USER MOD reduce.3.24.130724 H: found=0, std=0, add=879, rem=0, adj=20 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 -132:sc= 0.62 USER MOD Set 1.2: A 102 THR OG1 : rot 180:sc= 0.558 USER MOD Set 2.1: A 11 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 94 GLN : amide:sc= -1.05 K(o=-1.1,f=-2.1!) USER MOD Single : A 6 GLN : amide:sc= 0 X(o=0,f=0.19) USER MOD Single : A 7 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 164:sc= -0.0363 (180deg=-0.262) USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= -0.283 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 37 HIS : +bothHN:sc= -7.27! C(o=-7.3!,f=-13!) USER MOD Single : A 39 LYS NZ :NH3+ -162:sc= -1.75 (180deg=-2.01) USER MOD Single : A 41 ASN : amide:sc=-0.000243 K(o=-0.00024,f=-1.3) USER MOD Single : A 44 MET CE :methyl 150:sc= -2.03 (180deg=-3.7!) USER MOD Single : A 51 HIS : no HD1:sc= -0.0566 K(o=-0.057,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 USER MOD Single : A 70 ASN : amide:sc= 0 X(o=0,f=-0.24) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 TYR OH : rot 47:sc= 0.215 USER MOD Single : A 83 THR OG1 : rot 180:sc= -1.49 USER MOD Single : A 84 TYR OH : rot 180:sc= -0.109 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 TYR OH : rot 15:sc= -1.04 USER MOD Single : A 96 ASN : amide:sc= -0.7 X(o=-0.7,f=-0.76) USER MOD Single : A 106 ASN : amide:sc= -1.17 X(o=-1.2,f=-1.4!) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 180:sc= 0.0881 USER MOD Single : A 115 SER OG : rot 42:sc= 1.04 USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 6 162.301 11.004 8.900 1.00 0.00 N ATOM 2 CA GLN A 6 163.133 10.953 7.669 1.00 0.00 C ATOM 3 C GLN A 6 164.612 11.136 7.995 1.00 0.00 C ATOM 4 O GLN A 6 165.088 12.258 8.163 1.00 0.00 O ATOM 5 CB GLN A 6 162.660 12.051 6.713 1.00 0.00 C ATOM 6 CG GLN A 6 162.550 13.421 7.362 1.00 0.00 C ATOM 7 CD GLN A 6 161.113 13.890 7.499 1.00 0.00 C ATOM 8 OE1 GLN A 6 160.372 13.413 8.358 1.00 0.00 O ATOM 9 NE2 GLN A 6 160.713 14.828 6.648 1.00 0.00 N ATOM 0 HA GLN A 6 163.020 9.975 7.201 1.00 0.00 H new ATOM 0 HB2 GLN A 6 163.352 12.111 5.873 1.00 0.00 H new ATOM 0 HB3 GLN A 6 161.688 11.772 6.306 1.00 0.00 H new ATOM 0 HG2 GLN A 6 163.013 13.390 8.348 1.00 0.00 H new ATOM 0 HG3 GLN A 6 163.109 14.145 6.770 1.00 0.00 H new ATOM 0 HE21 GLN A 6 161.362 15.195 5.952 1.00 0.00 H new ATOM 0 HE22 GLN A 6 159.757 15.181 6.691 1.00 0.00 H new ATOM 18 N TYR A 7 165.333 10.022 8.083 1.00 0.00 N ATOM 19 CA TYR A 7 166.759 10.056 8.388 1.00 0.00 C ATOM 20 C TYR A 7 167.582 10.169 7.115 1.00 0.00 C ATOM 21 O TYR A 7 167.050 10.111 6.005 1.00 0.00 O ATOM 22 CB TYR A 7 167.163 8.803 9.170 1.00 0.00 C ATOM 23 CG TYR A 7 168.596 8.795 9.648 1.00 0.00 C ATOM 24 CD1 TYR A 7 169.049 9.740 10.561 1.00 0.00 C ATOM 25 CD2 TYR A 7 169.498 7.845 9.186 1.00 0.00 C ATOM 26 CE1 TYR A 7 170.359 9.737 11.002 1.00 0.00 C ATOM 27 CE2 TYR A 7 170.810 7.835 9.622 1.00 0.00 C ATOM 28 CZ TYR A 7 171.235 8.783 10.529 1.00 0.00 C ATOM 29 OH TYR A 7 172.539 8.777 10.965 1.00 0.00 O ATOM 0 H TYR A 7 164.953 9.085 7.947 1.00 0.00 H new ATOM 0 HA TYR A 7 166.956 10.935 9.002 1.00 0.00 H new ATOM 0 HB2 TYR A 7 166.505 8.702 10.033 1.00 0.00 H new ATOM 0 HB3 TYR A 7 166.999 7.929 8.540 1.00 0.00 H new ATOM 0 HD1 TYR A 7 168.366 10.489 10.932 1.00 0.00 H new ATOM 0 HD2 TYR A 7 169.169 7.102 8.475 1.00 0.00 H new ATOM 0 HE1 TYR A 7 170.694 10.478 11.713 1.00 0.00 H new ATOM 0 HE2 TYR A 7 171.499 7.089 9.254 1.00 0.00 H new ATOM 0 HH TYR A 7 173.024 8.041 10.537 1.00 0.00 H new ATOM 39 N VAL A 8 168.883 10.338 7.284 1.00 0.00 N ATOM 40 CA VAL A 8 169.794 10.468 6.153 1.00 0.00 C ATOM 41 C VAL A 8 170.692 9.242 6.015 1.00 0.00 C ATOM 42 O VAL A 8 170.875 8.482 6.964 1.00 0.00 O ATOM 43 CB VAL A 8 170.679 11.722 6.286 1.00 0.00 C ATOM 44 CG1 VAL A 8 171.433 11.984 4.992 1.00 0.00 C ATOM 45 CG2 VAL A 8 169.840 12.930 6.677 1.00 0.00 C ATOM 0 H VAL A 8 169.336 10.389 8.197 1.00 0.00 H new ATOM 0 HA VAL A 8 169.173 10.559 5.262 1.00 0.00 H new ATOM 0 HB VAL A 8 171.410 11.546 7.075 1.00 0.00 H new ATOM 0 HG11 VAL A 8 172.053 12.874 5.106 1.00 0.00 H new ATOM 0 HG12 VAL A 8 172.067 11.128 4.760 1.00 0.00 H new ATOM 0 HG13 VAL A 8 170.721 12.139 4.181 1.00 0.00 H new ATOM 0 HG21 VAL A 8 170.483 13.806 6.766 1.00 0.00 H new ATOM 0 HG22 VAL A 8 169.084 13.111 5.913 1.00 0.00 H new ATOM 0 HG23 VAL A 8 169.351 12.740 7.633 1.00 0.00 H new ATOM 55 N VAL A 9 171.251 9.057 4.823 1.00 0.00 N ATOM 56 CA VAL A 9 172.129 7.923 4.556 1.00 0.00 C ATOM 57 C VAL A 9 173.429 8.032 5.358 1.00 0.00 C ATOM 58 O VAL A 9 174.061 9.088 5.389 1.00 0.00 O ATOM 59 CB VAL A 9 172.463 7.826 3.054 1.00 0.00 C ATOM 60 CG1 VAL A 9 173.020 9.147 2.545 1.00 0.00 C ATOM 61 CG2 VAL A 9 173.437 6.685 2.786 1.00 0.00 C ATOM 0 H VAL A 9 171.111 9.678 4.026 1.00 0.00 H new ATOM 0 HA VAL A 9 171.597 7.022 4.863 1.00 0.00 H new ATOM 0 HB VAL A 9 171.542 7.613 2.512 1.00 0.00 H new ATOM 0 HG11 VAL A 9 173.250 9.060 1.483 1.00 0.00 H new ATOM 0 HG12 VAL A 9 172.281 9.935 2.693 1.00 0.00 H new ATOM 0 HG13 VAL A 9 173.929 9.394 3.094 1.00 0.00 H new ATOM 0 HG21 VAL A 9 173.657 6.637 1.719 1.00 0.00 H new ATOM 0 HG22 VAL A 9 174.360 6.857 3.340 1.00 0.00 H new ATOM 0 HG23 VAL A 9 172.992 5.743 3.107 1.00 0.00 H new ATOM 71 N PRO A 10 173.849 6.936 6.022 1.00 0.00 N ATOM 72 CA PRO A 10 175.078 6.919 6.825 1.00 0.00 C ATOM 73 C PRO A 10 176.330 7.130 5.982 1.00 0.00 C ATOM 74 O PRO A 10 176.247 7.500 4.810 1.00 0.00 O ATOM 75 CB PRO A 10 175.097 5.516 7.449 1.00 0.00 C ATOM 76 CG PRO A 10 173.712 4.992 7.288 1.00 0.00 C ATOM 77 CD PRO A 10 173.164 5.635 6.050 1.00 0.00 C ATOM 0 HA PRO A 10 175.081 7.726 7.558 1.00 0.00 H new ATOM 0 HB2 PRO A 10 175.821 4.873 6.948 1.00 0.00 H new ATOM 0 HB3 PRO A 10 175.381 5.558 8.500 1.00 0.00 H new ATOM 0 HG2 PRO A 10 173.715 3.906 7.194 1.00 0.00 H new ATOM 0 HG3 PRO A 10 173.100 5.235 8.157 1.00 0.00 H new ATOM 0 HD2 PRO A 10 173.381 5.045 5.159 1.00 0.00 H new ATOM 0 HD3 PRO A 10 172.081 5.750 6.100 1.00 0.00 H new ATOM 85 N SER A 11 177.490 6.893 6.589 1.00 0.00 N ATOM 86 CA SER A 11 178.763 7.057 5.901 1.00 0.00 C ATOM 87 C SER A 11 179.411 5.707 5.611 1.00 0.00 C ATOM 88 O SER A 11 179.623 4.902 6.516 1.00 0.00 O ATOM 89 CB SER A 11 179.702 7.917 6.744 1.00 0.00 C ATOM 90 OG SER A 11 180.762 8.438 5.961 1.00 0.00 O ATOM 0 H SER A 11 177.572 6.586 7.558 1.00 0.00 H new ATOM 0 HA SER A 11 178.574 7.553 4.949 1.00 0.00 H new ATOM 0 HB2 SER A 11 179.142 8.737 7.194 1.00 0.00 H new ATOM 0 HB3 SER A 11 180.109 7.322 7.561 1.00 0.00 H new ATOM 0 HG SER A 11 181.347 8.986 6.525 1.00 0.00 H new ATOM 96 N ALA A 12 179.723 5.468 4.340 1.00 0.00 N ATOM 97 CA ALA A 12 180.346 4.216 3.930 1.00 0.00 C ATOM 98 C ALA A 12 181.859 4.254 4.126 1.00 0.00 C ATOM 99 O ALA A 12 182.581 4.879 3.348 1.00 0.00 O ATOM 100 CB ALA A 12 180.009 3.912 2.477 