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 180:sc= 0 USER MOD Set 1.2: A 102 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 74 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0365) USER MOD Single : A 6 GLN : amide:sc= -0.0287 X(o=-0.029,f=0) USER MOD Single : A 7 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 TYR OH : rot 30:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= -0.0199 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 37 HIS : no HD1:sc= -4.93! C(o=-4.9!,f=-5.1!) USER MOD Single : A 39 LYS NZ :NH3+ -148:sc= 0.0854 (180deg=-0.0155) USER MOD Single : A 41 ASN : amide:sc= -0.382 K(o=-0.38,f=-2.4!) USER MOD Single : A 44 MET CE :methyl 169:sc= -0.39 (180deg=-0.535) USER MOD Single : A 51 HIS : no HE2:sc= -0.281 K(o=-0.28,f=-0.94) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 THR OG1 : rot 180:sc= -0.824 USER MOD Single : A 70 ASN : amide:sc= -0.272 X(o=-0.27,f=-0.032) USER MOD Single : A 78 LYS NZ :NH3+ -143:sc= 0.827 (180deg=0.224) USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 180:sc= -2.41 USER MOD Single : A 84 TYR OH : rot 180:sc= -0.174 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 TYR OH : rot 180:sc= -0.0794 USER MOD Single : A 94 GLN : amide:sc= -0.241 K(o=-0.24,f=-7.3!) USER MOD Single : A 96 ASN : amide:sc= -0.764 X(o=-0.76,f=-1) USER MOD Single : A 106 ASN :FLIP amide:sc= -3.47! C(o=-4.2!,f=-3.5!) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 180:sc= -0.223 USER MOD Single : A 115 SER OG : rot -104:sc= 0.0103 USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 6 162.652 12.364 9.597 1.00 0.00 N ATOM 2 CA GLN A 6 163.454 12.486 8.353 1.00 0.00 C ATOM 3 C GLN A 6 164.946 12.362 8.643 1.00 0.00 C ATOM 4 O GLN A 6 165.640 13.363 8.822 1.00 0.00 O ATOM 5 CB GLN A 6 163.152 13.842 7.711 1.00 0.00 C ATOM 6 CG GLN A 6 161.840 13.874 6.945 1.00 0.00 C ATOM 7 CD GLN A 6 162.042 13.907 5.442 1.00 0.00 C ATOM 8 OE1 GLN A 6 161.648 12.985 4.731 1.00 0.00 O ATOM 9 NE2 GLN A 6 162.660 14.976 4.952 1.00 0.00 N ATOM 0 HA GLN A 6 163.184 11.678 7.673 1.00 0.00 H new ATOM 0 HB2 GLN A 6 163.128 14.605 8.489 1.00 0.00 H new ATOM 0 HB3 GLN A 6 163.965 14.103 7.034 1.00 0.00 H new ATOM 0 HG2 GLN A 6 161.248 12.998 7.209 1.00 0.00 H new ATOM 0 HG3 GLN A 6 161.267 14.750 7.250 1.00 0.00 H new ATOM 0 HE21 GLN A 6 162.970 15.718 5.579 1.00 0.00 H new ATOM 0 HE22 GLN A 6 162.824 15.055 3.948 1.00 0.00 H new ATOM 18 N TYR A 7 165.434 11.127 8.691 1.00 0.00 N ATOM 19 CA TYR A 7 166.845 10.872 8.960 1.00 0.00 C ATOM 20 C TYR A 7 167.698 11.212 7.747 1.00 0.00 C ATOM 21 O TYR A 7 167.183 11.581 6.693 1.00 0.00 O ATOM 22 CB TYR A 7 167.055 9.409 9.360 1.00 0.00 C ATOM 23 CG TYR A 7 168.447 9.089 9.855 1.00 0.00 C ATOM 24 CD1 TYR A 7 168.963 9.714 10.984 1.00 0.00 C ATOM 25 CD2 TYR A 7 169.246 8.164 9.194 1.00 0.00 C ATOM 26 CE1 TYR A 7 170.235 9.425 11.439 1.00 0.00 C ATOM 27 CE2 TYR A 7 170.518 7.869 9.645 1.00 0.00 C ATOM 28 CZ TYR A 7 171.008 8.502 10.767 1.00 0.00 C ATOM 29 OH TYR A 7 172.276 8.213 11.218 1.00 0.00 O ATOM 0 H TYR A 7 164.874 10.287 8.547 1.00 0.00 H new ATOM 0 HA TYR A 7 167.154 11.511 9.787 1.00 0.00 H new ATOM 0 HB2 TYR A 7 166.338 9.152 10.139 1.00 0.00 H new ATOM 0 HB3 TYR A 7 166.834 8.775 8.501 1.00 0.00 H new ATOM 0 HD1 TYR A 7 168.360 10.437 11.514 1.00 0.00 H new ATOM 0 HD2 TYR A 7 168.866 7.668 8.313 1.00 0.00 H new ATOM 0 HE1 TYR A 7 170.622 9.920 12.317 1.00 0.00 H new ATOM 0 HE2 TYR A 7 171.125 7.146 9.121 1.00 0.00 H new ATOM 0 HH TYR A 7 172.686 7.542 10.633 1.00 0.00 H new ATOM 39 N VAL A 8 169.004 11.087 7.914 1.00 0.00 N ATOM 40 CA VAL A 8 169.947 11.381 6.843 1.00 0.00 C ATOM 41 C VAL A 8 170.743 10.142 6.448 1.00 0.00 C ATOM 42 O VAL A 8 170.815 9.170 7.200 1.00 0.00 O ATOM 43 CB VAL A 8 170.926 12.497 7.255 1.00 0.00 C ATOM 44 CG1 VAL A 8 171.763 12.943 6.067 1.00 0.00 C ATOM 45 CG2 VAL A 8 170.174 13.674 7.858 1.00 0.00 C ATOM 0 H VAL A 8 169.439 10.782 8.785 1.00 0.00 H new ATOM 0 HA VAL A 8 169.360 11.715 5.987 1.00 0.00 H new ATOM 0 HB VAL A 8 171.599 12.099 8.014 1.00 0.00 H new ATOM 0 HG11 VAL A 8 172.448 13.731 6.380 1.00 0.00 H new ATOM 0 HG12 VAL A 8 172.334 12.096 5.686 1.00 0.00 H new ATOM 0 HG13 VAL A 8 171.108 13.321 5.282 1.00 0.00 H new ATOM 0 HG21 VAL A 8 170.883 14.451 8.143 1.00 0.00 H new ATOM 0 HG22 VAL A 8 169.473 14.073 7.124 1.00 0.00 H new ATOM 0 HG23 VAL A 8 169.626 13.342 8.740 1.00 0.00 H new ATOM 55 N VAL A 9 171.337 10.183 5.260 1.00 0.00 N ATOM 56 CA VAL A 9 172.126 9.068 4.754 1.00 0.00 C ATOM 57 C VAL A 9 173.389 8.846 5.585 1.00 0.00 C ATOM 58 O VAL A 9 174.175 9.771 5.789 1.00 0.00 O ATOM 59 CB VAL A 9 172.562 9.306 3.297 1.00 0.00 C ATOM 60 CG1 VAL A 9 173.114 8.024 2.703 1.00 0.00 C ATOM 61 CG2 VAL A 9 171.417 9.851 2.454 1.00 0.00 C ATOM 0 H VAL A 9 171.286 10.981 4.627 1.00 0.00 H new ATOM 0 HA VAL A 9 171.483 8.190 4.817 1.00 0.00 H new ATOM 0 HB VAL A 9 173.350 10.059 3.295 1.00 0.00 H new ATOM 0 HG11 VAL A 9 173.420 8.203 1.672 1.00 0.00 H new ATOM 0 HG12 VAL A 9 173.975 7.695 3.285 1.00 0.00 H new ATOM 0 HG13 VAL A 9 172.345 7.252 2.725 1.00 0.00 H new ATOM 0 HG21 VAL A 9 171.760 10.007 1.431 1.00 0.00 H new ATOM 0 HG22 VAL A 9 170.593 9.138 2.455 1.00 0.00 H new ATOM 0 HG23 VAL A 9 171.077 10.799 2.871 1.00 0.00 H new ATOM 71 N PRO A 10 173.614 7.607 6.066 1.00 0.00 N ATOM 72 CA PRO A 10 174.800 7.275 6.863 1.00 0.00 C ATOM 73 C PRO A 10 176.095 7.483 6.088 1.00 0.00 C ATOM 74 O PRO A 10 176.082 7.939 4.944 1.00 0.00 O ATOM 75 CB PRO A 10 174.627 5.789 7.190 1.00 0.00 C ATOM 76 CG PRO A 10 173.635 5.279 6.201 1.00 0.00 C ATOM 77 CD PRO A 10 172.740 6.438 5.871 1.00 0.00 C ATOM 0 HA PRO A 10 174.875 7.913 7.744 1.00 0.00 H new ATOM 0 HB2 PRO A 10 175.574 5.256 7.107 1.00 0.00 H new ATOM 0 HB3 PRO A 10 174.271 5.650 8.211 1.00 0.00 H new ATOM 0 HG2 PRO A 10 174.134 4.905 5.307 1.00 0.00 H new ATOM 0 HG3 PRO A 10 173.062 4.450 6.616 1.00 0.00 H new ATOM 0 HD2 PRO A 10 172.368 6.380 4.848 1.00 0.00 H new ATOM 0 HD3 PRO A 10 171.869 6.473 6.526 1.00 0.00 H new ATOM 85 N SER A 11 177.210 7.147 6.723 1.00 0.00 N ATOM 86 CA SER A 11 178.520 7.292 6.107 1.00 0.00 C ATOM 87 C SER A 11 179.148 5.936 5.803 1.00 0.00 C ATOM 88 O SER A 11 179.517 5.193 6.713 1.00 0.00 O ATOM 89 CB SER A 11 179.434 8.094 7.028 1.00 0.00 C ATOM 90 OG SER A 11 180.538 8.627 6.317 1.00 0.00 O ATOM 0 H SER A 11 177.232 6.770 7.670 1.00 0.00 H new ATOM 0 HA SER A 11 178.394 7.821 5.162 1.00 0.00 H new ATOM 0 HB2 SER A 11 178.870 8.904 7.489 1.00 0.00 H new ATOM 0 HB3 SER A 11 179.792 7.455 7.835 1.00 0.00 H new ATOM 0 HG SER A 11 181.107 9.138 6.931 1.00 0.00 H new ATOM 96 N ALA A 12 179.269 5.617 4.516 1.00 0.00 N ATOM 97 CA ALA A 12 179.855 4.351 4.099 1.00 0.00 C ATOM 98 C ALA A 12 181.379 4.419 4.080 1.00 0.00 C ATOM 99 O ALA A 12 181.971 5.077 3.226 1.00 0.00 O ATOM 100 CB ALA A 12 179.327 3.950 2.731 1.00 0.00 C ATOM 0 H ALA A 12 178.969 6.218 3.748 1.00 0.00 H new ATOM 0 HA ALA A 12 179.565 3.594 4.828 1.00 0.00 H new ATOM 0 HB1 ALA A 12 179.774 3.002 2.432 1.00 0.00 H new ATOM 0 HB2 ALA A 12 178.243 3.842 2.777 1.00 0.00 H new ATOM 0 HB3 ALA A 12 179.585 4.718 2.002 1.00 0.00 H new ATOM 106 N LYS A 13 182.007 3.723 5.024 1.00 0.00 N ATOM 107 CA LYS A 13 183.464 3.693 5.113 1.00 0.00 C ATOM 108 C LYS A 13 184.027 2.632 4.173 1.00 0.00 C ATOM 109 O LYS A 13 183.292 1.768 3.695 1.00 0.00 O ATOM 110 CB LYS A 13 183.902 3.410 6.551 1.00 0.00 C ATOM 111 CG LYS A 13 184.320 4.657 7.314 1.00 0.00 C ATOM 112 CD LYS A 13 183.763 4.660 8.728 1.00 0.00 C ATOM 113 CE LYS A 13 183.945 6.013 9.397 1.00 0.00 C ATOM 114 NZ LYS A 13 182.988 6.211 10.520 1.00 0.00 N ATOM 0 H LYS A 13 181.530 3.172 5.738 1.00 0.00 H new ATOM 0 HA LYS A 13 183.852 4.667 4.815 1.00 0.00 H new ATOM 0 HB2 LYS A 13 183.083 2.925 7.083 1.00 0.00 H new ATOM 0 HB3 LYS A 13 184.734 2.706 6.537 1.00 0.00 H new ATOM 0 HG2 LYS A 13 185.408 4.714 7.351 1.00 0.00 H new ATOM 0 HG3 LYS A 13 183.972 5.543 6.783 1.00 0.00 H new ATOM 0 HD2 LYS A 13 182.704 4.405 8.703 1.00 0.00 H new ATOM 0 HD3 LYS A 13 184.262 3.891 9.318 1.00 0.00 H new ATOM 0 HE2 LYS A 13 184.965 6.099 9.770 1.00 0.00 H new ATOM 0 HE3 LYS A 13 183.808 6.804 8.660 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 183.145 7.145 10.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 182.014 6.155 10.160 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 183.136 5.472 11.236 1.00 0.00 H new ATOM 128 N LEU A 14 185.329 2.700 3.905 1.00 0.00 N ATOM 129 CA LEU A 14 185.962 1.735 3.012 1.00 0.00 C ATOM 130 C LEU A 14 187.451 1.567 3.310 1.00 0.00 C ATOM 131 O LEU A 14 188.164 2.540 3.551 1.00 0.00 O ATOM 132 CB LEU A 14 185.775 2.163 1.554 1.00 0.00 C ATOM 133 CG LEU A 14 184.368 1.945 0.990 1.00 0.00 C ATOM 134 CD1 LEU A 14 183.571 3.240 1.028 1.00 0.00 C ATOM 135 CD2 LEU A 14 184.440 1.401 -0.429 1.00 0.00 C ATOM 0 H LEU A 14 185.959 3.404 4.288 1.00 0.00 H new ATOM 0 HA LEU A 14 185.477 0.773 3.180 1.00 0.00 H new ATOM 0 HB2 LEU A 14 186.025 3.220 1.467 1.00 0.00 H new ATOM 0 HB3 LEU A 14 186.487 1.615 0.936 1.00 0.00 H new ATOM 0 HG LEU A 14 183.858 1.210 1.613 1.00 0.00 H new ATOM 0 HD11 LEU A 14 182.574 3.066 0.623 1.00 0.00 H new ATOM 0 HD12 LEU A 14 183.489 3.587 2.058 1.00 0.00 H new ATOM 0 HD13 LEU A 14 184.078 3.997 0.430 1.00 0.00 H new ATOM 0 HD21 LEU A 14 183.431 1.252 -0.813 1.00 0.00 H new ATOM 0 HD22 LEU A 14 184.969 2.111 -1.064 1.00 0.00 H new ATOM 0 HD23 LEU A 14 184.971 0.449 -0.427 1.00 0.00 H new ATOM 147 N GLU A 15 187.908 0.319 3.267 1.00 0.00 N ATOM 148 CA GLU A 15 189.308 -0.009 3.507 1.00 0.00 C ATOM 149 C GLU A 15 189.785 -1.008 2.455 1.00 0.00 C ATOM 150 O GLU A 15 189.064 -1.948 2.121 1.00 0.00 O ATOM 151 CB GLU A 15 189.489 -0.594 4.908 1.00 0.00 C ATOM 152 CG GLU A 15 189.492 0.455 6.008 1.00 0.00 C ATOM 153 CD GLU A 15 189.078 -0.110 7.353 1.00 0.00 C ATOM 154 OE1 GLU A 15 187.919 -0.559 7.476 1.00 0.00 O ATOM 155 OE2 GLU A 15 189.911 -0.102 8.283 1.00 0.00 O ATOM 0 H GLU A 15 187.320 -0.490 3.066 1.00 0.00 H new ATOM 0 HA GLU A 15 189.902 0.902 3.437 1.00 0.00 H new ATOM 0 HB2 GLU A 15 188.689 -1.309 5.101 1.00 0.00 H new ATOM 0 HB3 GLU A 15 190.427 -1.148 4.943 1.00 0.00 H new ATOM 0 HG2 GLU A 15 190.489 0.887 6.091 1.00 0.00 H new ATOM 0 HG3 GLU A 15 188.816 1.265 5.735 1.00 0.00 H new ATOM 162 N ALA A 16 190.984 -0.799 1.915 1.00 0.00 N ATOM 163 CA ALA A 16 191.506 -1.692 0.884 1.00 0.00 C ATOM 164 C ALA A 16 192.229 -2.885 1.497 1.00 0.00 C ATOM 165 O ALA A 16 193.261 -2.737 2.149 1.00 0.00 O ATOM 166 CB ALA A 16 192.427 -0.931 -0.057 1.00 0.00 C ATOM 0 H ALA A 16 191.604 -0.030 2.170 1.00 0.00 H new ATOM 0 HA ALA A 16 190.662 -2.076 0.312 1.00 0.00 H new ATOM 0 HB1 ALA A 16 192.809 -1.609 -0.820 1.00 0.00 H new ATOM 0 HB2 ALA A 16 191.873 -0.123 -0.534 1.00 0.00 H new ATOM 0 HB3 ALA A 16 193.261 -0.515 0.508 1.00 0.00 H new ATOM 172 N ILE A 17 191.665 -4.070 1.285 1.00 0.00 N ATOM 173 CA ILE A 17 192.233 -5.304 1.816 1.00 0.00 C ATOM 174 C ILE A 17 193.189 -5.952 0.819 1.00 0.00 C ATOM 175 O ILE A 17 192.768 -6.444 -0.228 1.00 0.00 O ATOM 176 CB ILE A 17 191.127 -6.315 2.182 1.00 0.00 C ATOM 177 CG1 ILE A 17 189.964 -5.606 2.882 1.00 0.00 C ATOM 178 CG2 ILE A 17 191.689 -7.417 3.067 1.00 0.00 C ATOM 179 CD1 ILE A 17 190.338 -5.005 4.219 1.00 0.00 C ATOM 0 H ILE A 17 190.809 -4.202 0.745 1.00 0.00 H new ATOM 0 HA ILE A 17 192.786 -5.034 2.716 1.00 0.00 H new ATOM 0 HB ILE A 17 190.752 -6.766 1.263 1.00 0.00 H new ATOM 0 HG12 ILE A 17 189.586 -4.817 2.232 1.00 0.00 H new ATOM 0 HG13 ILE A 17 189.151 -6.317 3.027 1.00 0.00 H new ATOM 0 HG21 ILE A 17 190.897 -8.123 3.317 1.00 0.00 H new ATOM 0 HG22 ILE A 17 192.486 -7.939 2.537 1.00 0.00 H new ATOM 0 HG23 ILE A 17 192.088 -6.980 3.983 1.00 0.00 H new ATOM 0 HD11 ILE A 17 189.466 -4.520 4.657 1.00 0.00 H new ATOM 0 HD12 ILE A 17 190.688 -5.792 4.887 1.00 0.00 H new ATOM 0 HD13 ILE A 17 191.130 -4.269 4.079 1.00 0.00 H new ATOM 191 N TYR A 18 194.475 -5.952 1.155 1.00 0.00 N ATOM 192 CA TYR A 18 195.493 -6.544 0.294 1.00 0.00 C ATOM 193 C TYR A 18 195.572 -8.054 0.521 1.00 0.00 C ATOM 194 O TYR A 18 195.352 -8.530 1.635 1.00 0.00 O ATOM 195 CB TYR A 18 196.856 -5.897 0.567 1.00 0.00 C ATOM 196 CG TYR A 18 197.589 -5.455 -0.681 1.00 0.00 C ATOM 197 CD1 TYR A 18 196.909 -4.885 -1.751 1.00 0.00 C ATOM 198 CD2 TYR A 18 198.967 -5.609 -0.788 1.00 0.00 C ATOM 199 CE1 TYR A 18 197.579 -4.482 -2.889 1.00 0.00 C ATOM 200 CE2 TYR A 18 199.643 -5.206 -1.924 1.00 0.00 C ATOM 201 CZ TYR A 18 198.945 -4.644 -2.972 1.00 0.00 C ATOM 202 OH TYR A 18 199.617 -4.243 -4.104 1.00 0.00 O ATOM 0 H TYR A 18 194.837 -5.548 2.019 1.00 0.00 H new ATOM 0 HA TYR A 18 195.218 -6.363 -0.745 1.00 0.00 H new ATOM 0 HB2 TYR A 18 196.713 -5.034 1.217 1.00 0.00 H new ATOM 0 HB3 TYR A 18 197.481 -6.606 1.111 1.00 0.00 H new ATOM 0 HD1 TYR A 18 195.839 -4.755 -1.691 1.00 