USER MOD reduce.3.24.130724 H: found=0, std=0, add=879, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 880 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 100 THR OG1 : rot -131:sc= 0.261 USER MOD Set 1.2: A 102 THR OG1 : rot 180:sc= 0.272 USER MOD Set 2.1: A 11 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 7 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= -0.196 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 37 HIS : +bothHN:sc= -8.31! C(o=-8.3!,f=-15!) USER MOD Single : A 39 LYS NZ :NH3+ -156:sc= 0.926 (180deg=0.591) USER MOD Single : A 41 ASN : amide:sc= 0.18 K(o=0.18,f=-1.6!) USER MOD Single : A 44 MET CE :methyl -122:sc= -1.27 (180deg=-4.77!) USER MOD Single : A 51 HIS : no HD1:sc= -0.371 X(o=-0.37,f=0.042) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ -158:sc= 0.25 (180deg=0.108) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 LYS NZ :NH3+ 164:sc=-0.00427 (180deg=-0.159) USER MOD Single : A 80 TYR OH : rot 180:sc= -0.0602 USER MOD Single : A 83 THR OG1 : rot 84:sc= -1.29 USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ -151:sc= -0.244 (180deg=-1.29!) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 GLN : amide:sc= -0.735 K(o=-0.74,f=-6!) USER MOD Single : A 96 ASN : amide:sc= -1.29 K(o=-1.3,f=-2.9!) USER MOD Single : A 106 ASN : amide:sc= -0.499 X(o=-0.5,f=-0.68) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 180:sc= 0.0258 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 6 162.500 11.484 9.765 1.00 0.00 N ATOM 2 CA GLN A 6 163.220 11.331 8.474 1.00 0.00 C ATOM 3 C GLN A 6 164.729 11.421 8.671 1.00 0.00 C ATOM 4 O GLN A 6 165.275 12.503 8.880 1.00 0.00 O ATOM 5 CB GLN A 6 162.746 12.429 7.520 1.00 0.00 C ATOM 6 CG GLN A 6 163.043 13.837 8.013 1.00 0.00 C ATOM 7 CD GLN A 6 161.823 14.737 7.980 1.00 0.00 C ATOM 8 OE1 GLN A 6 161.154 14.933 8.996 1.00 0.00 O ATOM 9 NE2 GLN A 6 161.527 15.290 6.810 1.00 0.00 N ATOM 0 HA GLN A 6 163.002 10.348 8.056 1.00 0.00 H new ATOM 0 HB2 GLN A 6 163.222 12.285 6.550 1.00 0.00 H new ATOM 0 HB3 GLN A 6 161.672 12.326 7.367 1.00 0.00 H new ATOM 0 HG2 GLN A 6 163.426 13.788 9.032 1.00 0.00 H new ATOM 0 HG3 GLN A 6 163.829 14.275 7.398 1.00 0.00 H new ATOM 0 HE21 GLN A 6 162.109 15.100 5.994 1.00 0.00 H new ATOM 0 HE22 GLN A 6 160.718 15.905 6.727 1.00 0.00 H new ATOM 18 N TYR A 7 165.398 10.274 8.603 1.00 0.00 N ATOM 19 CA TYR A 7 166.846 10.224 8.774 1.00 0.00 C ATOM 20 C TYR A 7 167.554 10.358 7.435 1.00 0.00 C ATOM 21 O TYR A 7 166.920 10.416 6.382 1.00 0.00 O ATOM 22 CB TYR A 7 167.255 8.915 9.455 1.00 0.00 C ATOM 23 CG TYR A 7 168.710 8.851 9.862 1.00 0.00 C ATOM 24 CD1 TYR A 7 169.232 9.750 10.783 1.00 0.00 C ATOM 25 CD2 TYR A 7 169.559 7.891 9.327 1.00 0.00 C ATOM 26 CE1 TYR A 7 170.562 9.695 11.160 1.00 0.00 C ATOM 27 CE2 TYR A 7 170.889 7.830 9.698 1.00 0.00 C ATOM 28 CZ TYR A 7 171.385 8.733 10.614 1.00 0.00 C ATOM 29 OH TYR A 7 172.708 8.675 10.985 1.00 0.00 O ATOM 0 H TYR A 7 164.961 9.368 8.431 1.00 0.00 H new ATOM 0 HA TYR A 7 167.143 11.061 9.406 1.00 0.00 H new ATOM 0 HB2 TYR A 7 166.636 8.771 10.341 1.00 0.00 H new ATOM 0 HB3 TYR A 7 167.042 8.086 8.780 1.00 0.00 H new ATOM 0 HD1 TYR A 7 168.589 10.504 11.212 1.00 0.00 H new ATOM 0 HD2 TYR A 7 169.174 7.181 8.610 1.00 0.00 H new ATOM 0 HE1 TYR A 7 170.953 10.401 11.877 1.00 0.00 H new ATOM 0 HE2 TYR A 7 171.537 7.078 9.272 1.00 0.00 H new ATOM 0 HH TYR A 7 173.149 7.940 10.510 1.00 0.00 H new ATOM 39 N VAL A 8 168.875 10.409 7.491 1.00 0.00 N ATOM 40 CA VAL A 8 169.690 10.540 6.290 1.00 0.00 C ATOM 41 C VAL A 8 170.590 9.323 6.100 1.00 0.00 C ATOM 42 O VAL A 8 170.839 8.571 7.040 1.00 0.00 O ATOM 43 CB VAL A 8 170.564 11.807 6.344 1.00 0.00 C ATOM 44 CG1 VAL A 8 171.239 12.051 5.004 1.00 0.00 C ATOM 45 CG2 VAL A 8 169.731 13.012 6.757 1.00 0.00 C ATOM 0 H VAL A 8 169.409 10.362 8.359 1.00 0.00 H new ATOM 0 HA VAL A 8 169.003 10.615 5.447 1.00 0.00 H new ATOM 0 HB VAL A 8 171.342 11.657 7.092 1.00 0.00 H new ATOM 0 HG11 VAL A 8 171.852 12.951 5.064 1.00 0.00 H new ATOM 0 HG12 VAL A 8 171.870 11.198 4.754 1.00 0.00 H new ATOM 0 HG13 VAL A 8 170.480 12.179 4.232 1.00 0.00 H new ATOM 0 HG21 VAL A 8 170.365 13.898 6.790 1.00 0.00 H new ATOM 0 HG22 VAL A 8 168.930 13.165 6.034 1.00 0.00 H new ATOM 0 HG23 VAL A 8 169.301 12.836 7.743 1.00 0.00 H new ATOM 55 N VAL A 9 171.073 9.134 4.876 1.00 0.00 N ATOM 56 CA VAL A 9 171.944 8.007 4.563 1.00 0.00 C ATOM 57 C VAL A 9 173.289 8.133 5.284 1.00 0.00 C ATOM 58 O VAL A 9 173.865 9.218 5.353 1.00 0.00 O ATOM 59 CB VAL A 9 172.186 7.898 3.044 1.00 0.00 C ATOM 60 CG1 VAL A 9 172.794 9.183 2.503 1.00 0.00 C ATOM 61 CG2 VAL A 9 173.068 6.699 2.720 1.00 0.00 C ATOM 0 H VAL A 9 170.876 9.747 4.085 1.00 0.00 H new ATOM 0 HA VAL A 9 171.440 7.104 4.908 1.00 0.00 H new ATOM 0 HB VAL A 9 171.223 7.748 2.556 1.00 0.00 H new ATOM 0 HG11 VAL A 9 172.957 9.085 1.430 1.00 0.00 H new ATOM 0 HG12 VAL A 9 172.115 10.015 2.693 1.00 0.00 H new ATOM 0 HG13 VAL A 9 173.746 9.372 2.999 1.00 0.00 H new ATOM 0 HG21 VAL A 9 173.225 6.643 1.643 1.00 0.00 H new ATOM 0 HG22 VAL A 9 174.030 6.809 3.221 1.00 0.00 H new ATOM 0 HG23 VAL A 9 172.582 5.786 3.064 1.00 0.00 H new ATOM 71 N PRO A 10 173.804 7.020 5.841 1.00 0.00 N ATOM 72 CA PRO A 10 175.080 7.018 6.562 1.00 0.00 C ATOM 73 C PRO A 10 176.280 7.205 5.643 1.00 0.00 C ATOM 74 O PRO A 10 176.133 7.502 4.457 1.00 0.00 O ATOM 75 CB PRO A 10 175.129 5.634 7.208 1.00 0.00 C ATOM 76 CG PRO A 10 174.249 4.780 6.362 1.00 0.00 C ATOM 77 CD PRO A 10 173.179 5.683 5.816 1.00 0.00 C ATOM 0 HA PRO A 10 175.133 7.843 7.272 1.00 0.00 H new ATOM 0 HB2 PRO A 10 176.148 5.247 7.234 1.00 0.00 H new ATOM 0 HB3 PRO A 10 174.774 5.667 8.238 1.00 0.00 H new ATOM 0 HG2 PRO A 10 174.817 4.318 5.554 1.00 0.00 H new ATOM 0 HG3 PRO A 10 173.813 3.971 6.948 1.00 0.00 H new ATOM 0 HD2 PRO A 10 172.889 5.395 4.805 1.00 0.00 H new ATOM 0 HD3 PRO A 10 172.277 5.651 6.428 1.00 0.00 H new ATOM 85 N SER A 11 177.470 7.027 6.207 1.00 0.00 N ATOM 86 CA SER A 11 178.709 7.174 5.457 1.00 0.00 C ATOM 87 C SER A 11 179.370 5.823 5.214 1.00 0.00 C ATOM 88 O SER A 11 179.591 5.052 6.147 1.00 0.00 O ATOM 89 CB SER A 11 179.667 8.097 6.208 1.00 0.00 C ATOM 90 OG SER A 11 180.679 8.593 5.350 1.00 0.00 O ATOM 0 H SER A 11 177.601 6.779 7.188 1.00 0.00 H new ATOM 0 HA SER A 11 178.469 7.612 4.488 1.00 0.00 H new ATOM 0 HB2 SER A 11 179.111 8.930 6.638 1.00 0.00 H new ATOM 0 HB3 SER A 11 180.123 7.556 7.037 1.00 0.00 H new ATOM 0 HG SER A 11 181.277 9.182 5.856 1.00 0.00 H new ATOM 96 N ALA A 12 179.683 5.540 3.952 1.00 0.00 N ATOM 97 CA ALA A 12 180.315 4.277 3.586 1.00 0.00 C ATOM 98 C ALA A 12 181.833 4.345 3.732 1.00 0.00 C ATOM 99 O ALA A 12 182.518 4.970 2.923 1.00 0.00 O ATOM 100 CB ALA A 12 179.936 3.894 2.163 1.00 0.00 C ATOM 0 H ALA A 12 179.509 6.168 3.167 1.00 0.00 H new ATOM 0 HA ALA A 12 179.952 3.511 4.271 1.00 0.00 H new ATOM 0 HB1 ALA A 12 180.413 2.950 1.901 1.00 0.00 H new ATOM 0 HB2 ALA A 12 178.854 3.786 2.091 1.00 0.00 H new ATOM 0 HB3 ALA A 12 180.269 4.672 1.476 1.00 0.00 H new ATOM 106 N LYS A 13 182.352 3.684 4.764 1.00 0.00 N ATOM 107 CA LYS A 13 183.790 3.653 5.012 1.00 0.00 C ATOM 108 C LYS A 13 184.393 2.369 4.451 1.00 0.00 C ATOM 109 O LYS A 13 184.162 1.283 4.982 1.00 0.00 O ATOM 110 CB LYS A 13 184.075 3.757 6.513 1.00 0.00 C ATOM 111 CG LYS A 13 185.249 4.662 6.849 1.00 0.00 C ATOM 112 CD LYS A 13 184.816 6.114 6.975 1.00 0.00 C ATOM 113 CE LYS A 13 185.114 6.898 5.707 1.00 0.00 C ATOM 114 NZ LYS A 13 183.970 7.765 5.308 1.00 0.00 N ATOM 0 H LYS A 13 181.797 3.162 5.442 1.00 0.00 H new ATOM 0 HA LYS A 13 184.248 4.506 4.511 1.00 0.00 H new ATOM 0 HB2 LYS A 13 183.184 4.129 7.018 1.00 0.00 H new ATOM 0 HB3 LYS A 13 184.272 2.760 6.907 1.00 0.00 H new ATOM 0 HG2 LYS A 13 185.706 4.335 7.783 1.00 0.00 H new ATOM 0 HG3 LYS A 13 186.011 4.574 6.074 1.00 0.00 H new ATOM 0 HD2 LYS A 13 183.748 6.159 7.189 1.00 0.00 H new ATOM 0 HD3 LYS A 13 185.330 6.576 7.818 1.00 0.00 H new ATOM 0 HE2 LYS A 13 186.000 7.514 5.861 1.00 0.00 H new ATOM 0 HE3 LYS A 13 185.344 6.205 4.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 184.213 8.283 4.439 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 183.131 7.175 5.136 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 183.766 8.443 6.070 1.00 0.00 H new ATOM 128 N LEU A 14 185.148 2.497 3.366 1.00 0.00 N ATOM 129 CA LEU A 14 185.761 1.342 2.722 1.00 0.00 C ATOM 130 C LEU A 14 187.247 1.222 3.049 1.00 0.00 C ATOM 131 O LEU A 14 187.907 2.208 3.378 1.00 0.00 O ATOM 132 CB LEU A 14 185.571 1.429 1.207 1.00 0.00 C ATOM 133 CG LEU A 14 184.119 1.545 0.743 1.00 0.00 C ATOM 134 CD1 LEU A 14 183.608 2.964 0.943 1.00 0.00 C ATOM 135 CD2 LEU A 14 183.990 1.129 -0.715 1.00 0.00 C ATOM 0 H LEU A 14 185.350 3.389 2.914 1.00 0.00 H new ATOM 0 HA LEU A 14 185.265 0.451 3.109 1.00 0.00 H new ATOM 0 HB2 LEU A 14 186.125 2.291 0.835 1.00 0.00 H new ATOM 0 HB3 LEU A 14 186.013 0.544 0.749 1.00 0.00 H new ATOM 0 HG LEU A 14 183.509 0.872 1.346 1.00 0.00 H new ATOM 0 HD11 LEU A 14 182.573 3.029 0.607 1.00 0.00 H new ATOM 0 HD12 LEU A 14 183.664 3.225 2.000 1.00 0.00 H new ATOM 0 HD13 LEU A 14 184.221 3.656 0.365 1.00 0.00 H new ATOM 0 HD21 LEU A 14 182.950 1.218 -1.028 1.00 0.00 H new ATOM 0 HD22 LEU A 14 184.612 1.776 -1.334 1.00 0.00 H new ATOM 0 HD23 LEU A 14 184.316 0.095 -0.829 1.00 0.00 H new ATOM 147 N GLU A 15 187.762 0.000 2.942 1.00 0.00 N ATOM 148 CA GLU A 15 189.168 -0.282 3.207 1.00 0.00 C ATOM 149 C GLU A 15 189.721 -1.229 2.143 1.00 0.00 C ATOM 150 O GLU A 15 189.030 -2.151 1.712 1.00 0.00 O ATOM 151 CB GLU A 15 189.334 -0.902 4.595 1.00 0.00 C ATOM 152 CG GLU A 15 188.791 -0.032 5.718 1.00 0.00 C ATOM 153 CD GLU A 15 189.877 0.454 6.658 1.00 0.00 C ATOM 154 OE1 GLU A 15 190.351 -0.353 7.487 1.00 0.00 O ATOM 155 OE2 GLU A 15 190.257 1.641 6.567 1.00 0.00 O ATOM 0 H GLU A 15 187.218 -0.819 2.670 1.00 0.00 H new ATOM 0 HA GLU A 15 189.724 0.655 3.174 1.00 0.00 H new ATOM 0 HB2 GLU A 15 188.827 -1.867 4.616 1.00 0.00 H new ATOM 0 HB3 GLU A 15 190.392 -1.094 4.774 1.00 0.00 H new ATOM 0 HG2 GLU A 15 188.275 0.827 5.290 1.00 0.00 H new ATOM 0 HG3 GLU A 15 188.051 -0.597 6.285 1.00 0.00 H new ATOM 162 N ALA A 16 190.959 -0.997 1.707 1.00 0.00 N ATOM 163 CA ALA A 16 191.560 -1.843 0.679 1.00 0.00 C ATOM 164 C ALA A 16 192.230 -3.068 1.290 1.00 0.00 C ATOM 165 O ALA A 16 193.338 -2.992 1.812 1.00 0.00 O ATOM 166 CB ALA A 16 192.563 -1.043 -0.140 1.00 0.00 C ATOM 0 H ALA A 16 191.557 -0.242 2.044 1.00 0.00 H new ATOM 0 HA ALA A 16 190.763 -2.192 0.022 1.00 0.00 H new ATOM 0 HB1 ALA A 16 193.004 -1.685 -0.903 1.00 0.00 H new ATOM 0 HB2 ALA A 16 192.056 -0.206 -0.619 1.00 0.00 H new ATOM 0 HB3 ALA A 16 193.348 -0.665 0.515 1.00 0.00 H new ATOM 172 N ILE A 17 191.536 -4.202 1.219 1.00 0.00 N ATOM 173 CA ILE A 17 192.050 -5.453 1.764 1.00 0.00 C ATOM 174 C ILE A 17 193.145 -6.037 0.875 1.00 0.00 C ATOM 175 O ILE A 17 193.067 -5.970 -0.350 1.00 0.00 O ATOM 176 CB ILE A 17 190.929 -6.503 1.928 1.00 0.00 C ATOM 177 CG1 ILE A 17 189.667 -5.857 2.510 1.00 0.00 C ATOM 178 CG2 ILE A 17 191.399 -7.643 2.817 1.00 0.00 C ATOM 179 CD1 ILE A 17 189.905 -5.140 3.821 1.00 0.00 C ATOM 0 H ILE A 17 190.615 -4.278 0.788 1.00 0.00 H new ATOM 0 HA ILE A 17 192.466 -5.217 2.744 1.00 0.00 H new ATOM 0 HB ILE A 17 190.687 -6.906 0.944 1.00 0.00 H new ATOM 0 HG12 ILE A 17 189.264 -5.149 1.786 1.00 0.00 H new ATOM 0 HG13 ILE A 17 188.910 -6.627 2.658 1.00 0.00 H new ATOM 0 HG21 ILE A 17 190.599 -8.375 2.923 1.00 0.00 H new ATOM 0 HG22 ILE A 17 192.270 -8.120 2.367 1.00 0.00 H new ATOM 0 HG23 ILE A 17 191.666 -7.252 3.799 1.00 0.00 H new ATOM 0 HD11 ILE A 17 188.969 -4.707 4.174 1.00 0.00 H new ATOM 0 HD12 ILE A 17 190.279 -5.848 4.560 1.00 0.00 H new ATOM 0 HD13 ILE A 17 190.639 -4.347 3.674 1.00 0.00 H new ATOM 191 N TYR A 18 194.164 -6.612 1.507 1.00 0.00 N ATOM 192 CA TYR A 18 195.277 -7.213 0.781 1.00 0.00 C ATOM 193 C TYR A 18 195.166 -8.738 0.794 1.00 0.00 C ATOM 194 O TYR A 18 194.782 -9.325 1.805 1.00 0.00 O ATOM 195 CB TYR A 18 196.606 -6.779 1.403 1.00 0.00 C ATOM 196 CG TYR A 18 197.799 -6.977 0.495 1.00 0.00 C ATOM 197 CD1 TYR A 18 198.082 -6.069 -0.518 1.00 0.00 C ATOM 198 CD2 TYR A 18 198.640 -8.072 0.650 1.00 0.00 C ATOM 199 CE1 TYR A 18 199.169 -6.246 -1.351 1.00 0.00 C ATOM 200 CE2 TYR A 18 199.730 -8.256 -0.179 1.00 0.00 C ATOM 201 CZ TYR A 18 199.990 -7.340 -1.177 1.00 0.00 C ATOM 202 OH TYR A 18 201.074 -7.520 -2.005 1.00 0.00 O ATOM 0 H TYR A 18 194.241 -6.674 2.522 1.00 0.00 H new ATOM 0 HA TYR A 18 195.240 -6.871 -0.253 1.00 0.00 H new ATOM 0 HB2 TYR A 18 196.541 -5.726 1.678 1.00 0.00 H new ATOM 0 HB3 TYR A 18 196.765 -7.339 2.324 1.00 0.00 H new ATOM 0 HD1 TYR A 18 197.441 -5.211 -0.656 1.00 0.00 H new ATOM 0 HD2 TYR A 18 198.439 -8.791 1.431 1.00 0.00 H new ATOM 0 HE1 TYR A 18 199.375 -5.532 -2.134 1.00 0.00 