATOM 1665 C ILE A 113 -20.419 -2.660 -10.678 1.00 0.00 C ATOM 1666 O ILE A 113 -20.817 -2.322 -9.564 1.00 0.00 O ATOM 1667 CB ILE A 113 -21.526 -4.893 -10.731 1.00 0.00 C ATOM 1668 CG1 ILE A 113 -21.247 -6.394 -10.765 1.00 0.00 C ATOM 1669 CG2 ILE A 113 -22.611 -4.533 -11.735 1.00 0.00 C ATOM 1670 CD1 ILE A 113 -22.446 -7.232 -10.409 1.00 0.00 C ATOM 0 H ILE A 113 -19.376 -5.073 -9.399 1.00 0.00 H new ATOM 0 HA ILE A 113 -20.036 -4.229 -12.099 1.00 0.00 H new ATOM 0 HB ILE A 113 -21.875 -4.622 -9.735 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -20.903 -6.670 -11.762 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -20.436 -6.621 -10.074 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -23.518 -5.093 -11.507 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -22.820 -3.465 -11.678 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -22.274 -4.783 -12.741 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -22.178 -8.288 -10.453 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -22.777 -6.983 -9.401 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -23.252 -7.033 -11.115 1.00 0.00 H new ATOM 1682 N ARG A 114 -20.106 -1.809 -11.629 1.00 0.00 N ATOM 1683 CA ARG A 114 -20.108 -0.381 -11.408 1.00 0.00 C ATOM 1684 C ARG A 114 -21.512 0.125 -11.113 1.00 0.00 C ATOM 1685 O ARG A 114 -21.710 0.885 -10.169 1.00 0.00 O ATOM 1686 CB ARG A 114 -19.490 0.332 -12.621 1.00 0.00 C ATOM 1687 CG ARG A 114 -19.976 1.759 -12.834 1.00 0.00 C ATOM 1688 CD ARG A 114 -19.674 2.639 -11.638 1.00 0.00 C ATOM 1689 NE ARG A 114 -18.238 2.867 -11.479 1.00 0.00 N ATOM 1690 CZ ARG A 114 -17.653 3.220 -10.334 1.00 0.00 C ATOM 1691 NH1 ARG A 114 -18.383 3.445 -9.247 1.00 0.00 N ATOM 1692 NH2 ARG A 114 -16.333 3.351 -10.284 1.00 0.00 N ATOM 0 H ARG A 114 -19.844 -2.086 -12.575 1.00 0.00 H new ATOM 0 HA ARG A 114 -19.500 -0.157 -10.532 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -18.406 0.345 -12.505 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -19.708 -0.249 -13.517 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -19.501 2.176 -13.722 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -21.050 1.754 -13.020 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -20.183 3.596 -11.753 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -20.070 2.174 -10.735 1.00 0.00 H new ATOM 0 HE ARG A 114 -17.644 2.748 -12.300 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -19.398 3.348 -9.285 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -17.929 3.715 -8.374 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -15.772 3.182 -11.119 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -15.880 3.621 -9.411 1.00 0.00 H new ATOM 1706 N GLU A 115 -22.480 -0.296 -11.905 1.00 0.00 N ATOM 1707 CA GLU A 115 -23.836 0.196 -11.748 1.00 0.00 C ATOM 1708 C GLU A 115 -24.827 -0.768 -12.401 1.00 0.00 C ATOM 1709 O GLU A 115 -24.445 -1.584 -13.238 1.00 0.00 O ATOM 1710 CB GLU A 115 -23.948 1.596 -12.361 1.00 0.00 C ATOM 1711 CG GLU A 115 -24.903 2.505 -11.609 1.00 0.00 C ATOM 1712 CD GLU A 115 -25.249 3.759 -12.380 1.00 0.00 C ATOM 1713 OE1 GLU A 115 -24.363 4.625 -12.541 1.00 0.00 O ATOM 1714 OE2 GLU A 115 -26.412 3.893 -12.817 1.00 0.00 O ATOM 0 H GLU A 115 -22.355 -0.972 -12.658 1.00 0.00 H new ATOM 0 HA GLU A 115 -24.078 0.259 -10.687 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -22.960 2.056 -12.382 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -24.280 1.507 -13.395 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -25.819 1.957 -11.386 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -24.457 2.783 -10.654 1.00 0.00 H new ATOM 1721 N ILE A 116 -26.091 -0.690 -12.008 1.00 0.00 N ATOM 1722 CA ILE A 116 -27.119 -1.535 -12.601 1.00 0.00 C ATOM 1723 C ILE A 116 -28.123 -0.689 -13.364 1.00 0.00 C ATOM 1724 O ILE A 116 -28.749 0.211 -12.803 1.00 0.00 O ATOM 1725 CB ILE A 116 -27.891 -2.367 -11.549 1.00 0.00 C ATOM 1726 CG1 ILE A 116 -26.931 -3.134 -10.647 1.00 0.00 C ATOM 1727 CG2 ILE A 116 -28.845 -3.338 -12.232 1.00 0.00 C ATOM 1728 CD1 ILE A 116 -25.977 -4.034 -11.391 1.00 0.00 C ATOM 0 H ILE A 116 -26.428 -0.054 -11.285 1.00 0.00 H new ATOM 0 HA ILE A 116 -26.599 -2.221 -13.270 1.00 0.00 H new ATOM 0 HB ILE A 116 -28.467 -1.676 -10.934 1.00 0.00 H new ATOM 0 HG12 ILE A 116 -26.356 -2.421 -10.056 1.00 0.00 H new ATOM 0 HG13 ILE A 116 -27.510 -3.735 -9.946 1.00 0.00 H new ATOM 0 HG21 ILE A 116 -29.379 -3.915 -11.477 1.00 0.00 H new ATOM 0 HG22 ILE A 116 -29.560 -2.781 -12.836 1.00 0.00 H new ATOM 0 HG23 ILE A 116 -28.279 -4.015 -12.872 1.00 0.00 H new ATOM 0 HD11 ILE A 116 -25.328 -4.544 -10.679 1.00 0.00 H new ATOM 0 HD12 ILE A 116 -26.542 -4.772 -11.960 1.00 0.00 H new ATOM 0 HD13 ILE A 116 -25.370 -3.437 -12.072 1.00 0.00 H new ATOM 1740 N ASN A 117 -28.264 -0.974 -14.641 1.00 0.00 N ATOM 1741 CA ASN A 117 -29.267 -0.325 -15.464 1.00 0.00 C ATOM 1742 C ASN A 117 -30.315 -1.346 -15.877 1.00 0.00 C ATOM 1743 O ASN A 117 -30.039 -2.544 -15.938 1.00 0.00 O ATOM 1744 CB ASN A 117 -28.619 0.317 -16.691 1.00 0.00 C ATOM 1745 CG ASN A 117 -27.945 1.635 -16.365 1.00 0.00 C ATOM 1746 OD1 ASN A 117 -28.558 2.696 -16.459 1.00 0.00 O ATOM 1747 ND2 ASN A 117 -26.684 1.581 -15.969 1.00 0.00 N ATOM 0 H ASN A 117 -27.692 -1.657 -15.137 1.00 0.00 H new ATOM 0 HA ASN A 117 -29.749 0.466 -14.890 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -27.884 -0.370 -17.112 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -29.378 0.480 -17.456 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -26.188 2.439 -15.729 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -26.208 0.681 -15.903 1.00 0.00 H new ATOM 1754 N GLY A 118 -31.517 -0.869 -16.151 1.00 0.00 N ATOM 1755 CA GLY A 118 -32.624 -1.763 -16.424 1.00 0.00 C ATOM 1756 C GLY A 118 -32.564 -2.374 -17.807 1.00 0.00 C ATOM 1757 O GLY A 118 -33.295 -3.316 -18.097 1.00 0.00 O ATOM 0 H GLY A 118 -31.748 0.124 -16.190 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -32.632 -2.560 -15.681 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -33.561 -1.216 -16.315 1.00 0.00 H new ATOM 1761 N ASP A 119 -31.717 -1.821 -18.664 1.00 0.00 N ATOM 1762 CA ASP A 119 -31.567 -2.307 -20.031 1.00 0.00 C ATOM 1763 C ASP A 119 -30.186 -2.933 -20.259 1.00 0.00 C ATOM 1764 O ASP A 119 -29.991 -3.710 -21.189 1.00 0.00 O ATOM 1765 CB ASP A 119 -31.788 -1.138 -21.002 1.00 0.00 C ATOM 1766 CG ASP A 119 -31.576 -1.508 -22.458 1.00 0.00 C ATOM 1767 OD1 ASP A 119 -32.411 -2.252 -23.018 1.00 0.00 O ATOM 1768 OD2 ASP A 119 -30.595 -1.024 -23.062 1.00 0.00 O ATOM 0 H ASP A 119 -31.118 -1.028 -18.435 1.00 0.00 H new ATOM 0 HA ASP A 119 -32.309 -3.086 -20.208 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -32.802 -0.759 -20.876 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -31.110 -0.326 -20.740 1.00 0.00 H new ATOM 1773 N SER A 120 -29.242 -2.619 -19.382 1.00 0.00 N ATOM 1774 CA SER A 120 -27.850 -3.023 -19.564 1.00 0.00 C ATOM 1775 C SER A 120 -27.145 -3.166 -18.214 1.00 0.00 C ATOM 1776 O SER A 120 -27.573 -2.579 -17.221 1.00 0.00 O ATOM 1777 CB SER A 120 -27.132 -1.990 -20.431 1.00 0.00 C ATOM 1778 OG SER A 120 -25.956 -2.519 -21.017 1.00 0.00 O ATOM 0 H SER A 120 -29.414 -2.083 -18.532 1.00 0.00 H new ATOM 0 HA SER A 120 -27.825 -3.993 -20.060 1.00 0.00 H new ATOM 0 HB2 SER A 120 -27.805 -1.644 -21.216 1.00 0.00 H new ATOM 0 HB3 SER A 120 -26.876 -1.121 -19.824 1.00 0.00 H new ATOM 0 HG SER A 120 -25.815 -3.435 -20.697 1.00 0.00 H new ATOM 1784 N ILE A 121 -26.063 -3.932 -18.175 1.00 0.00 N ATOM 1785 CA ILE A 121 -25.295 -4.098 -16.944 1.00 0.00 C ATOM 1786 C ILE A 121 -23.976 -3.330 -17.011 1.00 0.00 C ATOM 1787 O ILE A 121 -23.202 -3.473 -17.957 1.00 0.00 O ATOM 1788 CB ILE A 121 -25.012 -5.583 -16.633 1.00 0.00 C ATOM 1789 CG1 ILE A 121 -26.326 -6.349 -16.453 1.00 0.00 C ATOM 1790 CG2 ILE A 121 -24.143 -5.722 -15.388 1.00 0.00 C ATOM 1791 CD1 ILE A 121 -27.199 -5.822 -15.332 1.00 0.00 C ATOM 0 H ILE A 121 -25.697 -4.447 -18.976 1.00 0.00 H new ATOM 0 HA ILE A 121 -25.907 -3.692 -16.139 1.00 0.00 H new ATOM 0 HB ILE A 121 -24.469 -6.010 -17.476 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -26.888 -6.310 -17.386 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -26.100 -7.398 -16.261 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -23.958 -6.778 -15.190 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -23.194 -5.211 -15.548 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -24.656 -5.277 -14.535 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -28.110 -6.417 -15.270 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -26.658 -5.887 -14.388 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -27.458 -4.782 -15.531 1.00 0.00 H new ATOM 1803 N THR A 122 -23.733 -2.526 -15.991 1.00 0.00 N ATOM 1804 CA THR A 122 -22.531 -1.715 -15.950 1.00 0.00 C ATOM 1805 C THR A 122 -21.378 -2.427 -15.230 1.00 0.00 C ATOM 1806 O THR A 122 -21.369 -2.592 -14.012 1.00 0.00 O ATOM 1807 CB THR A 122 -22.789 -0.345 -15.307 1.00 0.00 C ATOM 1808 OG1 THR A 122 -23.990 0.232 -15.845 1.00 0.00 O ATOM 1809 CG2 THR A 122 -21.619 0.576 -15.576 1.00 0.00 C ATOM 0 H THR A 122 -24.348 -2.418 -15.185 1.00 0.00 H new ATOM 0 HA THR A 122 -22.235 -1.557 -16.987 1.00 0.00 H new ATOM 0 HB THR A 122 -22.906 -0.476 -14.231 1.00 0.00 H new ATOM 0 HG1 THR A 122 -23.812 0.580 -16.744 1.00 0.00 