0.00 H new ATOM 0 HD2 TYR A 18 199.518 -6.050 0.030 1.00 0.00 H new ATOM 0 HE1 TYR A 18 197.035 -4.041 -3.711 1.00 0.00 H new ATOM 0 HE2 TYR A 18 200.714 -5.331 -1.991 1.00 0.00 H new ATOM 0 HH TYR A 18 199.147 -3.486 -4.513 1.00 0.00 H new ATOM 212 N PRO A 19 195.884 -8.837 -0.530 1.00 0.00 N ATOM 213 CA PRO A 19 196.153 -8.330 -1.870 1.00 0.00 C ATOM 214 C PRO A 19 194.904 -8.294 -2.745 1.00 0.00 C ATOM 215 O PRO A 19 194.943 -7.826 -3.882 1.00 0.00 O ATOM 216 CB PRO A 19 197.149 -9.353 -2.403 1.00 0.00 C ATOM 217 CG PRO A 19 196.762 -10.643 -1.753 1.00 0.00 C ATOM 218 CD PRO A 19 196.001 -10.301 -0.489 1.00 0.00 C ATOM 0 HA PRO A 19 196.514 -7.302 -1.866 1.00 0.00 H new ATOM 0 HB2 PRO A 19 197.096 -9.427 -3.489 1.00 0.00 H new ATOM 0 HB3 PRO A 19 198.173 -9.076 -2.152 1.00 0.00 H new ATOM 0 HG2 PRO A 19 196.144 -11.241 -2.423 1.00 0.00 H new ATOM 0 HG3 PRO A 19 197.646 -11.236 -1.520 1.00 0.00 H new ATOM 0 HD2 PRO A 19 195.022 -10.779 -0.471 1.00 0.00 H new ATOM 0 HD3 PRO A 19 196.535 -10.634 0.401 1.00 0.00 H new ATOM 226 N ARG A 20 193.792 -8.788 -2.207 1.00 0.00 N ATOM 227 CA ARG A 20 192.539 -8.810 -2.936 1.00 0.00 C ATOM 228 C ARG A 20 191.350 -8.884 -1.984 1.00 0.00 C ATOM 229 O ARG A 20 190.913 -9.969 -1.603 1.00 0.00 O ATOM 230 CB ARG A 20 192.507 -9.990 -3.909 1.00 0.00 C ATOM 231 CG ARG A 20 193.091 -9.670 -5.276 1.00 0.00 C ATOM 232 CD ARG A 20 194.311 -10.527 -5.584 1.00 0.00 C ATOM 233 NE ARG A 20 194.049 -11.490 -6.653 1.00 0.00 N ATOM 234 CZ ARG A 20 193.504 -12.689 -6.457 1.00 0.00 C ATOM 235 NH1 ARG A 20 193.158 -13.081 -5.237 1.00 0.00 N ATOM 236 NH2 ARG A 20 193.304 -13.500 -7.487 1.00 0.00 N ATOM 0 H ARG A 20 193.739 -9.178 -1.266 1.00 0.00 H new ATOM 0 HA ARG A 20 192.466 -7.882 -3.502 1.00 0.00 H new ATOM 0 HB2 ARG A 20 193.059 -10.823 -3.474 1.00 0.00 H new ATOM 0 HB3 ARG A 20 191.476 -10.320 -4.032 1.00 0.00 H new ATOM 0 HG2 ARG A 20 192.332 -9.829 -6.042 1.00 0.00 H new ATOM 0 HG3 ARG A 20 193.367 -8.616 -5.316 1.00 0.00 H new ATOM 0 HD2 ARG A 20 195.143 -9.884 -5.872 1.00 0.00 H new ATOM 0 HD3 ARG A 20 194.617 -11.060 -4.683 1.00 0.00 H new ATOM 0 HE ARG A 20 194.299 -11.227 -7.606 1.00 0.00 H new ATOM 0 HH11 ARG A 20 193.309 -12.462 -4.440 1.00 0.00 H new ATOM 0 HH12 ARG A 20 192.741 -14.001 -5.096 1.00 0.00 H new ATOM 0 HH21 ARG A 20 193.568 -13.205 -8.427 1.00 0.00 H new ATOM 0 HH22 ARG A 20 192.887 -14.419 -7.339 1.00 0.00 H new ATOM 250 N GLY A 21 190.829 -7.720 -1.608 1.00 0.00 N ATOM 251 CA GLY A 21 189.693 -7.674 -0.707 1.00 0.00 C ATOM 252 C GLY A 21 189.169 -6.267 -0.503 1.00 0.00 C ATOM 253 O GLY A 21 189.766 -5.301 -0.977 1.00 0.00 O ATOM 0 H GLY A 21 191.173 -6.809 -1.911 1.00 0.00 H new ATOM 0 HA2 GLY A 21 188.894 -8.302 -1.103 1.00 0.00 H new ATOM 0 HA3 GLY A 21 189.981 -8.094 0.257 1.00 0.00 H new ATOM 257 N LEU A 22 188.049 -6.149 0.205 1.00 0.00 N ATOM 258 CA LEU A 22 187.442 -4.849 0.468 1.00 0.00 C ATOM 259 C LEU A 22 186.624 -4.880 1.757 1.00 0.00 C ATOM 260 O LEU A 22 185.999 -5.889 2.083 1.00 0.00 O ATOM 261 CB LEU A 22 186.553 -4.435 -0.707 1.00 0.00 C ATOM 262 CG LEU A 22 186.645 -2.962 -1.112 1.00 0.00 C ATOM 263 CD1 LEU A 22 186.005 -2.076 -0.055 1.00 0.00 C ATOM 264 CD2 LEU A 22 188.097 -2.562 -1.340 1.00 0.00 C ATOM 0 H LEU A 22 187.544 -6.939 0.607 1.00 0.00 H new ATOM 0 HA LEU A 22 188.241 -4.117 0.587 1.00 0.00 H new ATOM 0 HB2 LEU A 22 186.811 -5.048 -1.570 1.00 0.00 H new ATOM 0 HB3 LEU A 22 185.517 -4.661 -0.454 1.00 0.00 H new ATOM 0 HG LEU A 22 186.100 -2.827 -2.046 1.00 0.00 H new ATOM 0 HD11 LEU A 22 186.080 -1.032 -0.361 1.00 0.00 H new ATOM 0 HD12 LEU A 22 184.955 -2.346 0.059 1.00 0.00 H new ATOM 0 HD13 LEU A 22 186.520 -2.214 0.896 1.00 0.00 H new ATOM 0 HD21 LEU A 22 188.144 -1.512 -1.627 1.00 0.00 H new ATOM 0 HD22 LEU A 22 188.664 -2.713 -0.422 1.00 0.00 H new ATOM 0 HD23 LEU A 22 188.523 -3.175 -2.134 1.00 0.00 H new ATOM 276 N ARG A 23 186.635 -3.770 2.488 1.00 0.00 N ATOM 277 CA ARG A 23 185.895 -3.671 3.742 1.00 0.00 C ATOM 278 C ARG A 23 185.113 -2.361 3.810 1.00 0.00 C ATOM 279 O ARG A 23 185.699 -1.286 3.936 1.00 0.00 O ATOM 280 CB ARG A 23 186.851 -3.768 4.932 1.00 0.00 C ATOM 281 CG ARG A 23 186.149 -3.767 6.280 1.00 0.00 C ATOM 282 CD ARG A 23 187.100 -4.144 7.405 1.00 0.00 C ATOM 283 NE ARG A 23 186.794 -3.431 8.643 1.00 0.00 N ATOM 284 CZ ARG A 23 187.609 -3.385 9.693 1.00 0.00 C ATOM 285 NH1 ARG A 23 188.781 -4.008 9.661 1.00 0.00 N ATOM 286 NH2 ARG A 23 187.253 -2.712 10.780 1.00 0.00 N ATOM 0 H ARG A 23 187.148 -2.926 2.234 1.00 0.00 H new ATOM 0 HA ARG A 23 185.188 -4.500 3.784 1.00 0.00 H new ATOM 0 HB2 ARG A 23 187.441 -4.680 4.840 1.00 0.00 H new ATOM 0 HB3 ARG A 23 187.549 -2.932 4.895 1.00 0.00 H new ATOM 0 HG2 ARG A 23 185.730 -2.779 6.472 1.00 0.00 H new ATOM 0 HG3 ARG A 23 185.315 -4.468 6.257 1.00 0.00 H new ATOM 0 HD2 ARG A 23 187.044 -5.218 7.582 1.00 0.00 H new ATOM 0 HD3 ARG A 23 188.124 -3.923 7.103 1.00 0.00 H new ATOM 0 HE ARG A 23 185.902 -2.939 8.706 1.00 0.00 H new ATOM 0 HH11 ARG A 23 189.061 -4.526 8.828 1.00 0.00 H new ATOM 0 HH12 ARG A 23 189.402 -3.969 10.470 1.00 0.00 H new ATOM 0 HH21 ARG A 23 186.354 -2.230 10.810 1.00 0.00 H new ATOM 0 HH22 ARG A 23 187.878 -2.677 11.585 1.00 0.00 H new ATOM 300 N VAL A 24 183.789 -2.458 3.722 1.00 0.00 N ATOM 301 CA VAL A 24 182.931 -1.279 3.769 1.00 0.00 C ATOM 302 C VAL A 24 181.911 -1.378 4.902 1.00 0.00 C ATOM 303 O VAL A 24 181.391 -2.456 5.188 1.00 0.00 O ATOM 304 CB VAL A 24 182.185 -1.087 2.435 1.00 0.00 C ATOM 305 CG1 VAL A 24 181.409 0.222 2.428 1.00 0.00 C ATOM 306 CG2 VAL A 24 183.158 -1.146 1.267 1.00 0.00 C ATOM 0 H VAL A 24 183.288 -3.340 3.618 1.00 0.00 H new ATOM 0 HA VAL A 24 183.578 -0.420 3.949 1.00 0.00 H new ATOM 0 HB VAL A 24 181.468 -1.901 2.326 1.00 0.00 H new ATOM 0 HG11 VAL A 24 180.892 0.333 1.475 1.00 0.00 H new ATOM 0 HG12 VAL A 24 180.680 0.217 3.238 1.00 0.00 H new ATOM 0 HG13 VAL A 24 182.099 1.055 2.565 1.00 0.00 H new ATOM 0 HG21 VAL A 24 182.614 -1.009 0.333 1.00 0.00 H new ATOM 0 HG22 VAL A 24 183.902 -0.357 1.373 1.00 0.00 H new ATOM 0 HG23 VAL A 24 183.656 -2.115 1.257 1.00 0.00 H new ATOM 316 N SER A 25 181.630 -0.245 5.543 1.00 0.00 N ATOM 317 CA SER A 25 180.671 -0.204 6.643 1.00 0.00 C ATOM 318 C SER A 25 179.868 1.094 6.619 1.00 0.00 C ATOM 319 O SER A 25 180.379 2.141 6.227 1.00 0.00 O ATOM 320 CB SER A 25 181.395 -0.344 7.983 1.00 0.00 C ATOM 321 OG SER A 25 182.646 -0.989 7.822 1.00 0.00 O ATOM 0 H SER A 25 182.053 0.656 5.319 1.00 0.00 H new ATOM 0 HA SER A 25 179.981 -1.039 6.521 1.00 0.00 H new ATOM 0 HB2 SER A 25 181.545 0.642 8.424 1.00 0.00 H new ATOM 0 HB3 SER A 25 180.776 -0.913 8.677 1.00 0.00 H new ATOM 0 HG SER A 25 183.089 -1.065 8.693 1.00 0.00 H new ATOM 327 N ILE A 26 178.609 1.019 7.043 1.00 0.00 N ATOM 328 CA ILE A 26 177.738 2.195 7.067 1.00 0.00 C ATOM 329 C ILE A 26 176.935 2.265 8.366 1.00 0.00 C ATOM 330 O ILE A 26 176.195 1.335 8.694 1.00 0.00 O ATOM 331 CB ILE A 26 176.741 2.185 5.892 1.00 0.00 C ATOM 332 CG1 ILE A 26 175.949 0.878 5.884 1.00 0.00 C ATOM 333 CG2 ILE A 26 177.464 2.386 4.570 1.00 0.00 C ATOM 334 CD1 ILE A 26 174.469 1.070 6.129 1.00 0.00 C ATOM 0 H ILE A 26 178.169 0.160 7.374 1.00 0.00 H new ATOM 0 HA ILE A 26 178.393 3.062 6.987 1.00 0.00 H new ATOM 0 HB ILE A 26 176.043 3.012 6.022 1.00 0.00 H new ATOM 0 HG12 ILE A 26 176.089 0.383 4.923 1.00 0.00 H new ATOM 0 HG13 ILE A 26 176.353 0.213 6.647 1.00 0.00 H new ATOM 0 HG21 ILE A 26 176.741 2.375 3.755 1.00 0.00 H new ATOM 0 HG22 ILE A 26 177.984 3.344 4.582 1.00 0.00 H new ATOM 0 HG23 ILE A 26 178.186 1.583 4.425 1.00 0.00 H new ATOM 0 HD11 ILE A 26 173.968 0.102 6.110 1.00 0.00 H new ATOM 0 HD12 ILE A 26 174.319 1.537 7.102 1.00 0.00 H new ATOM 0 HD13 ILE A 26 174.051 1.710 5.351 1.00 0.00 H new ATOM 346 N PRO A 27 177.055 3.373 9.121 1.00 0.00 N ATOM 347 CA PRO A 27 176.320 3.554 10.376 1.00 0.00 C ATOM 348 C PRO A 27 174.840 3.212 10.227 1.00 0.00 C ATOM 349 O PRO A 27 174.087 3.939 9.581 1.00 0.00 O ATOM 350 CB PRO A 27 176.495 5.043 10.676 1.00 0.00 C ATOM 351 CG PRO A 27 177.784 5.411 10.025 1.00 0.00 C ATOM 352 CD PRO A 27 177.904 4.537 8.805 1.00 0.00 C ATOM 0 HA PRO A 27 176.689 2.901 11.167 1.00 0.00 H new ATOM 0 HB2 PRO A 27 175.667 5.628 10.274 1.00 0.00 H new ATOM 0 HB3 PRO A 27 176.526 5.230 11.749 1.00 0.00 H new ATOM 0 HG2 PRO A 27 177.794 6.466 9.750 1.00 0.00 H new ATOM 0 HG3 PRO A 27 178.622 5.250 10.703 1.00 0.00 H new ATOM 0 HD2 PRO A 27 177.559 5.052 7.908 1.00 0.00 H new ATOM 0 HD3 PRO A 27 178.938 4.241 8.625 1.00 0.00 H new ATOM 360 N ASP A 28 174.433 2.095 10.820 1.00 0.00 N ATOM 361 CA ASP A 28 173.047 1.650 10.743 1.00 0.00 C ATOM 362 C ASP A 28 172.151 2.457 11.676 1.00 0.00 C ATOM 363 O ASP A 28 172.591 2.943 12.719 1.00 0.00 O ATOM 364 CB ASP A 28 172.947 0.164 11.094 1.00 0.00 C ATOM 365 CG ASP A 28 171.528 -0.363 10.987 1.00 0.00 C ATOM 366 OD1 ASP A 28 170.767 0.147 10.137 1.00 0.00 O ATOM 367 OD2 ASP A 28 171.179 -1.286 11.751 1.00 0.00 O ATOM 0 H ASP A 28 175.044 1.481 11.359 1.00 0.00 H new ATOM 0 HA ASP A 28 172.706 1.806 9.720 1.00 0.00 H new ATOM 0 HB2 ASP A 28 173.595 -0.408 10.429 1.00 0.00 H new ATOM 0 HB3 ASP A 28 173.314 0.008 12.108 1.00 0.00 H new ATOM 372 N ASP A 29 170.888 2.581 11.291 1.00 0.00 N ATOM 373 CA ASP A 29 169.905 3.308 12.081 1.00 0.00 C ATOM 374 C ASP A 29 168.569 2.577 12.040 1.00 0.00 C ATOM 375 O ASP A 29 167.518 3.184 11.831 1.00 0.00 O ATOM 376 CB ASP A 29 169.744 4.738 11.561 1.00 0.00 C ATOM 377 CG ASP A 29 169.559 5.744 12.681 1.00 0.00 C ATOM 378 OD1 ASP A 29 169.932 5.428 13.831 1.00 0.00 O ATOM 379 OD2 ASP A 29 169.042 6.847 12.407 1.00 0.00 O ATOM 0 H ASP A 29 170.518 2.183 10.428 1.00 0.00 H new ATOM 0 HA ASP A 29 170.253 3.359 13.113 1.00 0.00 H new ATOM 0 HB2 ASP A 29 170.622 5.009 10.974 1.00 0.00 H new ATOM 0 HB3 ASP A 29 168.886 4.783 10.890 1.00 0.00 H new ATOM 384 N GLY A 30 168.624 1.264 12.236 1.00 0.00 N ATOM 385 CA GLY A 30 167.430 0.457 12.212 1.00 0.00 C ATOM 386 C GLY A 30 166.841 0.339 10.822 1.00 0.00 C ATOM 387 O GLY A 30 165.622 0.254 10.661 1.00 0.00 O ATOM 0 H GLY A 30 169.485 0.746 12.412 1.00 0.00 H new ATOM 0 HA2 GLY A 30 167.660 -0.538 12.592 1.00 0.00 H new ATOM 0 HA3 GLY A 30 166.688 0.891 12.882 1.00 0.00 H new ATOM 391 N PHE A 31 167.705 0.337 9.809 1.00 0.00 N ATOM 392 CA PHE A 31 167.257 0.230 8.427 1.00 0.00 C ATOM 393 C PHE A 31 166.796 -1.182 8.107 1.00 0.00 C ATOM 394 O PHE A 31 166.672 -2.032 8.990 1.00 0.00 O ATOM 395 CB PHE A 31 168.369 0.628 7.451 1.00 0.00 C ATOM 396 CG PHE A 31 169.056 1.916 7.811 1.00 0.00 C ATOM 397 CD1 PHE A 31 168.320 3.031 8.173 1.00 0.00 C ATOM 398 CD2 PHE A 31 170.439 2.011 7.781 1.00 0.00 C ATOM 399 CE1 PHE A 31 168.946 4.217 8.503 1.00 0.00 C ATOM 400 CE2 PHE A 31 171.072 3.195 8.108 1.00 0.00 C ATOM 401 CZ PHE A 31 170.326 4.299 8.470 1.00 0.00 C ATOM 0 H PHE A 31 168.716 0.408 9.921 1.00 0.00 H new ATOM 0 HA PHE A 31 166.418 0.916 8.311 1.00 0.00 H new ATOM 0 HB2 PHE A 31 169.110 -0.171 7.413 1.00 0.00 H new ATOM 0 HB3 PHE A 31 167.947 0.719 6.450 1.00 0.00 H new ATOM 0 HD1 PHE A 31 167.242 2.973 8.198 1.00 0.00 H new ATOM 0 HD2 PHE A 31 171.028 1.151 7.499 1.00 0.00 H new ATOM 0 HE1 PHE A 31 168.359 5.078 8.786 1.00 0.00 H new ATOM 0 HE2 PHE A 31 172.150 3.257 8.080 1.00 0.00 H new ATOM 0 HZ PHE A 31 170.819 5.225 8.727 1.00 0.00 H new ATOM 411 N SER A 32 166.549 -1.417 6.830 1.00 0.00 N ATOM 412 CA SER A 32 166.105 -2.712 6.351 1.00 0.00 C ATOM 413 C SER A 32 166.906 -3.139 5.126 1.00 0.00 C ATOM 414 O SER A 32 167.072 -4.332 4.880 1.00 0.00 O ATOM 415 CB SER A 32 164.610 -2.675 6.020 1.00 0.00 C ATOM 416 OG SER A 32 163.862 -3.428 6.957 1.00 0.00 O ATOM 0 H SER A 32 166.651 -0.715 6.097 1.00 0.00 H new ATOM 0 HA SER A 32 166.271 -3.443 7.142 1.00 0.00 H new ATOM 0 HB2 SER A 32 164.261 -1.643 6.017 1.00 0.00 H new ATOM 0 HB3 SER A 32 164.446 -3.070 5.017 1.00 0.00 H new ATOM 0 HG SER A 32 162.911 -3.387 6.725 1.00 0.00 H new ATOM 422 N LEU A 33 167.412 -2.170 4.356 1.00 0.00 N ATOM 423 CA LEU A 33 168.197 -2.516 3.169 1.00 0.00 C ATOM 424 C LEU A 33 169.400 -1.605 2.989 1.00 0.00 C ATOM 425 O LEU A 33 169.268 -0.387 2.962 1.00 0.00 O ATOM 426 CB LEU A 33 167.358 -2.454 1.895 1.00 0.00 C ATOM 427 CG LEU A 33 167.956 -3.213 0.707 1.00 0.00 C ATOM 428 CD1 LEU A 33 167.551 -4.677 0.733 1.00 0.00 C ATOM 429 CD2 LEU A 33 167.547 -2.565 -0.607 1.00 0.00 C ATOM 0 H LEU A 33 167.297 -1.171 4.526 1.00 0.00 H new ATOM 0 HA LEU A 33 168.540 -3.537 3.335 1.00 0.00 H new ATOM 0 HB2 LEU A 33 166.368 -2.857 2.107 1.00 0.00 H new ATOM 0 HB3 LEU A 33 167.224 -1.410 1.613 1.00 0.00 H new ATOM 0 HG LEU A 33 169.042 -3.164 0.790 1.00 0.00 H new ATOM 0 HD11 LEU A 33 167.990 -5.191 -0.122 1.00 0.00 H new ATOM 0 HD12 LEU A 33 167.907 -5.137 1.655 1.00 0.00 H new ATOM 0 HD13 LEU A 33 166.465 -4.755 0.685 1.00 0.00 H new ATOM 0 HD21 LEU A 33 167.983 -3.120 -1.438 1.00 0.00 H new ATOM 0 HD22 LEU A 33 166.461 -2.574 -0.695 1.00 0.00 H new ATOM 0 HD23 LEU A 33 167.904 -1.535 -0.632 1.00 0.00 H new ATOM 441 N PHE A 34 170.568 -2.219 2.845 1.00 0.00 N ATOM 442 CA PHE A 34 171.807 -1.494 2.637 1.00 0.00 C ATOM 443 C PHE A 34 172.418 -1.874 1.288 1.00 0.00 C ATOM 444 O PHE A 34 173.140 -2.866 1.182 1.00 0.00 O ATOM 445 CB PHE A 34 172.774 -1.818 3.770 1.00 0.00 C ATOM 446 CG PHE A 34 174.208 -1.464 3.478 1.00 0.00 C ATOM 447 CD1 PHE A 34 174.526 -0.303 2.792 1.00 0.00 C ATOM 448 CD2 PHE A 34 175.236 -2.300 3.884 1.00 0.00 C ATOM 449 CE1 PHE A 34 175.841 0.019 2.517 1.00 0.00 C ATOM 450 CE2 PHE A 34 176.554 -1.985 3.612 1.00 0.00 C ATOM 451 CZ PHE A 34 176.857 -0.824 2.927 1.00 0.00 C ATOM 0 H PHE A 34 170.679 -3.233 2.870 1.00 0.00 H new ATOM 0 HA PHE A 34 171.607 -0.423 2.632 1.00 0.00 H new ATOM 0 HB2 PHE A 34 172.456 -1.287 4.667 1.00 0.00 H new ATOM 0 HB3 PHE A 34 172.712 -2.883 3.992 1.00 0.00 H new ATOM 0 HD1 PHE A 34 173.736 0.358 2.468 1.00 0.00 H new ATOM 0 HD2 PHE A 34 175.004 -3.209 4.420 1.00 0.00 H new ATOM 0 HE1 PHE A 34 176.075 0.928 1.983 1.00 0.00 H new ATOM 0 HE2 PHE A 34 177.346 -2.645 3.934 1.00 0.00 H new ATOM 0 HZ PHE A 34 177.886 -0.575 2.712 1.00 0.00 H new ATOM 461 N ALA A 35 172.121 -1.085 0.262 1.00 0.00 N ATOM 462 CA ALA A 35 172.638 -1.342 -1.076 1.00 0.00 C ATOM 463 C ALA A 35 173.805 -0.420 -1.396 1.00 0.00 C ATOM 464 O ALA A 35 173.643 0.798 -1.486 1.00 0.00 O ATOM 465 CB ALA A 35 171.532 -1.180 -2.109 1.00 0.00 C ATOM 0 H ALA A 35 171.524 -0.261 0.332 1.00 0.00 H new ATOM 0 HA ALA A 35 173.001 -2.369 -1.110 1.00 0.00 H new ATOM 0 HB1 ALA A 35 171.932 -1.375 -3.104 1.00 0.00 H new ATOM 0 HB2 ALA A 35 170.729 -1.886 -1.896 1.00 0.00 H new ATOM 0 HB3 ALA A 35 171.142 -0.163 -2.068 1.00 0.00 H new ATOM 471 N PHE A 36 174.984 -1.005 -1.564 1.00 0.00 N ATOM 472 CA PHE A 36 176.180 -0.235 -1.870 1.00 0.00 C ATOM 473 C PHE A 36 176.582 -0.408 -3.331 1.00 0.00 C ATOM 474 O PHE A 36 176.743 -1.529 -3.810 1.00 0.00 O ATOM 475 CB PHE A 36 177.331 -0.661 -0.955 1.00 0.00 C ATOM 476 CG PHE A 36 178.622 0.053 -1.234 1.00 0.00 C ATOM 477 CD1 PHE A 36 178.673 1.438 -1.258 1.00 0.00 C ATOM 478 CD2 PHE A 36 179.786 -0.660 -1.472 1.00 0.00 C ATOM 479 CE1 PHE A 36 179.860 2.097 -1.514 1.00 0.00 C ATOM 480 CE2 PHE A 36 180.975 -0.008 -1.728 1.00 0.00 C ATOM 481 CZ PHE A 36 181.013 1.373 -1.749 1.00 0.00 C ATOM 0 H PHE A 36 175.136 -2.011 -1.493 1.00 0.00 H new ATOM 0 HA PHE A 36 175.959 0.818 -1.699 1.00 0.00 H new ATOM 0 HB2 PHE A 36 177.044 -0.482 0.081 1.00 0.00 H new ATOM 0 HB3 PHE A 36 177.490 -1.734 -1.061 1.00 0.00 H new ATOM 0 HD1 PHE A 36 177.775 2.009 -1.074 1.00 0.00 H new ATOM 0 HD2 PHE A 36 179.762 -1.740 -1.457 1.00 0.00 H new ATOM 0 HE1 PHE A 36 179.887 3.177 -1.530 1.00 0.00 H new ATOM 0 HE2 PHE A 36 181.875 -0.576 -1.912 1.00 0.00 H new ATOM 0 HZ PHE A 36 181.942 1.886 -1.949 1.00 0.00 H new ATOM 491 N HIS A 37 176.741 0.712 -4.030 1.00 0.00 N ATOM 492 CA HIS A 37 177.125 0.714 -5.425 1.00 0.00 C ATOM 493 C HIS A 37 178.438 1.473 -5.589 1.00 0.00 C ATOM 494 O HIS A 37 178.547 2.613 -5.137 1.00 0.00 O ATOM 495 CB HIS A 37 176.032 1.395 -6.235 1.00 0.00 C ATOM 496 CG HIS A 37 175.291 0.477 -7.158 1.00 0.00 C ATOM 497 ND1 HIS A 37 175.248 -0.891 -6.983 1.00 0.00 N ATOM 498 CD2 HIS A 37 174.542 0.736 -8.256 1.00 0.00 C ATOM 499 CE1 HIS A 37 174.507 -1.432 -7.933 1.00 0.00 C ATOM 500 NE2 HIS A 37 174.065 -0.465 -8.718 1.00 0.00 N ATOM 0 H HIS A 37 176.605 1.643 -3.637 1.00 0.00 H new ATOM 0 HA HIS A 37 177.258 -0.309 -5.776 1.00 0.00 H new ATOM 0 HB2 HIS A 37 175.320 1.855 -5.550 1.00 0.00 H new ATOM 0 HB3 HIS A 37 176.477 2.200 -6.820 1.00 0.00 H new ATOM 0 HD2 HIS A 37 174.355 1.708 -8.688 1.00 0.00 H new ATOM 0 HE1 HIS A 37 174.298 -2.485 -8.049 1.00 0.00 H new ATOM 0 HE2 HIS A 37 173.467 -0.591 -9.534 1.00 0.00 H new ATOM 509 N GLY A 38 179.441 0.859 -6.216 1.00 0.00 N ATOM 510 CA GLY A 38 180.709 1.552 -6.371 1.00 0.00 C ATOM 511 C GLY A 38 181.528 1.082 -7.554 1.00 0.00 C ATOM 512 O GLY A 38 181.726 -0.115 -7.751 1.00 0.00 O ATOM 0 H GLY A 38 179.401 -0.081 -6.610 1.00 0.00 H new ATOM 0 HA2 GLY A 38 180.517 2.620 -6.477 1.00 0.00 H new ATOM 0 HA3 GLY A 38 181.296 1.422 -5.462 1.00 0.00 H new ATOM 516 N LYS A 39 182.025 2.043 -8.329 1.00 0.00 N ATOM 517 CA LYS A 39 182.849 1.744 -9.492 1.00 0.00 C ATOM 518 C LYS A 39 184.300 2.131 -9.229 1.00 0.00 C ATOM 519 O LYS A 39 184.574 3.150 -8.592 1.00 0.00 O ATOM 520 CB LYS A 39 182.326 2.485 -10.724 1.00 0.00 C ATOM 521 CG LYS A 39 183.065 2.135 -12.004 1.00 0.00 C ATOM 522 CD LYS A 39 183.019 0.641 -12.286 1.00 0.00 C ATOM 523 CE LYS A 39 183.805 0.286 -13.539 1.00 0.00 C ATOM 524 NZ LYS A 39 183.010 0.520 -14.776 1.00 0.00 N ATOM 0 H LYS A 39 181.869 3.038 -8.170 1.00 0.00 H new ATOM 0 HA LYS A 39 182.799 0.672 -9.680 1.00 0.00 H new ATOM 0 HB2 LYS A 39 181.268 2.258 -10.852 1.00 0.00 H new ATOM 0 HB3 LYS A 39 182.403 3.559 -10.552 1.00 0.00 H new ATOM 0 HG2 LYS A 39 182.623 2.677 -12.840 1.00 0.00 H new ATOM 0 HG3 LYS A 39 184.103 2.459 -11.926 1.00 0.00 H new ATOM 0 HD2 LYS A 39 183.425 0.096 -11.434 1.00 0.00 H new ATOM 0 HD3 LYS A 39 181.983 0.323 -12.403 1.00 0.00 H new ATOM 0 HE2 LYS A 39 184.718 0.880 -13.576 1.00 0.00 H new ATOM 0 HE3 LYS A 39 184.108 -0.760 -13.494 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 183.284 -0.173 -15.501 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 181.997 0.416 -14.563 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 183.192 1.481 -15.129 1.00 0.00 H new ATOM 538 N LEU A 40 185.226 1.312 -9.715 1.00 0.00 N ATOM 539 CA LEU A 40 186.648 1.569 -9.526 1.00 0.00 C ATOM 540 C LEU A 40 187.217 2.367 -10.696 1.00 0.00 C ATOM 541 O LEU A 40 187.220 1.901 -11.836 1.00 0.00 O ATOM 542 CB LEU A 40 187.404 0.250 -9.371 1.00 0.00 C ATOM 543 CG LEU A 40 188.909 0.387 -9.139 1.00 0.00 C ATOM 544 CD1 LEU A 40 189.183 1.127 -7.839 1.00 0.00 C ATOM 545 CD2 LEU A 40 189.571 -0.981 -9.124 1.00 0.00 C ATOM 0 H LEU A 40 185.017 0.465 -10.243 1.00 0.00 H new ATOM 0 HA LEU A 40 186.772 2.159 -8.618 1.00 0.00 H new ATOM 0 HB2 LEU A 40 186.972 -0.302 -8.536 1.00 0.00 H new ATOM 0 HB3 LEU A 40 187.244 -0.350 -10.267 1.00 0.00 H new ATOM 0 HG LEU A 40 189.333 0.966 -9.959 1.00 0.00 H new ATOM 0 HD11 LEU A 40 190.259 1.215 -7.690 1.00 0.00 H new ATOM 0 HD12 LEU A 40 188.741 2.122 -7.887 1.00 0.00 H new ATOM 0 HD13 LEU A 40 188.746 0.575 -7.007 1.00 0.00 H new ATOM 0 HD21 LEU A 40 190.642 -0.865 -8.958 1.00 0.00 H new ATOM 0 HD22 LEU A 40 189.143 -1.584 -8.323 1.00 0.00 H new ATOM 0 HD23 LEU A 40 189.404 -1.477 -10.080 1.00 0.00 H new ATOM 557 N ASN A 41 187.697 3.574 -10.406 1.00 0.00 N ATOM 558 CA ASN A 41 188.269 4.440 -11.431 1.00 0.00 C ATOM 559 C ASN A 41 187.213 4.835 -12.460 1.00 0.00 C ATOM 560 O ASN A 41 187.304 4.469 -13.632 1.00 0.00 O ATOM 561 CB ASN A 41 189.441 3.742 -12.126 1.00 0.00 C ATOM 562 CG ASN A 41 190.158 4.649 -13.107 1.00 0.00 C ATOM 563 OD1 ASN A 41 189.804 5.819 -13.260 1.00 0.00 O ATOM 564 ND2 ASN A 41 191.169 4.114 -13.779 1.00 0.00 N ATOM 0 H ASN A 41 187.701 3.974 -9.468 1.00 0.00 H new ATOM 0 HA ASN A 41 188.633 5.345 -10.944 1.00 0.00 H new ATOM 0 HB2 ASN A 41 190.149 3.393 -11.374 1.00 0.00 H new ATOM 0 HB3 ASN A 41 189.074 2.861 -12.652 1.00 0.00 H new ATOM 0 HD21 ASN A 41 191.687 4.676 -14.454 1.00 0.00 H new ATOM 0 HD22 ASN A 41 191.428 3.140 -13.621 1.00 0.00 H new ATOM 571 N GLU A 42 186.211 5.589 -12.010 1.00 0.00 N ATOM 572 CA GLU A 42 185.132 6.047 -12.872 1.00 0.00 C ATOM 573 C GLU A 42 184.054 6.733 -12.044 1.00 0.00 C ATOM 574 O GLU A 42 183.352 6.092 -11.261 1.00 0.00 O ATOM 575 CB GLU A 42 184.516 4.886 -13.658 1.00 0.00 C ATOM 576 CG GLU A 42 183.335 5.304 -14.518 1.00 0.00 C ATOM 577 CD GLU A 42 182.715 4.143 -15.266 1.00 0.00 C ATOM 578 OE1 GLU A 42 183.431 3.501 -16.065 1.00 0.00 O ATOM 579 OE2 GLU A 42 181.514 3.872 -15.055 1.00 0.00 O ATOM 0 H GLU A 42 186.128 5.896 -11.041 1.00 0.00 H new ATOM 0 HA GLU A 42 185.553 6.758 -13.583 1.00 0.00 H new ATOM 0 HB2 GLU A 42 185.281 4.441 -14.294 1.00 0.00 H new ATOM 0 HB3 GLU A 42 184.193 4.114 -12.960 1.00 0.00 H new ATOM 0 HG2 GLU A 42 182.578 5.769 -13.887 1.00 0.00 H new ATOM 0 HG3 GLU A 42 183.661 6.059 -15.234 1.00 0.00 H new ATOM 586 N GLU A 43 183.940 8.041 -12.218 1.00 0.00 N ATOM 587 CA GLU A 43 182.955 8.834 -11.488 1.00 0.00 C ATOM 588 C GLU A 43 181.550 8.272 -11.660 1.00 0.00 C ATOM 589 O GLU A 43 181.362 7.168 -12.172 1.00 0.00 O ATOM 590 CB GLU A 43 182.990 10.290 -11.955 1.00 0.00 C ATOM 591 CG GLU A 43 184.375 10.898 -11.912 1.00 0.00 C ATOM 592 CD GLU A 43 184.412 12.313 -12.457 1.00 0.00 C ATOM 593 OE1 GLU A 43 183.479 12.689 -13.197 1.00 0.00 O ATOM 594 OE2 GLU A 43 185.374 13.045 -12.143 1.00 0.00 O ATOM 0 H GLU A 43 184.519 8.581 -12.861 1.00 0.00 H new ATOM 0 HA GLU A 43 183.214 8.788 -10.430 1.00 0.00 H new ATOM 0 HB2 GLU A 43 182.607 10.347 -12.974 1.00 0.00 H new ATOM 0 HB3 GLU A 43 182.321 10.881 -11.329 1.00 0.00 H new ATOM 0 HG2 GLU A 43 184.734 10.900 -10.883 1.00 0.00 H new ATOM 0 HG3 GLU A 43 185.059 10.274 -12.487 1.00 0.00 H new ATOM 601 N MET A 44 180.564 9.043 -11.222 1.00 0.00 N ATOM 602 CA MET A 44 179.169 8.633 -11.317 1.00 0.00 C ATOM 603 C MET A 44 178.270 9.821 -11.631 1.00 0.00 C ATOM 604 O MET A 44 178.481 10.926 -11.133 1.00 0.00 O ATOM 605 CB MET A 44 178.714 7.977 -10.012 1.00 0.00 C ATOM 606 CG MET A 44 179.796 7.164 -9.323 1.00 0.00 C ATOM 607 SD MET A 44 179.155 6.172 -7.960 1.00 0.00 S ATOM 608 CE MET A 44 178.767 4.632 -8.793 1.00 0.00 C ATOM 0 H MET A 44 180.705 9.959 -10.796 1.00 0.00 H new ATOM 0 HA MET A 44 179.090 7.911 -12.130 1.00 0.00 H new ATOM 0 HB2 MET A 44 178.365 8.752 -9.329 1.00 0.00 H new ATOM 0 HB3 MET A 44 177.863 7.329 -10.220 1.00 0.00 H new ATOM 0 HG2 MET A 44 180.273 6.509 -10.052 1.00 0.00 H new ATOM 0 HG3 MET A 44 180.567 7.837 -8.947 1.00 0.00 H new ATOM 0 HE1 MET A 44 178.548 3.863 -8.052 1.00 0.00 H new ATOM 0 HE2 MET A 44 177.899 4.775 -9.436 1.00 0.00 H new ATOM 0 HE3 MET A 44 179.619 4.321 -9.398 1.00 0.00 H new ATOM 618 N ASP A 45 177.259 9.579 -12.455 1.00 0.00 N ATOM 619 CA ASP A 45 176.311 10.615 -12.835 1.00 0.00 C ATOM 620 C ASP A 45 174.903 10.039 -12.879 1.00 0.00 C ATOM 621 O ASP A 45 174.128 10.313 -13.796 1.00 0.00 O ATOM 622 CB ASP A 45 176.689 11.204 -14.194 1.00 0.00 C ATOM 623 CG ASP A 45 175.960 12.499 -14.489 1.00 0.00 C ATOM 624 OD1 ASP A 45 174.849 12.692 -13.951 1.00 0.00 O ATOM 625 OD2 ASP A 45 176.499 13.321 -15.261 1.00 0.00 O ATOM 0 H ASP A 45 177.075 8.668 -12.875 1.00 0.00 H new ATOM 0 HA ASP A 45 176.341 11.412 -12.092 1.00 0.00 H new ATOM 0 HB2 ASP A 45 177.764 11.381 -14.223 1.00 0.00 H new ATOM 0 HB3 ASP A 45 176.465 10.478 -14.976 1.00 0.00 H new ATOM 630 N GLY A 46 174.596 9.224 -11.878 1.00 0.00 N ATOM 631 CA GLY A 46 173.312 8.589 -11.790 1.00 0.00 C ATOM 632 C GLY A 46 173.381 7.331 -10.953 1.00 0.00 C ATOM 633 O GLY A 46 174.105 7.280 -9.959 1.00 0.00 O ATOM 0 H GLY A 46 175.233 8.994 -11.116 1.00 0.00 H new ATOM 0 HA2 GLY A 46 172.591 9.280 -11.354 1.00 0.00 H new ATOM 0 HA3 GLY A 46 172.955 8.344 -12.790 1.00 0.00 H new ATOM 637 N LEU A 47 172.627 6.315 -11.346 1.00 0.00 N ATOM 638 CA LEU A 47 172.604 5.066 -10.627 1.00 0.00 C ATOM 639 C LEU A 47 173.126 3.927 -11.495 1.00 0.00 C ATOM 640 O LEU A 47 172.353 3.161 -12.069 1.00 0.00 O ATOM 641 CB LEU A 47 171.182 4.797 -10.181 1.00 0.00 C ATOM 642 CG LEU A 47 170.592 5.906 -9.314 1.00 0.00 C ATOM 643 CD1 LEU A 47 169.073 5.889 -9.379 1.00 0.00 C ATOM 644 CD2 LEU A 47 171.074 5.766 -7.879 1.00 0.00 C ATOM 0 H LEU A 47 172.021 6.340 -12.166 1.00 0.00 H new ATOM 0 HA LEU A 47 173.257 5.132 -9.757 1.00 0.00 H new ATOM 0 HB2 LEU A 47 170.554 4.663 -11.061 1.00 0.00 H new ATOM 0 HB3 LEU A 47 171.156 3.860 -9.625 1.00 0.00 H new ATOM 0 HG LEU A 47 170.934 6.866 -9.700 1.00 0.00 H new ATOM 0 HD11 LEU A 47 168.673 6.687 -8.754 1.00 0.00 H new ATOM 0 HD12 LEU A 47 168.751 6.039 -10.410 1.00 0.00 H new ATOM 0 HD13 LEU A 47 168.704 4.928 -9.020 1.00 0.00 H new ATOM 0 HD21 LEU A 47 170.646 6.563 -7.272 1.00 0.00 H new ATOM 0 HD22 LEU A 47 170.761 4.800 -7.483 1.00 0.00 H new ATOM 0 HD23 LEU A 47 172.162 5.834 -7.852 1.00 0.00 H new ATOM 656 N GLU A 48 174.448 3.828 -11.587 1.00 0.00 N ATOM 657 CA GLU A 48 175.086 2.789 -12.387 1.00 0.00 C ATOM 658 C GLU A 48 175.585 1.647 -11.507 1.00 0.00 C ATOM 659 O GLU A 48 175.937 1.854 -10.346 1.00 0.00 O ATOM 660 CB GLU A 48 176.247 3.376 -13.191 1.00 0.00 C ATOM 661 CG GLU A 48 175.806 4.126 -14.436 1.00 0.00 C ATOM 662 CD GLU A 48 176.974 4.692 -15.221 1.00 0.00 C ATOM 663 OE1 GLU A 48 177.909 5.226 -14.589 1.00 0.00 O ATOM 664 OE2 GLU A 48 176.952 4.603 -16.465 1.00 0.00 O ATOM 0 H GLU A 48 175.099 4.456 -11.116 1.00 0.00 H new ATOM 0 HA GLU A 48 174.341 2.390 -13.075 1.00 0.00 H new ATOM 0 HB2 GLU A 48 176.816 