H new ATOM 0 HE2 TYR A 18 200.375 -9.112 -0.046 1.00 0.00 H new ATOM 0 HH TYR A 18 201.549 -8.338 -1.748 1.00 0.00 H new ATOM 212 N PRO A 19 195.500 -9.409 -0.328 1.00 0.00 N ATOM 213 CA PRO A 19 195.962 -8.776 -1.557 1.00 0.00 C ATOM 214 C PRO A 19 194.827 -8.528 -2.544 1.00 0.00 C ATOM 215 O PRO A 19 195.051 -8.044 -3.655 1.00 0.00 O ATOM 216 CB PRO A 19 196.934 -9.818 -2.104 1.00 0.00 C ATOM 217 CG PRO A 19 196.415 -11.140 -1.621 1.00 0.00 C ATOM 218 CD PRO A 19 195.451 -10.866 -0.485 1.00 0.00 C ATOM 0 HA PRO A 19 196.400 -7.792 -1.389 1.00 0.00 H new ATOM 0 HB2 PRO A 19 196.973 -9.785 -3.193 1.00 0.00 H new ATOM 0 HB3 PRO A 19 197.947 -9.638 -1.743 1.00 0.00 H new ATOM 0 HG2 PRO A 19 195.913 -11.673 -2.429 1.00 0.00 H new ATOM 0 HG3 PRO A 19 197.235 -11.773 -1.283 1.00 0.00 H new ATOM 0 HD2 PRO A 19 194.444 -11.209 -0.723 1.00 0.00 H new ATOM 0 HD3 PRO A 19 195.754 -11.377 0.429 1.00 0.00 H new ATOM 226 N ARG A 20 193.606 -8.859 -2.134 1.00 0.00 N ATOM 227 CA ARG A 20 192.439 -8.670 -2.972 1.00 0.00 C ATOM 228 C ARG A 20 191.163 -8.769 -2.144 1.00 0.00 C ATOM 229 O ARG A 20 190.663 -9.863 -1.881 1.00 0.00 O ATOM 230 CB ARG A 20 192.419 -9.701 -4.105 1.00 0.00 C ATOM 231 CG ARG A 20 192.805 -9.124 -5.458 1.00 0.00 C ATOM 232 CD ARG A 20 192.750 -10.178 -6.551 1.00 0.00 C ATOM 233 NE ARG A 20 193.977 -10.211 -7.342 1.00 0.00 N ATOM 234 CZ ARG A 20 195.103 -10.799 -6.942 1.00 0.00 C ATOM 235 NH1 ARG A 20 195.159 -11.403 -5.761 1.00 0.00 N ATOM 236 NH2 ARG A 20 196.172 -10.783 -7.724 1.00 0.00 N ATOM 0 H ARG A 20 193.404 -9.262 -1.219 1.00 0.00 H new ATOM 0 HA ARG A 20 192.490 -7.673 -3.410 1.00 0.00 H new ATOM 0 HB2 ARG A 20 193.102 -10.514 -3.858 1.00 0.00 H new ATOM 0 HB3 ARG A 20 191.421 -10.133 -4.175 1.00 0.00 H new ATOM 0 HG2 ARG A 20 192.133 -8.303 -5.709 1.00 0.00 H new ATOM 0 HG3 ARG A 20 193.811 -8.708 -5.403 1.00 0.00 H new ATOM 0 HD2 ARG A 20 192.582 -11.157 -6.102 1.00 0.00 H new ATOM 0 HD3 ARG A 20 191.902 -9.977 -7.206 1.00 0.00 H new ATOM 0 HE ARG A 20 193.971 -9.757 -8.255 1.00 0.00 H new ATOM 0 HH11 ARG A 20 194.338 -11.418 -5.156 1.00 0.00 H new ATOM 0 HH12 ARG A 20 196.023 -11.852 -5.458 1.00 0.00 H new ATOM 0 HH21 ARG A 20 196.133 -10.320 -8.632 1.00 0.00 H new ATOM 0 HH22 ARG A 20 197.035 -11.233 -7.418 1.00 0.00 H new ATOM 250 N GLY A 21 190.645 -7.618 -1.734 1.00 0.00 N ATOM 251 CA GLY A 21 189.436 -7.590 -0.937 1.00 0.00 C ATOM 252 C GLY A 21 188.976 -6.180 -0.622 1.00 0.00 C ATOM 253 O GLY A 21 189.728 -5.220 -0.797 1.00 0.00 O ATOM 0 H GLY A 21 191.043 -6.702 -1.940 1.00 0.00 H new ATOM 0 HA2 GLY A 21 188.643 -8.116 -1.468 1.00 0.00 H new ATOM 0 HA3 GLY A 21 189.607 -8.129 -0.005 1.00 0.00 H new ATOM 257 N LEU A 22 187.741 -6.058 -0.155 1.00 0.00 N ATOM 258 CA LEU A 22 187.175 -4.760 0.191 1.00 0.00 C ATOM 259 C LEU A 22 186.369 -4.863 1.484 1.00 0.00 C ATOM 260 O LEU A 22 185.713 -5.872 1.734 1.00 0.00 O ATOM 261 CB LEU A 22 186.295 -4.247 -0.958 1.00 0.00 C ATOM 262 CG LEU A 22 185.172 -3.283 -0.560 1.00 0.00 C ATOM 263 CD1 LEU A 22 185.742 -2.041 0.114 1.00 0.00 C ATOM 264 CD2 LEU A 22 184.344 -2.899 -1.779 1.00 0.00 C ATOM 0 H LEU A 22 187.109 -6.845 -0.006 1.00 0.00 H new ATOM 0 HA LEU A 22 187.986 -4.050 0.349 1.00 0.00 H new ATOM 0 HB2 LEU A 22 186.935 -3.748 -1.686 1.00 0.00 H new ATOM 0 HB3 LEU A 22 185.850 -5.106 -1.461 1.00 0.00 H new ATOM 0 HG LEU A 22 184.522 -3.789 0.153 1.00 0.00 H new ATOM 0 HD11 LEU A 22 184.928 -1.370 0.388 1.00 0.00 H new ATOM 0 HD12 LEU A 22 186.290 -2.332 1.010 1.00 0.00 H new ATOM 0 HD13 LEU A 22 186.416 -1.531 -0.574 1.00 0.00 H new ATOM 0 HD21 LEU A 22 183.551 -2.214 -1.479 1.00 0.00 H new ATOM 0 HD22 LEU A 22 184.984 -2.413 -2.515 1.00 0.00 H new ATOM 0 HD23 LEU A 22 183.904 -3.795 -2.217 1.00 0.00 H new ATOM 276 N ARG A 23 186.426 -3.816 2.301 1.00 0.00 N ATOM 277 CA ARG A 23 185.702 -3.798 3.568 1.00 0.00 C ATOM 278 C ARG A 23 184.994 -2.462 3.770 1.00 0.00 C ATOM 279 O ARG A 23 185.620 -1.466 4.135 1.00 0.00 O ATOM 280 CB ARG A 23 186.663 -4.059 4.729 1.00 0.00 C ATOM 281 CG ARG A 23 185.981 -4.086 6.088 1.00 0.00 C ATOM 282 CD ARG A 23 186.796 -4.867 7.106 1.00 0.00 C ATOM 283 NE ARG A 23 185.959 -5.747 7.918 1.00 0.00 N ATOM 284 CZ ARG A 23 186.335 -6.258 9.089 1.00 0.00 C ATOM 285 NH1 ARG A 23 187.532 -5.978 9.588 1.00 0.00 N ATOM 286 NH2 ARG A 23 185.510 -7.049 9.761 1.00 0.00 N ATOM 0 H ARG A 23 186.964 -2.971 2.110 1.00 0.00 H new ATOM 0 HA ARG A 23 184.950 -4.587 3.541 1.00 0.00 H new ATOM 0 HB2 ARG A 23 187.167 -5.011 4.566 1.00 0.00 H new ATOM 0 HB3 ARG A 23 187.433 -3.287 4.733 1.00 0.00 H new ATOM 0 HG2 ARG A 23 185.835 -3.066 6.443 1.00 0.00 H new ATOM 0 HG3 ARG A 23 184.992 -4.534 5.991 1.00 0.00 H new ATOM 0 HD2 ARG A 23 187.550 -5.460 6.589 1.00 0.00 H new ATOM 0 HD3 ARG A 23 187.328 -4.171 7.755 1.00 0.00 H new ATOM 0 HE ARG A 23 185.031 -5.984 7.567 1.00 0.00 H new ATOM 0 HH11 ARG A 23 188.169 -5.369 9.074 1.00 0.00 H new ATOM 0 HH12 ARG A 23 187.815 -6.372 10.485 1.00 0.00 H new ATOM 0 HH21 ARG A 23 184.589 -7.266 9.381 1.00 0.00 H new ATOM 0 HH22 ARG A 23 185.797 -7.441 10.658 1.00 0.00 H new ATOM 300 N VAL A 24 183.686 -2.445 3.529 1.00 0.00 N ATOM 301 CA VAL A 24 182.897 -1.228 3.684 1.00 0.00 C ATOM 302 C VAL A 24 182.137 -1.222 5.006 1.00 0.00 C ATOM 303 O VAL A 24 181.896 -2.272 5.602 1.00 0.00 O ATOM 304 CB VAL A 24 181.890 -1.058 2.531 1.00 0.00 C ATOM 305 CG1 VAL A 24 181.330 0.356 2.514 1.00 0.00 C ATOM 306 CG2 VAL A 24 182.534 -1.399 1.196 1.00 0.00 C ATOM 0 H VAL A 24 183.151 -3.259 3.226 1.00 0.00 H new ATOM 0 HA VAL A 24 183.602 -0.397 3.670 1.00 0.00 H new ATOM 0 HB VAL A 24 181.065 -1.751 2.694 1.00 0.00 H new ATOM 0 HG11 VAL A 24 180.621 0.457 1.693 1.00 0.00 H new ATOM 0 HG12 VAL A 24 180.823 0.558 3.458 1.00 0.00 H new ATOM 0 HG13 VAL A 24 182.144 1.068 2.379 1.00 0.00 H new ATOM 0 HG21 VAL A 24 181.804 -1.272 0.397 1.00 0.00 H new ATOM 0 HG22 VAL A 24 183.382 -0.737 1.022 1.00 0.00 H new ATOM 0 HG23 VAL A 24 182.878 -2.433 1.212 1.00 0.00 H new ATOM 316 N SER A 25 181.757 -0.029 5.455 1.00 0.00 N ATOM 317 CA SER A 25 181.018 0.120 6.703 1.00 0.00 C ATOM 318 C SER A 25 180.152 1.374 6.670 1.00 0.00 C ATOM 319 O SER A 25 180.533 2.387 6.084 1.00 0.00 O ATOM 320 CB SER A 25 181.978 0.181 7.892 1.00 0.00 C ATOM 321 OG SER A 25 183.235 -0.384 7.562 1.00 0.00 O ATOM 0 H SER A 25 181.949 0.849 4.972 1.00 0.00 H new ATOM 0 HA SER A 25 180.370 -0.749 6.818 1.00 0.00 H new ATOM 0 HB2 SER A 25 182.112 1.217 8.203 1.00 0.00 H new ATOM 0 HB3 SER A 25 181.547 -0.353 8.739 1.00 0.00 H new ATOM 0 HG SER A 25 183.831 -0.331 8.338 1.00 0.00 H new ATOM 327 N ILE A 26 178.981 1.303 7.295 1.00 0.00 N ATOM 328 CA ILE A 26 178.065 2.442 7.322 1.00 0.00 C ATOM 329 C ILE A 26 177.308 2.530 8.647 1.00 0.00 C ATOM 330 O ILE A 26 176.669 1.564 9.068 1.00 0.00 O ATOM 331 CB ILE A 26 177.035 2.355 6.180 1.00 0.00 C ATOM 332 CG1 ILE A 26 176.424 0.953 6.124 1.00 0.00 C ATOM 333 CG2 ILE A 26 177.682 2.715 4.852 1.00 0.00 C ATOM 334 CD1 ILE A 26 174.916 0.956 6.011 1.00 0.00 C ATOM 0 H ILE A 26 178.644 0.476 7.787 1.00 0.00 H new ATOM 0 HA ILE A 26 178.680 3.333 7.199 1.00 0.00 H new ATOM 0 HB ILE A 26 176.236 3.071 6.374 1.00 0.00 H new ATOM 0 HG12 ILE A 26 176.843 0.416 5.273 1.00 0.00 H new ATOM 0 HG13 ILE A 26 176.712 0.404 7.020 1.00 0.00 H new ATOM 0 HG21 ILE A 26 176.940 2.648 4.056 1.00 0.00 H new ATOM 0 HG22 ILE A 26 178.072 3.732 4.901 1.00 0.00 H new ATOM 0 HG23 ILE A 26 178.499 2.023 4.646 1.00 0.00 H new ATOM 0 HD11 ILE A 26 174.552 -0.071 5.976 1.00 0.00 H new ATOM 0 HD12 ILE A 26 174.487 1.464 6.875 1.00 0.00 H new ATOM 0 HD13 ILE A 26 174.620 1.477 5.100 1.00 0.00 H new ATOM 346 N PRO A 27 177.352 3.699 9.320 1.00 0.00 N ATOM 347 CA PRO A 27 176.650 3.902 10.591 1.00 0.00 C ATOM 348 C PRO A 27 175.156 3.624 10.461 1.00 0.00 C ATOM 349 O PRO A 27 174.383 4.487 10.048 1.00 0.00 O ATOM 350 CB PRO A 27 176.895 5.382 10.922 1.00 0.00 C ATOM 351 CG PRO A 27 177.372 6.000 9.651 1.00 0.00 C ATOM 352 CD PRO A 27 178.072 4.908 8.895 1.00 0.00 C ATOM 0 HA PRO A 27 177.009 3.225 11.366 1.00 0.00 H new ATOM 0 HB2 PRO A 27 175.982 5.862 11.273 1.00 0.00 H new ATOM 0 HB3 PRO A 27 177.637 5.490 11.713 1.00 0.00 H new ATOM 0 HG2 PRO A 27 176.538 6.400 9.075 1.00 0.00 H new ATOM 0 HG3 PRO A 27 178.048 6.831 9.851 1.00 0.00 H new ATOM 0 HD2 PRO A 27 178.008 5.058 7.817 1.00 0.00 H new ATOM 0 HD3 PRO A 27 179.131 4.857 9.148 1.00 0.00 H new ATOM 360 N ASP A 28 174.764 2.404 10.808 1.00 0.00 N ATOM 361 CA ASP A 28 173.369 1.990 10.724 1.00 0.00 C ATOM 362 C ASP A 28 172.471 2.862 11.592 1.00 0.00 C ATOM 363 O ASP A 28 172.930 3.514 12.530 1.00 0.00 O ATOM 364 CB ASP A 28 173.225 0.526 11.147 1.00 0.00 C ATOM 365 CG ASP A 28 171.789 0.040 11.092 1.00 0.00 C ATOM 366 OD1 ASP A 28 171.045 0.489 10.195 1.00 0.00 O ATOM 367 OD2 ASP A 28 171.409 -0.789 11.947 1.00 0.00 O ATOM 0 H ASP A 28 175.396 1.681 11.152 1.00 0.00 H new ATOM 0 HA ASP A 28 173.055 2.105 9.687 1.00 0.00 H new ATOM 0 HB2 ASP A 28 173.841 -0.098 10.499 1.00 0.00 H new ATOM 0 HB3 ASP A 28 173.607 0.406 12.161 1.00 0.00 H new ATOM 372 N ASP A 29 171.184 2.848 11.272 1.00 0.00 N ATOM 373 CA ASP A 29 170.192 3.612 12.014 1.00 0.00 C ATOM 374 C ASP A 29 168.870 2.857 12.025 1.00 0.00 C ATOM 375 O ASP A 29 167.805 3.433 11.808 1.00 0.00 O ATOM 376 CB ASP A 29 170.009 5.000 11.397 1.00 0.00 C ATOM 377 CG ASP A 29 169.943 6.094 12.444 1.00 0.00 C ATOM 378 OD1 ASP A 29 170.517 5.905 13.537 1.00 0.00 O ATOM 379 OD2 ASP A 29 169.318 7.141 12.173 1.00 0.00 O ATOM 0 H ASP A 29 170.800 2.310 10.495 1.00 0.00 H new ATOM 0 HA ASP A 29 170.539 3.741 13.039 1.00 0.00 H new ATOM 0 HB2 ASP A 29 170.835 5.203 10.715 1.00 0.00 H new ATOM 0 HB3 ASP A 29 169.095 5.013 10.804 1.00 0.00 H new ATOM 384 N GLY A 30 168.960 1.555 12.277 1.00 0.00 N ATOM 385 CA GLY A 30 167.784 0.720 12.313 1.00 0.00 C ATOM 386 C GLY A 30 167.149 0.552 10.947 1.00 0.00 C ATOM 387 O GLY A 30 165.925 0.571 10.819 1.00 0.00 O ATOM 0 H GLY A 30 169.836 1.065 12.458 1.00 0.00 H new ATOM 0 HA2 GLY A 30 168.050 -0.260 12.709 1.00 0.00 H new ATOM 0 HA3 GLY A 30 167.055 1.154 12.998 1.00 0.00 H new ATOM 391 N PHE A 31 167.981 0.383 9.925 1.00 0.00 N ATOM 392 CA PHE A 31 167.488 0.210 8.566 1.00 0.00 C ATOM 393 C PHE A 31 167.094 -1.235 8.306 1.00 0.00 C ATOM 394 O PHE A 31 167.088 -2.071 9.211 1.00 0.00 O ATOM 395 CB PHE A 31 168.544 0.629 7.538 1.00 0.00 C ATOM 396 CG PHE A 31 169.206 1.940 7.851 1.00 0.00 C ATOM 397 CD1 PHE A 31 168.450 3.052 8.179 1.00 0.00 C ATOM 398 CD2 PHE A 31 170.586 2.057 7.816 1.00 0.00 C ATOM 399 CE1 PHE A 31 169.058 4.259 8.468 1.00 0.00 C ATOM 400 CE2 PHE A 31 171.200 3.262 8.104 1.00 0.00 C ATOM 401 CZ PHE A 31 170.435 4.364 8.430 1.00 0.00 C ATOM 0 H PHE A 31 168.997 0.362 10.013 1.00 0.00 H new ATOM 0 HA PHE A 31 166.610 0.848 8.462 1.00 0.00 H new ATOM 0 HB2 PHE A 31 169.307 -0.147 7.477 1.00 0.00 H new ATOM 0 HB3 PHE A 31 168.076 0.694 6.556 1.00 0.00 H new ATOM 0 HD1 PHE A 31 167.373 2.976 8.209 1.00 0.00 H new ATOM 0 HD2 PHE A 31 171.189 1.198 7.561 1.00 0.00 H new ATOM 0 HE1 PHE A 31 168.457 5.119 8.723 1.00 0.00 H new ATOM 0 HE2 PHE A 31 172.277 3.341 8.074 1.00 0.00 H new ATOM 0 HZ PHE A 31 170.912 5.306 8.655 1.00 0.00 H new ATOM 411 N SER A 32 166.777 -1.511 7.053 1.00 0.00 N ATOM 412 CA SER A 32 166.387 -2.841 6.626 1.00 0.00 C ATOM 413 C SER A 32 167.154 -3.246 5.374 1.00 0.00 C ATOM 414 O SER A 32 167.382 -4.433 5.142 1.00 0.00 O ATOM 415 CB SER A 32 164.881 -2.899 6.362 1.00 0.00 C ATOM 416 OG SER A 32 164.183 -3.381 7.498 1.00 0.00 O ATOM 0 H SER A 32 166.783 -0.819 6.304 1.00 0.00 H new ATOM 0 HA SER A 32 166.629 -3.541 7.426 1.00 0.00 H new ATOM 0 HB2 SER A 32 164.516 -1.906 6.101 1.00 0.00 H new ATOM 0 HB3 SER A 32 164.683 -3.546 5.508 1.00 0.00 H new ATOM 0 HG SER A 32 163.223 -3.407 7.305 1.00 0.00 H new ATOM 422 N LEU A 33 167.566 -2.264 4.567 1.00 0.00 N ATOM 423 CA LEU A 33 168.317 -2.579 3.353 1.00 0.00 C ATOM 424 C LEU A 33 169.446 -1.592 3.114 1.00 0.00 C ATOM 425 O LEU A 33 169.245 -0.384 3.169 1.00 0.00 O ATOM 426 CB LEU A 33 167.414 -2.590 2.121 1.00 0.00 C ATOM 427 CG LEU A 33 167.981 -3.359 0.926 1.00 0.00 C ATOM 428 CD1 LEU A 33 167.697 -4.846 1.053 1.00 0.00 C ATOM 429 CD2 LEU A 33 167.420 -2.812 -0.379 1.00 0.00 C ATOM 0 H LEU A 33 167.397 -1.271 4.727 1.00 0.00 H new ATOM 0 HA LEU A 33 168.736 -3.573 3.508 1.00 0.00 H new ATOM 0 HB2 LEU A 33 166.453 -3.026 2.394 1.00 0.00 H new ATOM 0 HB3 LEU A 33 167.223 -1.561 1.817 1.00 0.00 H new ATOM 0 HG LEU A 33 169.062 -3.223 0.917 1.00 0.00 H new ATOM 0 HD11 LEU A 33 168.110 -5.370 0.191 1.00 0.00 H new ATOM 0 HD12 LEU A 33 168.157 -5.228 1.965 1.00 0.00 H new ATOM 0 HD13 LEU A 33 166.620 -5.008 1.094 1.00 0.00 H new ATOM 0 HD21 LEU A 33 167.835 -3.372 -1.217 1.00 0.00 H new ATOM 0 HD22 LEU A 33 166.335 -2.912 -0.379 1.00 0.00 H new ATOM 0 HD23 LEU A 33 167.688 -1.760 -0.478 1.00 0.00 H new ATOM 441 N PHE A 34 170.624 -2.125 2.826 1.00 0.00 N ATOM 442 CA PHE A 34 171.793 -1.308 2.546 1.00 0.00 C ATOM 443 C PHE A 34 172.372 -1.662 1.177 1.00 0.00 C ATOM 444 O PHE A 34 173.114 -2.635 1.039 1.00 0.00 O ATOM 445 CB PHE A 34 172.849 -1.514 3.627 1.00 0.00 C ATOM 446 CG PHE A 34 174.134 -0.785 3.356 1.00 0.00 C ATOM 447 CD1 PHE A 34 174.134 0.578 3.114 1.00 0.00 C ATOM 448 CD2 PHE A 34 175.341 -1.466 3.338 1.00 0.00 C ATOM 449 CE1 PHE A 34 175.313 1.251 2.857 1.00 0.00 C ATOM 450 CE2 PHE A 34 176.524 -0.799 3.083 1.00 0.00 C ATOM 451 CZ PHE A 34 176.509 0.560 2.841 1.00 0.00 C ATOM 0 H PHE A 34 170.795 -3.129 2.780 1.00 0.00 H new ATOM 0 HA PHE A 34 171.492 -0.260 2.540 1.00 0.00 H new ATOM 0 HB2 PHE A 34 172.447 -1.182 4.584 1.00 0.00 H new ATOM 0 HB3 PHE A 34 173.058 -2.580 3.721 1.00 0.00 H new ATOM 0 HD1 PHE A 34 173.201 1.122 3.126 1.00 0.00 H new ATOM 0 HD2 PHE A 34 175.357 -2.530 3.525 1.00 0.00 H new ATOM 0 HE1 PHE A 34 175.300 2.314 2.669 1.00 0.00 H new ATOM 0 HE2 PHE A 34 177.459 -1.340 3.073 1.00 0.00 H new ATOM 0 HZ PHE A 34 177.432 1.083 2.639 1.00 0.00 H new ATOM 461 N ALA A 35 172.032 -0.867 0.166 1.00 0.00 N ATOM 462 CA ALA A 35 172.520 -1.100 -1.188 1.00 0.00 C ATOM 463 C ALA A 35 173.808 -0.328 -1.441 1.00 0.00 C ATOM 464 O ALA A 35 173.859 0.889 -1.259 1.00 0.00 O ATOM 465 CB ALA A 35 171.458 -0.712 -2.206 1.00 0.00 C ATOM 0 H ALA A 35 171.420 -0.056 0.260 1.00 0.00 H new ATOM 0 HA ALA A 35 172.736 -2.163 -1.296 1.00 0.00 H new ATOM 0 HB1 ALA A 35 171.836 -0.891 -3.212 1.00 0.00 H new ATOM 0 HB2 ALA A 35 170.562 -1.311 -2.043 1.00 0.00 H new ATOM 0 HB3 ALA A 35 171.214 0.344 -2.093 1.00 0.00 H new ATOM 471 N PHE A 36 174.850 -1.040 -1.853 1.00 0.00 N ATOM 472 CA PHE A 36 176.139 -0.418 -2.121 1.00 0.00 C ATOM 473 C PHE A 36 176.530 -0.561 -3.587 1.00 0.00 C ATOM 474 O PHE A 36 176.625 -1.671 -4.106 1.00 0.00 O ATOM 475 CB PHE A 36 177.216 -1.041 -1.231 1.00 0.00 C ATOM 476 CG PHE A 36 178.611 -0.580 -1.549 1.00 0.00 C ATOM 477 CD1 PHE A 36 178.943 0.764 -1.488 1.00 0.00 C ATOM 478 CD2 PHE A 36 179.590 -1.491 -1.911 1.00 0.00 C ATOM 479 CE1 PHE A 36 180.224 1.191 -1.782 1.00 0.00 C ATOM 480 CE2 PHE A 36 180.873 -1.072 -2.207 1.00 0.00 C ATOM 481 CZ PHE A 36 181.190 0.271 -2.142 1.00 0.00 C ATOM 0 H PHE A 36 174.827 -2.048 -2.008 1.00 0.00 H new ATOM 0 HA PHE A 36 176.053 0.645 -1.896 1.00 0.00 H new ATOM 0 HB2 PHE A 36 176.994 -0.805 -0.190 1.00 0.00 H new ATOM 0 HB3 PHE A 36 177.171 -2.126 -1.329 1.00 0.00 H new ATOM 0 HD1 PHE A 36 178.191 1.487 -1.207 1.00 0.00 H new ATOM 0 HD2 PHE A 36 179.347 -2.542 -1.962 1.00 0.00 H new ATOM 0 HE1 PHE A 36 180.470 2.241 -1.730 1.00 0.00 H new ATOM 0 HE2 PHE A 36 181.626 -1.793 -2.489 1.00 0.00 H new ATOM 0 HZ PHE A 36 182.192 0.602 -2.372 1.00 0.00 H new ATOM 491 N HIS A 37 176.766 0.572 -4.241 1.00 0.00 N ATOM 492 CA HIS A 37 177.164 0.598 -5.637 1.00 0.00 C ATOM 493 C HIS A 37 178.445 1.410 -5.772 1.00 0.00 C ATOM 494 O HIS A 37 178.505 2.543 -5.295 1.00 0.00 O ATOM 495 CB HIS A 37 176.061 1.228 -6.476 1.00 0.00 C ATOM 496 CG HIS A 37 175.592 0.361 -7.601 1.00 0.00 C ATOM 497 ND1 HIS A 37 174.287 -0.066 -7.726 1.00 0.00 N ATOM 498 CD2 HIS A 37 176.262 -0.169 -8.651 1.00 0.00 C ATOM 499 CE1 HIS A 37 174.175 -0.823 -8.802 1.00 0.00 C ATOM 500 NE2 HIS A 37 175.359 -0.903 -9.382 1.00 0.00 N ATOM 0 H HIS A 37 176.686 1.495 -3.815 1.00 0.00 H new ATOM 0 HA HIS A 37 177.336 -0.419 -5.989 1.00 0.00 H new ATOM 0 HB2 HIS A 37 175.214 1.461 -5.831 1.00 0.00 H new ATOM 0 HB3 HIS A 37 176.421 2.173 -6.883 1.00 0.00 H new ATOM 0 HD1 HIS A 37 173.527 0.167 -7.087 1.00 0.00 H new ATOM 0 HD2 HIS A 37 177.311 -0.039 -8.873 1.00 0.00 H new ATOM 0 HE1 HIS A 37 173.269 -1.297 -9.149 1.00 0.00 H new ATOM 0 HE2 HIS A 37 175.569 -1.424 -10.233 1.00 0.00 H new ATOM 509 N GLY A 38 179.478 0.848 -6.398 1.00 0.00 N ATOM 510 CA GLY A 38 180.716 1.597 -6.522 1.00 0.00 C ATOM 511 C GLY A 38 181.637 1.089 -7.604 1.00 0.00 C ATOM 512 O GLY A 38 181.691 -0.110 -7.873 1.00 0.00 O ATOM 0 H GLY A 38 179.482 -0.085 -6.810 1.00 0.00 H new ATOM 0 HA2 GLY A 38 180.478 2.641 -6.723 1.00 0.00 H new ATOM 0 HA3 GLY A 38 181.243 1.568 -5.568 1.00 0.00 H new ATOM 516 N LYS A 39 182.374 2.011 -8.215 1.00 0.00 N ATOM 517 CA LYS A 39 183.315 1.666 -9.271 1.00 0.00 C ATOM 518 C LYS A 39 184.713 2.186 -8.936 1.00 0.00 C ATOM 519 O LYS A 39 184.882 3.345 -8.558 1.00 0.00 O ATOM 520 CB LYS A 39 182.849 2.238 -10.612 1.00 0.00 C ATOM 521 CG LYS A 39 182.907 1.232 -11.751 1.00 0.00 C ATOM 522 CD LYS A 39 183.151 1.916 -13.086 1.00 0.00 C ATOM 523 CE LYS A 39 182.690 1.051 -14.250 1.00 0.00 C ATOM 524 NZ LYS A 39 183.752 0.897 -15.282 1.00 0.00 N ATOM 0 H LYS A 39 182.336 3.006 -7.995 1.00 0.00 H new ATOM 0 HA LYS A 39 183.356 0.580 -9.349 1.00 0.00 H new ATOM 0 HB2 LYS A 39 181.826 2.600 -10.508 1.00 0.00 H new ATOM 0 HB3 LYS A 39 183.467 3.099 -10.866 1.00 0.00 H new ATOM 0 HG2 LYS A 39 183.701 0.510 -11.560 1.00 0.00 H new ATOM 0 HG3 LYS A 39 181.972 0.674 -11.793 1.00 0.00 H new ATOM 0 HD2 LYS A 39 182.623 2.869 -13.109 1.00 0.00 H new ATOM 0 HD3 LYS A 39 184.213 2.137 -13.194 1.00 0.00 H new ATOM 0 HE2 LYS A 39 182.399 0.068 -13.879 1.00 0.00 H new ATOM 0 HE3 LYS A 39 181.804 1.495 -14.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 183.315 0.674 -16.199 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 184.291 1.783 -15.361 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 184.393 0.126 -15.008 1.00 0.00 H new ATOM 538 N LEU A 40 185.709 1.320 -9.080 1.00 0.00 N ATOM 539 CA LEU A 40 187.094 1.681 -8.796 1.00 0.00 C ATOM 540 C LEU A 40 187.696 2.461 -9.965 1.00 0.00 C ATOM 541 O LEU A 40 188.009 1.888 -11.008 1.00 0.00 O ATOM 542 CB LEU A 40 187.916 0.413 -8.529 1.00 0.00 C ATOM 543 CG LEU A 40 189.434 0.604 -8.483 1.00 0.00 C ATOM 544 CD1 LEU A 40 189.866 1.134 -7.126 1.00 0.00 C ATOM 545 CD2 LEU A 40 190.142 -0.707 -8.793 1.00 0.00 C ATOM 0 H LEU A 40 185.583 0.358 -9.393 1.00 0.00 H new ATOM 0 HA LEU A 40 187.116 2.316 -7.911 1.00 0.00 H new ATOM 0 HB2 LEU A 40 187.593 -0.014 -7.580 1.00 0.00 H new ATOM 0 HB3 LEU A 40 187.683 -0.318 -9.303 1.00 0.00 H new ATOM 0 HG LEU A 40 189.712 1.337 -9.241 1.00 0.00 H new ATOM 0 HD11 LEU A 40 190.948 1.263 -7.113 1.00 0.00 H new ATOM 0 HD12 LEU A 40 189.384 2.094 -6.940 1.00 0.00 H new ATOM 0 HD13 LEU A 40 189.576 0.426 -6.350 1.00 0.00 H new ATOM 0 HD21 LEU A 40 191.221 -0.555 -8.757 1.00 0.00 H new ATOM 0 HD22 LEU A 40 189.856 -1.458 -8.057 1.00 0.00 H new ATOM 0 HD23 LEU A 40 189.857 -1.048 -9.788 1.00 0.00 H new ATOM 557 N ASN A 41 187.854 3.770 -9.782 1.00 0.00 N ATOM 558 CA ASN A 41 188.421 4.637 -10.817 1.00 0.00 C ATOM 559 C ASN A 41 187.400 4.929 -11.917 1.00 0.00 C ATOM 560 O ASN A 41 187.585 4.537 -13.070 1.00 0.00 O ATOM 561 CB ASN A 41 189.681 4.005 -11.421 1.00 0.00 C ATOM 562 CG ASN A 41 190.819 5.000 -11.552 1.00 0.00 C ATOM 563 OD1 ASN A 41 190.607 6.212 -11.498 1.00 0.00 O ATOM 564 ND2 ASN A 41 192.033 4.492 -11.725 1.00 0.00 N ATOM 0 H ASN A 41 187.597 4.257 -8.923 1.00 0.00 H new ATOM 0 HA ASN A 41 188.692 5.581 -10.345 1.00 0.00 H new ATOM 0 HB2 ASN A 41 190.001 3.171 -10.797 1.00 0.00 H new ATOM 0 HB3 ASN A 41 189.444 3.596 -12.403 1.00 0.00 H new ATOM 0 HD21 ASN A 41 192.837 5.113 -11.819 1.00 0.00 H new ATOM 0 HD22 ASN A 41 192.162 3.481 -11.764 1.00 0.00 H new ATOM 571 N GLU A 42 186.333 5.637 -11.553 1.00 0.00 N ATOM 572 CA GLU A 42 185.283 6.008 -12.494 1.00 0.00 C ATOM 573 C GLU A 42 184.110 6.636 -11.754 1.00 0.00 C ATOM 574 O GLU A 42 183.386 5.960 -11.023 1.00 0.00 O ATOM 575 CB GLU A 42 184.791 4.804 -13.298 1.00 0.00 C ATOM 576 CG GLU A 42 183.767 5.183 -14.356 1.00 0.00 C ATOM 577 CD GLU A 42 183.333 4.001 -15.202 1.00 0.00 C ATOM 578 OE1 GLU A 42 184.202 3.387 -15.855 1.00 0.00 O ATOM 579 OE2 GLU A 42 182.123 3.691 -15.210 1.00 0.00 O ATOM 0 H GLU A 42 186.174 5.968 -10.601 1.00 0.00 H new ATOM 0 HA GLU A 42 185.710 6.731 -13.189 1.00 0.00 H new ATOM 0 HB2 GLU A 42 185.642 4.321 -13.778 1.00 0.00 H new ATOM 0 HB3 GLU A 42 184.352 4.074 -12.618 1.00 0.00 H new ATOM 0 HG2 GLU A 42 182.893 5.617 -13.871 1.00 0.00 H new ATOM 0 HG3 GLU A 42 184.187 5.953 -15.003 1.00 0.00 H new ATOM 586 N GLU A 43 183.936 7.935 -11.945 1.00 0.00 N ATOM 587 CA GLU A 43 182.860 8.670 -11.294 1.00 0.00 C ATOM 588 C GLU A 43 181.508 8.024 -11.544 1.00 0.00 C ATOM 589 O GLU A 43 181.409 6.961 -12.159 1.00 0.00 O ATOM 590 CB GLU A 43 182.824 10.119 -11.783 1.00 0.00 C ATOM 591 CG GLU A 43 184.150 10.828 -11.646 1.00 0.00 C ATOM 592 CD GLU A 43 184.124 12.237 -12.206 1.00 0.00 C ATOM 593 OE1 GLU A 43 183.746 13.165 -11.460 1.00 0.00 O ATOM 594 OE2 GLU A 43 184.480 12.412 -13.391 1.00 0.00 O ATOM 0 H GLU A 43 184.529 8.505 -12.548 1.00 0.00 H new ATOM 0 HA GLU A 43 183.061 8.650 -10.223 1.00 0.00 H new ATOM 0 HB2 GLU A 43 182.518 10.135 -12.829 1.00 0.00 H new ATOM 0 HB3 GLU A 43 182.067 10.666 -11.221 1.00 0.00 H new ATOM 0 HG2 GLU A 43 184.430 10.866 -10.593 1.00 0.00 H new ATOM 0 HG3 GLU A 43 184.920 10.252 -12.160 1.00 0.00 H new ATOM 601 N MET A 44 180.472 8.684 -11.053 1.00 0.00 N ATOM 602 CA MET A 44 179.105 8.202 -11.201 1.00 0.00 C ATOM 603 C MET A 44 178.114 9.252 -10.707 1.00 0.00 C ATOM 604 O MET A 44 178.183 9.691 -9.557 1.00 0.00 O ATOM 605 CB MET A 44 178.913 6.889 -10.433 1.00 0.00 C ATOM 606 CG MET A 44 179.777 6.773 -9.185 1.00 0.00 C ATOM 607 SD MET A 44 180.303 5.078 -8.849 1.00 0.00 S ATOM 608 CE MET A 44 178.750 4.192 -8.945 1.00 0.00 C ATOM 0 H MET A 44 180.552 9.564 -10.543 1.00 0.00 H new ATOM 0 HA MET A 44 178.918 8.016 -12.259 1.00 0.00 H new ATOM 0 HB2 MET A 44 177.865 6.796 -10.148 1.00 0.00 H new ATOM 0 HB3 MET A 44 179.137 6.055 -11.097 1.00 0.00 H new ATOM 0 HG2 MET A 44 180.657 7.405 -9.299 1.00 0.00 H new ATOM 0 HG3 MET A 44 179.221 7.152 -8.328 1.00 0.00 H new ATOM 0 HE1 MET A 44 178.567 3.676 -8.003 1.00 0.00 H new ATOM 0 HE2 MET A 44 177.940 4.896 -9.136 1.00 0.00 H new ATOM 0 HE3 MET A 44 178.796 3.464 -9.755 1.00 0.00 H new ATOM 618 N ASP A 45 177.199 9.657 -11.581 1.00 0.00 N ATOM 619 CA ASP A 45 176.200 10.664 -11.234 1.00 0.00 C ATOM 620 C ASP A 45 174.792 10.088 -11.338 1.00 0.00 C ATOM 621 O ASP A 45 174.028 10.443 -12.237 1.00 0.00 O ATOM 622 CB ASP A 45 176.337 11.882 -12.149 1.00 0.00 C ATOM 623 CG ASP A 45 175.546 13.073 -11.648 1.00 0.00 C ATOM 624 OD1 ASP A 45 174.535 12.862 -10.946 1.00 0.00 O ATOM 625 OD2 ASP A 45 175.934 14.219 -11.958 1.00 0.00 O ATOM 0 H ASP A 45 177.128 9.304 -12.535 1.00 0.00 H new ATOM 0 HA ASP A 45 176.371 10.973 -10.203 1.00 0.00 H new ATOM 0 HB2 ASP A 45 177.389 12.156 -12.230 1.00 0.00 H new ATOM 0 HB3 ASP A 45 175.998 11.620 -13.151 1.00 0.00 H new ATOM 630 N GLY A 46 174.462 9.193 -10.419 1.00 0.00 N ATOM 631 CA GLY A 46 173.171 8.571 -10.417 1.00 0.00 C ATOM 632 C GLY A 46 173.227 7.182 -9.827 1.00 0.00 C ATOM 633 O GLY A 46 173.753 6.985 -8.731 1.00 0.00 O ATOM 0 H GLY A 46 175.081 8.889 -9.668 1.00 0.00 H new ATOM 0 HA2 GLY A 46 172.472 9.182 -9.846 1.00 0.00 H new ATOM 0 HA3 GLY A 46 172.789 8.519 -11.437 1.00 0.00 H new ATOM 637 N LEU A 47 172.679 6.218 -10.548 1.00 0.00 N ATOM 638 CA LEU A 47 172.659 4.852 -10.097 1.00 0.00 C ATOM 639 C LEU A 47 173.286 3.929 -11.131 1.00 0.00 C ATOM 640 O LEU A 47 172.660 2.980 -11.601 1.00 0.00 O ATOM 641 CB LEU A 47 171.221 4.477 -9.821 1.00 0.00 C ATOM 642 CG LEU A 47 170.529 5.418 -8.845 1.00 0.00 C ATOM 643 CD1 LEU A 47 169.028 5.179 -8.831 1.00 0.00 C ATOM 644 CD2 LEU A 47 171.120 5.249 -7.454 1.00 0.00 C ATOM 0 H LEU A 47 172.240 6.367 -11.456 1.00 0.00 H new ATOM 0 HA LEU A 47 173.249 4.746 -9.187 1.00 0.00 H new ATOM 0 HB2 LEU A 47 170.668 4.469 -10.760 1.00 0.00 H new ATOM 0 HB3 LEU A 47 171.187 3.463 -9.423 1.00 0.00 H new ATOM 0 HG LEU A 47 170.696 6.444 -9.172 1.00 0.00 H new ATOM 0 HD11 LEU A 47 168.557 5.864 -8.126 1.00 0.00 H new ATOM 0 HD12 LEU A 47 168.623 5.350 -9.828 1.00 0.00 H new ATOM 0 HD13 LEU A 47 168.826 4.151 -8.529 1.00 0.00 H new ATOM 0 HD21 LEU A 47 170.620 5.926 -6.761 1.00 0.00 H new ATOM 0 HD22 LEU A 47 170.980 4.220 -7.122 1.00 0.00 H new ATOM 0 HD23 LEU A 47 172.185 5.479 -7.481 1.00 0.00 H new ATOM 656 N GLU A 48 174.532 4.225 -11.479 1.00 0.00 N ATOM 657 CA GLU A 48 175.266 3.435 -12.458 1.00 0.00 C ATOM 658 C GLU A 48 175.595 2.052 -11.904 1.00 0.00 C ATOM 659 O GLU A 48 175.825 1.892 -10.705 1.00 0.00 O ATOM 660 CB GLU A 48 176.552 4.153 -12.868 1.00 0.00 C ATOM 661 CG GLU A 48 176.376 5.084 -14.057 1.00 0.00 C ATOM 662 CD GLU A 48 175.790 4.382 -15.266 1.00 0.00 C ATOM 663 OE1 GLU A 48 176.496 3.549 -15.870 1.00 0.00 O ATOM 664 OE2 GLU A 48 174.623 4.667 -15.609 1.00 0.00 O ATOM 0 H GLU A 48 175.057 5.011 -11.095 1.00 0.00 H new ATOM 0 HA GLU A 48 174.633 3.314 -13.337 1.00 0.00 H new ATOM 0 HB2 GLU A 48 176.924 4.727 -12.019 1.00 0.00 H new ATOM 0 HB3 GLU A 48 177.312 3.410 -13.108 1.00 0.00 H new ATOM 0 HG2 GLU A 48 175.727 5.912 -13.772 1.00 0.00 H new ATOM 0 HG3 GLU A 48 177.342 5.513 -14.324 1.00 0.00 H new ATOM 671 N ALA A 49 175.613 1.058 -12.785 1.00 0.00 N ATOM 672 CA ALA A 49 175.908 -0.311 -12.390 1.00 0.00 C ATOM 673 C ALA A 49 177.221 -0.404 -11.615 1.00 0.00 C ATOM 674 O ALA A 49 177.425 -1.337 -10.839 1.00 0.00 O ATOM 675 CB ALA A 49 175.955 -1.213 -13.613 1.00 0.00 C ATOM 0 H ALA A 49 175.426 1.177 -13.781 1.00 0.00 H new ATOM 0 HA ALA A 49 175.108 -0.644 -11.729 1.00 0.00 H new ATOM 0 HB1 ALA A 49 176.177 -2.234 -13.304 1.00 0.00 H new ATOM 0 HB2 ALA A 49 174.991 -1.189 -14.120 1.00 0.00 H new ATOM 0 HB3 ALA A 49 176.732 -0.863 -14.293 1.00 0.00 H new ATOM 681 N GLY A 50 178.110 0.566 -11.835 1.00 0.00 N ATOM 682 CA GLY A 50 179.396 0.575 -11.155 1.00 0.00 C ATOM 683 C GLY A 50 180.023 -0.802 -11.075 1.00 0.00 C ATOM 684 O GLY A 50 179.951 -1.581 -12.025 1.00 0.00 O ATOM 0 H GLY A 50 177.961 1.347 -12.474 1.00 0.00 H new ATOM 0 HA2 GLY A 50 180.074 1.249 -11.678 1.00 0.00 H new ATOM 0 HA3 GLY A 50 179.267 0.971 -10.147 1.00 0.00 H new ATOM 688 N HIS A 51 180.622 -1.109 -9.931 1.00 0.00 N ATOM 689 CA HIS A 51 181.247 -2.406 -9.720 1.00 0.00 C ATOM 690 C HIS A 51 180.635 -3.092 -8.508 1.00 0.00 C ATOM 691 O HIS A 51 179.839 -4.021 -8.645 1.00 0.00 O ATOM 692 CB HIS A 51 182.760 -2.263 -9.543 1.00 0.00 C ATOM 693 CG HIS A 51 183.518 -2.278 -10.835 1.00 0.00 C ATOM 694 ND1 HIS A 51 184.893 -2.360 -10.901 1.00 0.00 N ATOM 695 CD2 HIS A 51 183.085 -2.220 -12.118 1.00 0.00 C ATOM 696 CE1 HIS A 51 185.274 -2.350 -12.166 1.00 0.00 C ATOM 697 NE2 HIS A 51 184.196 -2.268 -12.925 1.00 0.00 N ATOM 0 H HIS A 51 180.687 -0.475 -9.135 1.00 0.00 H new ATOM 0 HA HIS A 51 181.066 -3.020 -10.602 1.00 0.00 H new ATOM 0 HB2 HIS A 51 182.970 -1.331 -9.019 1.00 0.00 H new ATOM 0 HB3 HIS A 51 183.122 -3.073 -8.910 1.00 0.00 H new ATOM 0 HD2 HIS A 51 182.058 -2.149 -12.445 1.00 0.00 H new ATOM 0 HE1 HIS A 51 186.293 -2.400 -12.519 1.00 0.00 H new ATOM 0 HE2 HIS A 51 184.189 -2.244 -13.945 1.00 0.00 H new ATOM 706 N TRP A 52 180.994 -2.618 -7.323 1.00 0.00 N ATOM 707 CA TRP A 52 180.455 -3.180 -6.094 1.00 0.00 C ATOM 708 C TRP A 52 178.974 -2.861 -5.989 1.00 0.00 C ATOM 709 O TRP A 52 178.594 -1.843 -5.418 1.00 0.00 O ATOM 710 CB TRP A 52 181.202 -2.626 -4.883 1.00 0.00 C ATOM 711 CG TRP A 52 182.649 -2.999 -4.873 1.00 0.00 C ATOM 712 CD1 TRP A 52 183.170 -4.240 -4.661 1.00 0.00 C ATOM 713 CD2 TRP A 52 183.760 -2.127 -5.095 1.00 0.00 C ATOM 714 NE1 TRP A 52 184.538 -4.196 -4.737 1.00 0.00 N ATOM 715 CE2 TRP A 52 184.927 -2.908 -5.000 1.00 0.00 C ATOM 716 CE3 TRP A 52 183.883 -0.761 -5.364 1.00 0.00 C ATOM 717 CZ2 TRP A 52 186.199 -2.367 -5.167 1.00 0.00 C ATOM 718 CZ3 TRP A 52 185.145 -0.225 -5.528 1.00 0.00 C ATOM 719 CH2 TRP A 52 186.289 -1.027 -5.429 1.00 0.00 C ATOM 0 H TRP A 52 181.652 -1.851 -7.187 1.00 0.00 H new ATOM 0 HA TRP A 52 180.585 -4.262 -6.114 1.00 0.00 H new ATOM 0 HB2 TRP A 52 181.112 -1.540 -4.872 1.00 0.00 H new ATOM 0 HB3 TRP A 52 180.731 -2.994 -3.972 1.00 0.00 H new ATOM 0 HD1 TRP A 52 182.590 -5.129 -4.462 1.00 0.00 H new ATOM 0 HE1 TRP A 52 185.164 -4.992 -4.617 1.00 0.00 H new ATOM 0 HE3 TRP A 52 183.006 -0.135 -5.442 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 187.083 -2.983 -5.092 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 185.252 0.829 -5.736 1.00 0.00 H new ATOM 0 HH2 TRP A 52 187.262 -0.578 -5.562 1.00 0.00 H new ATOM 730 N ALA A 53 178.149 -3.735 -6.561 1.00 0.00 N ATOM 731 CA ALA A 53 176.701 -3.558 -6.551 1.00 0.00 C ATOM 732 C ALA A 53 176.018 -4.700 -5.810 1.00 0.00 C ATOM 733 O ALA A 53 175.618 -5.693 -6.420 1.00 0.00 O ATOM 734 CB ALA A 53 176.174 -3.462 -7.975 1.00 0.00 C ATOM 0 H ALA A 53 178.463 -4.579 -7.040 1.00 0.00 H new ATOM 0 HA ALA A 53 176.474 -2.630 -6.027 1.00 0.00 H new ATOM 0 HB1 ALA A 53 175.092 -3.330 -7.954 1.00 0.00 H new ATOM 0 HB2 ALA A 53 176.634 -2.611 -8.477 1.00 0.00 H new ATOM 0 HB3 ALA A 53 176.418 -4.377 -8.516 1.00 0.00 H new ATOM 740 N ARG A 54 175.899 -4.570 -4.495 1.00 0.00 N ATOM 741 CA ARG A 54 175.281 -5.609 -3.686 1.00 0.00 C ATOM 742 C ARG A 54 174.300 -5.026 -2.671 1.00 0.00 C ATOM 743 O ARG A 54 174.526 -3.950 -2.117 1.00 0.00 O ATOM 744 CB ARG A 54 176.373 -6.399 -2.974 1.00 0.00 C ATOM 745 CG ARG A 54 175.845 -7.523 -2.096 1.00 0.00 C ATOM 746 CD ARG A 54 176.485 -8.857 -2.448 1.00 0.00 C ATOM 747 NE ARG A 54 176.087 -9.321 -3.776 1.00 0.00 N ATOM 748 CZ ARG A 54 176.760 -10.232 -4.475 1.00 0.00 C ATOM 749 NH1 ARG A 54 177.861 -10.781 -3.978 1.00 0.00 N ATOM 750 NH2 ARG A 54 176.329 -10.596 -5.675 1.00 0.00 N ATOM 0 H ARG A 54 176.221 -3.758 -3.969 1.00 0.00 H new ATOM 0 HA ARG A 54 174.712 -6.268 -4.342 1.00 0.00 H new ATOM 0 HB2 ARG A 54 177.049 -6.819 -3.719 1.00 0.00 H new ATOM 0 HB3 ARG A 54 176.960 -5.716 -2.360 1.00 0.00 H new ATOM 0 HG2 ARG A 54 176.040 -7.290 -1.049 1.00 0.00 H new ATOM 0 HG3 ARG A 54 174.763 -7.597 -2.210 1.00 0.00 H new ATOM 0 HD2 ARG A 54 177.570 -8.761 -2.408 1.00 0.00 H new ATOM 0 HD3 ARG A 54 176.203 -9.602 -1.704 1.00 0.00 H new ATOM 0 HE ARG A 54 175.244 -8.923 -4.191 1.00 0.00 H new ATOM 0 HH11 ARG A 54 178.196 -10.505 -3.055 1.00 0.00 H new ATOM 0 HH12 ARG A 54 178.372 -11.479 -4.519 1.00 0.00 H new ATOM 0 HH21 ARG A 54 175.483 -10.178 -6.061 1.00 0.00 H new ATOM 0 HH22 ARG A 54 176.844 -11.294 -6.212 1.00 0.00 H new ATOM 764 N ASP A 55 173.209 -5.752 -2.434 1.00 0.00 N ATOM 765 CA ASP A 55 172.185 -5.324 -1.486 1.00 0.00 C ATOM 766 C ASP A 55 172.230 -6.180 -0.223 1.00 0.00 C ATOM 767 O ASP A 55 172.032 -7.394 -0.279 1.00 0.00 O ATOM 768 CB ASP A 55 170.799 -5.417 -2.127 1.00 0.00 C ATOM 769 CG ASP A 55 169.993 -4.146 -1.946 1.00 0.00 C ATOM 770 OD1 ASP A 55 170.346 -3.342 -1.059 1.00 0.00 O ATOM 771 OD2 ASP A 55 169.009 -3.956 -2.693 1.00 0.00 O ATOM 0 H ASP A 55 173.012 -6.644 -2.889 1.00 0.00 H new ATOM 0 HA ASP A 55 172.383 -4.288 -1.213 1.00 0.00 H new ATOM 0 HB2 ASP A 55 170.907 -5.627 -3.191 1.00 0.00 H new ATOM 0 HB3 ASP A 55 170.255 -6.254 -1.690 1.00 0.00 H new ATOM 776 N ILE A 56 172.491 -5.544 0.914 1.00 0.00 N ATOM 777 CA ILE A 56 172.560 -6.255 2.186 1.00 0.00 C ATOM 778 C ILE A 56 171.225 -6.196 2.920 1.00 0.00 C ATOM 779 O ILE A 56 170.454 -5.251 2.748 1.00 0.00 O ATOM 780 CB ILE A 56 173.665 -5.680 3.097 1.00 0.00 C ATOM 781 CG1 ILE A 56 174.939 -5.420 2.290 1.00 0.00 C ATOM 782 CG2 ILE A 56 173.947 -6.631 4.250 1.00 0.00 C ATOM 783 CD1 ILE A 56 176.079 -4.871 3.122 1.00 0.00 C ATOM 0 H ILE A 56 172.658 -4.540 0.981 1.00 0.00 H new ATOM 0 HA ILE A 56 172.799 -7.293 1.955 1.00 0.00 H new ATOM 0 HB ILE A 56 173.319 -4.732 3.509 1.00 0.00 H new ATOM 0 HG12 ILE A 56 175.258 -6.350 1.820 1.00 0.00 H new ATOM 0 HG13 ILE A 56 174.714 -4.718 1.487 1.00 0.00 H new ATOM 0 HG21 ILE A 56 174.728 -6.212 4.884 1.00 0.00 H new ATOM 0 HG22 ILE A 56 173.039 -6.770 4.837 1.00 0.00 H new ATOM 0 HG23 ILE A 56 174.276 -7.593 3.856 1.00 0.00 H new ATOM 0 HD11 ILE A 56 176.949 -4.711 2.486 1.00 0.00 H new ATOM 0 HD12 ILE A 56 175.779 -3.924 3.571 1.00 0.00 H new ATOM 0 HD13 ILE A 56 176.331 -5.582 3.909 1.00 0.00 H new ATOM 795 N THR A 57 170.955 -7.209 3.737 1.00 0.00 N ATOM 796 CA THR A 57 169.709 -7.271 4.494 1.00 0.00 C ATOM 797 C THR A 57 169.949 -7.797 5.907 1.00 0.00 C ATOM 798 O THR A 57 169.183 -8.619 6.410 1.00 0.00 O ATOM 799 CB THR A 57 168.695 -8.160 3.772 1.00 0.00 C ATOM 800 OG1 THR A 57 169.130 -9.508 3.760 1.00 0.00 O ATOM 801 CG2 THR A 57 168.447 -7.745 2.339 1.00 0.00 C ATOM 0 H THR A 57 171.582 -7.998 3.892 1.00 0.00 H new ATOM 0 HA THR A 57 169.310 -6.259 4.569 1.00 0.00 H new ATOM 0 HB THR A 57 167.765 -8.049 4.330 1.00 0.00 H new ATOM 0 HG1 THR A 57 168.468 -10.061 3.296 1.00 0.00 H new ATOM 0 HG21 THR A 57 167.718 -8.417 1.886 1.00 0.00 H new ATOM 0 HG22 THR A 57 168.063 -6.725 2.317 1.00 0.00 H new ATOM 0 HG23 THR A 57 169.381 -7.793 1.779 1.00 0.00 H new ATOM 809 N LYS A 58 171.014 -7.320 6.543 1.00 0.00 N ATOM 810 CA LYS A 58 171.350 -7.745 7.897 1.00 0.00 C ATOM 811 C LYS A 58 172.621 -7.054 8.388 1.00 0.00 C ATOM 812 O LYS A 58 173.730 -7.483 8.071 1.00 0.00 O ATOM 813 CB LYS A 58 171.531 -9.265 7.946 1.00 0.00 C ATOM 814 CG LYS A 58 170.621 -9.952 8.952 1.00 0.00 C ATOM 815 CD LYS A 58 170.068 -11.259 8.405 1.00 0.00 C ATOM 816 CE LYS A 58 168.602 -11.440 8.767 1.00 0.00 C ATOM 817 NZ LYS A 58 167.704 -11.120 7.623 1.00 0.00 N ATOM 0 H LYS A 58 171.659 -6.639 6.142 1.00 0.00 H new ATOM 0 HA LYS A 58 170.528 -7.461 8.554 1.00 0.00 H new ATOM 0 HB2 LYS A 58 171.341 -9.678 6.955 1.00 0.00 H new ATOM 0 HB3 LYS A 58 172.568 -9.492 8.192 1.00 0.00 H new ATOM 0 HG2 LYS A 58 171.174 -10.147 9.871 1.00 0.00 H new ATOM 0 HG3 LYS A 58 169.797 -9.288 9.211 1.00 0.00 H new ATOM 0 HD2 LYS A 58 170.181 -11.278 7.321 1.00 0.00 H new ATOM 0 HD3 LYS A 58 170.647 -12.094 8.800 1.00 0.00 H new ATOM 0 HE2 LYS A 58 168.431 -12.468 9.086 1.00 0.00 H new ATOM 0 HE3 LYS A 58 168.355 -10.798 9.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 166.755 -10.890 7.980 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 168.084 -10.305 7.101 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 167.645 -11.941 6.987 1.00 0.00 H new ATOM 831 N PRO A 59 172.481 -5.971 9.175 1.00 0.00 N ATOM 832 CA PRO A 59 173.629 -5.229 9.706 1.00 0.00 C ATOM 833 C PRO A 59 174.625 -6.138 10.414 1.00 0.00 C ATOM 834 O PRO A 59 174.461 -7.358 10.442 1.00 0.00 O ATOM 835 CB PRO A 59 172.998 -4.263 10.711 1.00 0.00 C ATOM 836 CG PRO A 59 171.600 -4.076 10.230 1.00 0.00 C ATOM 837 CD PRO A 59 171.197 -5.385 9.608 1.00 0.00 C ATOM 0 HA PRO A 59 174.194 -4.737 8.914 1.00 0.00 H new ATOM 0 HB2 PRO A 59 173.018 -4.673 11.721 1.00 0.00 H new ATOM 0 HB3 PRO A 59 173.536 -3.316 10.741 1.00 0.00 H new ATOM 0 HG2 PRO A 59 170.936 -3.814 11.054 1.00 0.00 H new ATOM 0 HG3 PRO A 59 171.542 -3.265 9.504 1.00 0.00 H new ATOM 0 HD2 PRO A 59 170.683 -6.028 10.323 1.00 0.00 H new ATOM 0 HD3 PRO A 59 170.519 -5.238 8.767 1.00 0.00 H new ATOM 845 N LYS A 60 175.652 -5.531 10.994 1.00 0.00 N ATOM 846 CA LYS A 60 176.674 -6.279 11.719 1.00 0.00 C ATOM 847 C LYS A 60 176.573 -5.994 13.212 1.00 0.00 C ATOM 848 O LYS A 60 176.555 -6.908 14.036 1.00 0.00 O ATOM 849 CB LYS A 60 178.069 -5.911 11.206 1.00 0.00 C ATOM 850 CG LYS A 60 179.065 -7.056 11.283 1.00 0.00 C ATOM 851 CD LYS A 60 179.655 -7.188 12.677 1.00 0.00 C ATOM 852 CE LYS A 60 179.848 -8.646 13.064 1.00 0.00 C ATOM 853 NZ LYS A 60 181.164 -9.173 12.604 1.00 0.00 N ATOM 0 H LYS A 60 175.801 -4.522 10.977 1.00 0.00 H new ATOM 0 HA LYS A 60 176.510 -7.344 11.551 1.00 0.00 H new ATOM 0 HB2 LYS A 60 177.991 -5.577 10.171 1.00 0.00 H new ATOM 0 HB3 LYS A 60 178.450 -5.069 11.784 1.00 0.00 H new ATOM 0 HG2 LYS A 60 178.572 -7.988 11.006 1.00 0.00 H new ATOM 0 HG3 LYS A 60 179.866 -6.892 10.562 1.00 0.00 H new ATOM 0 HD2 LYS A 60 180.613 -6.669 12.719 1.00 0.00 H new ATOM 0 HD3 LYS A 60 178.998 -6.703 13.399 1.00 0.00 H new ATOM 0 HE2 LYS A 60 179.775 -8.747 14.147 1.00 0.00 H new ATOM 0 HE3 LYS A 60 179.046 -9.245 12.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 181.257 -10.169 12.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 181.224 -9.100 11.