H new ATOM 0 HG21 THR A 122 -21.807 1.547 -15.118 1.00 0.00 H new ATOM 0 HG22 THR A 122 -20.712 0.145 -15.153 1.00 0.00 H new ATOM 0 HG23 THR A 122 -21.494 0.701 -16.652 1.00 0.00 H new ATOM 1817 N VAL A 123 -20.412 -2.823 -16.043 1.00 0.00 N ATOM 1818 CA VAL A 123 -19.239 -3.563 -15.586 1.00 0.00 C ATOM 1819 C VAL A 123 -18.035 -2.632 -15.421 1.00 0.00 C ATOM 1820 O VAL A 123 -17.984 -1.566 -16.025 1.00 0.00 O ATOM 1821 CB VAL A 123 -18.884 -4.731 -16.539 1.00 0.00 C ATOM 1822 CG1 VAL A 123 -17.825 -5.642 -15.922 1.00 0.00 C ATOM 1823 CG2 VAL A 123 -20.131 -5.529 -16.894 1.00 0.00 C ATOM 0 H VAL A 123 -20.417 -2.640 -17.047 1.00 0.00 H new ATOM 0 HA VAL A 123 -19.490 -3.990 -14.615 1.00 0.00 H new ATOM 0 HB VAL A 123 -18.471 -4.305 -17.453 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -17.595 -6.453 -16.613 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -16.921 -5.067 -15.724 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -18.202 -6.057 -14.988 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -19.862 -6.345 -17.564 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -20.573 -5.937 -15.985 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -20.852 -4.877 -17.387 1.00 0.00 H new ATOM 1833 N ASP A 124 -17.077 -3.057 -14.605 1.00 0.00 N ATOM 1834 CA ASP A 124 -15.911 -2.244 -14.282 1.00 0.00 C ATOM 1835 C ASP A 124 -14.763 -3.182 -13.875 1.00 0.00 C ATOM 1836 O ASP A 124 -14.724 -3.632 -12.740 1.00 0.00 O ATOM 1837 CB ASP A 124 -16.237 -1.245 -13.169 1.00 0.00 C ATOM 1838 CG ASP A 124 -15.196 -0.151 -13.038 1.00 0.00 C ATOM 1839 OD1 ASP A 124 -13.995 -0.470 -12.964 1.00 0.00 O ATOM 1840 OD2 ASP A 124 -15.576 1.041 -12.999 1.00 0.00 O ATOM 0 H ASP A 124 -17.086 -3.970 -14.151 1.00 0.00 H new ATOM 0 HA ASP A 124 -15.610 -1.662 -15.153 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -17.209 -0.793 -13.366 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -16.319 -1.778 -12.222 1.00 0.00 H new ATOM 1845 N PHE A 125 -13.846 -3.535 -14.778 1.00 0.00 N ATOM 1846 CA PHE A 125 -12.778 -4.475 -14.409 1.00 0.00 C ATOM 1847 C PHE A 125 -11.545 -3.740 -13.868 1.00 0.00 C ATOM 1848 O PHE A 125 -10.428 -4.263 -13.918 1.00 0.00 O ATOM 1849 CB PHE A 125 -12.360 -5.326 -15.616 1.00 0.00 C ATOM 1850 CG PHE A 125 -13.459 -6.127 -16.272 1.00 0.00 C ATOM 1851 CD1 PHE A 125 -14.237 -5.559 -17.268 1.00 0.00 C ATOM 1852 CD2 PHE A 125 -13.701 -7.450 -15.912 1.00 0.00 C ATOM 1853 CE1 PHE A 125 -15.232 -6.283 -17.892 1.00 0.00 C ATOM 1854 CE2 PHE A 125 -14.698 -8.178 -16.538 1.00 0.00 C ATOM 1855 CZ PHE A 125 -15.463 -7.594 -17.527 1.00 0.00 C ATOM 0 H PHE A 125 -13.816 -3.199 -15.741 1.00 0.00 H new ATOM 0 HA PHE A 125 -13.177 -5.120 -13.626 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -11.920 -4.668 -16.365 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -11.577 -6.014 -15.297 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -14.062 -4.534 -17.560 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -13.106 -7.912 -15.138 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -15.830 -5.824 -18.666 