4.052 -12.552 1.00 0.00 H new ATOM 0 HB3 GLU A 48 176.921 2.570 -13.482 1.00 0.00 H new ATOM 0 HG2 GLU A 48 175.234 3.455 -15.076 1.00 0.00 H new ATOM 0 HG3 GLU A 48 175.138 4.938 -14.149 1.00 0.00 H new ATOM 671 N ALA A 49 175.606 0.443 -12.068 1.00 0.00 N ATOM 672 CA ALA A 49 176.054 -0.733 -11.344 1.00 0.00 C ATOM 673 C ALA A 49 177.477 -0.566 -10.822 1.00 0.00 C ATOM 674 O ALA A 49 177.830 -1.101 -9.772 1.00 0.00 O ATOM 675 CB ALA A 49 175.956 -1.966 -12.231 1.00 0.00 C ATOM 0 H ALA A 49 175.315 0.259 -13.028 1.00 0.00 H new ATOM 0 HA ALA A 49 175.400 -0.861 -10.481 1.00 0.00 H new ATOM 0 HB1 ALA A 49 176.295 -2.841 -11.676 1.00 0.00 H new ATOM 0 HB2 ALA A 49 174.921 -2.111 -12.540 1.00 0.00 H new ATOM 0 HB3 ALA A 49 176.582 -1.831 -13.113 1.00 0.00 H new ATOM 681 N GLY A 50 178.292 0.177 -11.564 1.00 0.00 N ATOM 682 CA GLY A 50 179.669 0.396 -11.161 1.00 0.00 C ATOM 683 C GLY A 50 180.416 -0.905 -10.935 1.00 0.00 C ATOM 684 O GLY A 50 180.811 -1.576 -11.889 1.00 0.00 O ATOM 0 H GLY A 50 178.024 0.631 -12.437 1.00 0.00 H new ATOM 0 HA2 GLY A 50 180.181 0.978 -11.927 1.00 0.00 H new ATOM 0 HA3 GLY A 50 179.688 0.987 -10.245 1.00 0.00 H new ATOM 688 N HIS A 51 180.600 -1.263 -9.671 1.00 0.00 N ATOM 689 CA HIS A 51 181.293 -2.495 -9.316 1.00 0.00 C ATOM 690 C HIS A 51 180.741 -3.063 -8.015 1.00 0.00 C ATOM 691 O HIS A 51 179.947 -4.004 -8.028 1.00 0.00 O ATOM 692 CB HIS A 51 182.800 -2.255 -9.196 1.00 0.00 C ATOM 693 CG HIS A 51 183.616 -3.101 -10.124 1.00 0.00 C ATOM 694 ND1 HIS A 51 183.159 -3.527 -11.353 1.00 0.00 N ATOM 695 CD2 HIS A 51 184.867 -3.604 -9.996 1.00 0.00 C ATOM 696 CE1 HIS A 51 184.091 -4.255 -11.940 1.00 0.00 C ATOM 697 NE2 HIS A 51 185.137 -4.317 -11.138 1.00 0.00 N ATOM 0 H HIS A 51 180.278 -0.716 -8.872 1.00 0.00 H new ATOM 0 HA HIS A 51 181.124 -3.221 -10.111 1.00 0.00 H new ATOM 0 HB2 HIS A 51 183.009 -1.204 -9.396 1.00 0.00 H new ATOM 0 HB3 HIS A 51 183.111 -2.452 -8.170 1.00 0.00 H new ATOM 0 HD1 HIS A 51 182.243 -3.313 -11.748 1.00 0.00 H new ATOM 0 HD2 HIS A 51 185.529 -3.469 -9.153 1.00 0.00 H new ATOM 0 HE1 HIS A 51 184.011 -4.721 -12.911 1.00 0.00 H new ATOM 706 N TRP A 52 181.155 -2.483 -6.895 1.00 0.00 N ATOM 707 CA TRP A 52 180.685 -2.928 -5.590 1.00 0.00 C ATOM 708 C TRP A 52 179.170 -2.802 -5.516 1.00 0.00 C ATOM 709 O TRP A 52 178.650 -1.765 -5.113 1.00 0.00 O ATOM 710 CB TRP A 52 181.340 -2.104 -4.482 1.00 0.00 C ATOM 711 CG TRP A 52 182.815 -2.335 -4.369 1.00 0.00 C ATOM 712 CD1 TRP A 52 183.430 -3.442 -3.863 1.00 0.00 C ATOM 713 CD2 TRP A 52 183.859 -1.441 -4.771 1.00 0.00 C ATOM 714 NE1 TRP A 52 184.794 -3.294 -3.925 1.00 0.00 N ATOM 715 CE2 TRP A 52 185.084 -2.072 -4.479 1.00 0.00 C ATOM 716 CE3 TRP A 52 183.880 -0.170 -5.352 1.00 0.00 C ATOM 717 CZ2 TRP A 52 186.314 -1.473 -4.746 1.00 0.00 C ATOM 718 CZ3 TRP A 52 185.100 0.422 -5.617 1.00 0.00 C ATOM 719 CH2 TRP A 52 186.302 -0.229 -5.314 1.00 0.00 C ATOM 0 H TRP A 52 181.814 -1.705 -6.865 1.00 0.00 H new ATOM 0 HA TRP A 52 180.960 -3.974 -5.452 1.00 0.00 H new ATOM 0 HB2 TRP A 52 181.158 -1.046 -4.669 1.00 0.00 H new ATOM 0 HB3 TRP A 52 180.867 -2.346 -3.530 1.00 0.00 H new ATOM 0 HD1 TRP A 52 182.919 -4.309 -3.471 1.00 0.00 H new ATOM 0 HE1 TRP A 52 185.480 -3.980 -3.611 1.00 0.00 H new ATOM 0 HE3 TRP A 52 182.958 0.341 -5.590 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 187.242 -1.973 -4.513 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 185.127 1.404 -6.066 1.00 0.00 H new ATOM 0 HH2 TRP A 52 187.239 0.261 -5.533 1.00 0.00 H new ATOM 730 N ALA A 53 178.475 -3.860 -5.925 1.00 0.00 N ATOM 731 CA ALA A 53 177.015 -3.877 -5.921 1.00 0.00 C ATOM 732 C ALA A 53 176.479 -4.967 -5.003 1.00 0.00 C ATOM 733 O ALA A 53 176.260 -6.099 -5.435 1.00 0.00 O ATOM 734 CB ALA A 53 176.488 -4.066 -7.336 1.00 0.00 C ATOM 0 H ALA A 53 178.902 -4.721 -6.265 1.00 0.00 H new ATOM 0 HA ALA A 53 176.666 -2.918 -5.539 1.00 0.00 H new ATOM 0 HB1 ALA A 53 175.398 -4.077 -7.320 1.00 0.00 H new ATOM 0 HB2 ALA A 53 176.833 -3.246 -7.965 1.00 0.00 H new ATOM 0 HB3 ALA A 53 176.854 -5.011 -7.738 1.00 0.00 H new ATOM 740 N ARG A 54 176.286 -4.633 -3.736 1.00 0.00 N ATOM 741 CA ARG A 54 175.794 -5.595 -2.766 1.00 0.00 C ATOM 742 C ARG A 54 174.651 -5.021 -1.927 1.00 0.00 C ATOM 743 O ARG A 54 174.786 -3.967 -1.308 1.00 0.00 O ATOM 744 CB ARG A 54 176.952 -6.023 -1.870 1.00 0.00 C ATOM 745 CG ARG A 54 176.553 -6.969 -0.749 1.00 0.00 C ATOM 746 CD ARG A 54 176.375 -8.391 -1.260 1.00 0.00 C ATOM 747 NE ARG A 54 177.643 -8.985 -1.676 1.00 0.00 N ATOM 748 CZ ARG A 54 177.841 -10.295 -1.806 1.00 0.00 C ATOM 749 NH1 ARG A 54 176.857 -11.151 -1.553 1.00 0.00 N ATOM 750 NH2 ARG A 54 179.026 -10.752 -2.190 1.00 0.00 N ATOM 0 H ARG A 54 176.463 -3.703 -3.357 1.00 0.00 H new ATOM 0 HA ARG A 54 175.394 -6.458 -3.299 1.00 0.00 H new ATOM 0 HB2 ARG A 54 177.713 -6.505 -2.484 1.00 0.00 H new ATOM 0 HB3 ARG A 54 177.409 -5.134 -1.435 1.00 0.00 H new ATOM 0 HG2 ARG A 54 177.315 -6.954 0.031 1.00 0.00 H new ATOM 0 HG3 ARG A 54 175.624 -6.625 -0.294 1.00 0.00 H new ATOM 0 HD2 ARG A 54 175.927 -9.004 -0.478 1.00 0.00 H new ATOM 0 HD3 ARG A 54 175.682 -8.390 -2.101 1.00 0.00 H new ATOM 0 HE ARG A 54 178.423 -8.359 -1.879 1.00 0.00 H new ATOM 0 HH11 ARG A 54 175.944 -10.806 -1.257 1.00 0.00 H new ATOM 0 HH12 ARG A 54 177.015 -12.154 -1.654 1.00 0.00 H new ATOM 0 HH21 ARG A 54 179.785 -10.100 -2.386 1.00 0.00 H new ATOM 0 HH22 ARG A 54 179.178 -11.756 -2.290 1.00 0.00 H new ATOM 764 N ASP A 55 173.525 -5.736 -1.910 1.00 0.00 N ATOM 765 CA ASP A 55 172.353 -5.316 -1.145 1.00 0.00 C ATOM 766 C ASP A 55 172.195 -6.177 0.103 1.00 0.00 C ATOM 767 O ASP A 55 171.599 -7.254 0.054 1.00 0.00 O ATOM 768 CB ASP A 55 171.090 -5.417 -2.003 1.00 0.00 C ATOM 769 CG ASP A 55 170.040 -4.403 -1.599 1.00 0.00 C ATOM 770 OD1 ASP A 55 170.405 -3.396 -0.957 1.00 0.00 O ATOM 771 OD2 ASP A 55 168.853 -4.615 -1.926 1.00 0.00 O ATOM 0 H ASP A 55 173.401 -6.611 -2.419 1.00 0.00 H new ATOM 0 HA ASP A 55 172.497 -4.278 -0.845 1.00 0.00 H new ATOM 0 HB2 ASP A 55 171.352 -5.268 -3.051 1.00 0.00 H new ATOM 0 HB3 ASP A 55 170.674 -6.421 -1.918 1.00 0.00 H new ATOM 776 N ILE A 56 172.733 -5.702 1.221 1.00 0.00 N ATOM 777 CA ILE A 56 172.652 -6.438 2.478 1.00 0.00 C ATOM 778 C ILE A 56 171.305 -6.216 3.160 1.00 0.00 C ATOM 779 O ILE A 56 170.720 -5.139 3.064 1.00 0.00 O ATOM 780 CB ILE A 56 173.780 -6.026 3.446 1.00 0.00 C ATOM 781 CG1 ILE A 56 175.117 -5.949 2.705 1.00 0.00 C ATOM 782 CG2 ILE A 56 173.866 -7.010 4.606 1.00 0.00 C ATOM 783 CD1 ILE A 56 176.263 -5.479 3.575 1.00 0.00 C ATOM 0 H ILE A 56 173.229 -4.813 1.283 1.00 0.00 H new ATOM 0 HA ILE A 56 172.762 -7.494 2.233 1.00 0.00 H new ATOM 0 HB ILE A 56 173.553 -5.038 3.847 1.00 0.00 H new ATOM 0 HG12 ILE A 56 175.357 -6.933 2.302 1.00 0.00 H new ATOM 0 HG13 ILE A 56 175.015 -5.273 1.856 1.00 0.00 H new ATOM 0 HG21 ILE A 56 174.666 -6.707 5.281 1.00 0.00 H new ATOM 0 HG22 ILE A 56 172.919 -7.019 5.146 1.00 0.00 H new ATOM 0 HG23 ILE A 56 174.074 -8.008 4.221 1.00 0.00 H new ATOM 0 HD11 ILE A 56 177.179 -5.448 2.985 1.00 0.00 H new ATOM 0 HD12 ILE A 56 176.044 -4.482 3.958 1.00 0.00 H new ATOM 0 HD13 ILE A 56 176.392 -6.168 4.410 1.00 0.00 H new ATOM 795 N THR A 57 170.822 -7.246 3.849 1.00 0.00 N ATOM 796 CA THR A 57 169.544 -7.165 4.549 1.00 0.00 C ATOM 797 C THR A 57 169.692 -7.574 6.013 1.00 0.00 C ATOM 798 O THR A 57 168.720 -7.970 6.657 1.00 0.00 O ATOM 799 CB THR A 57 168.508 -8.055 3.862 1.00 0.00 C ATOM 800 OG1 THR A 57 169.120 -9.210 3.319 1.00 0.00 O ATOM 801 CG2 THR A 57 167.768 -7.356 2.741 1.00 0.00 C ATOM 0 H THR A 57 171.295 -8.145 3.937 1.00 0.00 H new ATOM 0 HA THR A 57 169.207 -6.129 4.515 1.00 0.00 H new ATOM 0 HB THR A 57 167.791 -8.318 4.640 1.00 0.00 H new ATOM 0 HG1 THR A 57 168.440 -9.767 2.885 1.00 0.00 H new ATOM 0 HG21 THR A 57 167.048 -8.043 2.296 1.00 0.00 H new ATOM 0 HG22 THR A 57 167.243 -6.487 3.138 1.00 0.00 H new ATOM 0 HG23 THR A 57 168.480 -7.034 1.981 1.00 0.00 H new ATOM 809 N LYS A 58 170.912 -7.474 6.533 1.00 0.00 N ATOM 810 CA LYS A 58 171.183 -7.833 7.921 1.00 0.00 C ATOM 811 C LYS A 58 172.409 -7.087 8.443 1.00 0.00 C ATOM 812 O LYS A 58 173.545 -7.472 8.163 1.00 0.00 O ATOM 813 CB LYS A 58 171.397 -9.341 8.047 1.00 0.00 C ATOM 814 CG LYS A 58 172.311 -9.918 6.977 1.00 0.00 C ATOM 815 CD LYS A 58 172.868 -11.270 7.390 1.00 0.00 C ATOM 816 CE LYS A 58 171.759 -12.285 7.615 1.00 0.00 C ATOM 817 NZ LYS A 58 172.143 -13.643 7.141 1.00 0.00 N ATOM 0 H LYS A 58 171.728 -7.148 6.015 1.00 0.00 H new ATOM 0 HA LYS A 58 170.320 -7.546 8.522 1.00 0.00 H new ATOM 0 HB2 LYS A 58 171.818 -9.559 9.029 1.00 0.00 H new ATOM 0 HB3 LYS A 58 170.430 -9.842 7.996 1.00 0.00 H new ATOM 0 HG2 LYS A 58 171.759 -10.021 6.043 1.00 0.00 H new ATOM 0 HG3 LYS A 58 173.133 -9.227 6.788 1.00 0.00 H new ATOM 0 HD2 LYS A 58 173.546 -11.636 6.619 1.00 0.00 H new ATOM 0 HD3 LYS A 58 173.453 -11.160 8.303 1.00 0.00 H new ATOM 0 HE2 LYS A 58 171.515 -12.327 8.677 1.00 0.00 H new ATOM 0 HE3 LYS A 58 170.859 -11.960 7.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 171.360 -14.305 7.313 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 172.351 -13.609 6.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 172.987 -13.965 7.656 1.00 0.00 H new ATOM 831 N PRO A 59 172.200 -6.001 9.212 1.00 0.00 N ATOM 832 CA PRO A 59 173.300 -5.207 9.766 1.00 0.00 C ATOM 833 C PRO A 59 174.316 -6.060 10.517 1.00 0.00 C ATOM 834 O PRO A 59 174.089 -7.246 10.757 1.00 0.00 O ATOM 835 CB PRO A 59 172.601 -4.251 10.736 1.00 0.00 C ATOM 836 CG PRO A 59 171.207 -4.137 10.223 1.00 0.00 C ATOM 837 CD PRO A 59 170.880 -5.466 9.596 1.00 0.00 C ATOM 0 HA PRO A 59 173.867 -4.707 8.981 1.00 0.00 H new ATOM 0 HB2 PRO A 59 172.617 -4.640 11.754 1.00 0.00 H new ATOM 0 HB3 PRO A 59 173.095 -3.279 10.758 1.00 0.00 H new ATOM 0 HG2 PRO A 59 170.513 -3.906 11.031 1.00 0.00 H new ATOM 0 HG3 PRO A 59 171.126 -3.332 9.493 1.00 0.00 H new ATOM 0 HD2 PRO A 59 170.368 -6.125 10.297 1.00 0.00 H new ATOM 0 HD3 PRO A 59 170.226 -5.352 8.731 1.00 0.00 H new ATOM 845 N LYS A 60 175.427 -5.441 10.897 1.00 0.00 N ATOM 846 CA LYS A 60 176.474 -6.134 11.637 1.00 0.00 C ATOM 847 C LYS A 60 176.607 -5.549 13.038 1.00 0.00 C ATOM 848 O LYS A 60 177.711 -5.372 13.553 1.00 0.00 O ATOM 849 CB LYS A 60 177.811 -6.049 10.894 1.00 0.00 C ATOM 850 CG LYS A 60 177.871 -6.932 9.658 1.00 0.00 C ATOM 851 CD LYS A 60 178.909 -8.036 9.802 1.00 0.00 C ATOM 852 CE LYS A 60 178.304 -9.409 9.549 1.00 0.00 C ATOM 853 NZ LYS A 60 177.915 -10.087 10.817 1.00 0.00 N ATOM 0 H LYS A 60 175.626 -4.459 10.705 1.00 0.00 H new ATOM 0 HA LYS A 60 176.196 -7.185 11.721 1.00 0.00 H new ATOM 0 HB2 LYS A 60 177.991 -5.014 10.602 1.00 0.00 H new ATOM 0 HB3 LYS A 60 178.615 -6.332 11.574 1.00 0.00 H new ATOM 0 HG2 LYS A 60 176.891 -7.375 9.480 1.00 0.00 H new ATOM 0 HG3 LYS A 60 178.108 -6.322 8.786 1.00 0.00 H new ATOM 0 HD2 LYS A 60 179.725 -7.863 9.101 1.00 0.00 H new ATOM 0 HD3 LYS A 60 179.337 -8.005 10.804 1.00 0.00 H new ATOM 0 HE2 LYS A 60 177.428 -9.307 8.908 1.00 0.00 H new ATOM 0 HE3 LYS A 60 179.022 -10.029 9.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 177.507 -11.019 10.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 178.755 -10.207 11.