1.00 0.00 C ATOM 0 H ALA A 12 179.554 6.125 3.578 1.00 0.00 H new ATOM 0 HA ALA A 12 179.949 3.422 4.562 1.00 0.00 H new ATOM 0 HB1 ALA A 12 180.480 2.974 2.183 1.00 0.00 H new ATOM 0 HB2 ALA A 12 178.928 3.826 2.364 1.00 0.00 H new ATOM 0 HB3 ALA A 12 180.377 4.718 1.842 1.00 0.00 H new ATOM 106 N LYS A 13 182.331 3.575 5.166 1.00 0.00 N ATOM 107 CA LYS A 13 183.760 3.519 5.460 1.00 0.00 C ATOM 108 C LYS A 13 184.387 2.289 4.814 1.00 0.00 C ATOM 109 O LYS A 13 184.210 1.169 5.293 1.00 0.00 O ATOM 110 CB LYS A 13 183.992 3.492 6.973 1.00 0.00 C ATOM 111 CG LYS A 13 185.422 3.814 7.374 1.00 0.00 C ATOM 112 CD LYS A 13 185.617 5.304 7.596 1.00 0.00 C ATOM 113 CE LYS A 13 187.084 5.651 7.798 1.00 0.00 C ATOM 114 NZ LYS A 13 187.884 5.425 6.564 1.00 0.00 N ATOM 0 H LYS A 13 181.746 3.055 5.820 1.00 0.00 H new ATOM 0 HA LYS A 13 184.232 4.411 5.048 1.00 0.00 H new ATOM 0 HB2 LYS A 13 183.320 4.207 7.448 1.00 0.00 H new ATOM 0 HB3 LYS A 13 183.730 2.505 7.355 1.00 0.00 H new ATOM 0 HG2 LYS A 13 185.676 3.273 8.286 1.00 0.00 H new ATOM 0 HG3 LYS A 13 186.105 3.468 6.598 1.00 0.00 H new ATOM 0 HD2 LYS A 13 185.227 5.854 6.740 1.00 0.00 H new ATOM 0 HD3 LYS A 13 185.044 5.621 8.467 1.00 0.00 H new ATOM 0 HE2 LYS A 13 187.172 6.694 8.101 1.00 0.00 H new ATOM 0 HE3 LYS A 13 187.491 5.048 8.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 188.797 5.916 6.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 188.049 4.406 6.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 187.366 5.795 5.742 1.00 0.00 H new ATOM 128 N LEU A 14 185.105 2.501 3.716 1.00 0.00 N ATOM 129 CA LEU A 14 185.740 1.403 2.996 1.00 0.00 C ATOM 130 C LEU A 14 187.208 1.243 3.386 1.00 0.00 C ATOM 131 O LEU A 14 187.823 2.157 3.933 1.00 0.00 O ATOM 132 CB LEU A 14 185.628 1.629 1.488 1.00 0.00 C ATOM 133 CG LEU A 14 184.207 1.564 0.928 1.00 0.00 C ATOM 134 CD1 LEU A 14 183.556 2.938 0.966 1.00 0.00 C ATOM 135 CD2 LEU A 14 184.217 1.011 -0.492 1.00 0.00 C ATOM 0 H LEU A 14 185.262 3.422 3.306 1.00 0.00 H new ATOM 0 HA LEU A 14 185.218 0.486 3.269 1.00 0.00 H new ATOM 0 HB2 LEU A 14 186.052 2.605 1.250 1.00 0.00 H new ATOM 0 HB3 LEU A 14 186.238 0.883 0.978 1.00 0.00 H new ATOM 0 HG LEU A 14 183.620 0.890 1.552 1.00 0.00 H new ATOM 0 HD11 LEU A 14 182.545 2.873 0.564 1.00 0.00 H new ATOM 0 HD12 LEU A 14 183.515 3.293 1.996 1.00 0.00 H new ATOM 0 HD13 LEU A 14 184.141 3.635 0.366 1.00 0.00 H new ATOM 0 HD21 LEU A 14 183.197 0.972 -0.874 1.00 0.00 H new ATOM 0 HD22 LEU A 14 184.819 1.658 -1.130 1.00 0.00 H new ATOM 0 HD23 LEU A 14 184.642 0.007 -0.489 1.00 0.00 H new ATOM 147 N GLU A 15 187.753 0.068 3.088 1.00 0.00 N ATOM 148 CA GLU A 15 189.146 -0.244 3.387 1.00 0.00 C ATOM 149 C GLU A 15 189.710 -1.176 2.319 1.00 0.00 C ATOM 150 O GLU A 15 189.039 -2.117 1.895 1.00 0.00 O ATOM 151 CB GLU A 15 189.253 -0.897 4.766 1.00 0.00 C ATOM 152 CG GLU A 15 189.235 0.100 5.914 1.00 0.00 C ATOM 153 CD GLU A 15 189.228 -0.574 7.272 1.00 0.00 C ATOM 154 OE1 GLU A 15 188.132 -0.950 7.743 1.00 0.00 O ATOM 155 OE2 GLU A 15 190.315 -0.724 7.867 1.00 0.00 O ATOM 0 H GLU A 15 187.245 -0.691 2.635 1.00 0.00 H new ATOM 0 HA GLU A 15 189.724 0.680 3.391 1.00 0.00 H new ATOM 0 HB2 GLU A 15 188.428 -1.598 4.892 1.00 0.00 H new ATOM 0 HB3 GLU A 15 190.175 -1.477 4.814 1.00 0.00 H new ATOM 0 HG2 GLU A 15 190.107 0.750 5.840 1.00 0.00 H new ATOM 0 HG3 GLU A 15 188.355 0.736 5.824 1.00 0.00 H new ATOM 162 N ALA A 16 190.933 -0.908 1.862 1.00 0.00 N ATOM 163 CA ALA A 16 191.544 -1.733 0.822 1.00 0.00 C ATOM 164 C ALA A 16 192.263 -2.938 1.417 1.00 0.00 C ATOM 165 O ALA A 16 193.366 -2.822 1.950 1.00 0.00 O ATOM 166 CB ALA A 16 192.503 -0.899 -0.011 1.00 0.00 C ATOM 0 H ALA A 16 191.513 -0.136 2.191 1.00 0.00 H new ATOM 0 HA ALA A 16 190.748 -2.108 0.178 1.00 0.00 H new ATOM 0 HB1 ALA A 16 192.953 -1.524 -0.783 1.00 0.00 H new ATOM 0 HB2 ALA A 16 191.959 -0.079 -0.479 1.00 0.00 H new ATOM 0 HB3 ALA A 16 193.286 -0.496 0.631 1.00 0.00 H new ATOM 172 N ILE A 17 191.616 -4.096 1.319 1.00 0.00 N ATOM 173 CA ILE A 17 192.167 -5.340 1.846 1.00 0.00 C ATOM 174 C ILE A 17 193.291 -5.874 0.962 1.00 0.00 C ATOM 175 O ILE A 17 193.366 -5.560 -0.226 1.00 0.00 O ATOM 176 CB ILE A 17 191.075 -6.421 1.971 1.00 0.00 C ATOM 177 CG1 ILE A 17 189.840 -5.847 2.671 1.00 0.00 C ATOM 178 CG2 ILE A 17 191.605 -7.628 2.729 1.00 0.00 C ATOM 179 CD1 ILE A 17 190.131 -5.290 4.047 1.00 0.00 C ATOM 0 H ILE A 17 190.703 -4.198 0.876 1.00 0.00 H new ATOM 0 HA ILE A 17 192.569 -5.112 2.833 1.00 0.00 H new ATOM 0 HB ILE A 17 190.789 -6.744 0.970 1.00 0.00 H new ATOM 0 HG12 ILE A 17 189.414 -5.058 2.051 1.00 0.00 H new ATOM 0 HG13 ILE A 17 189.084 -6.628 2.756 1.00 0.00 H new ATOM 0 HG21 ILE A 17 190.821 -8.381 2.808 1.00 0.00 H new ATOM 0 HG22 ILE A 17 192.458 -8.047 2.195 1.00 0.00 H new ATOM 0 HG23 ILE A 17 191.916 -7.322 3.728 1.00 0.00 H new ATOM 0 HD11 ILE A 17 189.211 -4.900 4.484 1.00 0.00 H new ATOM 0 HD12 ILE A 17 190.528 -6.081 4.683 1.00 0.00 H new ATOM 0 HD13 ILE A 17 190.863 -4.487 3.967 1.00 0.00 H new ATOM 191 N TYR A 18 194.158 -6.687 1.556 1.00 0.00 N ATOM 192 CA TYR A 18 195.280 -7.278 0.835 1.00 0.00 C ATOM 193 C TYR A 18 195.180 -8.805 0.845 1.00 0.00 C ATOM 194 O TYR A 18 194.716 -9.393 1.821 1.00 0.00 O ATOM 195 CB TYR A 18 196.603 -6.839 1.467 1.00 0.00 C ATOM 196 CG TYR A 18 197.631 -6.365 0.464 1.00 0.00 C ATOM 197 CD1 TYR A 18 197.490 -5.142 -0.177 1.00 0.00 C ATOM 198 CD2 TYR A 18 198.740 -7.142 0.157 1.00 0.00 C ATOM 199 CE1 TYR A 18 198.427 -4.705 -1.096 1.00 0.00 C ATOM 200 CE2 TYR A 18 199.682 -6.713 -0.758 1.00 0.00 C ATOM 201 CZ TYR A 18 199.520 -5.495 -1.382 1.00 0.00 C ATOM 202 OH TYR A 18 200.456 -5.064 -2.295 1.00 0.00 O ATOM 0 H TYR A 18 194.105 -6.953 2.539 1.00 0.00 H new ATOM 0 HA TYR A 18 195.246 -6.932 -0.198 1.00 0.00 H new ATOM 0 HB2 TYR A 18 196.407 -6.037 2.179 1.00 0.00 H new ATOM 0 HB3 TYR A 18 197.019 -7.673 2.033 1.00 0.00 H new ATOM 0 HD1 TYR A 18 196.635 -4.521 0.045 1.00 0.00 H new ATOM 0 HD2 TYR A 18 198.868 -8.098 0.642 1.00 0.00 H new ATOM 0 HE1 TYR A 18 198.303 -3.751 -1.586 1.00 0.00 H new ATOM 0 HE2 TYR A 18 200.540 -7.329 -0.983 1.00 0.00 H new ATOM 0 HH TYR A 18 201.163 -5.737 -2.381 1.00 0.00 H new ATOM 212 N PRO A 19 195.612 -9.475 -0.242 1.00 0.00 N ATOM 213 CA PRO A 19 196.172 -8.834 -1.430 1.00 0.00 C ATOM 214 C PRO A 19 195.090 -8.369 -2.402 1.00 0.00 C ATOM 215 O PRO A 19 195.387 -7.764 -3.433 1.00 0.00 O ATOM 216 CB PRO A 19 197.024 -9.945 -2.071 1.00 0.00 C ATOM 217 CG PRO A 19 196.820 -11.171 -1.229 1.00 0.00 C ATOM 218 CD PRO A 19 195.590 -10.925 -0.401 1.00 0.00 C ATOM 0 HA PRO A 19 196.737 -7.936 -1.178 1.00 0.00 H new ATOM 0 HB2 PRO A 19 196.717 -10.125 -3.101 1.00 0.00 H new ATOM 0 HB3 PRO A 19 198.076 -9.662 -2.097 1.00 0.00 H new ATOM 0 HG2 PRO A 19 196.695 -12.054 -1.855 1.00 0.00 H new ATOM 0 HG3 PRO A 19 197.686 -11.352 -0.592 1.00 0.00 H new ATOM 0 HD2 PRO A 19 194.685 -11.266 -0.904 1.00 0.00 H new ATOM 0 HD3 PRO A 19 195.635 -11.441 0.558 1.00 0.00 H new ATOM 226 N ARG A 20 193.834 -8.654 -2.068 1.00 0.00 N ATOM 227 CA ARG A 20 192.717 -8.266 -2.908 1.00 0.00 C ATOM 228 C ARG A 20 191.389 -8.491 -2.192 1.00 0.00 C ATOM 229 O ARG A 20 190.866 -9.605 -2.166 1.00 0.00 O ATOM 230 CB ARG A 20 192.742 -9.042 -4.226 1.00 0.00 C ATOM 231 CG ARG A 20 192.816 -10.550 -4.040 1.00 0.00 C ATOM 232 CD ARG A 20 193.905 -11.171 -4.901 1.00 0.00 C ATOM 233 NE ARG A 20 193.414 -12.316 -5.664 1.00 0.00 N ATOM 234 CZ ARG A 20 192.659 -12.211 -6.755 1.00 0.00 C ATOM 235 NH1 ARG A 20 192.306 -11.017 -7.214 1.00 0.00 N ATOM 236 NH2 ARG A 20 192.256 -13.304 -7.389 1.00 0.00 N ATOM 0 H ARG A 20 193.570 -9.153 -1.219 1.00 0.00 H new ATOM 0 HA ARG A 20 192.814 -7.202 -3.124 1.00 0.00 H new ATOM 0 HB2 ARG A 20 191.848 -8.798 -4.799 1.00 0.00 H new ATOM 0 HB3 ARG A 20 193.598 -8.714 -4.816 1.00 0.00 H new ATOM 0 HG2 ARG A 20 193.007 -10.778 -2.991 1.00 0.00 H new ATOM 0 HG3 ARG A 20 191.854 -10.995 -4.293 1.00 0.00 H new ATOM 0 HD2 ARG A 20 194.297 -10.420 -5.587 1.00 0.00 H new ATOM 0 HD3 ARG A 20 194.733 -11.487 -4.266 1.00 0.00 H new ATOM 0 HE ARG A 20 193.665 -13.251 -5.342 1.00 0.00 H new ATOM 0 HH11 ARG A 20 192.613 -10.173 -6.730 1.00 0.00 H new ATOM 0 HH12 ARG A 20 191.727 -10.943 -8.051 1.00 0.00 H new ATOM 0 HH21 ARG A 20 192.525 -14.224 -7.040 1.00 0.00 H new ATOM 0 HH22 ARG A 20 191.677 -13.224 -8.225 1.00 0.00 H new ATOM 250 N GLY A 21 190.850 -7.423 -1.613 1.00 0.00 N ATOM 251 CA GLY A 21 189.587 -7.518 -0.906 1.00 0.00 C ATOM 252 C GLY A 21 188.952 -6.161 -0.674 1.00 0.00 C ATOM 253 O GLY A 21 189.416 -5.153 -1.207 1.00 0.00 O ATOM 0 H GLY A 21 191.267 -6.492 -1.621 1.00 0.00 H new ATOM 0 HA2 GLY A 21 188.901 -8.145 -1.476 1.00 0.00 H new ATOM 0 HA3 GLY A 21 189.747 -8.010 0.053 1.00 0.00 H new ATOM 257 N LEU A 22 187.885 -6.133 0.120 1.00 0.00 N ATOM 258 CA LEU A 22 187.186 -4.887 0.414 1.00 0.00 C ATOM 259 C LEU A 22 186.490 -4.956 1.769 1.00 0.00 C ATOM 260 O LEU A 22 185.902 -5.977 2.125 1.00 0.00 O ATOM 261 CB LEU A 22 186.163 -4.582 -0.685 1.00 0.00 C ATOM 262 CG LEU A 22 186.191 -3.150 -1.221 1.00 0.00 C ATOM 263 CD1 LEU A 22 185.964 -2.152 -0.097 1.00 0.00 C ATOM 264 CD2 LEU A 22 187.509 -2.871 -1.925 1.00 0.00 C ATOM 0 H LEU A 22 187.487 -6.957 0.570 1.00 0.00 H new ATOM 0 HA LEU A 22 187.924 -4.086 0.449 1.00 0.00 H new ATOM 0 HB2 LEU A 22 186.331 -5.267 -1.516 1.00 0.00 H new ATOM 0 HB3 LEU A 22 185.165 -4.789 -0.298 1.00 0.00 H new ATOM 0 HG LEU A 22 185.383 -3.039 -1.945 1.00 0.00 H new ATOM 0 HD11 LEU A 22 185.988 -1.139 -0.499 1.00 0.00 H new ATOM 0 HD12 LEU A 22 184.993 -2.337 0.363 1.00 0.00 H new ATOM 0 HD13 LEU A 22 186.748 -2.263 0.652 1.00 0.00 H new ATOM 0 HD21 LEU A 22 187.512 -1.848 -2.300 1.00 0.00 H new ATOM 0 HD22 LEU A 22 188.332 -3.002 -1.222 1.00 0.00 H new ATOM 0 HD23 LEU A 22 187.630 -3.563 -2.758 1.00 0.00 H new ATOM 276 N ARG A 23 186.560 -3.863 2.520 1.00 0.00 N ATOM 277 CA ARG A 23 185.936 -3.793 3.835 1.00 0.00 C ATOM 278 C ARG A 23 185.164 -2.487 3.995 1.00 0.00 C ATOM 279 O ARG A 23 185.753 -1.433 4.239 1.00 0.00 O ATOM 280 CB ARG A 23 186.995 -3.916 4.934 1.00 0.00 C ATOM 281 CG ARG A 23 186.677 -4.982 5.969 1.00 0.00 C ATOM 282 CD ARG A 23 185.369 -4.688 6.686 1.00 0.00 C ATOM 283 NE ARG A 23 185.117 -5.632 7.773 1.00 0.00 N ATOM 284 CZ ARG A 23 185.695 -5.556 8.969 1.00 0.00 C ATOM 285 NH1 ARG A 23 186.558 -4.584 9.236 1.00 0.00 N ATOM 286 NH2 ARG A 23 185.409 -6.455 9.902 1.00 0.00 N ATOM 0 H ARG A 23 187.045 -3.011 2.239 1.00 0.00 H new ATOM 0 HA ARG A 23 185.236 -4.623 3.926 1.00 0.00 H new ATOM 0 HB2 ARG A 23 187.958 -4.142 4.476 1.00 0.00 H new ATOM 0 HB3 ARG A 23 187.099 -2.954 5.436 1.00 0.00 H new ATOM 0 HG2 ARG A 23 186.616 -5.956 5.483 1.00 0.00 H new ATOM 0 HG3 ARG A 23 187.487 -5.038 6.696 1.00 0.00 H new ATOM 0 HD2 ARG A 23 185.394 -3.674 7.085 1.00 0.00 H new ATOM 0 HD3 ARG A 23 184.547 -4.729 5.972 1.00 0.00 H new ATOM 0 HE ARG A 23 184.460 -6.394 7.605 1.00 0.00 H new ATOM 0 HH11 ARG A 23 186.781 -3.890 8.523 1.00 0.00 H new ATOM 0 HH12 ARG A 23 186.998 -4.531 10.155 1.00 0.00 H new ATOM 0 HH21 ARG A 23 184.746 -7.204 9.702 1.00 0.00 H new ATOM 0 HH22 ARG A 23 185.852 -6.397 10.819 1.00 0.00 H new ATOM 300 N VAL A 24 183.844 -2.560 3.850 1.00 0.00 N ATOM 301 CA VAL A 24 182.998 -1.379 3.971 1.00 0.00 C ATOM 302 C VAL A 24 182.162 -1.420 5.247 1.00 0.00 C ATOM 303 O VAL A 24 181.902 -2.488 5.800 1.00 0.00 O ATOM 304 CB VAL A 24 182.051 -1.241 2.761 1.00 0.00 C ATOM 305 CG1 VAL A 24 181.373 0.120 2.767 1.00 0.00 C ATOM 306 CG2 VAL A 24 182.811 -1.460 1.460 1.00 0.00 C ATOM 0 H VAL A 24 183.339 -3.423 3.649 1.00 0.00 H new ATOM 0 HA VAL A 24 183.667 -0.519 4.007 1.00 0.00 H new ATOM 0 HB VAL A 24 181.279 -2.007 2.838 1.00 0.00 H new ATOM 0 HG11 VAL A 24 180.709 0.199 1.906 1.00 0.00 H new ATOM 0 HG12 VAL A 24 180.794 0.234 3.684 1.00 0.00 H new ATOM 0 HG13 VAL A 24 182.129 0.903 2.715 1.00 0.00 H new ATOM 0 HG21 VAL A 24 182.127 -1.359 0.618 1.00 0.00 H new ATOM 0 HG22 VAL A 24 183.605 -0.719 1.373 1.00 0.00 H new ATOM 0 HG23 VAL A 24 183.246 -2.460 1.456 1.00 0.00 H new ATOM 316 N SER A 25 181.744 -0.244 5.707 1.00 0.00 N ATOM 317 CA SER A 25 180.936 -0.134 6.917 1.00 0.00 C ATOM 318 C SER A 25 180.101 1.144 6.893 1.00 0.00 C ATOM 319 O SER A 25 180.530 2.164 6.357 1.00 0.00 O ATOM 320 CB SER A 25 181.831 -0.154 8.159 1.00 0.00 C ATOM 321 OG SER A 25 183.103 -0.702 7.864 1.00 0.00 O ATOM 0 H SER A 25 181.952 0.648 5.258 1.00 0.00 H new ATOM 0 HA SER A 25 180.261 -0.989 6.956 1.00 0.00 H new ATOM 0 HB2 SER A 25 181.949 0.860 8.542 1.00 0.00 H new ATOM 0 HB3 SER A 25 181.354 -0.739 8.945 1.00 0.00 H new ATOM 0 HG SER A 25 183.655 -0.702 8.674 1.00 0.00 H new ATOM 327 N ILE A 26 178.905 1.081 7.468 1.00 0.00 N ATOM 328 CA ILE A 26 178.013 2.238 7.497 1.00 0.00 C ATOM 329 C ILE A 26 177.223 2.304 8.805 1.00 0.00 C ATOM 330 O ILE A 26 176.490 1.372 9.137 1.00 0.00 O ATOM 331 CB ILE A 26 177.011 2.192 6.330 1.00 0.00 C ATOM 332 CG1 ILE A 26 176.349 0.816 6.261 1.00 0.00 C ATOM 333 CG2 ILE A 26 177.705 2.523 5.018 1.00 0.00 C ATOM 334 CD1 ILE A 26 174.843 0.875 6.121 1.00 0.00 C ATOM 0 H ILE A 26 178.531 0.246 7.919 1.00 0.00 H new ATOM 0 HA ILE A 26 178.645 3.122 7.410 1.00 0.00 H new ATOM 0 HB ILE A 26 176.237 2.941 6.502 1.00 0.00 H new ATOM 0 HG12 ILE A 26 176.763 0.265 5.417 1.00 0.00 H new ATOM 0 HG13 ILE A 26 176.600 0.255 7.161 1.00 0.00 H new ATOM 0 HG21 ILE A 26 176.981 2.486 4.204 1.00 0.00 H new ATOM 0 HG22 ILE A 26 178.135 3.523 5.076 1.00 0.00 H new ATOM 0 HG23 ILE A 26 178.497 1.798 4.832 1.00 0.00 H new ATOM 0 HD11 ILE A 26 174.442 -0.138 6.078 1.00 0.00 H new ATOM 0 HD12 ILE A 26 174.418 1.398 6.978 1.00 0.00 H new ATOM 0 HD13 ILE A 26 174.583 1.407 