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -14.877 -9.204 -16.252 1.00 0.00 H new ATOM 0 HZ PHE A 125 -16.241 -8.162 -18.015 1.00 0.00 H new ATOM 1865 N ASN A 126 -11.749 -2.530 -13.360 1.00 0.00 N ATOM 1866 CA ASN A 126 -10.635 -1.689 -12.917 1.00 0.00 C ATOM 1867 C ASN A 126 -10.025 -2.138 -11.598 1.00 0.00 C ATOM 1868 O ASN A 126 -10.472 -3.092 -10.962 1.00 0.00 O ATOM 1869 CB ASN A 126 -11.043 -0.222 -12.835 1.00 0.00 C ATOM 1870 CG ASN A 126 -10.971 0.444 -14.185 1.00 0.00 C ATOM 1871 OD1 ASN A 126 -9.931 0.975 -14.572 1.00 0.00 O ATOM 1872 ND2 ASN A 126 -12.067 0.422 -14.914 1.00 0.00 N ATOM 0 H ASN A 126 -12.670 -2.108 -13.244 1.00 0.00 H new ATOM 0 HA ASN A 126 -9.863 -1.803 -13.678 1.00 0.00 H new ATOM 0 HB2 ASN A 126 -12.057 -0.146 -12.444 1.00 0.00 H new ATOM 0 HB3 ASN A 126 -10.391 0.300 -12.135 1.00 0.00 H new ATOM 0 HD21 ASN A 126 -12.074 0.856 -15.837 1.00 0.00 H new ATOM 0 HD22 ASN A 126 -12.909 -0.029 -14.556 1.00 0.00 H new ATOM 1964 N THR A 133 0.534 8.974 -11.931 1.00 0.00 N ATOM 1965 CA THR A 133 1.913 9.075 -11.516 1.00 0.00 C ATOM 1966 C THR A 133 1.982 9.434 -10.039 1.00 0.00 C ATOM 1967 O THR A 133 1.577 10.526 -9.636 1.00 0.00 O ATOM 1968 CB THR A 133 2.649 10.138 -12.344 1.00 0.00 C ATOM 1969 OG1 THR A 133 2.153 10.128 -13.694 1.00 0.00 O ATOM 1970 CG2 THR A 133 4.144 9.868 -12.356 1.00 0.00 C ATOM 0 HA THR A 133 2.396 8.111 -11.678 1.00 0.00 H new ATOM 0 HB THR A 133 2.471 11.113 -11.891 1.00 0.00 H new ATOM 0 HG1 THR A 133 1.220 9.829 -13.697 1.00 0.00 H new ATOM 0 HG21 THR A 133 4.647 10.633 -12.948 1.00 0.00 H new ATOM 0 HG22 THR A 133 4.526 9.890 -11.335 1.00 0.00 H new ATOM 0 HG23 THR A 133 4.333 8.888 -12.793 1.00 0.00 H new ATOM 1978 N VAL A 134 2.493 8.523 -9.233 1.00 0.00 N ATOM 1979 CA VAL A 134 2.505 8.728 -7.801 1.00 0.00 C ATOM 1980 C VAL A 134 3.861 9.224 -7.331 1.00 0.00 C ATOM 1981 O VAL A 134 4.900 8.625 -7.618 1.00 0.00 O ATOM 1982 CB VAL A 134 2.132 7.447 -7.025 1.00 0.00 C ATOM 1983 CG1 VAL A 134 0.635 7.187 -7.081 1.00 0.00 C ATOM 1984 CG2 VAL A 134 2.882 6.248 -7.562 1.00 0.00 C ATOM 0 H VAL A 134 2.902 7.642 -9.544 1.00 0.00 H new ATOM 0 HA VAL A 134 1.750 9.486 -7.592 1.00 0.00 H new ATOM 0 HB VAL A 134 2.419 7.602 -5.985 1.00 0.00 H new ATOM 0 HG11 VAL A 134 0.403 6.278 -6.526 1.00 0.00 H new ATOM 0 HG12 VAL A 134 0.103 8.029 -6.638 1.00 0.00 H new ATOM 0 HG13 VAL A 134 0.325 7.067 -8.119 1.00 0.00 H new ATOM 0 HG21 VAL A 134 2.600 5.360 -6.997 1.00 0.00 H new ATOM 0 HG22 VAL A 134 2.633 6.104 -8.613 1.00 0.00 H new ATOM 0 HG23 VAL A 134 3.955 6.416 -7.463 1.00 0.00 H new ATOM 1994 N HIS A 135 3.842 10.367 -6.676 1.00 0.00 N ATOM 1995 CA HIS A 135 5.043 10.898 -6.060 1.00 0.00 C ATOM 1996 C HIS A 135 5.006 10.673 -4.565 1.00 0.00 C ATOM 1997 O HIS A 135 3.972 10.856 -3.924 1.00 0.00 O ATOM 1998 CB HIS A 135 5.259 12.379 -6.402 1.00 0.00 C ATOM 1999 CG HIS A 135 4.214 13.334 -5.914 1.00 0.00 C ATOM 2000 ND1 HIS A 135 4.356 14.071 -4.763 1.00 0.00 N ATOM 2001 CD2 HIS A 135 3.044 13.728 -6.467 1.00 0.00 C ATOM 2002 CE1 HIS A 135 3.325 14.875 -4.627 1.00 0.00 C ATOM 2003 NE2 HIS A 135 2.510 14.689 -5.649 1.00 