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 181.930 -8.618 13.035 1.00 0.00 H new ATOM 867 N GLU A 61 176.493 -4.712 13.541 1.00 0.00 N ATOM 868 CA GLU A 61 176.378 -4.265 14.923 1.00 0.00 C ATOM 869 C GLU A 61 176.278 -2.755 14.960 1.00 0.00 C ATOM 870 O GLU A 61 177.271 -2.057 15.163 1.00 0.00 O ATOM 871 CB GLU A 61 177.568 -4.745 15.758 1.00 0.00 C ATOM 872 CG GLU A 61 177.325 -4.680 17.258 1.00 0.00 C ATOM 873 CD GLU A 61 177.198 -6.053 17.888 1.00 0.00 C ATOM 874 OE1 GLU A 61 176.203 -6.750 17.600 1.00 0.00 O ATOM 875 OE2 GLU A 61 178.095 -6.431 18.671 1.00 0.00 O ATOM 0 H GLU A 61 176.506 -3.954 12.859 1.00 0.00 H new ATOM 0 HA GLU A 61 175.475 -4.696 15.356 1.00 0.00 H new ATOM 0 HB2 GLU A 61 177.805 -5.772 15.481 1.00 0.00 H new ATOM 0 HB3 GLU A 61 178.441 -4.140 15.513 1.00 0.00 H new ATOM 0 HG2 GLU A 61 178.145 -4.141 17.732 1.00 0.00 H new ATOM 0 HG3 GLU A 61 176.416 -4.110 17.451 1.00 0.00 H new ATOM 882 N GLY A 62 175.075 -2.254 14.709 1.00 0.00 N ATOM 883 CA GLY A 62 174.874 -0.826 14.664 1.00 0.00 C ATOM 884 C GLY A 62 175.524 -0.237 13.430 1.00 0.00 C ATOM 885 O GLY A 62 175.501 0.976 13.219 1.00 0.00 O ATOM 0 H GLY A 62 174.239 -2.813 14.537 1.00 0.00 H new ATOM 0 HA2 GLY A 62 173.807 -0.603 14.662 1.00 0.00 H new ATOM 0 HA3 GLY A 62 175.294 -0.365 15.558 1.00 0.00 H new ATOM 889 N ARG A 63 176.109 -1.114 12.608 1.00 0.00 N ATOM 890 CA ARG A 63 176.778 -0.702 11.378 1.00 0.00 C ATOM 891 C ARG A 63 176.840 -1.859 10.388 1.00 0.00 C ATOM 892 O ARG A 63 177.218 -2.972 10.756 1.00 0.00 O ATOM 893 CB ARG A 63 178.197 -0.219 11.690 1.00 0.00 C ATOM 894 CG ARG A 63 178.299 1.277 11.932 1.00 0.00 C ATOM 895 CD ARG A 63 179.428 1.612 12.893 1.00 0.00 C ATOM 896 NE ARG A 63 179.268 2.938 13.484 1.00 0.00 N ATOM 897 CZ ARG A 63 180.149 3.491 14.314 1.00 0.00 C ATOM 898 NH1 ARG A 63 181.253 2.836 14.654 1.00 0.00 N ATOM 899 NH2 ARG A 63 179.927 4.702 14.806 1.00 0.00 N ATOM 0 H ARG A 63 176.130 -2.120 12.777 1.00 0.00 H new ATOM 0 HA ARG A 63 176.207 0.113 10.933 1.00 0.00 H new ATOM 0 HB2 ARG A 63 178.564 -0.745 12.571 1.00 0.00 H new ATOM 0 HB3 ARG A 63 178.852 -0.489 10.862 1.00 0.00 H new ATOM 0 HG2 ARG A 63 178.463 1.789 10.984 1.00 0.00 H new ATOM 0 HG3 ARG A 63 177.356 1.646 12.335 1.00 0.00 H new ATOM 0 HD2 ARG A 63 179.464 0.864 13.685 1.00 0.00 H new ATOM 0 HD3 ARG A 63 180.380 1.563 12.365 1.00 0.00 H new ATOM 0 HE ARG A 63 178.432 3.472 13.247 1.00 0.00 H new ATOM 0 HH11 ARG A 63 181.429 1.904 14.279 1.00 0.00 H new ATOM 0 HH12 ARG A 63 181.925 3.265 15.291 1.00 0.00 H new ATOM 0 HH21 ARG A 63 179.081 5.210 14.548 1.00 0.00 H new ATOM 0 HH22 ARG A 63 180.602 5.126 15.442 1.00 0.00 H new ATOM 913 N TRP A 64 176.495 -1.603 9.128 1.00 0.00 N ATOM 914 CA TRP A 64 176.551 -2.642 8.118 1.00 0.00 C ATOM 915 C TRP A 64 177.980 -2.820 7.643 1.00 0.00 C ATOM 916 O TRP A 64 178.790 -1.894 7.710 1.00 0.00 O ATOM 917 CB TRP A 64 175.660 -2.316 6.927 1.00 0.00 C ATOM 918 CG TRP A 64 174.238 -2.004 7.284 1.00 0.00 C ATOM 919 CD1 TRP A 64 173.793 -1.012 8.110 1.00 0.00 C ATOM 920 CD2 TRP A 64 173.068 -2.692 6.820 1.00 0.00 C ATOM 921 NE1 TRP A 64 172.421 -1.045 8.188 1.00 0.00 N ATOM 922 CE2 TRP A 64 171.954 -2.064 7.405 1.00 0.00 C ATOM 923 CE3 TRP A 64 172.853 -3.777 5.964 1.00 0.00 C ATOM 924 CZ2 TRP A 64 170.648 -2.482 7.165 1.00 0.00 C ATOM 925 CZ3 TRP A 64 171.554 -4.193 5.728 1.00 0.00 C ATOM 926 CH2 TRP A 64 170.466 -3.545 6.327 1.00 0.00 C ATOM 0 H TRP A 64 176.178 -0.694 8.791 1.00 0.00 H new ATOM 0 HA TRP A 64 176.189 -3.565 8.571 1.00 0.00 H new ATOM 0 HB2 TRP A 64 176.083 -1.464 6.395 1.00 0.00 H new ATOM 0 HB3 TRP A 64 175.672 -3.161 6.238 1.00 0.00 H new ATOM 0 HD1 TRP A 64 174.426 -0.305 8.626 1.00 0.00 H new ATOM 0 HE1 TRP A 64 171.844 -0.411 8.741 1.00 0.00 H new ATOM 0 HE3 TRP A 64 173.685 -4.281 5.496 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 169.808 -1.983 7.625 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 171.376 -5.031 5.071 1.00 0.00 H new ATOM 0 HH2 TRP A 64 169.464 -3.893 6.122 1.00 0.00 H new ATOM 937 N THR A 65 178.276 -4.017 7.165 1.00 0.00 N ATOM 938 CA THR A 65 179.609 -4.339 6.673 1.00 0.00 C ATOM 939 C THR A 65 179.544 -5.096 5.352 1.00 0.00 C ATOM 940 O THR A 65 178.975 -6.185 5.276 1.00 0.00 O ATOM 941 CB THR A 65 180.367 -5.171 7.710 1.00 0.00 C ATOM 942 OG1 THR A 65 180.281 -4.572 8.991 1.00 0.00 O ATOM 943 CG2 THR A 65 181.834 -5.343 7.382 1.00 0.00 C ATOM 0 H THR A 65 177.609 -4.786 7.106 1.00 0.00 H new ATOM 0 HA THR A 65 180.138 -3.401 6.503 1.00 0.00 H new ATOM 0 HB THR A 65 179.891 -6.152 7.699 1.00 0.00 H new ATOM 0 HG1 THR A 65 180.770 -5.118 9.641 1.00 0.00 H new ATOM 0 HG21 THR A 65 182.312 -5.942 8.157 1.00 0.00 H new ATOM 0 HG22 THR A 65 181.935 -5.846 6.420 1.00 0.00 H new ATOM 0 HG23 THR A 65 182.313 -4.365 7.332 1.00 0.00 H new ATOM 951 N PHE A 66 180.144 -4.524 4.315 1.00 0.00 N ATOM 952 CA PHE A 66 180.166 -5.159 3.003 1.00 0.00 C ATOM 953 C PHE A 66 181.576 -5.624 2.658 1.00 0.00 C ATOM 954 O PHE A 66 182.312 -4.938 1.950 1.00 0.00 O ATOM 955 CB PHE A 66 179.656 -4.200 1.926 1.00 0.00 C ATOM 956 CG PHE A 66 179.599 -4.821 0.559 1.00 0.00 C ATOM 957 CD1 PHE A 66 178.836 -5.955 0.332 1.00 0.00 C ATOM 958 CD2 PHE A 66 180.314 -4.276 -0.494 1.00 0.00 C ATOM 959 CE1 PHE A 66 178.787 -6.532 -0.922 1.00 0.00 C ATOM 960 CE2 PHE A 66 180.268 -4.849 -1.752 1.00 0.00 C ATOM 961 CZ PHE A 66 179.503 -5.979 -1.964 1.00 0.00 C ATOM 0 H PHE A 66 180.621 -3.623 4.357 1.00 0.00 H new ATOM 0 HA PHE A 66 179.506 -6.026 3.038 1.00 0.00 H new ATOM 0 HB2 PHE A 66 178.661 -3.851 2.201 1.00 0.00 H new ATOM 0 HB3 PHE A 66 180.303 -3.324 1.893 1.00 0.00 H new ATOM 0 HD1 PHE A 66 178.274 -6.392 1.144 1.00 0.00 H new ATOM 0 HD2 PHE A 66 180.915 -3.393 -0.331 1.00 0.00 H new ATOM 0 HE1 PHE A 66 178.188 -7.416 -1.087 1.00 0.00 H new ATOM 0 HE2 PHE A 66 180.829 -4.414 -2.566 1.00 0.00 H new ATOM 0 HZ PHE A 66 179.465 -6.430 -2.945 1.00 0.00 H new ATOM 971 N ARG A 67 181.948 -6.791 3.175 1.00 0.00 N ATOM 972 CA ARG A 67 183.274 -7.346 2.931 1.00 0.00 C ATOM 973 C ARG A 67 183.273 -8.270 1.717 1.00 0.00 C ATOM 974 O ARG A 67 182.473 -9.202 1.631 1.00 0.00 O ATOM 975 CB ARG A 67 183.763 -8.107 4.168 1.00 0.00 C ATOM 976 CG ARG A 67 184.901 -7.410 4.897 1.00 0.00 C ATOM 977 CD ARG A 67 185.854 -8.410 5.528 1.00 0.00 C ATOM 978 NE ARG A 67 187.246 -7.979 5.428 1.00 0.00 N ATOM 979 CZ ARG A 67 188.230 -8.463 6.184 1.00 0.00 C ATOM 980 NH1 ARG A 67 187.979 -9.396 7.094 1.00 0.00 N ATOM 981 NH2 ARG A 67 189.468 -8.015 6.027 1.00 0.00 N ATOM 0 H ARG A 67 181.350 -7.370 3.765 1.00 0.00 H new ATOM 0 HA ARG A 67 183.952 -6.518 2.726 1.00 0.00 H new ATOM 0 HB2 ARG A 67 182.928 -8.240 4.856 1.00 0.00 H new ATOM 0 HB3 ARG A 67 184.090 -9.102 3.867 1.00 0.00 H new ATOM 0 HG2 ARG A 67 185.447 -6.776 4.199 1.00 0.00 H new ATOM 0 HG3 ARG A 67 184.494 -6.757 5.669 1.00 0.00 H new ATOM 0 HD2 ARG A 67 185.592 -8.548 6.577 1.00 0.00 H new ATOM 0 HD3 ARG A 67 185.738 -9.378 5.040 1.00 0.00 H new ATOM 0 HE ARG A 67 187.478 -7.265 4.738 1.00 0.00 H new ATOM 0 HH11 ARG A 67 187.029 -9.746 7.217 1.00 0.00 H new ATOM 0 HH12 ARG A 67 188.736 -9.763 7.670 1.00 0.00 H new ATOM 0 HH21 ARG A 67 189.667 -7.300 5.327 1.00 0.00 H new ATOM 0 HH22 ARG A 67 190.222 -8.386 6.606 1.00 0.00 H new ATOM 995 N ASP A 68 184.180 -8.006 0.781 1.00 0.00 N ATOM 996 CA ASP A 68 184.297 -8.813 -0.429 1.00 0.00 C ATOM 997 C ASP A 68 185.759 -9.071 -0.768 1.00 0.00 C ATOM 998 O ASP A 68 186.490 -8.153 -1.141 1.00 0.00 O ATOM 999 CB ASP A 68 183.598 -8.121 -1.603 1.00 0.00 C ATOM 1000 CG ASP A 68 183.942 -6.648 -1.696 1.00 0.00 C ATOM 1001 OD1 ASP A 68 183.732 -5.925 -0.699 1.00 0.00 O ATOM 1002 OD2 ASP A 68 184.421 -6.217 -2.766 1.00 0.00 O ATOM 0 H ASP A 68 184.847 -7.236 0.838 1.00 0.00 H new ATOM 0 HA ASP A 68 183.811 -9.771 -0.246 1.00 0.00 H new ATOM 0 HB2 ASP A 68 183.880 -8.616 -2.532 1.00 0.00 H new ATOM 0 HB3 ASP A 68 182.519 -8.233 -1.496 1.00 0.00 H new ATOM 1007 N ARG A 69 186.180 -10.325 -0.634 1.00 0.00 N ATOM 1008 CA ARG A 69 187.558 -10.710 -0.923 1.00 0.00 C ATOM 1009 C ARG A 69 187.730 -11.103 -2.391 1.00 0.00 C ATOM 1010 O ARG A 69 188.664 -11.824 -2.742 1.00 0.00 O ATOM 1011 CB ARG A 69 187.983 -11.870 -0.018 1.00 0.00 C ATOM 1012 CG ARG A 69 189.144 -11.524 0.903 1.00 0.00 C ATOM 1013 CD ARG A 69 188.826 -11.855 2.353 1.00 0.00 C ATOM 1014 NE ARG A 69 189.979 -12.416 3.053 1.00 0.00 N ATOM 1015 CZ ARG A 69 190.368 -13.685 2.942 1.00 0.00 C ATOM 1016 NH1 ARG A 69 189.701 -14.526 2.162 1.00 0.00 N ATOM 1017 NH2 ARG A 69 191.429 -14.114 3.615 1.00 0.00 N ATOM 0 H ARG A 69 185.585 -11.094 -0.326 1.00 0.00 H new ATOM 0 HA ARG A 69 188.195 -9.847 -0.727 1.00 0.00 H new ATOM 0 HB2 ARG A 69 187.130 -12.181 0.586 1.00 0.00 H new ATOM 0 HB3 ARG A 69 188.262 -12.722 -0.638 1.00 0.00 H new ATOM 0 HG2 ARG A 69 190.033 -12.072 0.591 1.00 0.00 H new ATOM 0 HG3 ARG A 69 189.376 -10.463 0.814 1.00 0.00 H new ATOM 0 HD2 ARG A 69 188.494 -10.952 2.866 1.00 0.00 H new ATOM 0 HD3 ARG A 69 187.999 -12.565 2.390 1.00 0.00 H new ATOM 0 HE ARG A 69 190.517 -11.800 3.662 1.00 0.00 H new ATOM 0 HH11 ARG A 69 188.885 -14.202 1.643 1.00 0.00 H new ATOM 0 HH12 ARG A 69 190.004 -15.497 2.082 1.00 0.00 H new ATOM 0 HH21 ARG A 69 191.945 -13.472 4.216 1.00 0.00 H new ATOM 0 HH22 ARG A 69 191.728 -15.086 3.531 1.00 0.00 H new ATOM 1031 N ASN A 70 186.827 -10.626 -3.244 1.00 0.00 N ATOM 1032 CA ASN A 70 186.888 -10.933 -4.669 1.00 0.00 C ATOM 1033 C ASN A 70 186.963 -9.652 -5.494 1.00 0.00 C ATOM 1034 O ASN A 70 186.471 -9.597 -6.620 1.00 0.00 O ATOM 1035 CB ASN A 70 185.666 -11.752 -5.088 1.00 0.00 C ATOM 1036 CG ASN A 70 186.008 -12.813 -6.117 1.00 0.00 C ATOM 1037 OD1 ASN A 70 185.720 -12.659 -7.304 1.00 0.00 O ATOM 1038 ND2 ASN A 70 186.625 -13.899 -5.665 1.00 0.00 N ATOM 0 H ASN A 70 186.047 -10.027 -2.974 1.00 0.00 H new ATOM 0 HA ASN A 70 187.789 -11.519 -4.853 1.00 0.00 H new ATOM 0 HB2 ASN A 70 185.232 -12.228 -4.209 1.00 0.00 H new ATOM 0 HB3 ASN A 70 184.907 -11.085 -5.496 1.00 0.00 H new ATOM 0 HD21 ASN A 70 186.879 -14.647 -6.310 1.00 0.00 H new ATOM 0 HD22 ASN A 70 186.845 -13.985 -4.673 1.00 0.00 H new ATOM 1045 N ALA A 71 187.583 -8.625 -4.923 1.00 0.00 N ATOM 1046 CA ALA A 71 187.724 -7.343 -5.602 1.00 0.00 C ATOM 1047 C ALA A 71 189.167 -7.107 -6.032 1.00 0.00 C ATOM 1048 O ALA A 71 190.088 -7.194 -5.220 1.00 0.00 O ATOM 1049 CB ALA A 71 187.249 -6.215 -4.701 1.00 0.00 C ATOM 0 H ALA A 71 187.996 -8.656 -3.991 1.00 0.00 H new ATOM 0 HA ALA A 71 187.104 -7.363 -6.498 1.00 0.00 H new ATOM 0 HB1 ALA A 71 187.360 -5.263 -5.220 1.00 0.00 H new ATOM 0 HB2 ALA A 71 186.200 -6.370 -4.447 1.00 0.00 H new ATOM 0 HB3 ALA A 71 187.846 -6.202 -3.789 1.00 0.00 H new ATOM 1055 N LYS A 72 189.357 -6.805 -7.311 1.00 0.00 N ATOM 1056 CA LYS A 72 190.689 -6.553 -7.845 1.00 0.00 C ATOM 1057 C LYS A 72 191.071 -5.087 -7.675 1.00 0.00 C ATOM 1058 O LYS A 72 191.051 -4.314 -8.633 1.00 0.00 O ATOM 1059 CB LYS A 72 190.751 -6.943 -9.324 1.00 0.00 C ATOM 1060 CG LYS A 72 192.165 -7.170 -9.833 1.00 0.00 C ATOM 1061 CD LYS A 72 192.314 -6.726 -11.279 1.00 0.00 C ATOM 1062 CE LYS A 72 192.812 -5.291 -11.373 1.00 0.00 C ATOM 1063 NZ LYS A 72 193.256 -4.946 -12.752 1.00 0.00 N ATOM 0 H LYS A 72 188.606 -6.729 -7.997 1.00 0.00 H new ATOM 0 HA LYS A 72 191.400 -7.163 -7.288 1.00 0.00 H new ATOM 0 HB2 LYS A 72 190.168 -7.851 -9.477 1.00 0.00 H new ATOM 0 HB3 LYS A 72 190.281 -6.159 -9.918 1.00 0.00 H new ATOM 0 HG2 LYS A 72 192.870 -6.622 -9.208 1.00 0.00 H new ATOM 0 HG3 LYS A 72 192.418 -8.227 -9.748 1.00 0.00 H new ATOM 0 HD2 LYS A 72 193.010 -7.388 -11.794 1.00 0.00 H new ATOM 0 HD3 LYS A 72 191.354 -6.813 -11.788 1.00 0.00 H new ATOM 0 HE2 LYS A 72 192.018 -4.610 -11.067 1.00 0.00 H new ATOM 0 HE3 LYS A 72 193.640 -5.148 -10.679 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 193.588 -3.961 -12.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 194.031 -5.579 -13.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 192.459 -5.058 -13.411 1.00 0.00 H new ATOM 1077 N LEU A 73 191.420 -4.712 -6.450 1.00 0.00 N ATOM 1078 CA LEU A 73 191.809 -3.339 -6.153 1.00 0.00 C ATOM 1079 C LEU A 73 193.272 -3.105 -6.507 1.00 0.00 C ATOM 1080 O LEU A 73 194.072 -4.040 -6.527 1.00 0.00 O ATOM 1081 CB LEU A 73 191.576 -3.028 -4.673 1.00 0.00 C ATOM 1082 CG LEU A 73 190.116 -3.095 -4.220 1.00 0.00 C ATOM 1083 CD1 LEU A 73 190.031 -3.132 -2.703 1.00 0.00 C ATOM 1084 CD2 LEU A 73 189.333 -1.912 -4.770 1.00 0.00 C ATOM 0 H LEU A 73 191.442 -5.340 -5.646 1.00 0.00 H new ATOM 0 HA LEU A 73 191.193 -2.673 -6.757 1.00 0.00 H new ATOM 0 HB2 LEU A 73 192.159 -3.728 -4.074 1.00 0.00 H new ATOM 0 HB3 LEU A 73 191.961 -2.030 -4.462 1.00 0.00 H new ATOM 0 HG LEU A 73 189.675 -4.012 -4.612 1.00 0.00 H new ATOM 0 HD11 LEU A 73 188.986 -3.180 -2.398 1.00 0.00 H new ATOM 0 HD12 LEU A 73 190.558 -4.010 -2.330 1.00 0.00 H new ATOM 0 HD13 LEU A 73 190.489 -2.233 -2.291 1.00 0.00 H new ATOM 0 HD21 LEU A 73 188.297 -1.976 -4.438 1.00 0.00 H new ATOM 0 HD22 LEU A 73 189.774 -0.984 -4.407 1.00 0.00 H new ATOM 0 HD23 LEU A 73 189.367 -1.928 -5.859 1.00 0.00 H new ATOM 1096 N LYS A 74 193.618 -1.853 -6.788 1.00 0.00 N ATOM 1097 CA LYS A 74 194.989 -1.506 -7.142 1.00 0.00 C ATOM 1098 C LYS A 74 195.481 -0.312 -6.332 1.00 0.00 C ATOM 1099 O LYS A 74 194.717 0.603 -6.025 1.00 0.00 O ATOM 1100 CB LYS A 74 195.093 -1.204 -8.637 1.00 0.00 C ATOM 1101 CG LYS A 74 196.516 -1.243 -9.169 1.00 0.00 C ATOM 1102 CD LYS A 74 196.591 -1.942 -10.517 1.00 0.00 C ATOM 1103 CE LYS A 74 196.610 -0.943 -11.662 1.00 0.00 C ATOM 1104 NZ LYS A 74 197.570 -1.341 -12.730 1.00 0.00 N ATOM 0 H LYS A 74 192.971 -1.065 -6.778 1.00 0.00 H new ATOM 0 HA LYS A 74 195.622 -2.362 -6.907 1.00 0.00 H new ATOM 0 HB2 LYS A 74 194.489 -1.925 -9.187 1.00 0.00 H new ATOM 0 HB3 LYS A 74 194.669 -0.219 -8.830 1.00 0.00 H new ATOM 0 HG2 LYS A 74 196.897 -0.226 -9.264 1.00 0.00 H new ATOM 0 HG3 LYS A 74 197.158 -1.759 -8.455 1.00 0.00 H new ATOM 0 HD2 LYS A 74 197.487 -2.561 -10.558 1.00 0.00 H new ATOM 0 HD3 LYS A 74 195.737 -2.610 -10.630 1.00 0.00 H new ATOM 0 HE2 LYS A 74 195.610 -0.858 -12.086 1.00 0.00 H new ATOM 0 HE3 LYS A 74 196.879 0.042 -11.280 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 197.553 -0.634 -13.493 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 198.529 -1.398 -12.