5.206 1.00 0.00 H new ATOM 346 N PRO A 27 177.343 3.413 9.563 1.00 0.00 N ATOM 347 CA PRO A 27 176.614 3.577 10.824 1.00 0.00 C ATOM 348 C PRO A 27 175.107 3.461 10.616 1.00 0.00 C ATOM 349 O PRO A 27 174.459 4.397 10.148 1.00 0.00 O ATOM 350 CB PRO A 27 176.992 4.987 11.297 1.00 0.00 C ATOM 351 CG PRO A 27 177.583 5.667 10.107 1.00 0.00 C ATOM 352 CD PRO A 27 178.176 4.584 9.251 1.00 0.00 C ATOM 0 HA PRO A 27 176.871 2.806 11.550 1.00 0.00 H new ATOM 0 HB2 PRO A 27 176.117 5.525 11.661 1.00 0.00 H new ATOM 0 HB3 PRO A 27 177.706 4.946 12.119 1.00 0.00 H new ATOM 0 HG2 PRO A 27 176.822 6.222 9.559 1.00 0.00 H new ATOM 0 HG3 PRO A 27 178.346 6.385 10.409 1.00 0.00 H new ATOM 0 HD2 PRO A 27 178.132 4.839 8.192 1.00 0.00 H new ATOM 0 HD3 PRO A 27 179.224 4.408 9.493 1.00 0.00 H new ATOM 360 N ASP A 28 174.563 2.297 10.950 1.00 0.00 N ATOM 361 CA ASP A 28 173.138 2.035 10.787 1.00 0.00 C ATOM 362 C ASP A 28 172.289 2.957 11.653 1.00 0.00 C ATOM 363 O ASP A 28 172.761 3.515 12.644 1.00 0.00 O ATOM 364 CB ASP A 28 172.825 0.575 11.129 1.00 0.00 C ATOM 365 CG ASP A 28 171.340 0.261 11.077 1.00 0.00 C ATOM 366 OD1 ASP A 28 170.656 0.772 10.167 1.00 0.00 O ATOM 367 OD2 ASP A 28 170.863 -0.497 11.948 1.00 0.00 O ATOM 0 H ASP A 28 175.091 1.515 11.338 1.00 0.00 H new ATOM 0 HA ASP A 28 172.889 2.229 9.744 1.00 0.00 H new ATOM 0 HB2 ASP A 28 173.354 -0.077 10.434 1.00 0.00 H new ATOM 0 HB3 ASP A 28 173.204 0.351 12.126 1.00 0.00 H new ATOM 372 N ASP A 29 171.027 3.089 11.272 1.00 0.00 N ATOM 373 CA ASP A 29 170.076 3.914 12.000 1.00 0.00 C ATOM 374 C ASP A 29 168.722 3.220 12.036 1.00 0.00 C ATOM 375 O ASP A 29 167.679 3.841 11.830 1.00 0.00 O ATOM 376 CB ASP A 29 169.951 5.294 11.349 1.00 0.00 C ATOM 377 CG ASP A 29 170.014 6.419 12.364 1.00 0.00 C ATOM 378 OD1 ASP A 29 170.946 6.416 13.197 1.00 0.00 O ATOM 379 OD2 ASP A 29 169.133 7.304 12.325 1.00 0.00 O ATOM 0 H ASP A 29 170.635 2.628 10.451 1.00 0.00 H new ATOM 0 HA ASP A 29 170.435 4.052 13.020 1.00 0.00 H new ATOM 0 HB2 ASP A 29 170.750 5.422 10.619 1.00 0.00 H new ATOM 0 HB3 ASP A 29 169.009 5.352 10.804 1.00 0.00 H new ATOM 384 N GLY A 30 168.756 1.917 12.298 1.00 0.00 N ATOM 385 CA GLY A 30 167.548 1.133 12.358 1.00 0.00 C ATOM 386 C GLY A 30 166.916 0.932 10.995 1.00 0.00 C ATOM 387 O GLY A 30 165.707 1.095 10.834 1.00 0.00 O ATOM 0 H GLY A 30 169.612 1.390 12.471 1.00 0.00 H new ATOM 0 HA2 GLY A 30 167.771 0.161 12.798 1.00 0.00 H new ATOM 0 HA3 GLY A 30 166.833 1.624 13.017 1.00 0.00 H new ATOM 391 N PHE A 31 167.737 0.579 10.010 1.00 0.00 N ATOM 392 CA PHE A 31 167.248 0.357 8.656 1.00 0.00 C ATOM 393 C PHE A 31 166.849 -1.093 8.441 1.00 0.00 C ATOM 394 O PHE A 31 166.812 -1.894 9.376 1.00 0.00 O ATOM 395 CB PHE A 31 168.312 0.738 7.626 1.00 0.00 C ATOM 396 CG PHE A 31 168.956 2.067 7.893 1.00 0.00 C ATOM 397 CD1 PHE A 31 168.184 3.182 8.166 1.00 0.00 C ATOM 398 CD2 PHE A 31 170.334 2.197 7.874 1.00 0.00 C ATOM 399 CE1 PHE A 31 168.775 4.406 8.414 1.00 0.00 C ATOM 400 CE2 PHE A 31 170.931 3.416 8.123 1.00 0.00 C ATOM 401 CZ PHE A 31 170.150 4.523 8.393 1.00 0.00 C ATOM 0 H PHE A 31 168.741 0.441 10.125 1.00 0.00 H new ATOM 0 HA PHE A 31 166.369 0.989 8.525 1.00 0.00 H new ATOM 0 HB2 PHE A 31 169.082 -0.033 7.609 1.00 0.00 H new ATOM 0 HB3 PHE A 31 167.857 0.756 6.636 1.00 0.00 H new ATOM 0 HD1 PHE A 31 167.108 3.095 8.185 1.00 0.00 H new ATOM 0 HD2 PHE A 31 170.949 1.335 7.662 1.00 0.00 H new ATOM 0 HE1 PHE A 31 168.162 5.270 8.624 1.00 0.00 H new ATOM 0 HE2 PHE A 31 172.007 3.504 8.107 1.00 0.00 H new ATOM 0 HZ PHE A 31 170.615 5.478 8.587 1.00 0.00 H new ATOM 411 N SER A 32 166.561 -1.415 7.190 1.00 0.00 N ATOM 412 CA SER A 32 166.170 -2.755 6.804 1.00 0.00 C ATOM 413 C SER A 32 166.980 -3.223 5.603 1.00 0.00 C ATOM 414 O SER A 32 167.208 -4.420 5.437 1.00 0.00 O ATOM 415 CB SER A 32 164.676 -2.807 6.484 1.00 0.00 C ATOM 416 OG SER A 32 164.317 -4.055 5.918 1.00 0.00 O ATOM 0 H SER A 32 166.593 -0.752 6.416 1.00 0.00 H new ATOM 0 HA SER A 32 166.371 -3.423 7.641 1.00 0.00 H new ATOM 0 HB2 SER A 32 164.100 -2.638 7.394 1.00 0.00 H new ATOM 0 HB3 SER A 32 164.421 -2.004 5.792 1.00 0.00 H new ATOM 0 HG SER A 32 163.356 -4.062 5.724 1.00 0.00 H new ATOM 422 N LEU A 33 167.426 -2.283 4.764 1.00 0.00 N ATOM 423 CA LEU A 33 168.220 -2.662 3.595 1.00 0.00 C ATOM 424 C LEU A 33 169.372 -1.706 3.350 1.00 0.00 C ATOM 425 O LEU A 33 169.204 -0.491 3.390 1.00 0.00 O ATOM 426 CB LEU A 33 167.366 -2.718 2.330 1.00 0.00 C ATOM 427 CG LEU A 33 167.958 -3.569 1.205 1.00 0.00 C ATOM 428 CD1 LEU A 33 167.822 -5.050 1.515 1.00 0.00 C ATOM 429 CD2 LEU A 33 167.300 -3.237 -0.126 1.00 0.00 C ATOM 0 H LEU A 33 167.257 -1.283 4.868 1.00 0.00 H new ATOM 0 HA LEU A 33 168.618 -3.652 3.817 1.00 0.00 H new ATOM 0 HB2 LEU A 33 166.382 -3.111 2.587 1.00 0.00 H new ATOM 0 HB3 LEU A 33 167.217 -1.703 1.962 1.00 0.00 H new ATOM 0 HG LEU A 33 169.020 -3.335 1.130 1.00 0.00 H new ATOM 0 HD11 LEU A 33 168.250 -5.633 0.700 1.00 0.00 H new ATOM 0 HD12 LEU A 33 168.350 -5.278 2.441 1.00 0.00 H new ATOM 0 HD13 LEU A 33 166.768 -5.303 1.627 1.00 0.00 H new ATOM 0 HD21 LEU A 33 167.736 -3.854 -0.912 1.00 0.00 H new ATOM 0 HD22 LEU A 33 166.230 -3.434 -0.062 1.00 0.00 H new ATOM 0 HD23 LEU A 33 167.462 -2.185 -0.359 1.00 0.00 H new ATOM 441 N PHE A 34 170.538 -2.273 3.066 1.00 0.00 N ATOM 442 CA PHE A 34 171.728 -1.494 2.775 1.00 0.00 C ATOM 443 C PHE A 34 172.301 -1.907 1.419 1.00 0.00 C ATOM 444 O PHE A 34 172.884 -2.984 1.287 1.00 0.00 O ATOM 445 CB PHE A 34 172.774 -1.694 3.864 1.00 0.00 C ATOM 446 CG PHE A 34 174.080 -1.011 3.570 1.00 0.00 C ATOM 447 CD1 PHE A 34 174.113 0.334 3.237 1.00 0.00 C ATOM 448 CD2 PHE A 34 175.272 -1.716 3.612 1.00 0.00 C ATOM 449 CE1 PHE A 34 175.310 0.963 2.954 1.00 0.00 C ATOM 450 CE2 PHE A 34 176.473 -1.092 3.332 1.00 0.00 C ATOM 451 CZ PHE A 34 176.491 0.249 3.002 1.00 0.00 C ATOM 0 H PHE A 34 170.682 -3.282 3.032 1.00 0.00 H new ATOM 0 HA PHE A 34 171.456 -0.439 2.743 1.00 0.00 H new ATOM 0 HB2 PHE A 34 172.381 -1.318 4.809 1.00 0.00 H new ATOM 0 HB3 PHE A 34 172.952 -2.761 3.995 1.00 0.00 H new ATOM 0 HD1 PHE A 34 173.192 0.897 3.198 1.00 0.00 H new ATOM 0 HD2 PHE A 34 175.263 -2.766 3.867 1.00 0.00 H new ATOM 0 HE1 PHE A 34 175.322 2.012 2.696 1.00 0.00 H new ATOM 0 HE2 PHE A 34 177.396 -1.652 3.371 1.00 0.00 H new ATOM 0 HZ PHE A 34 177.428 0.739 2.782 1.00 0.00 H new ATOM 461 N ALA A 35 172.131 -1.053 0.415 1.00 0.00 N ATOM 462 CA ALA A 35 172.632 -1.344 -0.921 1.00 0.00 C ATOM 463 C ALA A 35 173.862 -0.504 -1.238 1.00 0.00 C ATOM 464 O ALA A 35 173.795 0.723 -1.280 1.00 0.00 O ATOM 465 CB ALA A 35 171.544 -1.106 -1.958 1.00 0.00 C ATOM 0 H ALA A 35 171.652 -0.157 0.502 1.00 0.00 H new ATOM 0 HA ALA A 35 172.923 -2.394 -0.953 1.00 0.00 H new ATOM 0 HB1 ALA A 35 171.934 -1.328 -2.952 1.00 0.00 H new ATOM 0 HB2 ALA A 35 170.694 -1.755 -1.749 