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 177.211 -9.509 11.318 1.00 0.00 H new ATOM 867 N GLU A 61 175.457 -5.258 13.644 1.00 0.00 N ATOM 868 CA GLU A 61 175.390 -4.698 14.995 1.00 0.00 C ATOM 869 C GLU A 61 175.557 -3.191 14.990 1.00 0.00 C ATOM 870 O GLU A 61 176.660 -2.669 15.145 1.00 0.00 O ATOM 871 CB GLU A 61 176.427 -5.345 15.919 1.00 0.00 C ATOM 872 CG GLU A 61 176.111 -5.183 17.395 1.00 0.00 C ATOM 873 CD GLU A 61 176.632 -6.334 18.232 1.00 0.00 C ATOM 874 OE1 GLU A 61 175.988 -7.404 18.239 1.00 0.00 O ATOM 875 OE2 GLU A 61 177.687 -6.166 18.882 1.00 0.00 O ATOM 0 H GLU A 61 174.544 -5.404 13.213 1.00 0.00 H new ATOM 0 HA GLU A 61 174.396 -4.924 15.381 1.00 0.00 H new ATOM 0 HB2 GLU A 61 176.497 -6.407 15.685 1.00 0.00 H new ATOM 0 HB3 GLU A 61 177.405 -4.909 15.715 1.00 0.00 H new ATOM 0 HG2 GLU A 61 176.545 -4.251 17.756 1.00 0.00 H new ATOM 0 HG3 GLU A 61 175.032 -5.103 17.525 1.00 0.00 H new ATOM 882 N GLY A 62 174.439 -2.495 14.805 1.00 0.00 N ATOM 883 CA GLY A 62 174.460 -1.052 14.776 1.00 0.00 C ATOM 884 C GLY A 62 175.140 -0.522 13.536 1.00 0.00 C ATOM 885 O GLY A 62 175.155 0.685 13.298 1.00 0.00 O ATOM 0 H GLY A 62 173.517 -2.912 14.675 1.00 0.00 H new ATOM 0 HA2 GLY A 62 173.439 -0.673 14.820 1.00 0.00 H new ATOM 0 HA3 GLY A 62 174.976 -0.679 15.660 1.00 0.00 H new ATOM 889 N ARG A 63 175.708 -1.425 12.739 1.00 0.00 N ATOM 890 CA ARG A 63 176.393 -1.021 11.516 1.00 0.00 C ATOM 891 C ARG A 63 176.469 -2.165 10.512 1.00 0.00 C ATOM 892 O ARG A 63 176.774 -3.296 10.882 1.00 0.00 O ATOM 893 CB ARG A 63 177.807 -0.530 11.841 1.00 0.00 C ATOM 894 CG ARG A 63 177.914 0.979 11.980 1.00 0.00 C ATOM 895 CD ARG A 63 178.938 1.369 13.034 1.00 0.00 C ATOM 896 NE ARG A 63 179.650 2.594 12.678 1.00 0.00 N ATOM 897 CZ ARG A 63 180.817 2.955 13.209 1.00 0.00 C ATOM 898 NH1 ARG A 63 181.406 2.188 14.118 1.00 0.00 N ATOM 899 NH2 ARG A 63 181.394 4.087 12.830 1.00 0.00 N ATOM 0 H ARG A 63 175.707 -2.430 12.916 1.00 0.00 H new ATOM 0 HA ARG A 63 175.817 -0.212 11.068 1.00 0.00 H new ATOM 0 HB2 ARG A 63 178.139 -0.996 12.769 1.00 0.00 H new ATOM 0 HB3 ARG A 63 178.487 -0.863 11.056 1.00 0.00 H new ATOM 0 HG2 ARG A 63 178.193 1.415 11.021 1.00 0.00 H new ATOM 0 HG3 ARG A 63 176.941 1.391 12.246 1.00 0.00 H new ATOM 0 HD2 ARG A 63 178.438 1.506 13.993 1.00 0.00 H new ATOM 0 HD3 ARG A 63 179.654 0.557 13.162 1.00 0.00 H new ATOM 0 HE ARG A 63 179.229 3.209 11.982 1.00 0.00 H new ATOM 0 HH11 ARG A 63 180.965 1.317 14.413 1.00 0.00 H new ATOM 0 HH12 ARG A 63 182.300 2.470 14.521 1.00 0.00 H new ATOM 0 HH21 ARG A 63 180.944 4.680 12.133 1.00 0.00 H new ATOM 0 HH22 ARG A 63 182.288 4.365 13.236 1.00 0.00 H new ATOM 913 N TRP A 64 176.224 -1.867 9.236 1.00 0.00 N ATOM 914 CA TRP A 64 176.307 -2.880 8.203 1.00 0.00 C ATOM 915 C TRP A 64 177.754 -3.042 7.760 1.00 0.00 C ATOM 916 O TRP A 64 178.557 -2.114 7.874 1.00 0.00 O ATOM 917 CB TRP A 64 175.454 -2.516 6.996 1.00 0.00 C ATOM 918 CG TRP A 64 174.040 -2.136 7.321 1.00 0.00 C ATOM 919 CD1 TRP A 64 173.618 -1.049 8.028 1.00 0.00 C ATOM 920 CD2 TRP A 64 172.854 -2.846 6.933 1.00 0.00 C ATOM 921 NE1 TRP A 64 172.245 -1.039 8.104 1.00 0.00 N ATOM 922 CE2 TRP A 64 171.755 -2.132 7.440 1.00 0.00 C ATOM 923 CE3 TRP A 64 172.617 -4.016 6.206 1.00 0.00 C ATOM 924 CZ2 TRP A 64 170.440 -2.548 7.245 1.00 0.00 C ATOM 925 CZ3 TRP A 64 171.312 -4.427 6.012 1.00 0.00 C ATOM 926 CH2 TRP A 64 170.237 -3.695 6.530 1.00 0.00 C ATOM 0 H TRP A 64 175.969 -0.938 8.902 1.00 0.00 H new ATOM 0 HA TRP A 64 175.933 -3.815 8.620 1.00 0.00 H new ATOM 0 HB2 TRP A 64 175.927 -1.687 6.470 1.00 0.00 H new ATOM 0 HB3 TRP A 64 175.440 -3.362 6.309 1.00 0.00 H new ATOM 0 HD1 TRP A 64 174.267 -0.305 8.465 1.00 0.00 H new ATOM 0 HE1 TRP A 64 171.683 -0.332 8.578 1.00 0.00 H new ATOM 0 HE3 TRP A 64 173.439 -4.589 5.803 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 169.610 -1.984 7.645 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 171.118 -5.329 5.451 1.00 0.00 H new ATOM 0 HH2 TRP A 64 169.229 -4.043 6.362 1.00 0.00 H new ATOM 937 N THR A 65 178.074 -4.221 7.253 1.00 0.00 N ATOM 938 CA THR A 65 179.425 -4.510 6.789 1.00 0.00 C ATOM 939 C THR A 65 179.410 -5.214 5.436 1.00 0.00 C ATOM 940 O THR A 65 178.866 -6.311 5.301 1.00 0.00 O ATOM 941 CB THR A 65 180.165 -5.369 7.815 1.00 0.00 C ATOM 942 OG1 THR A 65 179.924 -4.898 9.130 1.00 0.00 O ATOM 943 CG2 THR A 65 181.664 -5.396 7.603 1.00 0.00 C ATOM 0 H THR A 65 177.418 -4.995 7.151 1.00 0.00 H new ATOM 0 HA THR A 65 179.946 -3.560 6.671 1.00 0.00 H new ATOM 0 HB THR A 65 179.778 -6.379 7.680 1.00 0.00 H new ATOM 0 HG1 THR A 65 180.404 -5.461 9.772 1.00 0.00 H new ATOM 0 HG21 THR A 65 182.128 -6.023 8.364 1.00 0.00 H new ATOM 0 HG22 THR A 65 181.885 -5.801 6.615 1.00 0.00 H new ATOM 0 HG23 THR A 65 182.060 -4.383 7.676 1.00 0.00 H new ATOM 951 N PHE A 66 180.022 -4.584 4.442 1.00 0.00 N ATOM 952 CA PHE A 66 180.094 -5.155 3.102 1.00 0.00 C ATOM 953 C PHE A 66 181.517 -5.621 2.802 1.00 0.00 C ATOM 954 O PHE A 66 182.324 -4.872 2.250 1.00 0.00 O ATOM 955 CB PHE A 66 179.633 -4.129 2.057 1.00 0.00 C ATOM 956 CG PHE A 66 180.040 -4.464 0.649 1.00 0.00 C ATOM 957 CD1 PHE A 66 179.675 -5.672 0.077 1.00 0.00 C ATOM 958 CD2 PHE A 66 180.789 -3.572 -0.100 1.00 0.00 C ATOM 959 CE1 PHE A 66 180.050 -5.984 -1.216 1.00 0.00 C ATOM 960 CE2 PHE A 66 181.168 -3.878 -1.395 1.00 0.00 C ATOM 961 CZ PHE A 66 180.797 -5.086 -1.953 1.00 0.00 C ATOM 0 H PHE A 66 180.477 -3.676 4.538 1.00 0.00 H new ATOM 0 HA PHE A 66 179.429 -6.017 3.054 1.00 0.00 H new ATOM 0 HB2 PHE A 66 178.547 -4.045 2.100 1.00 0.00 H new ATOM 0 HB3 PHE A 66 180.039 -3.152 2.319 1.00 0.00 H new ATOM 0 HD1 PHE A 66 179.091 -6.378 0.648 1.00 0.00 H new ATOM 0 HD2 PHE A 66 181.081 -2.626 0.332 1.00 0.00 H new ATOM 0 HE1 PHE A 66 179.759 -6.929 -1.650 1.00 0.00 H new ATOM 0 HE2 PHE A 66 181.753 -3.174 -1.968 1.00 0.00 H new ATOM 0 HZ PHE A 66 181.091 -5.328 -2.964 1.00 0.00 H new ATOM 971 N ARG A 67 181.818 -6.859 3.178 1.00 0.00 N ATOM 972 CA ARG A 67 183.143 -7.425 2.956 1.00 0.00 C ATOM 973 C ARG A 67 183.209 -8.169 1.625 1.00 0.00 C ATOM 974 O ARG A 67 182.330 -8.971 1.305 1.00 0.00 O ATOM 975 CB ARG A 67 183.516 -8.369 4.102 1.00 0.00 C ATOM 976 CG ARG A 67 184.888 -8.094 4.697 1.00 0.00 C ATOM 977 CD ARG A 67 185.964 -8.944 4.039 1.00 0.00 C ATOM 978 NE ARG A 67 186.724 -9.717 5.018 1.00 0.00 N ATOM 979 CZ ARG A 67 186.301 -10.862 5.552 1.00 0.00 C ATOM 980 NH1 ARG A 67 185.123 -11.366 5.206 1.00 0.00 N ATOM 981 NH2 ARG A 67 187.057 -11.500 6.433 1.00 0.00 N ATOM 0 H ARG A 67 181.162 -7.490 3.638 1.00 0.00 H new ATOM 0 HA ARG A 67 183.858 -6.603 2.923 1.00 0.00 H new ATOM 0 HB2 ARG A 67 182.765 -8.287 4.888 1.00 0.00 H new ATOM 0 HB3 ARG A 67 183.486 -9.396 3.739 1.00 0.00 H new ATOM 0 HG2 ARG A 67 185.133 -7.039 4.576 1.00 0.00 H new ATOM 0 HG3 ARG A 67 184.868 -8.296 5.768 1.00 0.00 H new ATOM 0 HD2 ARG A 67 185.502 -9.622 3.321 1.00 0.00 H new ATOM 0 HD3 ARG A 67 186.643 -8.301 3.479 1.00 0.00 H new ATOM 0 HE ARG A 67 187.633 -9.359 5.310 1.00 0.00 H new ATOM 0 HH11 ARG A 67 184.538 -10.877 4.529 1.00 0.00 H new ATOM 0 HH12 ARG A 67 184.803 -12.243 5.617 1.00 0.00 H new ATOM 0 HH21 ARG A 67 187.962 -11.115 6.702 1.00 0.00 H new ATOM 0 HH22 ARG A 67 186.734 -12.377 6.842 1.00 0.00 H new ATOM 995 N ASP A 68 184.260 -7.901 0.857 1.00 0.00 N ATOM 996 CA ASP A 68 184.449 -8.545 -0.437 1.00 0.00 C ATOM 997 C ASP A 68 185.909 -8.942 -0.629 1.00 0.00 C ATOM 998 O ASP A 68 186.758 -8.098 -0.912 1.00 0.00 O ATOM 999 CB ASP A 68 184.008 -7.611 -1.565 1.00 0.00 C ATOM 1000 CG ASP A 68 183.905 -8.325 -2.899 1.00 0.00 C ATOM 1001 OD1 ASP A 68 184.878 -9.006 -3.286 1.00 0.00 O ATOM 1002 OD2 ASP A 68 182.850 -8.204 -3.559 1.00 0.00 O ATOM 0 H ASP A 68 184.995 -7.241 1.109 1.00 0.00 H new ATOM 0 HA ASP A 68 183.836 -9.446 -0.465 1.00 0.00 H new ATOM 0 HB2 ASP A 68 183.041 -7.174 -1.314 1.00 0.00 H new ATOM 0 HB3 ASP A 68 184.718 -6.788 -1.650 1.00 0.00 H new ATOM 1007 N ARG A 69 186.195 -10.231 -0.464 1.00 0.00 N ATOM 1008 CA ARG A 69 187.555 -10.744 -0.611 1.00 0.00 C ATOM 1009 C ARG A 69 187.852 -11.153 -2.054 1.00 0.00 C ATOM 1010 O ARG A 69 188.747 -11.960 -2.305 1.00 0.00 O ATOM 1011 CB ARG A 69 187.771 -11.939 0.320 1.00 0.00 C ATOM 1012 CG ARG A 69 186.835 -13.104 0.042 1.00 0.00 C ATOM 1013 CD ARG A 69 187.506 -14.437 0.327 1.00 0.00 C ATOM 1014 NE ARG A 69 186.769 -15.557 -0.256 1.00 0.00 N ATOM 1015 CZ ARG A 69 185.679 -16.091 0.290 1.00 0.00 C ATOM 1016 NH1 ARG A 69 185.193 -15.610 1.427 1.00 0.00 N ATOM 1017 NH2 ARG A 69 185.071 -17.109 -0.306 1.00 0.00 N ATOM 0 H ARG A 69 185.502 -10.941 -0.228 1.00 0.00 H new ATOM 0 HA ARG A 69 188.241 -9.941 -0.341 1.00 0.00 H new ATOM 0 HB2 ARG A 69 188.802 -12.281 0.225 1.00 0.00 H new ATOM 0 HB3 ARG A 69 187.637 -11.614 1.352 1.00 0.00 H new ATOM 0 HG2 ARG A 69 185.940 -13.007 0.656 1.00 0.00 H new ATOM 0 HG3 ARG A 69 186.513 -13.073 -0.999 1.00 0.00 H new ATOM 0 HD2 ARG A 69 188.521 -14.424 -0.071 1.00 0.00 H new ATOM 0 HD3 ARG A 69 187.588 -14.579 1.405 1.00 0.00 H new ATOM 0 HE ARG A 69 187.110 -15.952 -1.132 1.00 0.00 H new ATOM 0 HH11 ARG A 69 185.655 -14.826 1.888 1.00 0.00 H new ATOM 0 HH12 ARG A 69 184.357 -16.024 1.840 1.00 0.00 H new ATOM 0 HH21 ARG A 69 185.439 -17.481 -1.181 1.00 0.00 H new ATOM 0 HH22 ARG A 69 184.236 -17.519 0.111 1.00 0.00 H new ATOM 1031 N ASN A 70 187.101 -10.596 -3.000 1.00 0.00 N ATOM 1032 CA ASN A 70 187.295 -10.912 -4.411 1.00 0.00 C ATOM 1033 C ASN A 70 187.326 -9.643 -5.257 1.00 0.00 C ATOM 1034 O ASN A 70 186.746 -9.592 -6.341 1.00 0.00 O ATOM 1035 CB ASN A 70 186.183 -11.842 -4.904 1.00 0.00 C ATOM 1036 CG ASN A 70 186.454 -13.295 -4.568 1.00 0.00 C ATOM 1037 OD1 ASN A 70 185.621 -13.971 -3.965 1.00 0.00 O ATOM 1038 ND2 ASN A 70 187.625 -13.784 -4.959 1.00 0.00 N ATOM 0 H ASN A 70 186.355 -9.926 -2.816 1.00 0.00 H new ATOM 0 HA ASN A 70 188.255 -11.417 -4.515 1.00 0.00 H new ATOM 0 HB2 ASN A 70 185.236 -11.539 -4.458 1.00 0.00 H new ATOM 0 HB3 ASN A 70 186.076 -11.735 -5.983 1.00 0.00 H new ATOM 0 HD21 ASN A 70 187.863 -14.756 -4.762 1.00 0.00 H new ATOM 0 HD22 ASN A 70 188.286 -13.188 -5.457 1.00 0.00 H new ATOM 1045 N ALA A 71 188.011 -8.620 -4.754 1.00 0.00 N ATOM 1046 CA ALA A 71 188.119 -7.351 -5.464 1.00 0.00 C ATOM 1047 C ALA A 71 189.569 -7.044 -5.823 1.00 0.00 C ATOM 1048 O ALA A 71 190.345 -6.591 -4.981 1.00 0.00 O ATOM 1049 CB ALA A 71 187.531 -6.225 -4.626 1.00 0.00 C ATOM 0 H ALA A 71 188.499 -8.646 -3.859 1.00 0.00 H new ATOM 0 HA ALA A 71 187.552 -7.433 -6.391 1.00 0.00 H new ATOM 0 HB1 ALA A 71 187.619 -5.284 -5.169 1.00 0.00 H new ATOM 0 HB2 ALA A 71 186.480 -6.432 -4.425 1.00 0.00 H new ATOM 0 HB3 ALA A 71 188.073 -6.152 -3.683 1.00 0.00 H new ATOM 1055 N LYS A 72 189.928 -7.295 -7.077 1.00 0.00 N ATOM 1056 CA LYS A 72 191.287 -7.045 -7.548 1.00 0.00 C ATOM 1057 C LYS A 72 191.534 -5.550 -7.721 1.00 0.00 C ATOM 1058 O LYS A 72 191.136 -4.957 -8.724 1.00 0.00 O ATOM 1059 CB LYS A 72 191.534 -7.772 -8.870 1.00 0.00 C ATOM 1060 CG LYS A 72 193.000 -7.831 -9.267 1.00 0.00 C ATOM 1061 CD LYS A 72 193.300 -9.057 -10.114 1.00 0.00 C ATOM 1062 CE LYS A 72 194.789 -9.193 -10.390 1.00 0.00 C ATOM 1063 NZ LYS A 72 195.147 -8.720 -11.757 1.00 0.00 N ATOM 0 H LYS A 72 189.298 -7.671 -7.786 1.00 0.00 H new ATOM 0 HA LYS A 72 191.981 -7.426 -6.799 1.00 0.00 H new ATOM 0 HB2 LYS A 72 191.145 -8.788 -8.795 1.00 0.00 H new ATOM 0 HB3 LYS A 72 190.972 -7.273 -9.660 1.00 0.00 H new ATOM 0 HG2 LYS A 72 193.264 -6.931 -9.822 1.00 0.00 H new ATOM 0 HG3 LYS A 72 193.620 -7.846 -8.371 1.00 0.00 H new ATOM 0 HD2 LYS A 72 192.941 -9.950 -9.603 1.00 0.00 H new ATOM 0 HD3 LYS A 72 192.759 -8.990 -11.058 1.00 0.00 H new ATOM 0 HE2 LYS A 72 195.349 -8.621 -9.650 1.00 0.00 H new ATOM 0 HE3 LYS A 72 195.085 -10.236 -10.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 196.171 -8.830 -11.905 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 194.632 -9.282 -12.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 194.888 -7.718 -11.856 1.00 0.00 H new ATOM 1077 N LEU A 73 192.192 -4.947 -6.737 1.00 0.00 N ATOM 1078 CA LEU A 73 192.492 -3.520 -6.778 1.00 0.00 C ATOM 1079 C LEU A 73 193.996 -3.278 -6.678 1.00 0.00 C ATOM 1080 O LEU A 73 194.752 -4.168 -6.287 1.00 0.00 O ATOM 1081 CB LEU A 73 191.772 -2.791 -5.641 1.00 0.00 C ATOM 1082 CG LEU A 73 190.356 -3.289 -5.346 1.00 0.00 C ATOM 1083 CD1 LEU A 73 189.976 -2.993 -3.904 1.00 0.00 C ATOM 1084 CD2 LEU A 73 189.360 -2.651 -6.304 1.00 0.00 C ATOM 0 H LEU A 73 192.528 -5.424 -5.901 1.00 0.00 H new ATOM 0 HA LEU A 73 192.139 -3.128 -7.732 1.00 0.00 H new ATOM 0 HB2 LEU A 73 192.370 -2.884 -4.734 1.00 0.00 H new ATOM 0 HB3 LEU A 73 191.724 -1.729 -5.883 1.00 0.00 H new ATOM 0 HG LEU A 73 190.331 -4.369 -5.491 1.00 0.00 H new ATOM 0 HD11 LEU A 73 188.966 -3.354 -3.712 1.00 0.00 H new ATOM 0 HD12 LEU A 73 190.674 -3.495 -3.234 1.00 0.00 H new ATOM 0 HD13 LEU A 73 190.016 -1.918 -3.731 1.00 0.00 H new ATOM 0 HD21 LEU A 73 188.357 -3.015 -6.082 1.00 0.00 H new ATOM 0 HD22 LEU A 73 189.387 -1.567 -6.188 1.00 0.00 H new ATOM 0 HD23 LEU A 73 189.622 -2.913 -7.329 1.00 0.00 H new ATOM 1096 N LYS A 74 194.422 -2.068 -7.026 1.00 0.00 N ATOM 1097 CA LYS A 74 195.836 -1.712 -6.967 1.00 0.00 C ATOM 1098 C LYS A 74 196.007 -0.305 -6.409 1.00 0.00 C ATOM 1099 O LYS A 74 195.185 0.575 -6.663 1.00 0.00 O ATOM 1100 CB LYS A 74 196.467 -1.805 -8.358 1.00 0.00 C ATOM 1101 CG LYS A 74 196.545 -3.223 -8.899 1.00 0.00 C ATOM 1102 CD LYS A 74 196.370 -3.253 -10.409 1.00 0.00 C ATOM 1103 CE LYS A 74 197.218 -4.342 -11.045 1.00 0.00 C ATOM 1104 NZ LYS A 74 196.853 -5.695 -10.544 1.00 0.00 N ATOM 0 H LYS A 74 193.811 -1.319 -7.351 1.00 0.00 H new ATOM 0 HA LYS A 74 196.341 -2.415 -6.305 1.00 0.00 H new ATOM 0 HB2 LYS A 74 195.890 -1.192 -9.051 1.00 0.00 H new ATOM 0 HB3 LYS A 74 197.472 -1.384 -8.321 1.00 0.00 H new ATOM 0 HG2 LYS A 74 197.507 -3.662 -8.634 1.00 0.00 H new ATOM 0 HG3 LYS A 74 195.775 -3.835 -8.430 1.00 0.00 H new ATOM 0 HD2 LYS A 74 195.320 -3.419 -10.652 1.00 0.00 H new ATOM 0 HD3 LYS A 74 196.645 -2.285 -10.828 1.00 0.00 H new ATOM 0 HE2 LYS A 74 197.096 -4.311 -12.128 1.00 0.00 H new ATOM 0 HE3 LYS A 74 198.271 -4.150 -10.837 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 197.356 -6.418 -11.097 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 197.120 -5.778 -9.542 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 195.827 -5.836 -10.642 1.00 0.00 H new ATOM 1118 N LEU A 75 197.071 -0.095 -5.640 1.00 0.00 N ATOM 1119 CA LEU A 75 197.320 1.210 -5.050 1.00 0.00 C ATOM 1120 C LEU A 75 197.540 2.258 -6.133 1.00 0.00 C ATOM 1121 O LEU A 75 198.365 2.087 -7.030 1.00 0.00 O ATOM 1122 CB LEU A 75 198.489 1.141 -4.048 1.00 0.00 C ATOM 1123 CG LEU A 75 199.833 1.765 -4.459 1.00 0.00 C ATOM 1124 CD1 LEU A 75 199.699 3.252 -4.771 1.00 0.00 C ATOM 1125 CD2 LEU A 75 200.838 1.559 -3.341 1.00 0.00 C ATOM 0 H LEU A 75 197.767 -0.806 -5.414 1.00 0.00 H new ATOM 0 HA LEU A 75 196.438 1.517 -4.487 1.00 0.00 H new ATOM 0 HB2 LEU A 75 198.166 1.623 -3.125 1.00 0.00 H new ATOM 0 HB3 LEU A 75 198.666 0.091 -3.814 1.00 0.00 H new ATOM 0 HG LEU A 75 200.174 1.272 -5.369 1.00 0.00 H new ATOM 0 HD11 LEU A 75 200.671 3.653 -5.057 1.00 0.00 H new ATOM 0 HD12 LEU A 75 198.994 3.390 -5.591 1.00 0.00 H new ATOM 0 HD13 LEU A 75 199.335 3.778 -3.888 1.00 0.00 H new ATOM 0 HD21 LEU A 75 201.794 1.999 -3.625 1.00 0.00 H new ATOM 0 HD22 LEU A 75 200.474 2.038 -2.432 1.00 0.00 H new ATOM 0 HD23 LEU A 75 200.969 0.492 -3.161 1.00 0.00 H new ATOM 1137 N GLY A 76 196.770 3.335 -6.042 1.00 0.00 N ATOM 1138 CA GLY A 76 196.853 4.402 -7.015 1.00 0.00 C ATOM 1139 C GLY A 76 195.500 4.698 -7.625 1.00 0.00 C ATOM 1140 O GLY A 76 195.208 5.834 -7.999 1.00 0.00 O ATOM 0 H GLY A 76 196.084 3.487 -5.303 1.00 0.00 H new ATOM 0 HA2 GLY A 76 197.244 5.301 -6.539 1.00 0.00 H new ATOM 0 HA3 GLY A 76 197.556 4.126 -7.801 1.00 0.00 H new ATOM 1144 N ASP A 77 194.674 3.661 -7.723 1.00 0.00 N ATOM 1145 CA ASP A 77 193.345 3.784 -8.285 1.00 0.00 C ATOM 1146 C ASP A 77 192.411 4.518 -7.326 1.00 0.00 C ATOM 1147 O ASP A 77 192.570 4.444 -6.105 1.00 0.00 O ATOM 1148 CB ASP A 77 192.786 2.398 -8.617 1.00 0.00 C ATOM 1149 CG ASP A 77 191.560 2.462 -9.507 1.00 0.00 C ATOM 1150 OD1 ASP A 77 190.573 3.116 -9.112 1.00 0.00 O ATOM 1151 OD2 ASP A 77 191.589 1.861 -10.600 1.00 0.00 O ATOM 0 H ASP A 77 194.911 2.718 -7.415 1.00 0.00 H new ATOM 0 HA ASP A 77 193.413 4.369 -9.202 1.00 0.00 H new ATOM 0 HB2 ASP A 77 193.558 1.807 -9.110 1.00 0.00 H new ATOM 0 HB3 ASP A 77 192.532 1.881 -7.691 1.00 0.00 H new ATOM 1156 N LYS A 78 191.438 5.229 -7.888 1.00 0.00 N ATOM 1157 CA LYS A 78 190.477 5.982 -7.091 1.00 0.00 C ATOM 1158 C LYS A 78 189.146 5.239 -7.002 1.00 0.00 C ATOM 1159 O LYS A 78 188.889 4.307 -7.765 1.00 0.00 O ATOM 1160 CB LYS A 78 190.262 7.368 -7.702 1.00 0.00 C ATOM 1161 CG LYS A 78 189.912 8.441 -6.684 1.00 0.00 C ATOM 1162 CD LYS A 78 191.027 8.633 -5.667 1.00 0.00 C ATOM 1163 CE LYS A 78 191.713 9.979 -5.835 1.00 0.00 C ATOM 1164 NZ LYS A 78 191.207 10.985 -4.862 1.00 0.00 N ATOM 0 H LYS A 78 191.295 5.299 -8.895 1.00 0.00 H new ATOM 0 HA LYS A 78 190.878 6.092 -6.083 1.00 0.00 H new ATOM 0 HB2 LYS A 78 191.167 7.665 -8.232 1.00 0.00 H new ATOM 0 HB3 LYS A 78 189.464 7.309 -8.442 1.00 0.00 H new ATOM 0 HG2 LYS A 78 189.722 9.383 -7.198 1.00 0.00 H new ATOM 0 HG3 LYS A 78 188.991 8.168 -6.168 1.00 0.00 H new ATOM 0 HD2 LYS A 78 190.618 8.556 -4.659 1.00 0.00 H new ATOM 0 HD3 LYS A 78 191.761 7.834 -5.776 1.00 0.00 H new ATOM 0 HE2 LYS A 78 192.788 9.857 -5.705 1.00 0.00 H new ATOM 0 HE3 LYS A 78 191.554 10.343 -6.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 191.161 11.918 -5.319 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 190.257 10.710 -4.541 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 191.849 11.031 -4.045 1.00 0.00 H new ATOM 1178 N ILE A 79 188.312 5.649 -6.056 1.00 0.00 N ATOM 1179 CA ILE A 79 187.013 5.019 -5.845 1.00 0.00 C ATOM 1180 C ILE A 79 185.857 6.000 -6.048 1.00 0.00 C ATOM 1181 O ILE A 79 185.970 7.187 -5.745 1.00 0.00 O ATOM 1182 CB ILE A 79 186.915 4.366 -4.455 1.00 0.00 C ATOM 1183 CG1 ILE A 79 187.869 3.172 -4.376 1.00 0.00 C ATOM 1184 CG2 ILE A 79 185.487 3.924 -4.163 1.00 0.00 C ATOM 1185 CD1 ILE A 79 189.094 3.434 -3.535 1.00 0.00 C ATOM 0 H ILE A 79 188.512 6.420 -5.418 1.00 0.00 H new ATOM 0 HA ILE A 79 186.928 4.237 -6.599 1.00 0.00 H new ATOM 0 HB ILE A 79 187.200 5.102 -3.703 1.00 0.00 H new ATOM 0 HG12 ILE A 79 187.333 2.316 -3.966 1.00 0.00 H new ATOM 0 HG13 ILE A 79 188.182 2.900 -5.384 1.00 0.00 H new ATOM 0 HG21 ILE A 79 185.443 3.465 -3.175 1.00 0.00 H new ATOM 0 HG22 ILE A 79 184.825 4.790 -4.191 1.00 0.00 H new ATOM 0 HG23 ILE A 79 185.170 3.200 -4.914 1.00 0.00 H new ATOM 0 HD11 ILE A 79 189.725 2.545 -3.524 1.00 0.00 H new ATOM 0 HD12 ILE A 79 189.653 4.270 -3.956 1.00 0.00 H new ATOM 0 HD13 ILE A 79 188.791 3.677 -2.516 1.00 0.00 H new ATOM 1197 N TYR A 80 184.738 5.473 -6.529 1.00 0.00 N ATOM 1198 CA TYR A 80 183.530 6.262 -6.746 1.00 0.00 C ATOM 1199 C TYR A 80 182.315 5.397 -6.432 1.00 0.00 C ATOM 1200 O TYR A 80 182.192 4.293 -6.965 1.00 0.00 O ATOM 1201 CB TYR A 80 183.467 6.770 -8.187 1.00 0.00 C ATOM 1202 CG TYR A 80 184.412 7.918 -8.462 1.00 0.00 C ATOM 1203 CD1 TYR A 80 184.059 9.224 -8.145 1.00 0.00 C ATOM 1204 CD2 TYR A 80 185.657 7.696 -9.036 1.00 0.00 C ATOM 1205 CE1 TYR A 80 184.919 10.276 -8.394 1.00 0.00 C ATOM 1206 CE2 TYR A 80 186.523 8.743 -9.290 1.00 0.00 C ATOM 1207 CZ TYR A 80 186.149 10.031 -8.966 1.00 0.00 C ATOM 1208 OH TYR A 80 187.009 11.076 -9.215 1.00 0.00 O ATOM 0 H TYR A 80 184.641 4.489 -6.779 1.00 0.00 H new ATOM 0 HA TYR A 80 183.542 7.131 -6.088 1.00 0.00 H new ATOM 0 HB2 TYR A 80 183.699 5.948 -8.864 1.00 0.00 H new ATOM 0 HB3 TYR A 80 182.448 7.087 -8.408 1.00 0.00 H new ATOM 0 HD1 TYR A 80 183.096 9.420 -7.696 1.00 0.00 H new ATOM 0 HD2 TYR A 80 185.953 6.689 -9.288 1.00 0.00 H new ATOM 0 HE1 TYR A 80 184.629 11.285 -8.142 1.00 0.00 H new ATOM 0 HE2 TYR A 80 187.487 8.554 -9.739 1.00 0.00 H new ATOM 0 HH TYR A 80 187.833 10.732 -9.619 1.00 0.00 H new ATOM 1218 N PHE A 81 181.432 5.863 -5.551 1.00 0.00 N ATOM 1219 CA PHE A 81 180.271 5.053 -5.190 1.00 0.00 C ATOM 1220 C PHE A 81 179.110 5.863 -4.637 1.00 0.00 C ATOM 1221 O PHE A 81 179.169 7.085 -4.504 1.00 0.00 O ATOM 1222 CB PHE A 81 180.666 4.015 -4.140 1.00 0.00 C ATOM 1223 CG PHE A 81 181.558 4.558 -3.059 1.00 0.00 C ATOM 1224 CD1 PHE A 81 181.130 5.600 -2.250 1.00 0.00 C ATOM 1225 CD2 PHE A 81 182.821 4.028 -2.849 1.00 0.00 C ATOM 1226 CE1 PHE A 81 181.945 6.103 -1.254 1.00 0.00 C ATOM 1227 CE2 PHE A 81 183.640 4.528 -1.854 1.00 0.00 C ATOM 1228 CZ PHE A 81 183.202 5.566 -1.056 1.00 0.00 C ATOM 0 H PHE A 81 181.493 6.769 -5.086 1.00 0.00 H new ATOM 0 HA PHE A 81 179.938 4.583 -6.115 1.00 0.00 H new ATOM 0 HB2 PHE A 81 179.762 3.610 -3.684 1.00 0.00 H new ATOM 0 HB3 PHE A 81 181.172 3.186 -4.634 1.00 0.00 H new ATOM 0 HD1 PHE A 81 180.148 6.023 -2.400 1.00 0.00 H new ATOM 0 HD2 PHE A 81 183.169 3.215 -3.469 1.00 0.00 H new ATOM 0 HE1 PHE A 81 181.600 6.915 -0.631 1.00 0.00 H new ATOM 0 HE2 PHE A 81 184.623 4.107 -1.701 1.00 0.00 H new ATOM 0 HZ PHE A 81 183.841 5.957 -0.278 1.00 0.00 H new ATOM 1238 N TRP A 82 178.068 5.121 -4.283 1.00 0.00 N ATOM 1239 CA TRP A 82 176.860 5.676 -3.691 1.00 0.00 C ATOM 1240 C TRP A 82 176.169 4.587 -2.882 1.00 0.00 C ATOM 1241 O TRP A 82 176.053 3.449 -3.338 1.00 0.00 O ATOM 1242 CB TRP A 82 175.921 6.253 -4.758 1.00 0.00 C ATOM 1243 CG TRP A 82 175.343 5.237 -5.695 1.00 0.00 C ATOM 1244 CD1 TRP A 82 175.937 4.717 -6.806 1.00 0.00 C ATOM 1245 CD2 TRP A 82 174.045 4.637 -5.614 1.00 0.00 C ATOM 1246 NE1 TRP A 82 175.091 3.828 -7.421 1.00 0.00 N ATOM 1247 CE2 TRP A 82 173.924 3.758 -6.707 1.00 0.00 C ATOM 1248 CE3 TRP A 82 172.975 4.754 -4.723 1.00 0.00 C ATOM 1249 CZ2 TRP A 82 172.775 3.003 -6.933 1.00 0.00 C ATOM 1250 CZ3 TRP A 82 171.836 4.004 -4.946 1.00 0.00 C ATOM 1251 CH2 TRP A 82 171.744 3.138 -6.044 1.00 0.00 C ATOM 0 H TRP A 82 178.039 4.108 -4.400 1.00 0.00 H new ATOM 0 HA TRP A 82 177.131 6.503 -3.035 1.00 0.00 H new ATOM 0 HB2 TRP A 82 175.104 6.775 -4.260 1.00 0.00 H new ATOM 0 HB3 TRP A 82 176.466 6.996 -5.340 1.00 0.00 H new ATOM 0 HD1 TRP A 82 176.929 4.968 -7.152 1.00 0.00 H new ATOM 0 HE1 TRP A 82 175.298 3.304 -8.272 1.00 0.00 H new ATOM 0 HE3 TRP A 82 173.037 5.419 -3.874 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 172.701 2.336 -7.779 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 171.003 4.087 -4.263 1.00 0.00 H new ATOM 0 HH2 TRP A 82 170.840 2.565 -6.191 1.00 0.00 H new ATOM 1262 N THR A 83 175.733 4.918 -1.671 1.00 0.00 N ATOM 1263 CA THR A 83 175.084 3.925 -0.813 1.00 0.00 C ATOM 1264 C THR A 83 173.575 4.068 -0.864 1.00 0.00 C ATOM 1265 O THR A 83 173.072 5.098 -1.277 1.00 0.00 O ATOM 1266 CB THR A 83 175.578 4.061 0.629 1.00 0.00 C ATOM 1267 OG1 THR A 83 176.093 5.357 0.859 1.00 0.00 O ATOM 1268 CG2 THR A 83 176.664 3.071 0.985 1.00 0.00 C ATOM 0 H THR A 83 175.814 5.850 -1.264 1.00 0.00 H new ATOM 0 HA THR A 83 175.347 2.934 -1.184 1.00 0.00 H new ATOM 0 HB THR A 83 174.707 3.862 1.253 1.00 0.00 H new ATOM 0 HG1 THR A 83 176.402 5.426 1.786 1.00 0.00 H new ATOM 0 HG21 THR A 83 176.969 3.222 2.021 1.00 0.00 H new ATOM 0 HG22 THR A 83 176.286 2.056 0.862 1.00 0.00 H new ATOM 0 HG23 THR A 83 177.522 3.220 0.329 1.00 0.00 H new ATOM 1276 N TYR A 84 172.857 3.020 -0.462 1.00 0.00 N ATOM 1277 CA TYR A 84 171.402 3.041 -0.485 1.00 0.00 C ATOM 1278 C TYR A 84 170.823 2.252 0.688 1.00 0.00 C ATOM 1279 O TYR A 84 170.834 1.026 0.686 1.00 0.00 O ATOM 1280 CB TYR A 84 170.912 2.449 -1.801 1.00 0.00 C ATOM 1281 CG TYR A 84 169.407 2.422 -1.944 1.00 0.00 C ATOM 1282 CD1 TYR A 84 168.634 3.515 -1.577 1.00 0.00 C ATOM 1283 CD2 TYR A 84 168.758 1.302 -2.452 1.00 0.00 C ATOM 1284 CE1 TYR A 84 167.258 3.496 -1.708 1.00 0.00 C ATOM 1285 CE2 TYR A 84 167.384 1.274 -2.588 1.00 0.00 C ATOM 1286 CZ TYR A 84 166.638 2.373 -2.216 1.00 0.00 C ATOM 1287 OH TYR A 84 165.268 2.352 -2.351 1.00 0.00 O ATOM 0 H TYR A 84 173.262 2.149 -0.118 1.00 0.00 H new ATOM 0 HA TYR A 84 171.066 4.074 -0.395 1.00 0.00 H new ATOM 0 HB2 TYR A 84 171.334 3.024 -2.625 1.00 0.00 H new ATOM 0 HB3 TYR A 84 171.293 1.432 -1.894 1.00 0.00 H new ATOM 0 HD1 TYR A 84 169.117 4.397 -1.182 1.00 0.00 H new ATOM 0 HD2 TYR A 84 169.338 0.440 -2.745 1.00 0.00 H new ATOM 0 HE1 TYR A 84 166.672 4.355 -1.415 1.00 0.00 H new ATOM 0 HE2 TYR A 84 166.896 0.396 -2.984 1.00 0.00 H new ATOM 0 HH TYR A 84 164.989 1.490 -2.724 1.00 0.00 H new ATOM 1297 N VAL A 85 170.308 2.962 1.686 1.00 0.00 N ATOM 1298 CA VAL A 85 169.718 2.316 2.856 1.00 0.00 C ATOM 1299 C VAL A 85 168.193 2.354 2.762 1.00 0.00 C ATOM 1300 O VAL A 85 167.638 3.101 1.961 1.00 0.00 O ATOM 1301 CB VAL A 85 170.197 2.971 4.191 1.00 0.00 C ATOM 1302 CG1 VAL A 85 171.031 4.214 3.924 1.00 0.00 C ATOM 1303 CG2 VAL A 85 169.034 3.320 5.116 1.00 0.00 C ATOM 0 H VAL A 85 170.286 3.981 1.710 1.00 0.00 H new ATOM 0 HA VAL A 85 170.054 1.279 2.865 1.00 0.00 H new ATOM 0 HB VAL A 85 170.814 2.227 4.694 1.00 0.00 H new ATOM 0 HG11 VAL A 85 171.350 4.648 4.871 1.00 0.00 H new ATOM 0 HG12 VAL A 85 171.907 3.944 3.335 1.00 0.00 H new ATOM 0 HG13 VAL A 85 170.434 4.942 3.374 1.00 0.00 H new ATOM 0 HG21 VAL A 85 169.419 3.772 6.030 1.00 0.00 H new ATOM 0 HG22 VAL A 85 168.369 4.024 4.615 1.00 0.00 H new ATOM 0 HG23 VAL A 85 168.482 2.413 5.365 1.00 0.00 H new ATOM 1313 N ILE A 86 167.521 1.551 3.584 1.00 0.00 N ATOM 1314 CA ILE A 86 166.059 1.513 3.592 1.00 0.00 C ATOM 1315 C ILE A 86 165.531 1.343 5.002 1.00 0.00 C ATOM 1316 O ILE A 86 165.610 0.256 5.567 1.00 0.00 O ATOM 1317 CB ILE A 86 165.503 0.368 2.732 1.00 0.00 C ATOM 1318 CG1 ILE A 86 166.110 0.419 1.339 1.00 0.00 C ATOM 1319 CG2 ILE A 86 163.983 0.442 2.660 1.00 0.00 C ATOM 1320 CD1 ILE A 86 165.636 1.586 0.511 1.00 0.00 C ATOM 0 H ILE A 86 167.963 0.919 4.252 1.00 0.00 H new ATOM 0 HA ILE A 86 165.728 2.464 3.174 1.00 0.00 H new ATOM 0 HB ILE A 86 165.774 -0.581 3.195 1.00 0.00 H new ATOM 0 HG12 ILE A 86 167.195 0.465 1.427 1.00 0.00 H new ATOM 0 HG13 ILE A 86 165.872 -0.507 0.815 1.00 0.00 H new ATOM 0 HG21 ILE A 86 163.607 -0.377 2.047 1.00 0.00 H new ATOM 0 HG22 ILE A 86 163.567 0.363 3.664 1.00 0.00 H new ATOM 0 HG23 ILE A 86 163.686 1.393 2.217 1.00 0.00 H new ATOM 0 HD11 ILE A 86 166.113 1.554 -0.469 1.00 0.00 H new ATOM 0 HD12 ILE A 86 164.554 1.531 0.390 1.00 0.00 H new ATOM 0 HD13 ILE A 86 165.898 2.518 1.012 1.00 0.00 H new ATOM 1332 N LYS A 87 164.990 2.420 5.560 1.00 0.00 N ATOM 1333 CA LYS A 87 164.440 2.390 6.908 1.00 0.00 C ATOM 1334 C LYS A 87 162.931 2.160 6.881 1.00 0.00 C ATOM 1335 O LYS A 87 162.149 3.057 7.197 1.00 0.00 O ATOM 1336 CB LYS A 87 164.759 3.698 7.635 1.00 0.00 C ATOM 1337 CG LYS A 87 164.605 3.609 9.145 1.00 0.00 C ATOM 1338 CD LYS A 87 165.575 4.538 9.858 1.00 0.00 C ATOM 1339 CE LYS A 87 165.074 5.974 9.860 1.00 0.00 C ATOM 1340 NZ LYS A 87 165.274 6.628 11.184 1.00 0.00 N ATOM 0 H LYS A 87 164.921 3.326 5.097 1.00 0.00 H new ATOM 0 HA LYS A 87 164.901 1.560 7.444 1.00 0.00 H new ATOM 0 HB2 LYS A 87 165.781 3.995 7.399 1.00 0.00 H new ATOM 0 HB3 LYS A 87 164.104 4.483 7.257 1.00 0.00 H new ATOM 0 HG2 LYS A 87 163.583 3.865 9.424 1.00 0.00 H new ATOM 0 HG3 LYS A 87 164.777 2.583 9.470 1.00 0.00 H new ATOM 0 HD2 LYS A 87 165.716 4.200 10.884 1.00 0.00 H new ATOM 0 HD3 LYS A 87 166.549 4.492 9.371 1.00 0.00 H new ATOM 0 HE2 LYS A 87 165.597 6.543 9.091 1.00 0.00 H new ATOM 0 HE3 LYS A 87 164.015 5.990 9.