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 197.299 -2.269 -13.112 1.00 0.00 H new ATOM 1118 N LEU A 75 196.763 -0.335 -5.987 1.00 0.00 N ATOM 1119 CA LEU A 75 197.368 0.736 -5.205 1.00 0.00 C ATOM 1120 C LEU A 75 197.427 2.036 -5.996 1.00 0.00 C ATOM 1121 O LEU A 75 197.868 2.060 -7.146 1.00 0.00 O ATOM 1122 CB LEU A 75 198.776 0.327 -4.764 1.00 0.00 C ATOM 1123 CG LEU A 75 199.319 1.051 -3.531 1.00 0.00 C ATOM 1124 CD1 LEU A 75 199.316 2.555 -3.748 1.00 0.00 C ATOM 1125 CD2 LEU A 75 198.509 0.684 -2.299 1.00 0.00 C ATOM 0 H LEU A 75 197.405 -1.087 -6.238 1.00 0.00 H new ATOM 0 HA LEU A 75 196.746 0.906 -4.326 1.00 0.00 H new ATOM 0 HB2 LEU A 75 198.778 -0.745 -4.564 1.00 0.00 H new ATOM 0 HB3 LEU A 75 199.461 0.497 -5.594 1.00 0.00 H new ATOM 0 HG LEU A 75 200.349 0.733 -3.371 1.00 0.00 H new ATOM 0 HD11 LEU A 75 199.706 3.052 -2.859 1.00 0.00 H new ATOM 0 HD12 LEU A 75 199.943 2.800 -4.605 1.00 0.00 H new ATOM 0 HD13 LEU A 75 198.297 2.894 -3.935 1.00 0.00 H new ATOM 0 HD21 LEU A 75 198.909 1.208 -1.431 1.00 0.00 H new ATOM 0 HD22 LEU A 75 197.468 0.972 -2.449 1.00 0.00 H new ATOM 0 HD23 LEU A 75 198.568 -0.392 -2.132 1.00 0.00 H new ATOM 1137 N GLY A 76 196.982 3.121 -5.367 1.00 0.00 N ATOM 1138 CA GLY A 76 196.996 4.417 -6.017 1.00 0.00 C ATOM 1139 C GLY A 76 195.682 4.741 -6.700 1.00 0.00 C ATOM 1140 O GLY A 76 195.351 5.909 -6.903 1.00 0.00 O ATOM 0 H GLY A 76 196.612 3.124 -4.417 1.00 0.00 H new ATOM 0 HA2 GLY A 76 197.217 5.187 -5.278 1.00 0.00 H new ATOM 0 HA3 GLY A 76 197.800 4.441 -6.753 1.00 0.00 H new ATOM 1144 N ASP A 77 194.936 3.704 -7.061 1.00 0.00 N ATOM 1145 CA ASP A 77 193.659 3.876 -7.731 1.00 0.00 C ATOM 1146 C ASP A 77 192.690 4.690 -6.878 1.00 0.00 C ATOM 1147 O ASP A 77 192.853 4.796 -5.660 1.00 0.00 O ATOM 1148 CB ASP A 77 193.054 2.511 -8.056 1.00 0.00 C ATOM 1149 CG ASP A 77 191.946 2.599 -9.086 1.00 0.00 C ATOM 1150 OD1 ASP A 77 190.874 3.146 -8.757 1.00 0.00 O ATOM 1151 OD2 ASP A 77 192.153 2.122 -10.221 1.00 0.00 O ATOM 0 H ASP A 77 195.198 2.732 -6.899 1.00 0.00 H new ATOM 0 HA ASP A 77 193.833 4.424 -8.657 1.00 0.00 H new ATOM 0 HB2 ASP A 77 193.837 1.848 -8.425 1.00 0.00 H new ATOM 0 HB3 ASP A 77 192.662 2.064 -7.142 1.00 0.00 H new ATOM 1156 N LYS A 78 191.675 5.255 -7.526 1.00 0.00 N ATOM 1157 CA LYS A 78 190.668 6.052 -6.835 1.00 0.00 C ATOM 1158 C LYS A 78 189.340 5.303 -6.774 1.00 0.00 C ATOM 1159 O LYS A 78 189.145 4.307 -7.472 1.00 0.00 O ATOM 1160 CB LYS A 78 190.480 7.400 -7.531 1.00 0.00 C ATOM 1161 CG LYS A 78 189.825 8.453 -6.652 1.00 0.00 C ATOM 1162 CD LYS A 78 190.412 9.833 -6.903 1.00 0.00 C ATOM 1163 CE LYS A 78 190.175 10.761 -5.724 1.00 0.00 C ATOM 1164 NZ LYS A 78 191.028 10.404 -4.556 1.00 0.00 N ATOM 0 H LYS A 78 191.529 5.175 -8.532 1.00 0.00 H new ATOM 0 HA LYS A 78 191.015 6.230 -5.817 1.00 0.00 H new ATOM 0 HB2 LYS A 78 191.452 7.768 -7.861 1.00 0.00 H new ATOM 0 HB3 LYS A 78 189.873 7.256 -8.425 1.00 0.00 H new ATOM 0 HG2 LYS A 78 188.752 8.473 -6.844 1.00 0.00 H new ATOM 0 HG3 LYS A 78 189.956 8.186 -5.603 1.00 0.00 H new ATOM 0 HD2 LYS A 78 191.482 9.746 -7.090 1.00 0.00 H new ATOM 0 HD3 LYS A 78 189.966 10.262 -7.800 1.00 0.00 H new ATOM 0 HE2 LYS A 78 190.381 11.789 -6.024 1.00 0.00 H new ATOM 0 HE3 LYS A 78 189.125 10.718 -5.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 191.045 11.197 -3.883 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 190.640 9.561 -4.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 191.996 10.205 -4.881 1.00 0.00 H new ATOM 1178 N ILE A 79 188.445 5.769 -5.917 1.00 0.00 N ATOM 1179 CA ILE A 79 187.146 5.126 -5.734 1.00 0.00 C ATOM 1180 C ILE A 79 185.975 6.096 -5.913 1.00 0.00 C ATOM 1181 O ILE A 79 186.065 7.270 -5.556 1.00 0.00 O ATOM 1182 CB ILE A 79 187.061 4.435 -4.369 1.00 0.00 C ATOM 1183 CG1 ILE A 79 188.292 3.546 -4.175 1.00 0.00 C ATOM 1184 CG2 ILE A 79 185.775 3.627 -4.253 1.00 0.00 C ATOM 1185 CD1 ILE A 79 188.185 2.191 -4.842 1.00 0.00 C ATOM 0 H ILE A 79 188.592 6.593 -5.334 1.00 0.00 H new ATOM 0 HA ILE A 79 187.063 4.373 -6.518 1.00 0.00 H new ATOM 0 HB ILE A 79 187.043 5.190 -3.583 1.00 0.00 H new ATOM 0 HG12 ILE A 79 189.167 4.064 -4.567 1.00 0.00 H new ATOM 0 HG13 ILE A 79 188.459 3.402 -3.108 1.00 0.00 H new ATOM 0 HG21 ILE A 79 185.735 3.145 -3.276 1.00 0.00 H new ATOM 0 HG22 ILE A 79 184.917 4.290 -4.366 1.00 0.00 H new ATOM 0 HG23 ILE A 79 185.751 2.867 -5.034 1.00 0.00 H new ATOM 0 HD11 ILE A 79 189.096 1.622 -4.658 1.00 0.00 H new ATOM 0 HD12 ILE A 79 187.331 1.651 -4.433 1.00 0.00 H new ATOM 0 HD13 ILE A 79 188.051 2.324 -5.916 1.00 0.00 H new ATOM 1197 N TYR A 80 184.873 5.579 -6.447 1.00 0.00 N ATOM 1198 CA TYR A 80 183.658 6.364 -6.658 1.00 0.00 C ATOM 1199 C TYR A 80 182.435 5.481 -6.418 1.00 0.00 C ATOM 1200 O TYR A 80 182.375 4.366 -6.936 1.00 0.00 O ATOM 1201 CB TYR A 80 183.636 6.937 -8.075 1.00 0.00 C ATOM 1202 CG TYR A 80 184.760 7.913 -8.345 1.00 0.00 C ATOM 1203 CD1 TYR A 80 186.037 7.463 -8.654 1.00 0.00 C ATOM 1204 CD2 TYR A 80 184.543 9.284 -8.287 1.00 0.00 C ATOM 1205 CE1 TYR A 80 187.067 8.351 -8.898 1.00 0.00 C ATOM 1206 CE2 TYR A 80 185.568 10.178 -8.530 1.00 0.00 C ATOM 1207 CZ TYR A 80 186.828 9.707 -8.835 1.00 0.00 C ATOM 1208 OH TYR A 80 187.850 10.594 -9.078 1.00 0.00 O ATOM 0 H TYR A 80 184.795 4.607 -6.746 1.00 0.00 H new ATOM 0 HA TYR A 80 183.640 7.196 -5.955 1.00 0.00 H new ATOM 0 HB2 TYR A 80 183.696 6.118 -8.791 1.00 0.00 H new ATOM 0 HB3 TYR A 80 182.682 7.437 -8.242 1.00 0.00 H new ATOM 0 HD1 TYR A 80 186.228 6.401 -8.704 1.00 0.00 H new ATOM 0 HD2 TYR A 80 183.558 9.657 -8.048 1.00 0.00 H new ATOM 0 HE1 TYR A 80 188.054 7.984 -9.137 1.00 0.00 H new ATOM 0 HE2 TYR A 80 185.383 11.241 -8.481 1.00 0.00 H new ATOM 0 HH TYR A 80 187.514 11.511 -8.995 1.00 0.00 H new ATOM 1218 N PHE A 81 181.472 5.950 -5.620 1.00 0.00 N ATOM 1219 CA PHE A 81 180.298 5.129 -5.338 1.00 0.00 C ATOM 1220 C PHE A 81 179.115 5.921 -4.806 1.00 0.00 C ATOM 1221 O PHE A 81 179.155 7.143 -4.665 1.00 0.00 O ATOM 1222 CB PHE A 81 180.649 4.052 -4.310 1.00 0.00 C ATOM 1223 CG PHE A 81 181.430 4.574 -3.138 1.00 0.00 C ATOM 1224 CD1 PHE A 81 182.769 4.902 -3.266 1.00 0.00 C ATOM 1225 CD2 PHE A 81 180.819 4.740 -1.904 1.00 0.00 C ATOM 1226 CE1 PHE A 81 183.486 5.385 -2.187 1.00 0.00 C ATOM 1227 CE2 PHE A 81 181.530 5.223 -0.821 1.00 0.00 C ATOM 1228 CZ PHE A 81 182.865 5.545 -0.964 1.00 0.00 C ATOM 0 H PHE A 81 181.481 6.866 -5.171 1.00 0.00 H new ATOM 0 HA PHE A 81 180.004 4.692 -6.292 1.00 0.00 H new ATOM 0 HB2 PHE A 81 179.729 3.593 -3.948 1.00 0.00 H new ATOM 0 HB3 PHE A 81 181.225 3.267 -4.800 1.00 0.00 H new ATOM 0 HD1 PHE A 81 183.259 4.779 -4.220 1.00 0.00 H new ATOM 0 HD2 PHE A 81 179.775 4.489 -1.788 1.00 0.00 H new ATOM 0 HE1 PHE A 81 184.530 5.637 -2.300 1.00 0.00 H new ATOM 0 HE2 PHE A 81 181.042 5.348 0.134 1.00 0.00 H new ATOM 0 HZ PHE A 81 183.423 5.922 -0.120 1.00 0.00 H new ATOM 1238 N TRP A 82 178.075 5.163 -4.479 1.00 0.00 N ATOM 1239 CA TRP A 82 176.846 5.690 -3.909 1.00 0.00 C ATOM 1240 C TRP A 82 176.194 4.591 -3.079 1.00 0.00 C ATOM 1241 O TRP A 82 176.107 3.445 -3.520 1.00 0.00 O ATOM 1242 CB TRP A 82 175.893 6.199 -4.997 1.00 0.00 C ATOM 1243 CG TRP A 82 175.409 5.142 -5.942 1.00 0.00 C ATOM 1244 CD1 TRP A 82 176.003 4.752 -7.108 1.00 0.00 C ATOM 1245 CD2 TRP A 82 174.220 4.352 -5.815 1.00 0.00 C ATOM 1246 NE1 TRP A 82 175.257 3.769 -7.710 1.00 0.00 N ATOM 1247 CE2 TRP A 82 174.160 3.502 -6.935 1.00 0.00 C ATOM 1248 CE3 TRP A 82 173.202 4.279 -4.860 1.00 0.00 C ATOM 1249 CZ2 TRP A 82 173.125 2.593 -7.127 1.00 0.00 C ATOM 1250 CZ3 TRP A 82 172.173 3.375 -5.052 1.00 0.00 C ATOM 1251 CH2 TRP A 82 172.142 2.543 -6.177 1.00 0.00 C ATOM 0 H TRP A 82 178.064 4.151 -4.605 1.00 0.00 H new ATOM 0 HA TRP A 82 177.078 6.546 -3.275 1.00 0.00 H new ATOM 0 HB2 TRP A 82 175.031 6.664 -4.519 1.00 0.00 H new ATOM 0 HB3 TRP A 82 176.398 6.977 -5.570 1.00 0.00 H new ATOM 0 HD1 TRP A 82 176.924 5.157 -7.499 1.00 0.00 H new ATOM 0 HE1 TRP A 82 175.484 3.311 -8.593 1.00 0.00 H new ATOM 0 HE3 TRP A 82 173.219 4.917 -3.988 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 173.098 1.950 -7.994 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 171.380 3.310 -4.322 1.00 0.00 H new ATOM 0 HH2 TRP A 82 171.325 1.847 -6.298 1.00 0.00 H new ATOM 1262 N THR A 83 175.764 4.924 -1.868 1.00 0.00 N ATOM 1263 CA THR A 83 175.156 3.927 -0.989 1.00 0.00 C ATOM 1264 C THR A 83 173.682 4.206 -0.786 1.00 0.00 C ATOM 1265 O THR A 83 173.253 5.342 -0.889 1.00 0.00 O ATOM 1266 CB THR A 83 175.867 3.903 0.366 1.00 0.00 C ATOM 1267 OG1 THR A 83 176.236 5.209 0.762 1.00 0.00 O ATOM 1268 CG2 THR A 83 177.117 3.050 0.373 1.00 0.00 C ATOM 0 H THR A 83 175.823 5.863 -1.474 1.00 0.00 H new ATOM 0 HA THR A 83 175.263 2.953 -1.467 1.00 0.00 H new ATOM 0 HB THR A 83 175.148 3.469 1.060 1.00 0.00 H new ATOM 0 HG1 THR A 83 175.474 5.646 1.197 1.00 0.00 H new ATOM 0 HG21 THR A 83 177.571 3.078 1.364 1.00 0.00 H new ATOM 0 HG22 THR A 83 176.857 2.022 0.121 1.00 0.00 H new ATOM 0 HG23 THR A 83 177.825 3.435 -0.361 1.00 0.00 H new ATOM 1276 N TYR A 84 172.915 3.161 -0.502 1.00 0.00 N ATOM 1277 CA TYR A 84 171.484 3.302 -0.292 1.00 0.00 C ATOM 1278 C TYR A 84 171.033 2.485 0.914 1.00 0.00 C ATOM 1279 O TYR A 84 171.511 1.375 1.131 1.00 0.00 O ATOM 1280 CB TYR A 84 170.739 2.845 -1.543 1.00 0.00 C ATOM 1281 CG TYR A 84 169.247 3.084 -1.496 1.00 0.00 C ATOM 1282 CD1 TYR A 84 168.733 4.309 -1.093 1.00 0.00 C ATOM 1283 CD2 TYR A 84 168.352 2.086 -1.863 1.00 0.00 C ATOM 1284 CE1 TYR A 84 167.370 4.533 -1.053 1.00 0.00 C ATOM 1285 CE2 TYR A 84 166.989 2.303 -1.826 1.00 0.00 C ATOM 1286 CZ TYR A 84 166.502 3.527 -1.421 1.00 0.00 C ATOM 1287 OH TYR A 84 165.145 3.747 -1.384 1.00 0.00 O ATOM 0 H TYR A 84 173.263 2.206 -0.412 1.00 0.00 H new ATOM 0 HA TYR A 84 171.258 4.350 -0.097 1.00 0.00 H new ATOM 0 HB2 TYR A 84 171.152 3.364 -2.408 1.00 0.00 H new ATOM 0 HB3 TYR A 84 170.921 1.781 -1.692 1.00 0.00 H new ATOM 0 HD1 TYR A 84 169.410 5.100 -0.806 1.00 0.00 H new ATOM 0 HD2 TYR A 84 168.729 1.125 -2.182 1.00 0.00 H new ATOM 0 HE1 TYR A 84 166.987 5.491 -0.735 1.00 0.00 H new ATOM 0 HE2 TYR A 84 166.307 1.516 -2.113 1.00 0.00 H new ATOM 0 HH TYR A 84 164.674 2.938 -1.675 1.00 0.00 H new ATOM 1297 N VAL A 85 170.113 3.035 1.695 1.00 0.00 N ATOM 1298 CA VAL A 85 169.601 2.344 2.875 1.00 0.00 C ATOM 1299 C VAL A 85 168.073 2.330 2.855 1.00 0.00 C ATOM 1300 O VAL A 85 167.453 3.105 2.132 1.00 0.00 O ATOM 1301 CB VAL A 85 170.114 2.992 4.197 1.00 0.00 C ATOM 1302 CG1 VAL A 85 170.909 4.257 3.917 1.00 0.00 C ATOM 1303 CG2 VAL A 85 168.978 3.297 5.169 1.00 0.00 C ATOM 0 H VAL A 85 169.705 3.956 1.535 1.00 0.00 H new ATOM 0 HA VAL A 85 169.974 1.320 2.844 1.00 0.00 H new ATOM 0 HB VAL A 85 170.769 2.259 4.667 1.00 0.00 H new ATOM 0 HG11 VAL A 85 171.253 4.686 4.858 1.00 0.00 H new ATOM 0 HG12 VAL A 85 171.769 4.016 3.292 1.00 0.00 H new ATOM 0 HG13 VAL A 85 170.276 4.978 3.400 1.00 0.00 H new ATOM 0 HG21 VAL A 85 169.385 3.747 6.074 1.00 0.00 H new ATOM 0 HG22 VAL A 85 168.277 3.989 4.703 1.00 0.00 H new ATOM 0 HG23 VAL A 85 168.460 2.373 5.425 1.00 0.00 H new ATOM 1313 N ILE A 86 167.478 1.456 3.663 1.00 0.00 N ATOM 1314 CA ILE A 86 166.022 1.357 3.749 1.00 0.00 C ATOM 1315 C ILE A 86 165.574 1.208 5.190 1.00 0.00 C ATOM 1316 O ILE A 86 165.744 0.149 5.788 1.00 0.00 O ATOM 1317 CB ILE A 86 165.468 0.163 2.954 1.00 0.00 C ATOM 1318 CG1 ILE A 86 166.010 0.177 1.535 1.00 0.00 C ATOM 1319 CG2 ILE A 86 163.945 0.186 2.948 1.00 0.00 C ATOM 1320 CD1 ILE A 86 165.528 1.341 0.711 1.00 0.00 C ATOM 0 H ILE A 86 167.981 0.806 4.268 1.00 0.00 H new ATOM 0 HA ILE A 86 165.633 2.281 3.320 1.00 0.00 H new ATOM 0 HB ILE A 86 165.793 -0.758 3.438 1.00 0.00 H new ATOM 0 HG12 ILE A 86 167.099 0.197 1.572 1.00 0.00 H new ATOM 0 HG13 ILE A 86 165.725 -0.750 1.038 1.00 0.00 H new ATOM 0 HG21 ILE A 86 163.570 -0.666 2.381 1.00 0.00 H new ATOM 0 HG22 ILE A 86 163.576 0.131 3.972 1.00 0.00 H new ATOM 0 HG23 ILE A 86 163.597 1.110 2.487 1.00 0.00 H new ATOM 0 HD11 ILE A 86 165.958 1.282 -0.289 1.00 0.00 H new ATOM 0 HD12 ILE A 86 164.441 1.312 0.641 1.00 0.00 H new ATOM 0 HD13 ILE A 86 165.836 2.274 1.184 1.00 0.00 H new ATOM 1332 N LYS A 87 164.995 2.269 5.731 1.00 0.00 N ATOM 1333 CA LYS A 87 164.507 2.263 7.105 1.00 0.00 C ATOM 1334 C LYS A 87 162.986 2.144 7.134 1.00 0.00 C ATOM 1335 O LYS A 87 162.283 3.086 7.502 1.00 0.00 O ATOM 1336 CB LYS A 87 164.951 3.537 7.829 1.00 0.00 C ATOM 1337 CG LYS A 87 165.203 3.337 9.315 1.00 0.00 C ATOM 1338 CD LYS A 87 163.959 3.629 10.138 1.00 0.00 C ATOM 1339 CE LYS A 87 163.940 5.068 10.627 1.00 0.00 C ATOM 1340 NZ LYS A 87 165.176 5.414 11.382 1.00 0.00 N ATOM 0 H LYS A 87 164.850 3.150 5.238 1.00 0.00 H new ATOM 0 HA LYS A 87 164.931 1.400 7.618 1.00 0.00 H new ATOM 0 HB2 LYS A 87 165.862 3.912 7.362 1.00 0.00 H new ATOM 0 HB3 LYS A 87 164.187 4.304 7.699 1.00 0.00 H new ATOM 0 HG2 LYS A 87 165.527 2.312 9.495 1.00 0.00 H new ATOM 0 HG3 LYS A 87 166.015 3.989 9.638 1.00 0.00 H new ATOM 0 HD2 LYS A 87 163.070 3.436 