1.00 0.00 H new ATOM 0 HB3 ALA A 35 171.224 -0.065 -1.918 1.00 0.00 H new ATOM 471 N PHE A 36 174.986 -1.174 -1.459 1.00 0.00 N ATOM 472 CA PHE A 36 176.232 -0.487 -1.769 1.00 0.00 C ATOM 473 C PHE A 36 176.586 -0.651 -3.243 1.00 0.00 C ATOM 474 O PHE A 36 176.686 -1.768 -3.743 1.00 0.00 O ATOM 475 CB PHE A 36 177.367 -1.026 -0.895 1.00 0.00 C ATOM 476 CG PHE A 36 178.699 -0.388 -1.178 1.00 0.00 C ATOM 477 CD1 PHE A 36 178.890 0.968 -0.974 1.00 0.00 C ATOM 478 CD2 PHE A 36 179.758 -1.148 -1.648 1.00 0.00 C ATOM 479 CE1 PHE A 36 180.113 1.557 -1.234 1.00 0.00 C ATOM 480 CE2 PHE A 36 180.984 -0.566 -1.911 1.00 0.00 C ATOM 481 CZ PHE A 36 181.161 0.789 -1.702 1.00 0.00 C ATOM 0 H PHE A 36 175.060 -2.191 -1.429 1.00 0.00 H new ATOM 0 HA PHE A 36 176.097 0.574 -1.561 1.00 0.00 H new ATOM 0 HB2 PHE A 36 177.113 -0.868 0.153 1.00 0.00 H new ATOM 0 HB3 PHE A 36 177.450 -2.102 -1.045 1.00 0.00 H new ATOM 0 HD1 PHE A 36 178.074 1.573 -0.607 1.00 0.00 H new ATOM 0 HD2 PHE A 36 179.624 -2.207 -1.811 1.00 0.00 H new ATOM 0 HE1 PHE A 36 180.249 2.616 -1.071 1.00 0.00 H new ATOM 0 HE2 PHE A 36 181.801 -1.168 -2.279 1.00 0.00 H new ATOM 0 HZ PHE A 36 182.118 1.247 -1.905 1.00 0.00 H new ATOM 491 N HIS A 37 176.778 0.473 -3.924 1.00 0.00 N ATOM 492 CA HIS A 37 177.127 0.472 -5.334 1.00 0.00 C ATOM 493 C HIS A 37 178.400 1.284 -5.544 1.00 0.00 C ATOM 494 O HIS A 37 178.494 2.414 -5.065 1.00 0.00 O ATOM 495 CB HIS A 37 175.985 1.072 -6.144 1.00 0.00 C ATOM 496 CG HIS A 37 175.516 0.194 -7.261 1.00 0.00 C ATOM 497 ND1 HIS A 37 174.187 -0.097 -7.479 1.00 0.00 N ATOM 498 CD2 HIS A 37 176.207 -0.466 -8.217 1.00 0.00 C ATOM 499 CE1 HIS A 37 174.079 -0.902 -8.522 1.00 0.00 C ATOM 500 NE2 HIS A 37 175.292 -1.140 -8.989 1.00 0.00 N ATOM 0 H HIS A 37 176.696 1.404 -3.515 1.00 0.00 H new ATOM 0 HA HIS A 37 177.298 -0.552 -5.667 1.00 0.00 H new ATOM 0 HB2 HIS A 37 175.147 1.277 -5.478 1.00 0.00 H new ATOM 0 HB3 HIS A 37 176.306 2.029 -6.556 1.00 0.00 H new ATOM 0 HD1 HIS A 37 173.408 0.254 -6.922 1.00 0.00 H new ATOM 0 HD2 HIS A 37 177.279 -0.464 -8.349 1.00 0.00 H new ATOM 0 HE1 HIS A 37 173.158 -1.297 -8.923 1.00 0.00 H new ATOM 0 HE2 HIS A 37 175.513 -1.729 -9.792 1.00 0.00 H new ATOM 509 N GLY A 38 179.389 0.721 -6.239 1.00 0.00 N ATOM 510 CA GLY A 38 180.623 1.462 -6.439 1.00 0.00 C ATOM 511 C GLY A 38 181.462 0.979 -7.603 1.00 0.00 C ATOM 512 O GLY A 38 181.605 -0.221 -7.825 1.00 0.00 O ATOM 0 H GLY A 38 179.360 -0.209 -6.656 1.00 0.00 H new ATOM 0 HA2 GLY A 38 180.380 2.513 -6.594 1.00 0.00 H new ATOM 0 HA3 GLY A 38 181.219 1.403 -5.528 1.00 0.00 H new ATOM 516 N LYS A 39 182.037 1.932 -8.332 1.00 0.00 N ATOM 517 CA LYS A 39 182.893 1.625 -9.471 1.00 0.00 C ATOM 518 C LYS A 39 184.314 2.121 -9.212 1.00 0.00 C ATOM 519 O LYS A 39 184.512 3.234 -8.721 1.00 0.00 O ATOM 520 CB LYS A 39 182.338 2.264 -10.747 1.00 0.00 C ATOM 521 CG LYS A 39 182.417 1.359 -11.965 1.00 0.00 C ATOM 522 CD LYS A 39 183.852 1.150 -12.417 1.00 0.00 C ATOM 523 CE LYS A 39 183.914 0.493 -13.787 1.00 0.00 C ATOM 524 NZ LYS A 39 183.631 1.463 -14.882 1.00 0.00 N ATOM 0 H LYS A 39 181.923 2.929 -8.151 1.00 0.00 H new ATOM 0 HA LYS A 39 182.915 0.543 -9.605 1.00 0.00 H new ATOM 0 HB2 LYS A 39 181.298 2.544 -10.580 1.00 0.00 H new ATOM 0 HB3 LYS A 39 182.887 3.183 -10.952 1.00 0.00 H new ATOM 0 HG2 LYS A 39 181.965 0.395 -11.732 1.00 0.00 H new ATOM 0 HG3 LYS A 39 181.838 1.794 -12.780 1.00 0.00 H new ATOM 0 HD2 LYS A 39 184.368 2.110 -12.449 1.00 0.00 H new ATOM 0 HD3 LYS A 39 184.377 0.530 -11.691 1.00 0.00 H new ATOM 0 HE2 LYS A 39 184.901 0.056 -13.936 1.00 0.00 H new ATOM 0 HE3 LYS A 39 183.194 -0.324 -13.831 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 183.382 0.945 -15.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 182.838 2.077 -14.606 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 184.475 2.045 -15.057 1.00 0.00 H new ATOM 538 N LEU A 40 185.296 1.287 -9.534 1.00 0.00 N ATOM 539 CA LEU A 40 186.695 1.641 -9.327 1.00 0.00 C ATOM 540 C LEU A 40 187.284 2.316 -10.564 1.00 0.00 C ATOM 541 O LEU A 40 187.232 1.772 -11.667 1.00 0.00 O ATOM 542 CB LEU A 40 187.504 0.391 -8.971 1.00 0.00 C ATOM 543 CG LEU A 40 189.015 0.601 -8.851 1.00 0.00 C ATOM 544 CD1 LEU A 40 189.391 0.970 -7.424 1.00 0.00 C ATOM 545 CD2 LEU A 40 189.764 -0.647 -9.295 1.00 0.00 C ATOM 0 H LEU A 40 185.150 0.362 -9.939 1.00 0.00 H new ATOM 0 HA LEU A 40 186.747 2.350 -8.501 1.00 0.00 H new ATOM 0 HB2 LEU A 40 187.133 -0.005 -8.026 1.00 0.00 H new ATOM 0 HB3 LEU A 40 187.319 -0.370 -9.730 1.00 0.00 H new ATOM 0 HG LEU A 40 189.301 1.425 -9.505 1.00 0.00 H new ATOM 0 HD11 LEU A 40 190.469 1.115 -7.358 1.00 0.00 H new ATOM 0 HD12 LEU A 40 188.882 1.891 -7.140 1.00 0.00 H new ATOM 0 HD13 LEU A 40 189.091 0.168 -6.750 1.00 0.00 H new ATOM 0 HD21 LEU A 40 190.837 -0.479 -9.203 1.00 0.00 H new ATOM 0 HD22 LEU A 40 189.473 -1.489 -8.667 1.00 0.00 H new ATOM 0 HD23 LEU A 40 189.519 -0.868 -10.334 1.00 0.00 H new ATOM 557 N ASN A 41 187.855 3.502 -10.364 1.00 0.00 N ATOM 558 CA ASN A 41 188.470 4.257 -11.453 1.00 0.00 C ATOM 559 C ASN A 41 187.432 4.701 -12.484 1.00 0.00 C ATOM 560 O ASN A 41 187.618 4.505 -13.685 1.00 0.00 O ATOM 561 CB ASN A 41 189.555 3.420 -12.134 1.00 0.00 C ATOM 562 CG ASN A 41 190.613 4.277 -12.800 1.00 0.00 C ATOM 563 OD1 ASN A 41 190.384 5.450 -13.093 1.00 0.00 O ATOM 564 ND2 ASN A 41 191.781 3.694 -13.044 1.00 0.00 N ATOM 0 H ASN A 41 187.904 3.962 -9.455 1.00 0.00 H new ATOM 0 HA ASN A 41 188.921 5.150 -11.021 1.00 0.00 H new ATOM 0 HB2 ASN A 41 190.028 2.773 -11.395 1.00 0.00 H new ATOM 0 HB3 ASN A 41 189.095 2.771 -12.879 1.00 0.00 H new ATOM 0 HD21 ASN A 41 192.531 4.222 -13.491 1.00 0.00 H new ATOM 0 HD22 ASN A 41 191.928 2.719 -12.784 1.00 0.00 H new ATOM 571 N GLU A 42 186.349 5.312 -12.005 1.00 0.00 N ATOM 572 CA GLU A 42 185.284 5.801 -12.874 1.00 0.00 C ATOM 573 C GLU A 42 184.081 6.231 -12.046 1.00 0.00 C ATOM 574 O GLU A 42 183.392 5.403 -11.451 1.00 0.00 O ATOM 575 CB GLU A 42 184.852 4.739 -13.890 1.00 0.00 C ATOM 576 CG GLU A 42 183.737 5.211 -14.808 1.00 0.00 C ATOM 577 CD GLU A 42 183.327 4.160 -15.821 1.00 0.00 C ATOM 578 OE1 GLU A 42 184.225 3.535 -16.424 1.00 0.00 O ATOM 579 OE2 GLU A 42 182.108 3.962 -16.012 1.00 0.00 O ATOM 0 H GLU A 42 186.187 5.480 -11.012 1.00 0.00 H new ATOM 0 HA GLU A 42 185.677 6.658 -13.421 1.00 0.00 H new ATOM 0 HB2 GLU A 42 185.713 4.450 -14.493 1.00 0.00 H new ATOM 0 HB3 GLU A 42 184.522 3.847 -13.357 1.00 0.00 H new ATOM 0 HG2 GLU A 42 182.871 5.488 -14.207 1.00 0.00 H new ATOM 0 HG3 GLU A 42 184.061 6.109 -15.334 1.00 0.00 H new ATOM 586 N GLU A 43 183.838 7.533 -12.013 1.00 0.00 N ATOM 587 CA GLU A 43 182.722 8.088 -11.257 1.00 0.00 C ATOM 588 C GLU A 43 181.406 7.426 -11.638 1.00 0.00 C ATOM 589 O GLU A 43 181.375 6.459 -12.401 1.00 0.00 O ATOM 590 CB GLU A 43 182.618 9.595 -11.478 1.00 