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 164.920 7.605 11.145 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 164.754 6.100 11.914 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 166.287 6.636 11.418 1.00 0.00 H new ATOM 1354 N ASP A 88 162.530 0.949 6.507 1.00 0.00 N ATOM 1355 CA ASP A 88 161.117 0.592 6.443 1.00 0.00 C ATOM 1356 C ASP A 88 160.348 1.538 5.524 1.00 0.00 C ATOM 1357 O ASP A 88 159.267 2.014 5.872 1.00 0.00 O ATOM 1358 CB ASP A 88 160.503 0.614 7.846 1.00 0.00 C ATOM 1359 CG ASP A 88 159.148 -0.065 7.894 1.00 0.00 C ATOM 1360 OD1 ASP A 88 159.049 -1.225 7.443 1.00 0.00 O ATOM 1361 OD2 ASP A 88 158.186 0.564 8.383 1.00 0.00 O ATOM 0 H ASP A 88 163.166 0.196 6.243 1.00 0.00 H new ATOM 0 HA ASP A 88 161.044 -0.415 6.033 1.00 0.00 H new ATOM 0 HB2 ASP A 88 161.179 0.120 8.543 1.00 0.00 H new ATOM 0 HB3 ASP A 88 160.401 1.647 8.179 1.00 0.00 H new ATOM 1366 N GLY A 89 160.910 1.803 4.350 1.00 0.00 N ATOM 1367 CA GLY A 89 160.258 2.686 3.400 1.00 0.00 C ATOM 1368 C GLY A 89 160.805 4.099 3.443 1.00 0.00 C ATOM 1369 O GLY A 89 160.094 5.057 3.141 1.00 0.00 O ATOM 0 H GLY A 89 161.804 1.423 4.039 1.00 0.00 H new ATOM 0 HA2 GLY A 89 160.380 2.284 2.394 1.00 0.00 H new ATOM 0 HA3 GLY A 89 159.188 2.709 3.607 1.00 0.00 H new ATOM 1373 N LEU A 90 162.074 4.231 3.818 1.00 0.00 N ATOM 1374 CA LEU A 90 162.720 5.538 3.898 1.00 0.00 C ATOM 1375 C LEU A 90 164.167 5.439 3.446 1.00 0.00 C ATOM 1376 O LEU A 90 165.090 5.430 4.262 1.00 0.00 O ATOM 1377 CB LEU A 90 162.644 6.082 5.321 1.00 0.00 C ATOM 1378 CG LEU A 90 161.331 5.785 6.034 1.00 0.00 C ATOM 1379 CD1 LEU A 90 161.447 6.081 7.522 1.00 0.00 C ATOM 1380 CD2 LEU A 90 160.203 6.589 5.408 1.00 0.00 C ATOM 0 H LEU A 90 162.676 3.448 4.072 1.00 0.00 H new ATOM 0 HA LEU A 90 162.195 6.227 3.236 1.00 0.00 H new ATOM 0 HB2 LEU A 90 163.464 5.661 5.903 1.00 0.00 H new ATOM 0 HB3 LEU A 90 162.794 7.161 5.294 1.00 0.00 H new ATOM 0 HG LEU A 90 161.105 4.725 5.921 1.00 0.00 H new ATOM 0 HD11 LEU A 90 160.498 5.862 8.012 1.00 0.00 H new ATOM 0 HD12 LEU A 90 162.231 5.461 7.956 1.00 0.00 H new ATOM 0 HD13 LEU A 90 161.695 7.133 7.666 1.00 0.00 H new ATOM 0 HD21 LEU A 90 159.269 6.369 5.925 1.00 0.00 H new ATOM 0 HD22 LEU A 90 160.424 7.653 5.494 1.00 0.00 H new ATOM 0 HD23 LEU A 90 160.106 6.322 4.356 1.00 0.00 H new ATOM 1392 N GLY A 91 164.346 5.339 2.141 1.00 0.00 N ATOM 1393 CA GLY A 91 165.665 5.212 1.577 1.00 0.00 C ATOM 1394 C GLY A 91 166.550 6.423 1.789 1.00 0.00 C ATOM 1395 O GLY A 91 166.078 7.544 1.971 1.00 0.00 O ATOM 0 H GLY A 91 163.590 5.344 1.457 1.00 0.00 H new ATOM 0 HA2 GLY A 91 166.152 4.339 2.013 1.00 0.00 H new ATOM 0 HA3 GLY A 91 165.574 5.025 0.507 1.00 0.00 H new ATOM 1399 N TYR A 92 167.847 6.165 1.745 1.00 0.00 N ATOM 1400 CA TYR A 92 168.875 7.187 1.908 1.00 0.00 C ATOM 1401 C TYR A 92 170.124 6.745 1.161 1.00 0.00 C ATOM 1402 O TYR A 92 170.523 5.584 1.261 1.00 0.00 O ATOM 1403 CB TYR A 92 169.194 7.400 3.386 1.00 0.00 C ATOM 1404 CG TYR A 92 168.049 7.994 4.173 1.00 0.00 C ATOM 1405 CD1 TYR A 92 167.633 9.302 3.954 1.00 0.00 C ATOM 1406 CD2 TYR A 92 167.382 7.246 5.136 1.00 0.00 C ATOM 1407 CE1 TYR A 92 166.586 9.846 4.672 1.00 0.00 C ATOM 1408 CE2 TYR A 92 166.333 7.784 5.859 1.00 0.00 C ATOM 1409 CZ TYR A 92 165.940 9.084 5.623 1.00 0.00 C ATOM 1410 OH TYR A 92 164.896 9.624 6.339 1.00 0.00 O ATOM 0 H TYR A 92 168.223 5.229 1.593 1.00 0.00 H new ATOM 0 HA TYR A 92 168.514 8.132 1.503 1.00 0.00 H new ATOM 0 HB2 TYR A 92 169.472 6.444 3.830 1.00 0.00 H new ATOM 0 HB3 TYR A 92 170.061 8.055 3.471 1.00 0.00 H new ATOM 0 HD1 TYR A 92 168.136 9.902 3.211 1.00 0.00 H new ATOM 0 HD2 TYR A 92 167.688 6.227 5.323 1.00 0.00 H new ATOM 0 HE1 TYR A 92 166.274 10.864 4.490 1.00 0.00 H new ATOM 0 HE2 TYR A 92 165.825 7.189 6.604 1.00 0.00 H new ATOM 0 HH TYR A 92 164.550 8.956 6.967 1.00 0.00 H new ATOM 1420 N ARG A 93 170.736 7.640 0.398 1.00 0.00 N ATOM 1421 CA ARG A 93 171.919 7.272 -0.354 1.00 0.00 C ATOM 1422 C ARG A 93 173.045 8.266 -0.192 1.00 0.00 C ATOM 1423 O ARG A 93 172.838 9.480 -0.191 1.00 0.00 O ATOM 1424 CB ARG A 93 171.597 7.128 -1.836 1.00 0.00 C ATOM 1425 CG ARG A 93 171.148 8.424 -2.493 1.00 0.00 C ATOM 1426 CD ARG A 93 169.755 8.297 -3.089 1.00 0.00 C ATOM 1427 NE ARG A 93 168.725 8.787 -2.176 1.00 0.00 N ATOM 1428 CZ ARG A 93 168.431 10.075 -2.013 1.00 0.00 C ATOM 1429 NH1 ARG A 93 169.090 11.005 -2.693 1.00 0.00 N ATOM 1430 NH2 ARG A 93 167.476 10.435 -1.165 1.00 0.00 N ATOM 0 H ARG A 93 170.437 8.609 0.286 1.00 0.00 H new ATOM 0 HA ARG A 93 172.249 6.316 0.052 1.00 0.00 H new ATOM 0 HB2 ARG A 93 172.479 6.754 -2.356 1.00 0.00 H new ATOM 0 HB3 ARG A 93 170.814 6.379 -1.958 1.00 0.00 H new ATOM 0 HG2 ARG A 93 171.157 9.228 -1.757 1.00 0.00 H new ATOM 0 HG3 ARG A 93 171.855 8.700 -3.275 1.00 0.00 H new ATOM 0 HD2 ARG A 93 169.708 8.856 -4.023 1.00 0.00 H new ATOM 0 HD3 ARG A 93 169.558 7.253 -3.332 1.00 0.00 H new ATOM 0 HE ARG A 93 168.201 8.102 -1.632 1.00 0.00 H new ATOM 0 HH11 ARG A 93 169.826 10.734 -3.345 1.00 0.00 H new ATOM 0 HH12 ARG A 93 168.860 11.990 -2.564 1.00 0.00 H new ATOM 0 HH21 ARG A 93 166.967 9.725 -0.638 1.00 0.00 H new ATOM 0 HH22 ARG A 93 167.251 11.422 -1.040 1.00 0.00 H new ATOM 1444 N GLN A 94 174.250 7.729 -0.098 1.00 0.00 N ATOM 1445 CA GLN A 94 175.436 8.549 0.015 1.00 0.00 C ATOM 1446 C GLN A 94 176.147 8.549 -1.320 1.00 0.00 C ATOM 1447 O GLN A 94 177.167 7.883 -1.494 1.00 0.00 O ATOM 1448 CB GLN A 94 176.370 8.039 1.111 1.00 0.00 C ATOM 1449 CG GLN A 94 177.175 9.143 1.773 1.00 0.00 C ATOM 1450 CD GLN A 94 178.519 8.660 2.281 1.00 0.00 C ATOM 1451 OE1 GLN A 94 178.605 7.650 2.978 1.00 0.00 O ATOM 1452 NE2 GLN A 94 179.578 9.381 1.932 1.00 0.00 N ATOM 0 H GLN A 94 174.429 6.725 -0.098 1.00 0.00 H new ATOM 0 HA GLN A 94 175.142 9.562 0.289 1.00 0.00 H new ATOM 0 HB2 GLN A 94 175.782 7.523 1.869 1.00 0.00 H new ATOM 0 HB3 GLN A 94 177.054 7.306 0.684 1.00 0.00 H new ATOM 0 HG2 GLN A 94 177.330 9.952 1.060 1.00 0.00 H new ATOM 0 HG3 GLN A 94 176.604 9.556 2.604 1.00 0.00 H new ATOM 0 HE21 GLN A 94 179.461 10.212 1.352 1.00 0.00 H new ATOM 0 HE22 GLN A 94 180.509 9.104 2.244 1.00 0.00 H new ATOM 1461 N ASP A 95 175.569 9.272 -2.269 1.00 0.00 N ATOM 1462 CA ASP A 95 176.117 9.349 -3.616 1.00 0.00 C ATOM 1463 C ASP A 95 177.253 10.354 -3.700 1.00 0.00 C ATOM 1464 O ASP A 95 177.548 11.065 -2.738 1.00 0.00 O ATOM 1465 CB ASP A 95 175.022 9.724 -4.610 1.00 0.00 C ATOM 1466 CG ASP A 95 174.314 11.010 -4.235 1.00 0.00 C ATOM 1467 OD1 ASP A 95 174.796 12.091 -4.634 1.00 0.00 O ATOM 1468 OD2 ASP A 95 173.278 10.938 -3.541 1.00 0.00 O ATOM 0 H ASP A 95 174.717 9.816 -2.130 1.00 0.00 H new ATOM 0 HA ASP A 95 176.515 8.366 -3.867 1.00 0.00 H new ATOM 0 HB2 ASP A 95 175.458 9.829 -5.603 1.00 0.00 H new ATOM 0 HB3 ASP A 95 174.294 8.915 -4.666 1.00 0.00 H new ATOM 1473 N ASN A 96 177.888 10.403 -4.864 1.00 0.00 N ATOM 1474 CA ASN A 96 178.997 11.315 -5.091 1.00 0.00 C ATOM 1475 C ASN A 96 180.146 11.015 -4.131 1.00 0.00 C ATOM 1476 O ASN A 96 181.026 11.849 -3.919 1.00 0.00 O ATOM 1477 CB ASN A 96 178.527 12.761 -4.926 1.00 0.00 C ATOM 1478 CG ASN A 96 179.634 13.770 -5.161 1.00 0.00 C ATOM 1479 OD1 ASN A 96 180.451 13.612 -6.068 1.00 0.00 O ATOM 1480 ND2 ASN A 96 179.665 14.815 -4.342 1.00 0.00 N ATOM 0 H ASN A 96 177.652 9.819 -5.666 1.00 0.00 H new ATOM 0 HA ASN A 96 179.360 11.176 -6.110 1.00 0.00 H new ATOM 0 HB2 ASN A 96 177.711 12.955 -5.623 1.00 0.00 H new ATOM 0 HB3 ASN A 96 178.127 12.895 -3.921 1.00 0.00 H new ATOM 0 HD21 ASN A 96 180.387 15.527 -4.451 1.00 0.00 H new ATOM 0 HD22 ASN A 96 178.967 14.905 -3.604 1.00 0.00 H new ATOM 1487 N GLY A 97 180.140 9.812 -3.559 1.00 0.00 N ATOM 1488 CA GLY A 97 181.191 9.431 -2.640 1.00 0.00 C ATOM 1489 C GLY A 97 182.465 9.064 -3.362 1.00 0.00 C ATOM 1490 O GLY A 97 182.455 8.807 -4.566 1.00 0.00 O ATOM 0 H GLY A 97 179.427 9.100 -3.717 1.00 0.00 H new ATOM 0 HA2 GLY A 97 181.388 10.254 -1.952 1.00 0.00 H new ATOM 0 HA3 GLY A 97 180.858 8.585 -2.038 1.00 0.00 H new ATOM 1494 N GLU A 98 183.564 9.036 -2.626 1.00 0.00 N ATOM 1495 CA GLU A 98 184.856 8.699 -3.204 1.00 0.00 C ATOM 1496 C GLU A 98 185.780 8.087 -2.160 1.00 0.00 C ATOM 1497 O GLU A 98 185.681 8.391 -0.971 1.00 0.00 O ATOM 1498 CB GLU A 98 185.505 9.944 -3.813 1.00 0.00 C ATOM 1499 CG GLU A 98 186.706 9.640 -4.692 1.00 0.00 C ATOM 1500 CD GLU A 98 187.691 10.791 -4.751 1.00 0.00 C ATOM 1501 OE1 GLU A 98 188.513 10.917 -3.818 1.00 0.00 O ATOM 1502 OE2 GLU A 98 187.641 11.567 -5.729 1.00 0.00 O ATOM 0 H GLU A 98 183.588 9.242 -1.627 1.00 0.00 H new ATOM 0 HA GLU A 98 184.692 7.961 -3.990 1.00 0.00 H new ATOM 0 HB2 GLU A 98 184.761 10.479 -4.403 1.00 0.00 H new ATOM 0 HB3 GLU A 98 185.814 10.612 -3.009 1.00 0.00 H new ATOM 0 HG2 GLU A 98 187.213 8.752 -4.314 1.00 0.00 H new ATOM 0 HG3 GLU A 98 186.364 9.407 -5.700 1.00 0.00 H new ATOM 1509 N TRP A 99 186.680 7.224 -2.613 1.00 0.00 N ATOM 1510 CA TRP A 99 187.626 6.564 -1.725 1.00 0.00 C ATOM 1511 C TRP A 99 188.936 6.278 -2.468 1.00 0.00 C ATOM 1512 O TRP A 99 188.988 6.364 -3.694 1.00 0.00 O ATOM 1513 CB TRP A 99 186.998 5.283 -1.169 1.00 0.00 C ATOM 1514 CG TRP A 99 187.902 4.505 -0.270 1.00 0.00 C ATOM 1515 CD1 TRP A 99 188.597 4.971 0.808 1.00 0.00 C ATOM 1516 CD2 TRP A 99 188.197 3.110 -0.368 1.00 0.00 C ATOM 1517 NE1 TRP A 99 189.327 3.954 1.372 1.00 0.00 N ATOM 1518 CE2 TRP A 99 189.092 2.801 0.668 1.00 0.00 C ATOM 1519 CE3 TRP A 99 187.791 2.096 -1.238 1.00 0.00 C ATOM 1520 CZ2 TRP A 99 189.592 1.519 0.855 1.00 0.00 C ATOM 1521 CZ3 TRP A 99 188.285 0.823 -1.051 1.00 0.00 C ATOM 1522 CH2 TRP A 99 189.178 0.544 -0.012 1.00 0.00 C ATOM 0 H TRP A 99 186.774 6.964 -3.595 1.00 0.00 H new ATOM 0 HA TRP A 99 187.862 7.218 -0.885 1.00 0.00 H new ATOM 0 HB2 TRP A 99 186.092 5.543 -0.621 1.00 0.00 H new ATOM 0 HB3 TRP A 99 186.695 4.648 -2.001 1.00 0.00 H new ATOM 0 HD1 TRP A 99 188.576 5.990 1.165 1.00 0.00 H new ATOM 0 HE1 TRP A 99 189.942 4.042 2.181 1.00 0.00 H new ATOM 0 HE3 TRP A 99 187.102 2.306 -2.043 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 190.283 1.299 1.656 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 187.978 0.030 -1.716 1.00 0.00 H new ATOM 0 HH2 TRP A 99 189.549 -0.463 0.109 1.00 0.00 H new ATOM 1533 N THR A 100 189.998 5.975 -1.728 1.00 0.00 N ATOM 1534 CA THR A 100 191.307 5.721 -2.331 1.00 0.00 C ATOM 1535 C THR A 100 191.689 4.242 -2.318 1.00 0.00 C ATOM 1536 O THR A 100 191.193 3.462 -1.505 1.00 0.00 O ATOM 1537 CB THR A 100 192.375 6.513 -1.572 1.00 0.00 C ATOM 1538 OG1 THR A 100 193.575 6.581 -2.322 1.00 0.00 O ATOM 1539 CG2 THR A 100 192.714 5.918 -0.214 1.00 0.00 C ATOM 0 H THR A 100 189.981 5.899 -0.711 1.00 0.00 H new ATOM 0 HA THR A 100 191.247 6.036 -3.373 1.00 0.00 H new ATOM 0 HB THR A 100 191.946 7.504 -1.420 1.00 0.00 H new ATOM 0 HG1 THR A 100 194.245 7.092 -1.822 1.00 0.00 H new ATOM 0 HG21 THR A 100 193.477 6.528 0.270 1.00 0.00 H new ATOM 0 HG22 THR A 100 191.819 5.896 0.407 1.00 0.00 H new ATOM 0 HG23 THR A 100 193.090 4.903 -0.345 1.00 0.00 H new ATOM 1547 N VAL A 101 192.609 3.883 -3.210 1.00 0.00 N ATOM 1548 CA VAL A 101 193.112 2.515 -3.301 1.00 0.00 C ATOM 1549 C VAL A 101 194.623 2.464 -3.059 1.00 0.00 C ATOM 1550 O VAL A 101 195.198 1.387 -2.916 1.00 0.00 O ATOM 1551 CB VAL A 101 192.831 1.890 -4.682 1.00 0.00 C ATOM 1552 CG1 VAL A 101 193.186 0.412 -4.674 1.00 0.00 C ATOM 1553 CG2 VAL A 101 191.381 2.094 -5.086 1.00 0.00 C ATOM 0 H VAL A 101 193.024 4.526 -3.885 1.00 0.00 H new ATOM 0 HA VAL A 101 192.588 1.948 -2.532 1.00 0.00 H new ATOM 0 HB VAL A 101 193.457 2.392 -5.420 1.00 0.00 H new ATOM 0 HG11 VAL A 101 192.983 -0.016 -5.655 1.00 0.00 H new ATOM 0 HG12 VAL A 101 194.244 0.293 -4.438 1.00 0.00 H new ATOM 0 HG13 VAL A 101 192.587 -0.102 -3.922 1.00 0.00 H new ATOM 0 HG21 VAL A 101 191.209 1.644 -6.064 1.00 0.00 H new ATOM 0 HG22 VAL A 101 190.729 1.624 -4.350 1.00 0.00 H new ATOM 0 HG23 VAL A 101 191.163 3.161 -5.134 1.00 0.00 H new ATOM 1563 N THR A 102 195.259 3.636 -3.030 1.00 0.00 N ATOM 1564 CA THR A 102 196.707 3.737 -2.836 1.00 0.00 C ATOM 1565 C THR A 102 197.162 3.140 -1.506 1.00 0.00 C ATOM 1566 O THR A 102 198.358 2.957 -1.279 1.00 0.00 O ATOM 1567 CB THR A 102 197.147 5.200 -2.919 1.00 0.00 C ATOM 1568 OG1 THR A 102 196.749 5.910 -1.760 1.00 0.00 O ATOM 1569 CG2 THR A 102 196.580 5.926 -4.120 1.00 0.00 C ATOM 0 H THR A 102 194.790 4.535 -3.139 1.00 0.00 H new ATOM 0 HA THR A 102 197.176 3.159 -3.632 1.00 0.00 H new ATOM 0 HB THR A 102 198.233 5.172 -3.010 1.00 0.00 H new ATOM 0 HG1 THR A 102 197.041 6.843 -1.831 1.00 0.00 H new ATOM 0 HG21 THR A 102 196.930 6.958 -4.120 1.00 0.00 H