9.537 1.00 0.00 H new ATOM 0 HD3 LYS A 87 163.919 2.953 10.992 1.00 0.00 H new ATOM 0 HE2 LYS A 87 163.835 5.740 9.775 1.00 0.00 H new ATOM 0 HE3 LYS A 87 163.070 5.223 11.265 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 164.959 6.149 12.085 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 165.535 4.567 11.867 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 165.898 5.768 10.722 1.00 0.00 H new ATOM 1354 N ASP A 88 162.483 0.977 6.743 1.00 0.00 N ATOM 1355 CA ASP A 88 161.045 0.728 6.724 1.00 0.00 C ATOM 1356 C ASP A 88 160.341 1.648 5.730 1.00 0.00 C ATOM 1357 O ASP A 88 159.545 2.504 6.115 1.00 0.00 O ATOM 1358 CB ASP A 88 160.454 0.919 8.123 1.00 0.00 C ATOM 1359 CG ASP A 88 159.193 0.103 8.333 1.00 0.00 C ATOM 1360 OD1 ASP A 88 158.422 -0.059 7.365 1.00 0.00 O ATOM 1361 OD2 ASP A 88 158.976 -0.372 9.468 1.00 0.00 O ATOM 0 H ASP A 88 163.051 0.188 6.435 1.00 0.00 H new ATOM 0 HA ASP A 88 160.887 -0.303 6.407 1.00 0.00 H new ATOM 0 HB2 ASP A 88 161.196 0.636 8.870 1.00 0.00 H new ATOM 0 HB3 ASP A 88 160.231 1.974 8.280 1.00 0.00 H new ATOM 1366 N GLY A 89 160.639 1.464 4.446 1.00 0.00 N ATOM 1367 CA GLY A 89 160.024 2.284 3.416 1.00 0.00 C ATOM 1368 C GLY A 89 160.509 3.720 3.450 1.00 0.00 C ATOM 1369 O GLY A 89 159.783 4.637 3.064 1.00 0.00 O ATOM 0 H GLY A 89 161.294 0.763 4.101 1.00 0.00 H new ATOM 0 HA2 GLY A 89 160.239 1.854 2.438 1.00 0.00 H new ATOM 0 HA3 GLY A 89 158.941 2.267 3.541 1.00 0.00 H new ATOM 1373 N LEU A 90 161.741 3.915 3.909 1.00 0.00 N ATOM 1374 CA LEU A 90 162.330 5.248 3.994 1.00 0.00 C ATOM 1375 C LEU A 90 163.813 5.185 3.680 1.00 0.00 C ATOM 1376 O LEU A 90 164.656 5.243 4.575 1.00 0.00 O ATOM 1377 CB LEU A 90 162.110 5.834 5.386 1.00 0.00 C ATOM 1378 CG LEU A 90 160.744 5.525 5.982 1.00 0.00 C ATOM 1379 CD1 LEU A 90 160.714 5.855 7.465 1.00 0.00 C ATOM 1380 CD2 LEU A 90 159.664 6.290 5.234 1.00 0.00 C ATOM 0 H LEU A 90 162.353 3.164 4.229 1.00 0.00 H new ATOM 0 HA LEU A 90 161.844 5.893 3.262 1.00 0.00 H new ATOM 0 HB2 LEU A 90 162.881 5.452 6.055 1.00 0.00 H new ATOM 0 HB3 LEU A 90 162.237 6.915 5.337 1.00 0.00 H new ATOM 0 HG LEU A 90 160.551 4.458 5.875 1.00 0.00 H new ATOM 0 HD11 LEU A 90 159.728 5.626 7.869 1.00 0.00 H new ATOM 0 HD12 LEU A 90 161.466 5.262 7.985 1.00 0.00 H new ATOM 0 HD13 LEU A 90 160.927 6.915 7.606 1.00 0.00 H new ATOM 0 HD21 LEU A 90 158.690 6.062 5.668 1.00 0.00 H new ATOM 0 HD22 LEU A 90 159.855 7.360 5.313 1.00 0.00 H new ATOM 0 HD23 LEU A 90 159.671 5.997 4.184 1.00 0.00 H new ATOM 1392 N GLY A 91 164.119 5.033 2.405 1.00 0.00 N ATOM 1393 CA GLY A 91 165.488 4.926 1.985 1.00 0.00 C ATOM 1394 C GLY A 91 166.146 6.246 1.648 1.00 0.00 C ATOM 1395 O GLY A 91 165.481 7.239 1.350 1.00 0.00 O ATOM 0 H GLY A 91 163.435 4.982 1.650 1.00 0.00 H new ATOM 0 HA2 GLY A 91 166.060 4.441 2.775 1.00 0.00 H new ATOM 0 HA3 GLY A 91 165.537 4.276 1.111 1.00 0.00 H new ATOM 1399 N TYR A 92 167.471 6.229 1.686 1.00 0.00 N ATOM 1400 CA TYR A 92 168.295 7.394 1.378 1.00 0.00 C ATOM 1401 C TYR A 92 169.642 6.918 0.853 1.00 0.00 C ATOM 1402 O TYR A 92 170.094 5.833 1.218 1.00 0.00 O ATOM 1403 CB TYR A 92 168.485 8.263 2.622 1.00 0.00 C ATOM 1404 CG TYR A 92 167.186 8.689 3.268 1.00 0.00 C ATOM 1405 CD1 TYR A 92 166.519 7.849 4.150 1.00 0.00 C ATOM 1406 CD2 TYR A 92 166.628 9.933 2.995 1.00 0.00 C ATOM 1407 CE1 TYR A 92 165.331 8.234 4.742 1.00 0.00 C ATOM 1408 CE2 TYR A 92 165.441 10.326 3.584 1.00 0.00 C ATOM 1409 CZ TYR A 92 164.796 9.473 4.456 1.00 0.00 C ATOM 1410 OH TYR A 92 163.613 9.861 5.043 1.00 0.00 O ATOM 0 H TYR A 92 168.011 5.400 1.933 1.00 0.00 H new ATOM 0 HA TYR A 92 167.799 8.000 0.620 1.00 0.00 H new ATOM 0 HB2 TYR A 92 169.080 7.713 3.351 1.00 0.00 H new ATOM 0 HB3 TYR A 92 169.054 9.152 2.350 1.00 0.00 H new ATOM 0 HD1 TYR A 92 166.936 6.879 4.377 1.00 0.00 H new ATOM 0 HD2 TYR A 92 167.130 10.603 2.312 1.00 0.00 H new ATOM 0 HE1 TYR A 92 164.824 7.568 5.425 1.00 0.00 H new ATOM 0 HE2 TYR A 92 165.020 11.296 3.363 1.00 0.00 H new ATOM 0 HH TYR A 92 163.375 10.761 4.736 1.00 0.00 H new ATOM 1420 N ARG A 93 170.290 7.697 -0.011 1.00 0.00 N ATOM 1421 CA ARG A 93 171.569 7.275 -0.552 1.00 0.00 C ATOM 1422 C ARG A 93 172.645 8.337 -0.419 1.00 0.00 C ATOM 1423 O ARG A 93 172.375 9.537 -0.463 1.00 0.00 O ATOM 1424 CB ARG A 93 171.433 6.891 -2.023 1.00 0.00 C ATOM 1425 CG ARG A 93 171.008 8.046 -2.916 1.00 0.00 C ATOM 1426 CD ARG A 93 170.336 7.549 -4.188 1.00 0.00 C ATOM 1427 NE ARG A 93 170.436 8.520 -5.273 1.00 0.00 N ATOM 1428 CZ ARG A 93 169.653 9.592 -5.385 1.00 0.00 C ATOM 1429 NH1 ARG A 93 168.712 9.832 -4.480 1.00 0.00 N ATOM 1430 NH2 ARG A 93 169.811 10.426 -6.403 1.00 0.00 N ATOM 0 H ARG A 93 169.956 8.602 -0.342 1.00 0.00 H new ATOM 0 HA ARG A 93 171.875 6.410 0.037 1.00 0.00 H new ATOM 0 HB2 ARG A 93 172.387 6.500 -2.378 1.00 0.00 H new ATOM 0 HB3 ARG A 93 170.705 6.085 -2.114 1.00 0.00 H new ATOM 0 HG2 ARG A 93 170.323 8.696 -2.371 1.00 0.00 H new ATOM 0 HG3 ARG A 93 171.880 8.647 -3.175 1.00 0.00 H new ATOM 0 HD2 ARG A 93 170.795 6.610 -4.498 1.00 0.00 H new ATOM 0 HD3 ARG A 93 169.286 7.339 -3.985 1.00 0.00 H new ATOM 0 HE ARG A 93 171.148 8.369 -5.988 1.00 0.00 H new ATOM 0 HH11 ARG A 93 168.586 9.194 -3.694 1.00 0.00 H new ATOM 0 HH12 ARG A 93 168.115 10.654 -4.571 1.00 0.00 H new ATOM 0 HH21 ARG A 93 170.533 10.247 -7.101 1.00 0.00 H new ATOM 0 HH22 ARG A 93 169.211 11.246 -6.488 1.00 0.00 H new ATOM 1444 N GLN A 94 173.877 7.864 -0.293 1.00 0.00 N ATOM 1445 CA GLN A 94 175.030 8.734 -0.197 1.00 0.00 C ATOM 1446 C GLN A 94 175.782 8.696 -1.516 1.00 0.00 C ATOM 1447 O GLN A 94 176.821 8.045 -1.635 1.00 0.00 O ATOM 1448 CB GLN A 94 175.948 8.303 0.948 1.00 0.00 C ATOM 1449 CG GLN A 94 176.986 9.347 1.316 1.00 0.00 C ATOM 1450 CD GLN A 94 178.306 8.733 1.742 1.00 0.00 C ATOM 1451 OE1 GLN A 94 178.345 7.622 2.268 1.00 0.00 O ATOM 1452 NE2 GLN A 94 179.395 9.457 1.514 1.00 0.00 N ATOM 0 H GLN A 94 174.100 6.869 -0.255 1.00 0.00 H new ATOM 0 HA GLN A 94 174.695 9.750 0.011 1.00 0.00 H new ATOM 0 HB2 GLN A 94 175.341 8.080 1.826 1.00 0.00 H new ATOM 0 HB3 GLN A 94 176.456 7.380 0.669 1.00 0.00 H new ATOM 0 HG2 GLN A 94 177.154 10.004 0.462 1.00 0.00 H new ATOM 0 HG3 GLN A 94 176.601 9.968 2.125 1.00 0.00 H new ATOM 0 HE21 GLN A 94 179.315 10.374 1.075 1.00 0.00 H new ATOM 0 HE22 GLN A 94 180.312 9.096 1.778 1.00 0.00 H new ATOM 1461 N ASP A 95 175.224 9.371 -2.513 1.00 0.00 N ATOM 1462 CA ASP A 95 175.817 9.404 -3.843 1.00 0.00 C ATOM 1463 C ASP A 95 177.038 10.311 -3.884 1.00 0.00 C ATOM 1464 O ASP A 95 177.340 11.014 -2.921 1.00 0.00 O ATOM 1465 CB ASP A 95 174.790 9.879 -4.866 1.00 0.00 C ATOM 1466 CG ASP A 95 174.121 11.175 -4.458 1.00 0.00 C ATOM 1467 OD1 ASP A 95 174.834 12.189 -4.305 1.00 0.00 O ATOM 1468 OD2 ASP A 95 172.883 11.178 -4.292 1.00 0.00 O ATOM 0 H ASP A 95 174.359 9.904 -2.425 1.00 0.00 H new ATOM 0 HA ASP A 95 176.135 8.391 -4.090 1.00 0.00 H new ATOM 0 HB2 ASP A 95 175.279 10.014 -5.831 1.00 0.00 H new ATOM 0 HB3 ASP A 95 174.031 9.108 -4.999 1.00 0.00 H new ATOM 1473 N ASN A 96 177.735 10.282 -5.012 1.00 0.00 N ATOM 1474 CA ASN A 96 178.926 11.095 -5.196 1.00 0.00 C ATOM 1475 C ASN A 96 180.002 10.722 -4.179 1.00 0.00 C ATOM 1476 O ASN A 96 180.939 11.486 -3.944 1.00 0.00 O ATOM 1477 CB ASN A 96 178.567 12.578 -5.074 1.00 0.00 C ATOM 1478 CG ASN A 96 179.761 13.489 -5.283 1.00 0.00 C ATOM 1479 OD1 ASN A 96 180.775 13.083 -5.851 1.00 0.00 O ATOM 1480 ND2 ASN A 96 179.647 14.730 -4.824 1.00 0.00 N ATOM 0 H ASN A 96 177.494 9.701 -5.815 1.00 0.00 H new ATOM 0 HA ASN A 96 179.325 10.906 -6.193 1.00 0.00 H new ATOM 0 HB2 ASN A 96 177.797 12.822 -5.805 1.00 0.00 H new ATOM 0 HB3 ASN A 96 178.141 12.764 -4.088 1.00 0.00 H new ATOM 0 HD21 ASN A 96 180.418 15.388 -4.936 1.00 0.00 H new ATOM 0 HD22 ASN A 96 178.788 15.025 -4.359 1.00 0.00 H new ATOM 1487 N GLY A 97 179.869 9.539 -3.583 1.00 0.00 N ATOM 1488 CA GLY A 97 180.848 9.096 -2.612 1.00 0.00 C ATOM 1489 C GLY A 97 182.211 8.910 -3.234 1.00 0.00 C ATOM 1490 O GLY A 97 182.341 8.868 -4.457 1.00 0.00 O ATOM 0 H GLY A 97 179.105 8.885 -3.755 1.00 0.00 H new ATOM 0 HA2 GLY A 97 180.914 9.825 -1.804 1.00 0.00 H new ATOM 0 HA3 GLY A 97 180.520 8.156 -2.168 1.00 0.00 H new ATOM 1494 N GLU A 98 183.233 8.800 -2.398 1.00 0.00 N ATOM 1495 CA GLU A 98 184.590 8.620 -2.889 1.00 0.00 C ATOM 1496 C GLU A 98 185.464 7.911 -1.862 1.00 0.00 C ATOM 1497 O GLU A 98 185.269 8.054 -0.654 1.00 0.00 O ATOM 1498 CB GLU A 98 185.205 9.974 -3.251 1.00 0.00 C ATOM 1499 CG GLU A 98 185.452 10.874 -2.051 1.00 0.00 C ATOM 1500 CD GLU A 98 185.372 12.347 -2.399 1.00 0.00 C ATOM 1501 OE1 GLU A 98 184.273 12.813 -2.766 1.00 0.00 O ATOM 1502 OE2 GLU A 98 186.410 13.036 -2.308 1.00 0.00 O ATOM 0 H GLU A 98 183.149 8.832 -1.382 1.00 0.00 H new ATOM 0 HA GLU A 98 184.541 7.995 -3.781 1.00 0.00 H new ATOM 0 HB2 GLU A 98 186.149 9.807 -3.769 1.00 0.00 H new ATOM 0 HB3 GLU A 98 184.545 10.488 -3.949 1.00 0.00 H new ATOM 0 HG2 GLU A 98 184.720 10.648 -1.275 1.00 0.00 H new ATOM 0 HG3 GLU A 98 186.435 10.656 -1.635 1.00 0.00 H new ATOM 1509 N TRP A 99 186.434 7.154 -2.357 1.00 0.00 N ATOM 1510 CA TRP A 99 187.356 6.425 -1.499 1.00 0.00 C ATOM 1511 C TRP A 99 188.698 6.237 -2.213 1.00 0.00 C ATOM 1512 O TRP A 99 188.799 6.454 -3.421 1.00 0.00 O ATOM 1513 CB TRP A 99 186.754 5.079 -1.085 1.00 0.00 C ATOM 1514 CG TRP A 99 187.665 4.272 -0.219 1.00 0.00 C ATOM 1515 CD1 TRP A 99 188.259 4.672 0.943 1.00 0.00 C ATOM 1516 CD2 TRP A 99 188.092 2.927 -0.449 1.00 0.00 C ATOM 1517 NE1 TRP A 99 189.049 3.666 1.436 1.00 0.00 N ATOM 1518 CE2 TRP A 99 188.958 2.584 0.602 1.00 0.00 C ATOM 1519 CE3 TRP A 99 187.830 1.981 -1.442 1.00 0.00 C ATOM 1520 CZ2 TRP A 99 189.566 1.341 0.685 1.00 0.00 C ATOM 1521 CZ3 TRP A 99 188.431 0.742 -1.357 1.00 0.00 C ATOM 1522 CH2 TRP A 99 189.292 0.432 -0.301 1.00 0.00 C ATOM 0 H TRP A 99 186.603 7.029 -3.355 1.00 0.00 H new ATOM 0 HA TRP A 99 187.530 7.003 -0.592 1.00 0.00 H new ATOM 0 HB2 TRP A 99 185.818 5.254 -0.554 1.00 0.00 H new ATOM 0 HB3 TRP A 99 186.511 4.506 -1.980 1.00 0.00 H new ATOM 0 HD1 TRP A 99 188.126 5.639 1.406 1.00 0.00 H new ATOM 0 HE1 TRP A 99 189.612 3.715 2.285 1.00 0.00 H new ATOM 0 HE3 TRP A 99 187.168 2.215 -2.263 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 190.233 1.098 1.499 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 188.233 0.001 -2.118 1.00 0.00 H new ATOM 0 HH2 TRP A 99 189.751 -0.545 -0.262 1.00 0.00 H new ATOM 1533 N THR A 100 189.733 5.878 -1.463 1.00 0.00 N ATOM 1534 CA THR A 100 191.068 5.711 -2.028 1.00 0.00 C ATOM 1535 C THR A 100 191.565 4.269 -1.979 1.00 0.00 C ATOM 1536 O THR A 100 191.075 3.447 -1.205 1.00 0.00 O ATOM 1537 CB THR A 100 192.049 6.582 -1.243 1.00 0.00 C ATOM 1538 OG1 THR A 100 193.229 6.810 -1.992 1.00 0.00 O ATOM 1539 CG2 THR A 100 192.458 5.971 0.093 1.00 0.00 C ATOM 0 H THR A 100 189.674 5.697 -0.461 1.00 0.00 H new ATOM 0 HA THR A 100 191.009 6.004 -3.076 1.00 0.00 H new ATOM 0 HB THR A 100 191.519 7.515 -1.051 1.00 0.00 H new ATOM 0 HG1 THR A 100 194.012 6.622 -1.434 1.00 0.00 H new ATOM 0 HG21 THR A 100 193.155 6.638 0.600 1.00 0.00 H new ATOM 0 HG22 THR A 100 191.574 5.829 0.714 1.00 0.00 H new ATOM 0 HG23 THR A 100 192.938 5.008 -0.079 1.00 0.00 H new ATOM 1547 N VAL A 101 192.592 4.006 -2.779 1.00 0.00 N ATOM 1548 CA VAL A 101 193.242 2.698 -2.814 1.00 0.00 C ATOM 1549 C VAL A 101 194.755 2.870 -2.675 1.00 0.00 C ATOM 1550 O VAL A 101 195.522 1.954 -2.966 1.00 0.00 O ATOM 1551 CB VAL A 101 192.956 1.921 -4.115 1.00 0.00 C ATOM 1552 CG1 VAL A 101 193.072 0.425 -3.869 1.00 0.00 C ATOM 1553 CG2 VAL A 101 191.581 2.268 -4.674 1.00 0.00 C ATOM 0 H VAL A 101 192.997 4.689 -3.419 1.00 0.00 H new ATOM 0 HA VAL A 101 192.833 2.123 -1.983 1.00 0.00 H new ATOM 0 HB VAL A 101 193.699 2.214 -4.856 1.00 0.00 H new ATOM 0 HG11 VAL A 101 192.868 -0.113 -4.795 1.00 0.00 H new ATOM 0 HG12 VAL A 101 194.080 0.190 -3.527 1.00 0.00 H new ATOM 0 HG13 VAL A 101 192.351 0.124 -3.108 1.00 0.00 H new ATOM 0 HG21 VAL A 101 191.408 1.705 -5.591 1.00 0.00 H new ATOM 0 HG22 VAL A 101 190.815 2.012 -3.941 1.00 0.00 H new ATOM 0 HG23 VAL A 101 191.535 3.335 -4.890 1.00 0.00 H new ATOM 1563 N THR A 102 195.173 4.058 -2.235 1.00 0.00 N ATOM 1564 CA THR A 102 196.588 4.373 -2.067 1.00 0.00 C ATOM 1565 C THR A 102 197.277 3.376 -1.142 1.00 0.00 C ATOM 1566 O THR A 102 198.492 3.188 -1.215 1.00 0.00 O ATOM 1567 CB THR A 102 196.749 5.789 -1.511 1.00 0.00 C ATOM 1568 OG1 THR A 102 195.805 6.034 -0.484 1.00 0.00 O ATOM 1569 CG2 THR A 102 196.577 6.866 -2.561 1.00 0.00 C ATOM 0 H THR A 102 194.544 4.822 -1.987 1.00 0.00 H new ATOM 0 HA THR A 102 197.061 4.309 -3.047 1.00 0.00 H new ATOM 0 HB THR A 102 197.769 5.837 -1.129 1.00 0.00 H new ATOM 0 HG1 THR A 102 195.925 6.944 -0.140 1.00 0.00 H new ATOM 0 HG21 THR A 102 196.703 7.846 -2.101 1.00 0.00 H new ATOM 0 HG22 THR A 102 197.324 