0.00 N ATOM 0 H HIS A 135 3.011 10.946 -6.556 1.00 0.00 H new ATOM 0 HA HIS A 135 5.897 10.358 -6.469 1.00 0.00 H new ATOM 0 HB2 HIS A 135 6.221 12.687 -5.993 1.00 0.00 H new ATOM 0 HB3 HIS A 135 5.328 12.473 -7.486 1.00 0.00 H new ATOM 0 HD2 HIS A 135 2.611 13.354 -7.383 1.00 0.00 H new ATOM 0 HE1 HIS A 135 3.171 15.571 -3.816 1.00 0.00 H new ATOM 0 HE2 HIS A 135 1.629 15.179 -5.804 1.00 0.00 H new ATOM 2012 N PHE A 136 6.136 10.268 -4.014 1.00 0.00 N ATOM 2013 CA PHE A 136 6.210 9.918 -2.617 1.00 0.00 C ATOM 2014 C PHE A 136 7.436 10.538 -1.978 1.00 0.00 C ATOM 2015 O PHE A 136 8.522 10.568 -2.561 1.00 0.00 O ATOM 2016 CB PHE A 136 6.230 8.398 -2.410 1.00 0.00 C ATOM 2017 CG PHE A 136 6.442 7.589 -3.661 1.00 0.00 C ATOM 2018 CD1 PHE A 136 7.714 7.374 -4.153 1.00 0.00 C ATOM 2019 CD2 PHE A 136 5.365 7.038 -4.342 1.00 0.00 C ATOM 2020 CE1 PHE A 136 7.909 6.632 -5.299 1.00 0.00 C ATOM 2021 CE2 PHE A 136 5.558 6.295 -5.485 1.00 0.00 C ATOM 2022 CZ PHE A 136 6.830 6.092 -5.965 1.00 0.00 C ATOM 0 H PHE A 136 7.017 10.175 -4.520 1.00 0.00 H new ATOM 0 HA PHE A 136 5.314 10.312 -2.138 1.00 0.00 H new ATOM 0 HB2 PHE A 136 7.019 8.154 -1.699 1.00 0.00 H new ATOM 0 HB3 PHE A 136 5.287 8.096 -1.955 1.00 0.00 H new ATOM 0 HD1 PHE A 136 8.565 7.791 -3.635 1.00 0.00 H new ATOM 0 HD2 PHE A 136 4.363 7.194 -3.970 1.00 0.00 H new ATOM 0 HE1 PHE A 136 8.909 6.474 -5.675 1.00 0.00 H new ATOM 0 HE2 PHE A 136 4.711 5.872 -6.004 1.00 0.00 H new ATOM 0 HZ PHE A 136 6.983 5.511 -6.862 1.00 0.00 H new ATOM 2032 N ASP A 137 7.233 11.039 -0.783 1.00 0.00 N ATOM 2033 CA ASP A 137 8.313 11.579 0.017 1.00 0.00 C ATOM 2034 C ASP A 137 8.738 10.527 1.014 1.00 0.00 C ATOM 2035 O ASP A 137 8.016 10.250 1.958 1.00 0.00 O ATOM 2036 CB ASP A 137 7.880 12.855 0.737 1.00 0.00 C ATOM 2037 CG ASP A 137 9.011 13.468 1.532 1.00 0.00 C ATOM 2038 OD1 ASP A 137 9.983 13.954 0.914 1.00 0.00 O ATOM 2039 OD2 ASP A 137 8.940 13.468 2.778 1.00 0.00 O ATOM 0 H ASP A 137 6.317 11.085 -0.336 1.00 0.00 H new ATOM 0 HA ASP A 137 9.150 11.841 -0.631 1.00 0.00 H new ATOM 0 HB2 ASP A 137 7.517 13.578 0.007 1.00 0.00 H new ATOM 0 HB3 ASP A 137 7.048 12.630 1.404 1.00 0.00 H new ATOM 2044 N ILE A 138 9.906 9.944 0.799 1.00 0.00 N ATOM 2045 CA ILE A 138 10.301 8.750 1.527 1.00 0.00 C ATOM 2046 C ILE A 138 11.584 8.986 2.307 1.00 0.00 C ATOM 2047 O ILE A 138 12.622 9.337 1.744 1.00 0.00 O ATOM 2048 CB ILE A 138 10.468 7.559 0.558 1.00 0.00 C ATOM 2049 CG1 ILE A 138 9.095 7.144 0.020 1.00 0.00 C ATOM 2050 CG2 ILE A 138 11.167 6.384 1.230 1.00 0.00 C ATOM 2051 CD1 ILE A 138 9.144 6.011 -0.976 1.00 0.00 C ATOM 0 H ILE A 138 10.597 10.278 0.127 1.00 0.00 H new ATOM 0 HA ILE A 138 9.512 8.511 2.240 1.00 0.00 H new ATOM 0 HB ILE A 138 11.100 7.873 -0.273 1.00 0.00 H new ATOM 0 HG12 ILE A 138 8.461 6.851 0.857 1.00 0.00 H new ATOM 0 HG13 ILE A 138 8.624 8.007 -0.450 1.00 0.00 H new ATOM 0 HG21 ILE A 138 11.267 5.565 0.518 1.00 0.00 H new ATOM 0 HG22 ILE A 138 12.156 6.694 1.568 1.00 0.00 H new ATOM 0 HG23 ILE A 138 10.579 6.052 2.085 1.00 0.00 H new ATOM 0 HD11 ILE A 138 8.133 5.776 -1.310 1.00 0.00 H new ATOM 0 