new ATOM 0 HG22 THR A 102 196.910 5.431 -5.033 1.00 0.00 H new ATOM 0 HG23 THR A 102 195.491 5.912 -4.073 1.00 0.00 H new ATOM 1577 N GLU A 103 196.215 2.843 -0.632 1.00 0.00 N ATOM 1578 CA GLU A 103 196.538 2.272 0.672 1.00 0.00 C ATOM 1579 C GLU A 103 195.654 1.069 0.977 1.00 0.00 C ATOM 1580 O GLU A 103 194.499 1.012 0.556 1.00 0.00 O ATOM 1581 CB GLU A 103 196.379 3.328 1.767 1.00 0.00 C ATOM 1582 CG GLU A 103 197.045 2.946 3.080 1.00 0.00 C ATOM 1583 CD GLU A 103 198.028 3.996 3.563 1.00 0.00 C ATOM 1584 OE1 GLU A 103 198.957 4.336 2.801 1.00 0.00 O ATOM 1585 OE2 GLU A 103 197.869 4.477 4.705 1.00 0.00 O ATOM 0 H GLU A 103 195.219 2.986 -0.797 1.00 0.00 H new ATOM 0 HA GLU A 103 197.575 1.937 0.646 1.00 0.00 H new ATOM 0 HB2 GLU A 103 196.800 4.270 1.416 1.00 0.00 H new ATOM 0 HB3 GLU A 103 195.317 3.500 1.944 1.00 0.00 H new ATOM 0 HG2 GLU A 103 196.279 2.793 3.841 1.00 0.00 H new ATOM 0 HG3 GLU A 103 197.565 1.996 2.956 1.00 0.00 H new ATOM 1592 N PHE A 104 196.202 0.108 1.715 1.00 0.00 N ATOM 1593 CA PHE A 104 195.458 -1.090 2.075 1.00 0.00 C ATOM 1594 C PHE A 104 195.667 -1.421 3.544 1.00 0.00 C ATOM 1595 O PHE A 104 196.722 -1.133 4.107 1.00 0.00 O ATOM 1596 CB PHE A 104 195.907 -2.271 1.213 1.00 0.00 C ATOM 1597 CG PHE A 104 195.671 -2.078 -0.259 1.00 0.00 C ATOM 1598 CD1 PHE A 104 196.482 -1.232 -0.998 1.00 0.00 C ATOM 1599 CD2 PHE A 104 194.645 -2.751 -0.904 1.00 0.00 C ATOM 1600 CE1 PHE A 104 196.273 -1.058 -2.354 1.00 0.00 C ATOM 1601 CE2 PHE A 104 194.431 -2.579 -2.259 1.00 0.00 C ATOM 1602 CZ PHE A 104 195.246 -1.732 -2.985 1.00 0.00 C ATOM 0 H PHE A 104 197.156 0.137 2.074 1.00 0.00 H new ATOM 0 HA PHE A 104 194.399 -0.902 1.900 1.00 0.00 H new ATOM 0 HB2 PHE A 104 196.970 -2.446 1.380 1.00 0.00 H new ATOM 0 HB3 PHE A 104 195.381 -3.168 1.540 1.00 0.00 H new ATOM 0 HD1 PHE A 104 197.287 -0.702 -0.510 1.00 0.00 H new ATOM 0 HD2 PHE A 104 194.006 -3.417 -0.342 1.00 0.00 H new ATOM 0 HE1 PHE A 104 196.912 -0.396 -2.919 1.00 0.00 H new ATOM 0 HE2 PHE A 104 193.627 -3.107 -2.750 1.00 0.00 H new ATOM 0 HZ PHE A 104 195.080 -1.597 -4.044 1.00 0.00 H new ATOM 1612 N VAL A 105 194.666 -2.035 4.164 1.00 0.00 N ATOM 1613 CA VAL A 105 194.768 -2.409 5.566 1.00 0.00 C ATOM 1614 C VAL A 105 195.139 -3.883 5.700 1.00 0.00 C ATOM 1615 O VAL A 105 194.891 -4.685 4.800 1.00 0.00 O ATOM 1616 CB VAL A 105 193.466 -2.120 6.344 1.00 0.00 C ATOM 1617 CG1 VAL A 105 193.049 -0.670 6.157 1.00 0.00 C ATOM 1618 CG2 VAL A 105 192.348 -3.060 5.910 1.00 0.00 C ATOM 0 H VAL A 105 193.781 -2.282 3.720 1.00 0.00 H new ATOM 0 HA VAL A 105 195.556 -1.796 6.003 1.00 0.00 H new ATOM 0 HB VAL A 105 193.657 -2.294 7.403 1.00 0.00 H new ATOM 0 HG11 VAL A 105 192.130 -0.481 6.711 1.00 0.00 H new ATOM 0 HG12 VAL A 105 193.837 -0.014 6.527 1.00 0.00 H new ATOM 0 HG13 VAL A 105 192.881 -0.473 5.098 1.00 0.00 H new ATOM 0 HG21 VAL A 105 191.443 -2.834 6.474 1.00 0.00 H new ATOM 0 HG22 VAL A 105 192.154 -2.928 4.845 1.00 0.00 H new ATOM 0 HG23 VAL A 105 192.646 -4.091 6.100 1.00 0.00 H new ATOM 1628 N ASN A 106 195.745 -4.221 6.826 1.00 0.00 N ATOM 1629 CA ASN A 106 196.179 -5.580 7.101 1.00 0.00 C ATOM 1630 C ASN A 106 195.048 -6.415 7.659 1.00 0.00 C ATOM 1631 O ASN A 106 194.155 -5.901 8.330 1.00 0.00 O ATOM 1632 CB ASN A 106 197.340 -5.554 8.094 1.00 0.00 C ATOM 1633 CG ASN A 106 198.689 -5.662 7.415 1.00 0.00 C ATOM 1634 OD1 ASN A 106 199.587 -4.740 7.741 1.00 0.00 O flip ATOM 1635 ND2 ASN A 106 198.922 -6.563 6.608 1.00 0.00 N flip ATOM 0 H ASN A 106 195.950 -3.560 7.576 1.00 0.00 H new ATOM 0 HA ASN A 106 196.503 -6.032 6.164 1.00 0.00 H new ATOM 0 HB2 ASN A 106 197.300 -4.629 8.670 1.00 0.00 H new ATOM 0 HB3 ASN A 106 197.227 -6.375 8.802 1.00 0.00 H new ATOM 0 HD21 ASN A 106 198.201 -7.250 6.388 1.00 0.00 H new ATOM 0 HD22 ASN A 106 199.836 -6.622 6.160 1.00 0.00 H new ATOM 1642 N GLU A 107 195.114 -7.722 7.416 1.00 0.00 N ATOM 1643 CA GLU A 107 194.112 -8.630 7.945 1.00 0.00 C ATOM 1644 C GLU A 107 194.032 -8.448 9.459 1.00 0.00 C ATOM 1645 O GLU A 107 193.049 -8.830 10.095 1.00 0.00 O ATOM 1646 CB GLU A 107 194.461 -10.080 7.603 1.00 0.00 C ATOM 1647 CG GLU A 107 195.903 -10.449 7.914 1.00 0.00 C ATOM 1648 CD GLU A 107 196.780 -10.461 6.679 1.00 0.00 C ATOM 1649 OE1 GLU A 107 196.331 -10.982 5.635 1.00 0.00 O ATOM 1650 OE2 GLU A 107 197.918 -9.950 6.752 1.00 0.00 O ATOM 0 H GLU A 107 195.845 -8.168 6.861 1.00 0.00 H new ATOM 0 HA GLU A 107 193.146 -8.403 7.494 1.00 0.00 H new ATOM 0 HB2 GLU A 107 193.797 -10.745 8.156 1.00 0.00 H new ATOM 0 HB3 GLU A 107 194.272 -10.250 6.543 1.00 0.00 H new ATOM 0 HG2 GLU A 107 196.308 -9.740 8.636 1.00 0.00 H new ATOM 0 HG3 GLU A 107 195.929 -11.432 8.384 1.00 0.00 H new ATOM 1657 N ASP A 108 195.078 -7.834 10.017 1.00 0.00 N ATOM 1658 CA ASP A 108 195.138 -7.565 11.445 1.00 0.00 C ATOM 1659 C ASP A 108 194.151 -6.461 11.807 1.00 0.00 C ATOM 1660 O ASP A 108 193.599 -6.447 12.908 1.00 0.00 O ATOM 1661 CB ASP A 108 196.556 -7.159 11.855 1.00 0.00 C ATOM 1662 CG ASP A 108 197.045 -7.921 13.071 1.00 0.00 C ATOM 1663 OD1 ASP A 108 197.197 -9.157 12.974 1.00 0.00 O ATOM 1664 OD2 ASP A 108 197.275 -7.282 14.119 1.00 0.00 O ATOM 0 H ASP A 108 195.894 -7.515 9.495 1.00 0.00 H new ATOM 0 HA ASP A 108 194.870 -8.474 11.983 1.00 0.00 H new ATOM 0 HB2 ASP A 108 197.237 -7.334 11.022 1.00 0.00 H new ATOM 0 HB3 ASP A 108 196.579 -6.090 12.066 1.00 0.00 H new ATOM 1669 N GLY A 109 193.919 -5.543 10.868 1.00 0.00 N ATOM 1670 CA GLY A 109 192.986 -4.461 11.111 1.00 0.00 C ATOM 1671 C GLY A 109 193.631 -3.090 11.068 1.00 0.00 C ATOM 1672 O GLY A 109 193.088 -2.131 11.616 1.00 0.00 O ATOM 0 H GLY A 109 194.360 -5.532 9.948 1.00 0.00 H new ATOM 0 HA2 GLY A 109 192.190 -4.504 10.368 1.00 0.00 H new ATOM 0 HA3 GLY A 109 192.520 -4.605 12.086 1.00 0.00 H new ATOM 1676 N THR A 110 194.779 -2.984 10.405 1.00 0.00 N ATOM 1677 CA THR A 110 195.461 -1.701 10.295 1.00 0.00 C ATOM 1678 C THR A 110 196.194 -1.575 8.971 1.00 0.00 C ATOM 1679 O THR A 110 196.483 -2.564 8.310 1.00 0.00 O ATOM 1680 CB THR A 110 196.430 -1.477 11.453 1.00 0.00 C ATOM 1681 OG1 THR A 110 197.671 -2.113 11.203 1.00 0.00 O ATOM 1682 CG2 THR A 110 195.910 -1.983 12.782 1.00 0.00 C ATOM 0 H THR A 110 195.251 -3.761 9.942 1.00 0.00 H new ATOM 0 HA THR A 110 194.692 -0.930 10.340 1.00 0.00 H new ATOM 0 HB THR A 110 196.549 -0.396 11.520 1.00 0.00 H new ATOM 0 HG1 THR A 110 198.277 -1.955 11.957 1.00 0.00 H new ATOM 0 HG21 THR A 110 196.650 -1.791 13.559 1.00 0.00 H new ATOM 0 HG22 THR A 110 194.982 -1.468 13.029 1.00 0.00 H new ATOM 0 HG23 THR A 110 195.724 -3.055 12.716 1.00 0.00 H new ATOM 1690 N PRO A 111 196.496 -0.338 8.572 1.00 0.00 N ATOM 1691 CA PRO A 111 197.181 -0.050 7.314 1.00 0.00 C ATOM 1692 C PRO A 111 198.406 -0.929 7.086 1.00 0.00 C ATOM 1693 O PRO A 111 199.295 -1.015 7.933 1.00 0.00 O ATOM 1694 CB PRO A 111 197.580 1.418 7.462 1.00 0.00 C ATOM 1695 CG PRO A 111 196.552 1.992 8.378 1.00 0.00 C ATOM 1696 CD PRO A 111 196.181 0.885 9.328 1.00 0.00 C ATOM 0 HA PRO A 111 196.545 -0.249 6.451 1.00 0.00 H new ATOM 0 HB2 PRO A 111 198.583 1.517 7.878 1.00 0.00 H new ATOM 0 HB3 PRO A 111 197.583 1.928 6.499 1.00 0.00 H new ATOM 0 HG2 PRO A 111 196.947 2.853 8.917 1.00 0.00 H new ATOM 0 HG3 PRO A 111 195.681 2.337 7.821 1.00 0.00 H new ATOM 0 HD2 PRO A 111 196.753 0.943 10.254 1.00 0.00 H new ATOM 0 HD3 PRO A 111 195.127 0.927 9.601 1.00 0.00 H new ATOM 1704 N ALA A 112 198.438 -1.576 5.926 1.00 0.00 N ATOM 1705 CA ALA A 112 199.541 -2.450 5.560 1.00 0.00 C ATOM 1706 C ALA A 112 200.495 -1.752 4.600 1.00 0.00 C ATOM 1707 O ALA A 112 200.805 -2.269 3.527 1.00 0.00 O ATOM 1708 CB ALA A 112 199.011 -3.738 4.947 1.00 0.00 C ATOM 0 H ALA A 112 197.705 -1.509 5.220 1.00 0.00 H new ATOM 0 HA ALA A 112 200.097 -2.697 6.465 1.00 0.00 H new ATOM 0 HB1 ALA A 112 199.847 -4.384 4.677 1.00 0.00 H new ATOM 0 HB2 ALA A 112 198.375 -4.250 5.669 1.00 0.00 H new ATOM 0 HB3 ALA A 112 198.431 -3.504 4.055 1.00 0.00 H new ATOM 1714 N ASP A 113 200.960 -0.572 4.997 1.00 0.00 N ATOM 1715 CA ASP A 113 201.882 0.207 4.177 1.00 0.00 C ATOM 1716 C ASP A 113 203.129 -0.604 3.835 1.00 0.00 C ATOM 1717 O ASP A 113 203.191 -1.806 4.097 1.00 0.00 O ATOM 1718 CB ASP A 113 202.280 1.494 4.903 1.00 0.00 C ATOM 1719 CG ASP A 113 202.383 2.680 3.965 1.00 0.00 C ATOM 1720 OD1 ASP A 113 203.377 2.759 3.215 1.00 0.00 O ATOM 1721 OD2 ASP A 113 201.467 3.530 3.981 1.00 0.00 O ATOM 0 H ASP A 113 200.713 -0.133 5.884 1.00 0.00 H new ATOM 0 HA ASP A 113 201.373 0.463 3.248 1.00 0.00 H new ATOM 0 HB2 ASP A 113 201.546 1.711 5.679 1.00 0.00 H new ATOM 0 HB3 ASP A 113 203.238 1.345 5.402 1.00 0.00 H new ATOM 1726 N THR A 114 204.118 0.061 3.248 1.00 0.00 N ATOM 1727 CA THR A 114 205.364 -0.597 2.868 1.00 0.00 C ATOM 1728 C THR A 114 205.109 -1.684 1.830 1.00 0.00 C ATOM 1729 O THR A 114 205.796 -2.705 1.804 1.00 0.00 O ATOM 1730 CB THR A 114 206.044 -1.199 4.099 1.00 0.00 C ATOM 1731 OG1 THR A 114 205.622 -0.539 5.279 1.00 0.00 O ATOM 1732 CG2 THR A 114 207.555 -1.122 4.044 1.00 0.00 C ATOM 0 H THR A 114 204.082 1.056 3.025 1.00 0.00 H new ATOM 0 HA THR A 114 206.023 0.152 2.429 1.00 0.00 H new ATOM 0 HB THR A 114 205.749 -2.248 4.108 1.00 0.00 H new ATOM 0 HG1 THR A 114 206.067 -0.940 6.055 1.00 0.00 H new ATOM 0 HG21 THR A 114 207.975 -1.566 4.947 1.00 0.00 H new ATOM 0 HG22 THR A 114 207.915 -1.666 3.171 1.00 0.00 H new ATOM 0 HG23 THR A 114 207.864 -0.079 3.975 1.00 0.00 H new ATOM 1740 N SER A 115 204.116 -1.457 0.976 1.00 0.00 N ATOM 1741 CA SER A 115 203.769 -2.416 -0.066 1.00 0.00 C ATOM 1742 C SER A 115 204.148 -1.884 -1.444 1.00 0.00 C ATOM 1743 O SER A 115 204.726 -0.804 -1.565 1.00 0.00 O ATOM 1744 CB SER A 115 202.271 -2.728 -0.022 1.00 0.00 C ATOM 1745 OG SER A 115 201.522 -1.580 0.338 1.00 0.00 O ATOM 0 H SER A 115 203.538 -0.617 0.985 1.00 0.00 H new ATOM 0 HA SER A 115 204.331 -3.332 0.117 1.00 0.00 H new ATOM 0 HB2 SER A 115 201.943 -3.090 -0.996 1.00 0.00 H new ATOM 0 HB3 SER A 115 202.084 -3.528 0.694 1.00 0.00 H new ATOM 0 HG SER A 115 201.226 -1.661 1.269 1.00 0.00 H new ATOM 1751 N LEU A 116 203.819 -2.649 -2.480 1.00 0.00 N ATOM 1752 CA LEU A 116 204.125 -2.256 -3.850 1.00 0.00 C ATOM 1753 C LEU A 116 205.632 -2.130 -4.057 1.00 0.00 C ATOM 1754 O LEU A 116 206.214 -1.070 -3.825 1.00 0.00 O ATOM 1755 CB LEU A 116 203.434 -0.932 -4.190 1.00 0.00 C ATOM 1756 CG LEU A 116 202.529 -0.973 -5.423 1.00 0.00 C ATOM 1757 CD1 LEU A 116 203.324 -1.361 -6.658 1.00 0.00 C ATOM 1758 CD2 LEU A 116 201.375 -1.941 -5.203 1.00 0.00 C ATOM 0 H LEU A 116 203.340 -3.546 -2.396 1.00 0.00 H new ATOM 0 HA LEU A 116 203.751 -3.032 -4.517 1.00 0.00 H new ATOM 0 HB2 LEU A 116 202.839 -0.619 -3.332 1.00 0.00 H new ATOM 0 HB3 LEU A 116 204.198 -0.170 -4.344 1.00 0.00 H new ATOM 0 HG LEU A 116 202.118 0.024 -5.581 1.00 0.00 H new ATOM 0 HD11 LEU A 116 202.662 -1.385 -7.524 1.00 0.00 H new ATOM 0 HD12 LEU A 116 204.115 -0.630 -6.826 1.00 0.00 H new ATOM 0 HD13 LEU A 116 203.765 -2.347 -6.512 1.00 0.00 H new ATOM 0 HD21 LEU A 116 200.741 -1.958 -6.089 1.00 0.00 H new ATOM 0 HD22 LEU A 116 201.769 -2.941 -5.019 1.00 0.00 H new ATOM 0 HD23 LEU A 116 200.788 -1.618 -4.343 1.00 0.00 H new ATOM 1770 N GLU A 117 206.256 -3.219 -4.494 1.00 0.00 N ATOM 1771 CA GLU A 117 207.695 -3.231 -4.732 1.00 0.00 C ATOM 1772 C GLU A 117 208.070 -4.315 -5.741 1.00 0.00 C ATOM 1773 O GLU A 117 208.352 -5.453 -5.365 1.00 0.00 O ATOM 1774 CB GLU A 117 208.448 -3.458 -3.420 1.00 0.00 C ATOM 1775 CG GLU A 117 208.881 -2.169 -2.737 1.00 0.00 C ATOM 1776 CD GLU A 117 208.606 -2.178 -1.244 1.00 0.00 C ATOM 1777 OE1 GLU A 117 207.506 -2.616 -0.847 1.00 0.00 O ATOM 1778 OE2 GLU A 117 209.492 -1.748 -0.475 1.00 0.00 O ATOM 0 H GLU A 117 205.788 -4.104 -4.690 1.00 0.00 H new ATOM 0 HA GLU A 117 207.979 -2.262 -5.143 1.00 0.00 H new ATOM 0 HB2 GLU A 117 207.813 -4.025 -2.739 1.00 0.00 H new ATOM 0 HB3 GLU A 117 209.329 -4.069 -3.617 1.00 0.00 H new ATOM 0 HG2 GLU A 117 209.947 -2.013 -2.905 1.00 0.00 H new ATOM 0 HG3 GLU A 117 208.360 -1.328 -3.194 1.00 0.00 H new ATOM 1785 N PRO A 118 208.076 -3.975 -7.043 1.00 0.00 N ATOM 1786 CA PRO A 118 208.418 -4.926 -8.105 1.00 0.00 C ATOM 1787 C PRO A 118 209.743 -5.636 -7.844 1.00 0.00 C ATOM 1788 O PRO A 118 209.913 -6.771 -8.338 1.00 0.00 O ATOM 1789 CB PRO A 118 208.520 -4.047 -9.353 1.00 0.00 C ATOM 1790 CG PRO A 118 207.648 -2.875 -9.061 1.00 0.00 C ATOM 1791 CD PRO A 118 207.750 -2.640 -7.578 1.00 0.00 C ATOM 0 HA PRO A 118 207.680 -5.723 -8.189 1.00 0.00 H new ATOM 0 HB2 PRO A 118 209.549 -3.739 -9.538 1.00 0.00 H new ATOM 0 HB3 PRO A 118 208.183 -4.580 -10.242 1.00 0.00 H new ATOM 0 HG2 PRO A 118 207.975 -1.997 -9.618 1.00 0.00 H new ATOM 0 HG3 PRO A 118 206.617 -3.073 -9.354 1.00 0.00 H new ATOM 0 HD2 PRO A 118 208.524 -1.911 -7.339 1.00 0.00 H new ATOM 0 HD3 PRO A 118 206.815 -2.259 -7.166 1.00 0.00 H new TER 1799 PRO A 118