0.00 C ATOM 591 CG GLU A 43 183.902 10.329 -11.164 1.00 0.00 C ATOM 592 CD GLU A 43 183.799 11.824 -11.400 1.00 0.00 C ATOM 593 OE1 GLU A 43 183.584 12.227 -12.564 1.00 0.00 O ATOM 594 OE2 GLU A 43 183.934 12.591 -10.425 1.00 0.00 O ATOM 0 H GLU A 43 184.401 8.229 -12.503 1.00 0.00 H new ATOM 0 HA GLU A 43 182.915 7.890 -10.203 1.00 0.00 H new ATOM 0 HB2 GLU A 43 182.341 9.786 -12.515 1.00 0.00 H new ATOM 0 HB3 GLU A 43 181.817 9.993 -10.855 1.00 0.00 H new ATOM 0 HG2 GLU A 43 184.173 10.148 -10.124 1.00 0.00 H new ATOM 0 HG3 GLU A 43 184.706 9.924 -11.778 1.00 0.00 H new ATOM 601 N MET A 44 180.324 7.959 -11.094 1.00 0.00 N ATOM 602 CA MET A 44 178.993 7.429 -11.360 1.00 0.00 C ATOM 603 C MET A 44 178.046 8.543 -11.794 1.00 0.00 C ATOM 604 O MET A 44 177.712 9.431 -11.009 1.00 0.00 O ATOM 605 CB MET A 44 178.437 6.726 -10.117 1.00 0.00 C ATOM 606 CG MET A 44 179.508 6.178 -9.184 1.00 0.00 C ATOM 607 SD MET A 44 179.808 4.415 -9.421 1.00 0.00 S ATOM 608 CE MET A 44 178.260 3.722 -8.845 1.00 0.00 C ATOM 0 H MET A 44 180.340 8.761 -10.464 1.00 0.00 H new ATOM 0 HA MET A 44 179.073 6.704 -12.170 1.00 0.00 H new ATOM 0 HB2 MET A 44 177.813 7.428 -9.564 1.00 0.00 H new ATOM 0 HB3 MET A 44 177.792 5.907 -10.434 1.00 0.00 H new ATOM 0 HG2 MET A 44 180.437 6.725 -9.345 1.00 0.00 H new ATOM 0 HG3 MET A 44 179.208 6.355 -8.151 1.00 0.00 H new ATOM 0 HE1 MET A 44 178.056 2.794 -9.379 1.00 0.00 H new ATOM 0 HE2 MET A 44 178.328 3.518 -7.776 1.00 0.00 H new ATOM 0 HE3 MET A 44 177.453 4.431 -9.029 1.00 0.00 H new ATOM 618 N ASP A 45 177.621 8.492 -13.051 1.00 0.00 N ATOM 619 CA ASP A 45 176.726 9.480 -13.603 1.00 0.00 C ATOM 620 C ASP A 45 175.281 9.177 -13.212 1.00 0.00 C ATOM 621 O ASP A 45 174.415 8.999 -14.068 1.00 0.00 O ATOM 622 CB ASP A 45 176.874 9.510 -15.127 1.00 0.00 C ATOM 623 CG ASP A 45 177.634 8.325 -15.697 1.00 0.00 C ATOM 624 OD1 ASP A 45 178.878 8.308 -15.585 1.00 0.00 O ATOM 625 OD2 ASP A 45 176.983 7.415 -16.255 1.00 0.00 O ATOM 0 H ASP A 45 177.892 7.761 -13.709 1.00 0.00 H new ATOM 0 HA ASP A 45 176.986 10.458 -13.199 1.00 0.00 H new ATOM 0 HB2 ASP A 45 175.882 9.543 -15.578 1.00 0.00 H new ATOM 0 HB3 ASP A 45 177.385 10.429 -15.414 1.00 0.00 H new ATOM 630 N GLY A 46 175.033 9.120 -11.910 1.00 0.00 N ATOM 631 CA GLY A 46 173.713 8.842 -11.418 1.00 0.00 C ATOM 632 C GLY A 46 173.461 7.366 -11.244 1.00 0.00 C ATOM 633 O GLY A 46 173.168 6.654 -12.205 1.00 0.00 O ATOM 0 H GLY A 46 175.736 9.264 -11.185 1.00 0.00 H new ATOM 0 HA2 GLY A 46 173.571 9.347 -10.462 1.00 0.00 H new ATOM 0 HA3 GLY A 46 172.977 9.254 -12.108 1.00 0.00 H new ATOM 637 N LEU A 47 173.558 6.928 -9.999 1.00 0.00 N ATOM 638 CA LEU A 47 173.333 5.543 -9.612 1.00 0.00 C ATOM 639 C LEU A 47 173.562 4.565 -10.761 1.00 0.00 C ATOM 640 O LEU A 47 172.616 4.088 -11.387 1.00 0.00 O ATOM 641 CB LEU A 47 171.918 5.412 -9.067 1.00 0.00 C ATOM 642 CG LEU A 47 171.374 6.685 -8.419 1.00 0.00 C ATOM 643 CD1 LEU A 47 169.884 6.553 -8.139 1.00 0.00 C ATOM 644 CD2 LEU A 47 172.140 6.987 -7.142 1.00 0.00 C ATOM 0 H LEU A 47 173.799 7.535 -9.215 1.00 0.00 H new ATOM 0 HA LEU A 47 174.060 5.282 -8.843 1.00 0.00 H new ATOM 0 HB2 LEU A 47 171.254 5.119 -9.880 1.00 0.00 H new ATOM 0 HB3 LEU A 47 171.897 4.607 -8.333 1.00 0.00 H new ATOM 0 HG LEU A 47 171.511 7.516 -9.111 1.00 0.00 H new ATOM 0 HD11 LEU A 47 169.518 7.470 -7.678 1.00 0.00 H new ATOM 0 HD12 LEU A 47 169.352 6.380 -9.074 1.00 0.00 H new ATOM 0 HD13 LEU A 47 169.714 5.714 -7.464 1.00 0.00 H new ATOM 0 HD21 LEU A 47 171.745 7.896 -6.687 1.00 0.00 H new ATOM 0 HD22 LEU A 47 172.029 6.155 -6.446 1.00 0.00 H new ATOM 0 HD23 LEU A 47 173.196 7.127 -7.375 1.00 0.00 H new ATOM 656 N GLU A 48 174.830 4.273 -11.025 1.00 0.00 N ATOM 657 CA GLU A 48 175.198 3.353 -12.094 1.00 0.00 C ATOM 658 C GLU A 48 175.554 1.983 -11.528 1.00 0.00 C ATOM 659 O GLU A 48 175.906 1.857 -10.355 1.00 0.00 O ATOM 660 CB GLU A 48 176.379 3.908 -12.892 1.00 0.00 C ATOM 661 CG GLU A 48 176.026 5.130 -13.726 1.00 0.00 C ATOM 662 CD GLU A 48 175.832 4.798 -15.193 1.00 0.00 C ATOM 663 OE1 GLU A 48 176.468 3.835 -15.673 1.00 0.00 O ATOM 664 OE2 GLU A 48 175.042 5.498 -15.860 1.00 0.00 O ATOM 0 H GLU A 48 175.622 4.661 -10.512 1.00 0.00 H new ATOM 0 HA GLU A 48 174.340 3.244 -12.758 1.00 0.00 H new ATOM 0 HB2 GLU A 48 177.183 4.168 -12.203 1.00 0.00 H new ATOM 0 HB3 GLU A 48 176.762 3.127 -13.549 1.00 0.00 H new ATOM 0 HG2 GLU A 48 175.114 5.581 -13.335 1.00 0.00 H new ATOM 0 HG3 GLU A 48 176.817 5.874 -13.627 1.00 0.00 H new ATOM 671 N ALA A 49 175.460 0.956 -12.369 1.00 0.00 N ATOM 672 CA ALA A 49 175.769 -0.406 -11.954 1.00 0.00 C ATOM 673 C ALA A 49 177.142 -0.490 -11.291 1.00 0.00 C ATOM 674 O ALA A 49 177.396 -1.380 -10.482 1.00 0.00 O ATOM 675 CB ALA A 49 175.701 -1.348 -13.147 1.00 0.00 C ATOM 0 H ALA A 49 175.172 1.044 -13.343 1.00 0.00 H new ATOM 0 HA ALA A 49 175.024 -0.708 -11.218 1.00 0.00 H new ATOM 0 HB1 ALA A 49 175.934 -2.362 -12.823 1.00 0.00 H new ATOM 0 HB2 ALA A 49 174.698 -1.324 -13.573 1.00 0.00 H new ATOM 0 HB3 ALA A 49 176.422 -1.033 -13.901 1.00 0.00 H new ATOM 681 N GLY A 50 178.023 0.445 -11.644 1.00 0.00 N ATOM 682 CA GLY A 50 179.363 0.470 -11.080 1.00 0.00 C ATOM 683 C GLY A 50 179.997 -0.905 -10.992 1.00 0.00 C ATOM 684 O GLY A 50 180.090 -1.622 -11.988 1.00 0.00 O ATOM 0 H GLY A 50 177.830 1.189 -12.314 1.00 0.00 H new ATOM 0 HA2 GLY A 50 179.995 1.117 -11.689 1.00 0.00 H new ATOM 0 HA3 GLY A 50 179.323 0.910 -10.083 1.00 0.00 H new ATOM 688 N HIS A 51 180.428 -1.270 -9.791 1.00 0.00 N ATOM 689 CA HIS A 51 181.052 -2.565 -9.556 1.00 0.00 C ATOM 690 C HIS A 51 180.533 -3.174 -8.262 1.00 0.00 C ATOM 691 O HIS A 51 179.737 -4.112 -8.280 1.00 0.00 O ATOM 692 CB HIS A 51 182.576 -2.427 -9.502 1.00 0.00 C ATOM 693 CG HIS A 51 183.264 -2.886 -10.750 1.00 0.00 C ATOM 694 ND1 HIS A 51 183.123 -2.250 -11.966 1.00 0.00 N ATOM 695 CD2 HIS A 51 184.105 -3.926 -10.967 1.00 0.00 C ATOM 696 CE1 HIS A 51 183.845 -2.879 -12.876 1.00 0.00 C ATOM 697 NE2 HIS A 51 184.453 -3.898 -12.296 1.00 0.00 N ATOM 0 H HIS A 51 180.356 -0.683 -8.960 1.00 0.00 H new ATOM 0 HA HIS A 51 180.794 -3.226 -10.383 1.00 0.00 H new ATOM 0 HB2 HIS A 51 182.832 -1.383 -9.319 1.00 0.00 H new ATOM 0 HB3 HIS A 51 182.955 -3.001 -8.656 1.00 0.00 H new ATOM 0 HD2 HIS A 51 184.440 -4.643 -10.232 1.00 0.00 H new ATOM 0 HE1 HIS A 51 183.925 -2.606 -13.918 1.00 0.00 H new ATOM 0 HE2 HIS A 51 185.079 -4.557 -12.759 1.00 0.00 H new ATOM 706 N TRP A 52 180.976 -2.620 -7.137 1.00 0.00 N ATOM 707 CA TRP A 52 180.539 -3.097 -5.834 1.00 0.00 C ATOM 708 C TRP A 52 179.042 -2.873 -5.681 1.00 0.00 C ATOM 709 O TRP A 52 178.616 -1.878 -5.103 1.00 0.00 O ATOM 710 CB TRP A 52 181.293 -2.368 -4.724 1.00 0.00 C ATOM 711 CG TRP A 52 182.768 -2.602 -4.773 1.00 0.00 C ATOM 712 CD1 TRP A 52 183.410 -3.791 -4.594 1.00 0.00 C ATOM 713 CD2 TRP A 52 183.786 -1.627 -5.024 1.00 0.00 C ATOM 714 NE1 TRP A 52 184.764 -3.618 -4.717 1.00 0.00 N ATOM 715 CE2 TRP A 52 185.023 -2.296 -4.979 1.00 0.00 C ATOM 716 CE3 TRP A 52 183.772 -0.254 -5.282 1.00 0.00 C ATOM 717 CZ2 TRP A 52 186.234 -1.638 -5.183 1.00 0.00 C ATOM 718 CZ3 TRP A 52 184.974 0.399 -5.485 1.00 0.00 C ATOM 719 CH2 TRP A 52 186.190 -0.294 -5.434 1.00 0.00 C ATOM 0 H TRP A 52 181.635 -1.843 -7.104 1.00 0.00 H new ATOM 0 HA TRP A 52 180.752 -4.163 -5.758 1.00 0.00 H new ATOM 0 HB2 TRP A 52 181.097 -1.298 -4.800 1.00 0.00 H new ATOM 0 HB3 TRP A 52 180.910 -2.694 -3.757 1.00 0.00 H new ATOM 0 HD1 TRP A 52 182.923 -4.732 -4.386 1.00 0.00 H new ATOM 0 HE1 TRP A 52 185.466 -4.353 -4.628 1.00 0.00 H new ATOM 0 HE3 TRP A 52 182.839 0.288 -5.322 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 187.173 -2.170 -5.144 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 184.975 1.460 -5.686 1.00 0.00 H new ATOM 0 HH2 TRP A 52 187.112 0.244 -5.596 1.00 0.00 H new ATOM 730 N ALA A 53 178.260 -3.800 -6.223 1.00 0.00 N ATOM 731 CA ALA A 53 176.803 -3.716 -6.171 1.00 0.00 C ATOM 732 C ALA A 53 176.210 -4.895 -5.412 1.00 0.00 C ATOM 733 O ALA A 53 175.968 -5.954 -5.990 1.00 0.00 O ATOM 734 CB ALA A 53 176.229 -3.652 -7.578 1.00 0.00 C ATOM 0 H ALA A 53 178.613 -4.625 -6.707 1.00 0.00 H new ATOM 0 HA ALA A 53 176.536 -2.804 -5.637 1.00 0.00 H new ATOM 0 HB1 ALA A 53 175.142 -3.590 -7.525 1.00 0.00 H new ATOM 0 HB2 ALA A 53 176.618 -2.772 -8.090 1.00 0.00 H new ATOM 0 HB3 ALA A 53 176.515 -4.548 -8.129 1.00 0.00 H new ATOM 740 N ARG A 54 175.991 -4.721 -4.115 1.00 0.00 N ATOM 741 CA ARG A 54 175.447 -5.788 -3.297 1.00 0.00 C ATOM 742 C ARG A 54 174.452 -5.262 -2.263 1.00 0.00 C ATOM 743 O ARG A 54 174.769 -4.369 -1.476 1.00 0.00 O ATOM 744 CB ARG A 54 176.597 -6.511 -2.610 1.00 0.00 C ATOM 745 CG ARG A 54 176.159 -7.680 -1.743 1.00 0.00 C ATOM 746 CD ARG A 54 176.031 -8.959 -2.555 1.00 0.00 C ATOM 747 NE ARG A 54 174.994 -8.856 -3.579 1.00 0.00 N ATOM 748 CZ ARG A 54 173.695 -9.005 -3.337 1.00 0.00 C ATOM 749 NH1 ARG A 54 173.266 -9.263 -2.107 1.00 0.00 N ATOM 750 NH2 ARG A 54 172.818 -8.897 -4.327 1.00 0.00 N ATOM 0 H ARG A 54 176.182 -3.854 -3.612 1.00 0.00 H new ATOM 0 HA ARG A 54 174.900 -6.478 -3.940 1.00 0.00 H new ATOM 0 HB2 ARG A 54 177.290 -6.874 -3.369 1.00 0.00 H new ATOM 0 HB3 ARG A 54 177.144 -5.799 -1.993 1.00 0.00 H new ATOM 0 HG2 ARG A 54 176.880 -7.829 -0.939 1.00 0.00 H new ATOM 0 HG3 ARG A 54 175.203 -7.448 -1.274 1.00 0.00 H new ATOM 0 HD2 ARG A 54 176.987 -9.185 -3.028 1.00 0.00 H new ATOM 0 HD3 ARG A 54 175.801 -9.790 -1.888 1.00 0.00 H new ATOM 0 HE ARG A 54 175.284 -8.658 -4.537 1.00 0.00 H new ATOM 0 HH11 ARG A 54 173.934 -9.348 -1.341 1.00 0.00 H new ATOM 0 HH12 ARG A 54 172.268 -9.376 -1.928 1.00 0.00 H new ATOM 0 HH21 ARG A 54 173.140 -8.700 -5.274 1.00 0.00 H new ATOM 0 HH22 ARG A 54 171.822 -9.011 -4.141 1.00 0.00 H new ATOM 764 N ASP A 55 173.248 -5.832 -2.270 1.00 0.00 N ATOM 765 CA ASP A 55 172.198 -5.442 -1.338 1.00 0.00 C ATOM 766 C ASP A 55 172.259 -6.285 -0.069 1.00 0.00 C ATOM 767 O ASP A 55 172.359 -7.511 -0.132 1.00 0.00 O ATOM 768 CB ASP A 55 170.828 -5.600 -1.998 1.00 0.00 C ATOM 769 CG ASP A 55 170.674 -6.926 -2.719 1.00 0.00 C ATOM 770 OD1 ASP A 55 170.798 -7.978 -2.056 1.00 0.00 O ATOM 771 OD2 ASP A 55 170.428 -6.913 -3.942 1.00 0.00 O ATOM 0 H ASP A 55 172.977 -6.572 -2.918 1.00 0.00 H new ATOM 0 HA ASP A 55 172.351 -4.397 -1.068 1.00 0.00 H new ATOM 0 HB2 ASP A 55 170.051 -5.512 -1.238 1.00 0.00 H new ATOM 0 HB3 ASP A 55 170.675 -4.786 -2.707 1.00 0.00 H new ATOM 776 N ILE A 56 172.203 -5.626 1.083 1.00 0.00 N ATOM 777 CA ILE A 56 172.255 -6.321 2.366 1.00 0.00 C ATOM 778 C ILE A 56 170.967 -6.107 3.156 1.00 0.00 C ATOM 779 O ILE A 56 170.373 -5.031 3.115 1.00 0.00 O ATOM 780 CB ILE A 56 173.451 -5.852 3.217 1.00 0.00 C ATOM 781 CG1 ILE A 56 174.696 -5.676 2.343 1.00 0.00 C ATOM 782 CG2 ILE A 56 173.723 -6.844 4.338 1.00 0.00 C ATOM 783 CD1 ILE A 56 175.912 -5.203 3.110 1.00 0.00 C ATOM 0 H ILE A 56 172.122 -4.612 1.156 1.00 0.00 H new ATOM 0 HA ILE A 56 172.374 -7.382 2.146 1.00 0.00 H new ATOM 0 HB ILE A 56 173.204 -4.887 3.660 1.00 0.00 H new ATOM 0 HG12 ILE A 56 174.928 -6.625 1.860 1.00 0.00 H new ATOM 0 HG13 ILE A 56 174.475 -4.961 1.551 1.00 0.00 H new ATOM 0 HG21 ILE A 56 174.570 -6.500 4.931 1.00 0.00 H new ATOM 0 HG22 ILE A 56 172.842 -6.923 4.975 1.00 0.00 H new ATOM 0 HG23 ILE A 56 173.951 -7.821 3.912 1.00 0.00 H new ATOM 0 HD11 ILE A 56 176.756 -5.101 2.427 1.00 0.00 H new ATOM 0 HD12 ILE A 56 175.699 -4.238 3.571 1.00 0.00 H new ATOM 0 HD13 ILE A 56 176.158 -5.929 3.885 1.00 0.00 H new ATOM 795 N THR A 57 170.541 -7.141 3.877 1.00 0.00 N ATOM 796 CA THR A 57 169.323 -7.065 4.678 1.00 0.00 C ATOM 797 C THR A 57 169.551 -7.625 6.079 1.00 0.00 C ATOM 798 O THR A 57 168.615 -8.098 6.726 1.00 0.00 O ATOM 799 CB THR A 57 168.190 -7.834 3.991 1.00 0.00 C ATOM 800 OG1 THR A 57 168.447 -7.983 2.605 1.00 0.00 O ATOM 801 CG2 THR A 57 166.840 -7.166 4.138 1.00 0.00 C ATOM 0 H THR A 57 171.021 -8.040 3.923 1.00 0.00 H new ATOM 0 HA THR A 57 169.045 -6.015 4.768 1.00 0.00 H new ATOM 0 HB THR A 57 168.157 -8.802 4.490 1.00 0.00 H new ATOM 0 HG1 THR A 57 167.712 -8.478 2.187 1.00 0.00 H new ATOM 0 HG21 THR A 57 166.082 -7.761 3.629 1.00 0.00 H new ATOM 0 HG22 THR A 57 166.588 -7.084 5.195 1.00 0.00 H new ATOM 0 HG23 THR A 57 166.877 -6.170 3.696 1.00 0.00 H new ATOM 809 N LYS A 58 170.794 -7.569 6.546 1.00 0.00 N ATOM 810 CA LYS A 58 171.136 -8.074 7.872 1.00 0.00 C ATOM 811 C LYS A 58 172.360 -7.357 8.436 1.00 0.00 C ATOM 812 O LYS A 58 173.494 -7.767 8.192 1.00 0.00 O ATOM 813 CB LYS A 58 171.401 -9.580 7.811 1.00 0.00 C ATOM 814 CG LYS A 58 170.160 -10.411 7.528 1.00 0.00 C ATOM 815 CD LYS A 58 169.157 -10.328 8.670 1.00 0.00 C ATOM 816 CE LYS A 58 169.048 -11.650 9.413 1.00 0.00 C ATOM 817 NZ LYS A 58 168.788 -11.450 10.865 1.00 0.00 N ATOM 0 H LYS A 58 171.581 -7.179 6.027 1.00 0.00 H new ATOM 0 HA LYS A 58 170.291 -7.882 8.533 1.00 0.00 H new ATOM 0 HB2 LYS A 58 172.143 -9.778 7.038 1.00 0.00 H new ATOM 0 HB3 LYS A 58 171.834 -9.902 8.758 1.00 0.00 H new ATOM 0 HG2 LYS A 58 169.692 -10.065 6.606 1.00 0.00 H new ATOM 0 HG3 LYS A 58 170.446 -11.451 7.369 1.00 0.00 H new ATOM 0 HD2 LYS A 58 169.458 -9.543 9.364 1.00 0.00 H new ATOM 0 HD3 LYS A 58 168.179 -10.048 8.277 1.00 0.00 H new ATOM 0 HE2 LYS A 58 168.245 -12.245 8.979 1.00 0.00 H new ATOM 0 HE3 LYS A 58 169.970 -12.216 9.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 168.720 -12.375 11.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 169.567 -10.904 11.