HD12 ILE A 138 9.750 6.306 -1.833 1.00 0.00 H new ATOM 0 HD13 ILE A 138 9.584 5.132 -0.506 1.00 0.00 H new ATOM 2063 N GLU A 139 11.502 8.816 3.614 1.00 0.00 N ATOM 2064 CA GLU A 139 12.637 9.033 4.485 1.00 0.00 C ATOM 2065 C GLU A 139 13.130 7.712 5.066 1.00 0.00 C ATOM 2066 O GLU A 139 12.432 7.084 5.864 1.00 0.00 O ATOM 2067 CB GLU A 139 12.216 9.983 5.605 1.00 0.00 C ATOM 2068 CG GLU A 139 11.567 11.255 5.084 1.00 0.00 C ATOM 2069 CD GLU A 139 11.089 12.177 6.186 1.00 0.00 C ATOM 2070 OE1 GLU A 139 11.924 12.907 6.761 1.00 0.00 O ATOM 2071 OE2 GLU A 139 9.874 12.188 6.473 1.00 0.00 O ATOM 0 H GLU A 139 10.652 8.526 4.097 1.00 0.00 H new ATOM 0 HA GLU A 139 13.456 9.472 3.915 1.00 0.00 H new ATOM 0 HB2 GLU A 139 11.519 9.470 6.268 1.00 0.00 H new ATOM 0 HB3 GLU A 139 13.090 10.244 6.202 1.00 0.00 H new ATOM 0 HG2 GLU A 139 12.281 11.789 4.457 1.00 0.00 H new ATOM 0 HG3 GLU A 139 10.722 10.990 4.449 1.00 0.00 H new ATOM 2078 N VAL A 140 14.318 7.284 4.646 1.00 0.00 N ATOM 2079 CA VAL A 140 14.911 6.050 5.162 1.00 0.00 C ATOM 2080 C VAL A 140 15.243 6.197 6.645 1.00 0.00 C ATOM 2081 O VAL A 140 16.131 6.969 7.017 1.00 0.00 O ATOM 2082 CB VAL A 140 16.203 5.663 4.409 1.00 0.00 C ATOM 2083 CG1 VAL A 140 16.737 4.327 4.916 1.00 0.00 C ATOM 2084 CG2 VAL A 140 15.967 5.609 2.907 1.00 0.00 C ATOM 0 H VAL A 140 14.888 7.770 3.953 1.00 0.00 H new ATOM 0 HA VAL A 140 14.171 5.264 5.012 1.00 0.00 H new ATOM 0 HB VAL A 140 16.950 6.432 4.604 1.00 0.00 H new ATOM 0 HG11 VAL A 140 17.647 4.070 4.374 1.00 0.00 H new ATOM 0 HG12 VAL A 140 16.957 4.404 5.981 1.00 0.00 H new ATOM 0 HG13 VAL A 140 15.988 3.551 4.756 1.00 0.00 H new ATOM 0 HG21 VAL A 140 16.893 5.334 2.403 1.00 0.00 H new ATOM 0 HG22 VAL A 140 15.200 4.867 2.686 1.00 0.00 H new ATOM 0 HG23 VAL A 140 15.639 6.587 2.555 1.00 0.00 H new ATOM 2094 N LEU A 141 14.523 5.474 7.487 1.00 0.00 N ATOM 2095 CA LEU A 141 14.752 5.536 8.922 1.00 0.00 C ATOM 2096 C LEU A 141 15.619 4.365 9.370 1.00 0.00 C ATOM 2097 O LEU A 141 16.617 4.551 10.058 1.00 0.00 O ATOM 2098 CB LEU A 141 13.417 5.500 9.662 1.00 0.00 C ATOM 2099 CG LEU A 141 12.370 6.503 9.184 1.00 0.00 C ATOM 2100 CD1 LEU A 141 11.091 6.317 9.974 1.00 0.00 C ATOM 2101 CD2 LEU A 141 12.878 7.933 9.307 1.00 0.00 C ATOM 0 H LEU A 141 13.777 4.839 7.203 1.00 0.00 H new ATOM 0 HA LEU A 141 15.269 6.467 9.154 1.00 0.00 H new ATOM 0 HB2 LEU A 141 13.000 4.497 9.573 1.00 0.00 H new ATOM 0 HB3 LEU A 141 13.605 5.675 10.721 1.00 0.00 H new ATOM 0 HG LEU A 141 12.168 6.319 8.129 1.00 0.00 H new ATOM 0 HD11 LEU A 141 10.344 7.034 9.632 1.00 0.00 H new ATOM 0 HD12 LEU A 141 10.716 5.304 9.826 1.00 0.00 H new ATOM 0 HD13 LEU A 141 11.291 6.479 11.033 1.00 0.00 H new ATOM 0 HD21 LEU A 141 12.110 8.623 8.959 1.00 0.00 H new ATOM 0 HD22 LEU A 141 13.113 8.147 10.350 1.00 0.00 H new ATOM 0 HD23 LEU A 141 13.776 8.054 8.701 1.00 0.00 H new ATOM 2113 N GLU A 142 15.234 3.163 8.954 1.00 0.00 N ATOM 2114 CA GLU A 142 15.997 1.952 9.250 1.00 0.00 C ATOM 2115 C GLU A 142 16.003 1.008 8.066 1.00 0.00 C ATOM 2116 O GLU A 142 15.186 1.129 7.153 1.00 0.00 O ATOM 2117 CB GLU A 