6.733 -3.344 1.00 0.00 H new ATOM 0 HG23 THR A 102 195.580 6.795 -2.995 1.00 0.00 H new ATOM 1577 N GLU A 103 196.501 2.745 -0.272 1.00 0.00 N ATOM 1578 CA GLU A 103 197.048 1.772 0.665 1.00 0.00 C ATOM 1579 C GLU A 103 196.086 0.609 0.867 1.00 0.00 C ATOM 1580 O GLU A 103 194.953 0.636 0.389 1.00 0.00 O ATOM 1581 CB GLU A 103 197.348 2.439 2.008 1.00 0.00 C ATOM 1582 CG GLU A 103 198.394 3.538 1.921 1.00 0.00 C ATOM 1583 CD GLU A 103 198.477 4.365 3.190 1.00 0.00 C ATOM 1584 OE1 GLU A 103 198.079 3.853 4.258 1.00 0.00 O ATOM 1585 OE2 GLU A 103 198.939 5.523 3.116 1.00 0.00 O ATOM 0 H GLU A 103 195.494 2.888 -0.195 1.00 0.00 H new ATOM 0 HA GLU A 103 197.975 1.383 0.244 1.00 0.00 H new ATOM 0 HB2 GLU A 103 196.426 2.858 2.410 1.00 0.00 H new ATOM 0 HB3 GLU A 103 197.688 1.680 2.713 1.00 0.00 H new ATOM 0 HG2 GLU A 103 199.368 3.093 1.718 1.00 0.00 H new ATOM 0 HG3 GLU A 103 198.160 4.191 1.080 1.00 0.00 H new ATOM 1592 N PHE A 104 196.543 -0.412 1.586 1.00 0.00 N ATOM 1593 CA PHE A 104 195.721 -1.579 1.858 1.00 0.00 C ATOM 1594 C PHE A 104 195.803 -1.942 3.334 1.00 0.00 C ATOM 1595 O PHE A 104 196.822 -1.702 3.983 1.00 0.00 O ATOM 1596 CB PHE A 104 196.175 -2.766 1.004 1.00 0.00 C ATOM 1597 CG PHE A 104 195.865 -2.620 -0.462 1.00 0.00 C ATOM 1598 CD1 PHE A 104 196.467 -1.626 -1.218 1.00 0.00 C ATOM 1599 CD2 PHE A 104 194.977 -3.483 -1.084 1.00 0.00 C ATOM 1600 CE1 PHE A 104 196.187 -1.497 -2.568 1.00 0.00 C ATOM 1601 CE2 PHE A 104 194.693 -3.359 -2.432 1.00 0.00 C ATOM 1602 CZ PHE A 104 195.300 -2.364 -3.175 1.00 0.00 C ATOM 0 H PHE A 104 197.479 -0.452 1.989 1.00 0.00 H new ATOM 0 HA PHE A 104 194.688 -1.341 1.605 1.00 0.00 H new ATOM 0 HB2 PHE A 104 197.250 -2.898 1.126 1.00 0.00 H new ATOM 0 HB3 PHE A 104 195.698 -3.672 1.377 1.00 0.00 H new ATOM 0 HD1 PHE A 104 197.162 -0.945 -0.749 1.00 0.00 H new ATOM 0 HD2 PHE A 104 194.500 -4.263 -0.509 1.00 0.00 H new ATOM 0 HE1 PHE A 104 196.662 -0.718 -3.146 1.00 0.00 H new ATOM 0 HE2 PHE A 104 193.998 -4.038 -2.903 1.00 0.00 H new ATOM 0 HZ PHE A 104 195.081 -2.265 -4.228 1.00 0.00 H new ATOM 1612 N VAL A 105 194.735 -2.521 3.868 1.00 0.00 N ATOM 1613 CA VAL A 105 194.715 -2.908 5.268 1.00 0.00 C ATOM 1614 C VAL A 105 195.023 -4.392 5.427 1.00 0.00 C ATOM 1615 O VAL A 105 195.101 -5.134 4.448 1.00 0.00 O ATOM 1616 CB VAL A 105 193.366 -2.579 5.944 1.00 0.00 C ATOM 1617 CG1 VAL A 105 193.004 -1.120 5.720 1.00 0.00 C ATOM 1618 CG2 VAL A 105 192.261 -3.495 5.431 1.00 0.00 C ATOM 0 H VAL A 105 193.879 -2.731 3.355 1.00 0.00 H new ATOM 0 HA VAL A 105 195.490 -2.325 5.765 1.00 0.00 H new ATOM 0 HB VAL A 105 193.470 -2.749 7.016 1.00 0.00 H new ATOM 0 HG11 VAL A 105 192.051 -0.903 6.202 1.00 0.00 H new ATOM 0 HG12 VAL A 105 193.779 -0.483 6.146 1.00 0.00 H new ATOM 0 HG13 VAL A 105 192.922 -0.926 4.651 1.00 0.00 H new ATOM 0 HG21 VAL A 105 191.322 -3.243 5.923 1.00 0.00 H new ATOM 0 HG22 VAL A 105 192.153 -3.367 4.354 1.00 0.00 H new ATOM 0 HG23 VAL A 105 192.517 -4.532 5.649 1.00 0.00 H new ATOM 1628 N ASN A 106 195.209 -4.804 6.668 1.00 0.00 N ATOM 1629 CA ASN A 106 195.527 -6.187 6.990 1.00 0.00 C ATOM 1630 C ASN A 106 194.275 -6.987 7.274 1.00 0.00 C ATOM 1631 O ASN A 106 193.282 -6.455 7.771 1.00 0.00 O ATOM 1632 CB ASN A 106 196.448 -6.235 8.209 1.00 0.00 C ATOM 1633 CG ASN A 106 197.404 -7.409 8.169 1.00 0.00 C ATOM 1634 OD1 ASN A 106 197.962 -7.736 7.123 1.00 0.00 O ATOM 1635 ND2 ASN A 106 197.596 -8.051 9.315 1.00 0.00 N ATOM 0 H ASN A 106 195.144 -4.192 7.481 1.00 0.00 H new ATOM 0 HA ASN A 106 196.028 -6.627 6.128 1.00 0.00 H new ATOM 0 HB2 ASN A 106 197.019 -5.308 8.266 1.00 0.00 H new ATOM 0 HB3 ASN A 106 195.844 -6.293 9.114 1.00 0.00 H new ATOM 0 HD21 ASN A 106 198.228 -8.851 9.352 1.00 0.00 H new ATOM 0 HD22 ASN A 106 197.112 -7.744 10.159 1.00 0.00 H new ATOM 1642 N GLU A 107 194.340 -8.286 6.998 1.00 0.00 N ATOM 1643 CA GLU A 107 193.218 -9.165 7.274 1.00 0.00 C ATOM 1644 C GLU A 107 192.849 -9.053 8.749 1.00 0.00 C ATOM 1645 O GLU A 107 191.754 -9.435 9.162 1.00 0.00 O ATOM 1646 CB GLU A 107 193.569 -10.613 6.924 1.00 0.00 C ATOM 1647 CG GLU A 107 193.841 -10.834 5.445 1.00 0.00 C ATOM 1648 CD GLU A 107 194.482 -12.178 5.165 1.00 0.00 C ATOM 1649 OE1 GLU A 107 194.067 -13.178 5.790 1.00 0.00 O ATOM 1650 OE2 GLU A 107 195.403 -12.234 4.322 1.00 0.00 O ATOM 0 H GLU A 107 195.152 -8.746 6.587 1.00 0.00 H new ATOM 0 HA GLU A 107 192.368 -8.866 6.660 1.00 0.00 H new ATOM 0 HB2 GLU A 107 194.448 -10.913 7.495 1.00 0.00 H new ATOM 0 HB3 GLU A 107 192.750 -11.262 7.235 1.00 0.00 H new ATOM 0 HG2 GLU A 107 192.905 -10.760 4.892 1.00 0.00 H new ATOM 0 HG3 GLU A 107 194.492 -10.041 5.077 1.00 0.00 H new ATOM 1657 N ASP A 108 193.779 -8.502 9.534 1.00 0.00 N ATOM 1658 CA ASP A 108 193.563 -8.308 10.959 1.00 0.00 C ATOM 1659 C ASP A 108 192.558 -7.186 11.193 1.00 0.00 C ATOM 1660 O ASP A 108 191.828 -7.192 12.185 1.00 0.00 O ATOM 1661 CB ASP A 108 194.884 -7.982 11.661 1.00 0.00 C ATOM 1662 CG ASP A 108 194.844 -8.296 13.143 1.00 0.00 C ATOM 1663 OD1 ASP A 108 194.392 -9.404 13.503 1.00 0.00 O ATOM 1664 OD2 ASP A 108 195.264 -7.436 13.945 1.00 0.00 O ATOM 0 H ASP A 108 194.689 -8.184 9.200 1.00 0.00 H new ATOM 0 HA ASP A 108 193.164 -9.233 11.376 1.00 0.00 H new ATOM 0 HB2 ASP A 108 195.690 -8.548 11.194 1.00 0.00 H new ATOM 0 HB3 ASP A 108 195.115 -6.926 11.522 1.00 0.00 H new ATOM 1669 N GLY A 109 192.516 -6.226 10.269 1.00 0.00 N ATOM 1670 CA GLY A 109 191.584 -5.121 10.397 1.00 0.00 C ATOM 1671 C GLY A 109 192.270 -3.775 10.524 1.00 0.00 C ATOM 1672 O GLY A 109 191.637 -2.787 10.898 1.00 0.00 O ATOM 0 H GLY A 109 193.108 -6.196 9.439 1.00 0.00 H new ATOM 0 HA2 GLY A 109 190.926 -5.106 9.528 1.00 0.00 H new ATOM 0 HA3 GLY A 109 190.954 -5.285 11.271 1.00 0.00 H new ATOM 1676 N THR A 110 193.559 -3.721 10.200 1.00 0.00 N ATOM 1677 CA THR A 110 194.301 -2.470 10.271 1.00 0.00 C ATOM 1678 C THR A 110 195.237 -2.330 9.085 1.00 0.00 C ATOM 1679 O THR A 110 195.525 -3.294 8.392 1.00 0.00 O ATOM 1680 CB THR A 110 195.081 -2.357 11.578 1.00 0.00 C ATOM 1681 OG1 THR A 110 196.332 -3.016 11.480 1.00 0.00 O ATOM 1682 CG2 THR A 110 194.348 -2.936 12.771 1.00 0.00 C ATOM 0 H THR A 110 194.106 -4.523 9.888 1.00 0.00 H new ATOM 0 HA THR A 110 193.575 -1.657 10.241 1.00 0.00 H new ATOM 0 HB THR A 110 195.211 -1.287 11.738 1.00 0.00 H new ATOM 0 HG1 THR A 110 196.815 -2.929 12.328 1.00 0.00 H new ATOM 0 HG21 THR A 110 194.961 -2.821 13.665 1.00 0.00 H new ATOM 0 HG22 THR A 110 193.404 -2.409 12.908 1.00 0.00 H new ATOM 0 HG23 THR A 110 194.152 -3.994 12.599 1.00 0.00 H new ATOM 1690 N PRO A 111 195.714 -1.109 8.837 1.00 0.00 N ATOM 1691 CA PRO A 111 196.605 -0.818 7.718 1.00 0.00 C ATOM 1692 C PRO A 111 197.698 -1.862 7.530 1.00 0.00 C ATOM 1693 O PRO A 111 198.388 -2.244 8.475 1.00 0.00 O ATOM 1694 CB PRO A 111 197.195 0.539 8.094 1.00 0.00 C ATOM 1695 CG PRO A 111 196.125 1.199 8.896 1.00 0.00 C ATOM 1696 CD PRO A 111 195.410 0.093 9.633 1.00 0.00 C ATOM 0 HA PRO A 111 196.076 -0.822 6.765 1.00 0.00 H new ATOM 0 HB2 PRO A 111 198.113 0.427 8.671 1.00 0.00 H new ATOM 0 HB3 PRO A 111 197.445 1.123 7.208 1.00 0.00 H new ATOM 0 HG2 PRO A 111 196.550 1.920 9.594 1.00 0.00 H new ATOM 0 HG3 PRO A 111 195.437 1.746 8.252 1.00 0.00 H new ATOM 0 HD2 PRO A 111 195.770 -0.003 10.657 1.00 0.00 H new ATOM 0 HD3 PRO A 111 194.337 0.276 9.688 1.00 0.00 H new ATOM 1704 N ALA A 112 197.836 -2.319 6.289 1.00 0.00 N ATOM 1705 CA ALA A 112 198.828 -3.323 5.938 1.00 0.00 C ATOM 1706 C ALA A 112 200.237 -2.860 6.287 1.00 0.00 C ATOM 1707 O ALA A 112 200.759 -1.917 5.691 1.00 0.00 O ATOM 1708 CB ALA A 112 198.723 -3.654 4.459 1.00 0.00 C ATOM 0 H ALA A 112 197.266 -2.004 5.504 1.00 0.00 H new ATOM 0 HA ALA A 112 198.627 -4.222 6.521 1.00 0.00 H new ATOM 0 HB1 ALA A 112 199.468 -4.407 4.201 1.00 0.00 H new ATOM 0 HB2 ALA A 112 197.727 -4.040 4.242 1.00 0.00 H new ATOM 0 HB3 ALA A 112 198.898 -2.753 3.871 1.00 0.00 H new ATOM 1714 N ASP A 113 200.851 -3.531 7.257 1.00 0.00 N ATOM 1715 CA ASP A 113 202.205 -3.192 7.687 1.00 0.00 C ATOM 1716 C ASP A 113 203.178 -4.316 7.348 1.00 0.00 C ATOM 1717 O ASP A 113 202.807 -5.490 7.333 1.00 0.00 O ATOM 1718 CB ASP A 113 202.229 -2.914 9.190 1.00 0.00 C ATOM 1719 CG ASP A 113 203.154 -1.768 9.551 1.00 0.00 C ATOM 1720 OD1 ASP A 113 204.381 -1.916 9.373 1.00 0.00 O ATOM 1721 OD2 ASP A 113 202.650 -0.721 10.010 1.00 0.00 O ATOM 0 H ASP A 113 200.433 -4.313 7.761 1.00 0.00 H new ATOM 0 HA ASP A 113 202.517 -2.293 7.155 1.00 0.00 H new ATOM 0 HB2 ASP A 113 201.219 -2.684 9.530 1.00 0.00 H new ATOM 0 HB3 ASP A 113 202.546 -3.813 9.718 1.00 0.00 H new ATOM 1726 N THR A 114 204.426 -3.947 7.074 1.00 0.00 N ATOM 1727 CA THR A 114 205.453 -4.925 6.734 1.00 0.00 C ATOM 1728 C THR A 114 206.314 -5.255 7.951 1.00 0.00 C ATOM 1729 O THR A 114 207.528 -5.430 7.838 1.00 0.00 O ATOM 1730 CB THR A 114 206.331 -4.400 5.592 1.00 0.00 C ATOM 1731 OG1 THR A 114 205.925 -3.100 5.200 1.00 0.00 O ATOM 1732 CG2 THR A 114 206.296 -5.281 4.361 1.00 0.00 C ATOM 0 H THR A 114 204.750 -2.980 7.081 1.00 0.00 H new ATOM 0 HA THR A 114 204.957 -5.839 6.407 1.00 0.00 H new ATOM 0 HB THR A 114 207.346 -4.392 5.989 1.00 0.00 H new ATOM 0 HG1 THR A 114 206.499 -2.784 4.472 1.00 0.00 H new ATOM 0 HG21 THR A 114 206.938 -4.854 3.590 1.00 0.00 H new ATOM 0 HG22 THR A 114 206.651 -6.279 4.618 1.00 0.00 H new ATOM 0 HG23 THR A 114 205.274 -5.345 3.988 1.00 0.00 H new ATOM 1740 N SER A 115 205.676 -5.340 9.114 1.00 0.00 N ATOM 1741 CA SER A 115 206.382 -5.649 10.352 1.00 0.00 C ATOM 1742 C SER A 115 207.089 -6.997 10.254 1.00 0.00 C ATOM 1743 O SER A 115 206.840 -7.775 9.334 1.00 0.00 O ATOM 1744 CB SER A 115 205.407 -5.656 11.530 1.00 0.00 C ATOM 1745 OG SER A 115 204.587 -4.502 11.520 1.00 0.00 O ATOM 0 H SER A 115 204.672 -5.199 9.225 1.00 0.00 H new ATOM 0 HA SER A 115 207.134 -4.877 10.515 1.00 0.00 H new ATOM 0 HB2 SER A 115 204.784 -6.549 11.485 1.00 0.00 H new ATOM 0 HB3 SER A 115 205.963 -5.702 12.466 1.00 0.00 H new ATOM 0 HG SER A 115 203.972 -4.531 12.282 1.00 0.00 H new ATOM 1751 N LEU A 116 207.971 -7.267 11.212 1.00 0.00 N ATOM 1752 CA LEU A 116 208.715 -8.521 11.235 1.00 0.00 C ATOM 1753 C LEU A 116 209.471 -8.678 12.551 1.00 0.00 C ATOM 1754 O LEU A 116 210.677 -8.439 12.617 1.00 0.00 O ATOM 1755 CB LEU A 116 209.693 -8.580 10.060 1.00 0.00 C ATOM 1756 CG LEU A 116 209.983 -9.985 9.530 1.00 0.00 C ATOM 1757 CD1 LEU A 116 210.447 -10.896 10.657 1.00 0.00 C ATOM 1758 CD2 LEU A 116 208.753 -10.562 8.848 1.00 0.00 C ATOM 0 H LEU A 116 208.187 -6.634 11.982 1.00 0.00 H new ATOM 0 HA LEU A 116 208.002 -9.341 11.145 1.00 0.00 H new ATOM 0 HB2 LEU A 116 209.295 -7.976 9.245 1.00 0.00 H new ATOM 0 HB3 LEU A 116 210.634 -8.122 10.366 1.00 0.00 H new ATOM 0 HG LEU A 116 210.783 -9.916 8.793 1.00 0.00 H new ATOM 0 HD11 LEU A 116 210.648 -11.891 10.261 1.00 0.00 H new ATOM 0 HD12 LEU A 116 211.356 -10.491 11.101 1.00 0.00 H new ATOM 0 HD13 LEU A 116 209.669 -10.959 11.418 1.00 0.00 H new ATOM 0 HD21 LEU A 116 208.978 -11.562 8.477 1.00 0.00 H new ATOM 0 HD22 LEU A 116 207.932 -10.616 9.563 1.00 0.00 H new ATOM 0 HD23 LEU A 116 208.466 -9.922 8.014 1.00 0.00 H new ATOM 1770 N GLU A 117 208.756 -9.084 13.595 1.00 0.00 N ATOM 1771 CA GLU A 117 209.360 -9.272 14.909 1.00 0.00 C ATOM 1772 C GLU A 117 208.747 -10.477 15.622 1.00 0.00 C ATOM 1773 O GLU A 117 207.710 -10.358 16.277 1.00 0.00 O ATOM 1774 CB GLU A 117 209.178 -8.015 15.761 1.00 0.00 C ATOM 1775 CG GLU A 117 210.290 -7.801 16.774 1.00 0.00 C ATOM 1776 CD GLU A 117 210.637 -6.336 16.957 1.00 0.00 C ATOM 1777 OE1 GLU A 117 211.099 -5.709 15.981 1.00 0.00 O ATOM 1778 OE2 GLU A 117 210.447 -5.816 18.076 1.00 0.00 O ATOM 0 H GLU A 117 207.758 -9.289 13.557 1.00 0.00 H new ATOM 0 HA GLU A 117 210.425 -9.457 14.769 1.00 0.00 H new ATOM 0 HB2 GLU A 117 209.123 -7.146 15.105 1.00 0.00 H new ATOM 0 HB3 GLU A 117 208.225 -8.078 16.287 1.00 0.00 H new ATOM 0 HG2 GLU A 117 209.989 -8.222 17.733 1.00 0.00 H new ATOM 0 HG3 GLU A 117 211.179 -8.344 16.453 1.00 0.00 H new ATOM 1785 N PRO A 118 209.382 -11.657 15.508 1.00 0.00 N ATOM 1786 CA PRO A 118 208.889 -12.882 16.150 1.00 0.00 C ATOM 1787 C PRO A 118 209.018 -12.832 17.668 1.00 0.00 C ATOM 1788 O PRO A 118 210.125 -12.524 18.157 1.00 0.00 O ATOM 1789 CB PRO A 118 209.789 -13.976 15.571 1.00 0.00 C ATOM 1790 CG PRO A 118 211.043 -13.270 15.184 1.00 0.00 C ATOM 1791 CD PRO A 118 210.624 -11.892 14.751 1.00 0.00 C ATOM 0 HA PRO A 118 207.828 -13.042 15.960 1.00 0.00 H new ATOM 0 HB2 PRO A 118 209.985 -14.757 16.305 1.00 0.00 H new ATOM 0 HB3 PRO A 118 209.324 -14.457 14.711 1.00 0.00 H new ATOM 0 HG2 PRO A 118 211.738 -13.221 16.022 1.00 0.00 H new ATOM 0 HG3 PRO A 118 211.553 -13.795 14.376 1.00 0.00 H new ATOM 0 HD2 PRO A 118 211.385 -11.148 14.987 1.00 0.00 H new ATOM 0 HD3 PRO A 118 210.454 -11.843 13.675 1.00 0.00 H new TER 1799 PRO A 118