142 15.430 1.194 10.450 1.00 0.00 C ATOM 2118 CG GLU A 142 15.719 1.823 11.797 1.00 0.00 C ATOM 2119 CD GLU A 142 17.187 2.112 12.022 1.00 0.00 C ATOM 2120 OE1 GLU A 142 18.020 1.214 11.780 1.00 0.00 O ATOM 2121 OE2 GLU A 142 17.518 3.234 12.456 1.00 0.00 O ATOM 0 H GLU A 142 14.390 2.999 8.405 1.00 0.00 H new ATOM 0 HA GLU A 142 17.010 2.283 9.477 1.00 0.00 H new ATOM 0 HB2 GLU A 142 14.350 1.108 10.330 1.00 0.00 H new ATOM 0 HB3 GLU A 142 15.833 0.181 10.445 1.00 0.00 H new ATOM 0 HG2 GLU A 142 15.156 2.752 11.884 1.00 0.00 H new ATOM 0 HG3 GLU A 142 15.362 1.159 12.584 1.00 0.00 H new ATOM 2128 N ILE A 143 16.922 0.060 8.108 1.00 0.00 N ATOM 2129 CA ILE A 143 17.017 -0.974 7.084 1.00 0.00 C ATOM 2130 C ILE A 143 17.088 -2.352 7.727 1.00 0.00 C ATOM 2131 O ILE A 143 18.076 -2.703 8.374 1.00 0.00 O ATOM 2132 CB ILE A 143 18.243 -0.770 6.173 1.00 0.00 C ATOM 2133 CG1 ILE A 143 18.121 0.550 5.418 1.00 0.00 C ATOM 2134 CG2 ILE A 143 18.387 -1.929 5.195 1.00 0.00 C ATOM 2135 CD1 ILE A 143 19.401 0.967 4.736 1.00 0.00 C ATOM 0 H ILE A 143 17.621 -0.018 8.847 1.00 0.00 H new ATOM 0 HA ILE A 143 16.120 -0.900 6.469 1.00 0.00 H new ATOM 0 HB ILE A 143 19.136 -0.738 6.797 1.00 0.00 H new ATOM 0 HG12 ILE A 143 17.331 0.462 4.672 1.00 0.00 H new ATOM 0 HG13 ILE A 143 17.816 1.332 6.114 1.00 0.00 H new ATOM 0 HG21 ILE A 143 19.259 -1.764 4.562 1.00 0.00 H new ATOM 0 HG22 ILE A 143 18.512 -2.859 5.749 1.00 0.00 H new ATOM 0 HG23 ILE A 143 17.494 -1.994 4.573 1.00 0.00 H new ATOM 0 HD11 ILE A 143 19.246 1.913 4.218 1.00 0.00 H new ATOM 0 HD12 ILE A 143 20.188 1.086 5.481 1.00 0.00 H new ATOM 0 HD13 ILE A 143 19.695 0.203 4.016 1.00 0.00 H new ATOM 2147 N ASP A 144 16.023 -3.116 7.556 1.00 0.00 N ATOM 2148 CA ASP A 144 15.953 -4.477 8.061 1.00 0.00 C ATOM 2149 C ASP A 144 16.722 -5.409 7.124 1.00 0.00 C ATOM 2150 O ASP A 144 16.447 -5.452 5.924 1.00 0.00 O ATOM 2151 CB ASP A 144 14.490 -4.914 8.180 1.00 0.00 C ATOM 2152 CG ASP A 144 14.329 -6.215 8.936 1.00 0.00 C ATOM 2153 OD1 ASP A 144 14.399 -6.192 10.182 1.00 0.00 O ATOM 2154 OD2 ASP A 144 14.107 -7.264 8.295 1.00 0.00 O ATOM 0 H ASP A 144 15.183 -2.811 7.064 1.00 0.00 H new ATOM 0 HA ASP A 144 16.406 -4.524 9.051 1.00 0.00 H new ATOM 0 HB2 ASP A 144 13.922 -4.133 8.684 1.00 0.00 H new ATOM 0 HB3 ASP A 144 14.065 -5.023 7.182 1.00 0.00 H new ATOM 2159 N PRO A 145 17.698 -6.162 7.655 1.00 0.00 N ATOM 2160 CA PRO A 145 18.565 -7.020 6.841 1.00 0.00 C ATOM 2161 C PRO A 145 17.802 -8.178 6.207 1.00 0.00 C ATOM 2162 O PRO A 145 16.836 -8.689 6.781 1.00 0.00 O ATOM 2163 CB PRO A 145 19.602 -7.536 7.839 1.00 0.00 C ATOM 2164 CG PRO A 145 18.937 -7.441 9.168 1.00 0.00 C ATOM 2165 CD PRO A 145 18.016 -6.255 9.089 1.00 0.00 C ATOM 0 HA PRO A 145 19.003 -6.478 6.003 1.00 0.00 H new ATOM 0 HB2 PRO A 145 19.890 -8.563 7.614 1.00 0.00 H new ATOM 0 HB3 PRO A 145 20.512 -6.936 7.809 1.00 0.00 H new ATOM 0 HG2 PRO A 145 18.381 -8.352 9.392 1.00 0.00 H new ATOM 0 HG3 PRO A 145 19.671 -7.312 9.963 1.00 0.00 H new ATOM 0 HD2 PRO A 145 17.119 -6.403 9.690 1.00 0.00 H new ATOM 0 HD3 PRO A 145 18.498 -5.348 9.453 1.00 0.00 H new