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 167.895 -10.932 10.990 1.00 0.00 H new ATOM 831 N PRO A 59 172.149 -6.273 9.205 1.00 0.00 N ATOM 832 CA PRO A 59 173.247 -5.508 9.804 1.00 0.00 C ATOM 833 C PRO A 59 174.202 -6.392 10.593 1.00 0.00 C ATOM 834 O PRO A 59 174.070 -7.616 10.605 1.00 0.00 O ATOM 835 CB PRO A 59 172.536 -4.537 10.749 1.00 0.00 C ATOM 836 CG PRO A 59 171.169 -4.386 10.179 1.00 0.00 C ATOM 837 CD PRO A 59 170.830 -5.711 9.551 1.00 0.00 C ATOM 0 HA PRO A 59 173.858 -5.020 9.045 1.00 0.00 H new ATOM 0 HB2 PRO A 59 172.500 -4.929 11.765 1.00 0.00 H new ATOM 0 HB3 PRO A 59 173.054 -3.579 10.795 1.00 0.00 H new ATOM 0 HG2 PRO A 59 170.449 -4.127 10.956 1.00 0.00 H new ATOM 0 HG3 PRO A 59 171.141 -3.586 9.439 1.00 0.00 H new ATOM 0 HD2 PRO A 59 170.287 -6.356 10.242 1.00 0.00 H new ATOM 0 HD3 PRO A 59 170.202 -5.588 8.669 1.00 0.00 H new ATOM 845 N LYS A 60 175.153 -5.757 11.266 1.00 0.00 N ATOM 846 CA LYS A 60 176.127 -6.478 12.080 1.00 0.00 C ATOM 847 C LYS A 60 175.908 -6.157 13.553 1.00 0.00 C ATOM 848 O LYS A 60 175.816 -7.053 14.394 1.00 0.00 O ATOM 849 CB LYS A 60 177.551 -6.104 11.666 1.00 0.00 C ATOM 850 CG LYS A 60 178.625 -6.873 12.417 1.00 0.00 C ATOM 851 CD LYS A 60 179.114 -6.104 13.635 1.00 0.00 C ATOM 852 CE LYS A 60 180.190 -6.872 14.384 1.00 0.00 C ATOM 853 NZ LYS A 60 180.978 -5.986 15.287 1.00 0.00 N ATOM 0 H LYS A 60 175.272 -4.744 11.265 1.00 0.00 H new ATOM 0 HA LYS A 60 175.992 -7.548 11.924 1.00 0.00 H new ATOM 0 HB2 LYS A 60 177.668 -6.283 10.597 1.00 0.00 H new ATOM 0 HB3 LYS A 60 177.699 -5.036 11.829 1.00 0.00 H new ATOM 0 HG2 LYS A 60 178.230 -7.839 12.730 1.00 0.00 H new ATOM 0 HG3 LYS A 60 179.464 -7.073 11.751 1.00 0.00 H new ATOM 0 HD2 LYS A 60 179.507 -5.137 13.322 1.00 0.00 H new ATOM 0 HD3 LYS A 60 178.275 -5.906 14.303 1.00 0.00 H new ATOM 0 HE2 LYS A 60 179.728 -7.668 14.968 1.00 0.00 H new ATOM 0 HE3 LYS A 60 180.860 -7.350 13.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 181.702 -6.548 15.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 181.440 -5.242 14.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 180.343 -5.550 15.986 1.00 0.00 H new ATOM 867 N GLU A 61 175.814 -4.868 13.845 1.00 0.00 N ATOM 868 CA GLU A 61 175.590 -4.386 15.200 1.00 0.00 C ATOM 869 C GLU A 61 175.533 -2.873 15.190 1.00 0.00 C ATOM 870 O GLU A 61 176.533 -2.197 15.436 1.00 0.00 O ATOM 871 CB GLU A 61 176.686 -4.876 16.149 1.00 0.00 C ATOM 872 CG GLU A 61 176.420 -4.543 17.608 1.00 0.00 C ATOM 873 CD GLU A 61 177.575 -4.925 18.512 1.00 0.00 C ATOM 874 OE1 GLU A 61 177.606 -6.084 18.977 1.00 0.00 O ATOM 875 OE2 GLU A 61 178.447 -4.066 18.757 1.00 0.00 O ATOM 0 H GLU A 61 175.891 -4.126 13.149 1.00 0.00 H new ATOM 0 HA GLU A 61 174.641 -4.783 15.562 1.00 0.00 H new ATOM 0 HB2 GLU A 61 176.790 -5.956 16.044 1.00 0.00 H new ATOM 0 HB3 GLU A 61 177.637 -4.434 15.852 1.00 0.00 H new ATOM 0 HG2 GLU A 61 176.226 -3.475 17.704 1.00 0.00 H new ATOM 0 HG3 GLU A 61 175.519 -5.061 17.937 1.00 0.00 H new ATOM 882 N GLY A 62 174.364 -2.347 14.851 1.00 0.00 N ATOM 883 CA GLY A 62 174.208 -0.916 14.754 1.00 0.00 C ATOM 884 C GLY A 62 174.944 -0.381 13.542 1.00 0.00 C ATOM 885 O GLY A 62 174.977 0.827 13.307 1.00 0.00 O ATOM 0 H GLY A 62 173.524 -2.887 14.642 1.00 0.00 H new ATOM 0 HA2 GLY A 62 173.150 -0.664 14.684 1.00 0.00 H new ATOM 0 HA3 GLY A 62 174.590 -0.441 15.657 1.00 0.00 H new ATOM 889 N ARG A 63 175.539 -1.295 12.768 1.00 0.00 N ATOM 890 CA ARG A 63 176.280 -0.922 11.571 1.00 0.00 C ATOM 891 C ARG A 63 176.379 -2.096 10.601 1.00 0.00 C ATOM 892 O ARG A 63 176.584 -3.236 11.018 1.00 0.00 O ATOM 893 CB ARG A 63 177.681 -0.438 11.948 1.00 0.00 C ATOM 894 CG ARG A 63 178.379 0.335 10.840 1.00 0.00 C ATOM 895 CD ARG A 63 179.889 0.195 10.930 1.00 0.00 C ATOM 896 NE ARG A 63 180.449 0.971 12.035 1.00 0.00 N ATOM 897 CZ ARG A 63 180.724 2.270 11.964 1.00 0.00 C ATOM 898 NH1 ARG A 63 180.490 2.948 10.846 1.00 0.00 N ATOM 899 NH2 ARG A 63 181.235 2.897 13.014 1.00 0.00 N ATOM 0 H ARG A 63 175.518 -2.298 12.954 1.00 0.00 H new ATOM 0 HA ARG A 63 175.741 -0.113 11.077 1.00 0.00 H new ATOM 0 HB2 ARG A 63 177.611 0.195 12.832 1.00 0.00 H new ATOM 0 HB3 ARG A 63 178.292 -1.299 12.219 1.00 0.00 H new ATOM 0 HG2 ARG A 63 178.036 -0.027 9.871 1.00 0.00 H new ATOM 0 HG3 ARG A 63 178.106 1.388 10.902 1.00 0.00 H new ATOM 0 HD2 ARG A 63 180.148 -0.856 11.058 1.00 0.00 H new ATOM 0 HD3 ARG A 63 180.339 0.522 9.993 1.00 0.00 H new ATOM 0 HE ARG A 63 180.640 0.487 12.912 1.00 0.00 H new ATOM 0 HH11 ARG A 63 180.097 2.472 10.034 1.00 0.00 H new ATOM 0 HH12 ARG A 63 180.704 3.944 10.800 1.00 0.00 H new ATOM 0 HH21 ARG A 63 181.417 2.383 13.876 1.00 0.00 H new ATOM 0 HH22 ARG A 63 181.446 3.893 12.960 1.00 0.00 H new ATOM 913 N TRP A 64 176.251 -1.817 9.307 1.00 0.00 N ATOM 914 CA TRP A 64 176.349 -2.856 8.301 1.00 0.00 C ATOM 915 C TRP A 64 177.793 -3.027 7.858 1.00 0.00 C ATOM 916 O TRP A 64 178.599 -2.099 7.950 1.00 0.00 O ATOM 917 CB TRP A 64 175.483 -2.525 7.093 1.00 0.00 C ATOM 918 CG TRP A 64 174.076 -2.135 7.436 1.00 0.00 C ATOM 919 CD1 TRP A 64 173.677 -1.077 8.199 1.00 0.00 C ATOM 920 CD2 TRP A 64 172.874 -2.805 7.023 1.00 0.00 C ATOM 921 NE1 TRP A 64 172.306 -1.050 8.287 1.00 0.00 N ATOM 922 CE2 TRP A 64 171.791 -2.096 7.574 1.00 0.00 C ATOM 923 CE3 TRP A 64 172.610 -3.933 6.241 1.00 0.00 C ATOM 924 CZ2 TRP A 64 170.467 -2.476 7.370 1.00 0.00 C ATOM 925 CZ3 TRP A 64 171.294 -4.310 6.039 1.00 0.00 C ATOM 926 CH2 TRP A 64 170.237 -3.582 6.602 1.00 0.00 C ATOM 0 H TRP A 64 176.080 -0.882 8.937 1.00 0.00 H new ATOM 0 HA TRP A 64 175.994 -3.787 8.744 1.00 0.00 H new ATOM 0 HB2 TRP A 64 175.949 -1.711 6.538 1.00 0.00 H new ATOM 0 HB3 TRP A 64 175.457 -3.390 6.430 1.00 0.00 H new ATOM 0 HD1 TRP A 64 174.341 -0.365 8.666 1.00 0.00 H new ATOM 0 HE1 TRP A 64 171.760 -0.360 8.802 1.00 0.00 H new ATOM 0 HE3 TRP A 64 173.418 -4.500 5.803 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 169.651 -1.916 7.803 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 171.078 -5.180 5.437 1.00 0.00 H new ATOM 0 HH2 TRP A 64 169.221 -3.902 6.425 1.00 0.00 H new ATOM 937 N THR A 65 178.107 -4.219 7.380 1.00 0.00 N ATOM 938 CA THR A 65 179.454 -4.533 6.917 1.00 0.00 C ATOM 939 C THR A 65 179.423 -5.272 5.585 1.00 0.00 C ATOM 940 O THR A 65 178.856 -6.360 5.482 1.00 0.00 O ATOM 941 CB THR A 65 180.190 -5.372 7.962 1.00 0.00 C ATOM 942 OG1 THR A 65 179.808 -4.992 9.272 1.00 0.00 O ATOM 943 CG2 THR A 65 181.695 -5.254 7.872 1.00 0.00 C ATOM 0 H THR A 65 177.445 -4.991 7.301 1.00 0.00 H new ATOM 0 HA THR A 65 179.985 -3.593 6.771 1.00 0.00 H new ATOM 0 HB THR A 65 179.909 -6.404 7.752 1.00 0.00 H new ATOM 0 HG1 THR A 65 180.289 -5.542 9.925 1.00 0.00 H new ATOM 0 HG21 THR A 65 182.155 -5.874 8.641 1.00 0.00 H new ATOM 0 HG22 THR A 65 182.028 -5.588 6.889 1.00 0.00 H new ATOM 0 HG23 THR A 65 181.988 -4.215 8.020 1.00 0.00 H new ATOM 951 N PHE A 66 180.041 -4.682 4.570 1.00 0.00 N ATOM 952 CA PHE A 66 180.092 -5.295 3.247 1.00 0.00 C ATOM 953 C PHE A 66 181.523 -5.681 2.889 1.00 0.00 C ATOM 954 O PHE A 66 182.355 -4.822 2.596 1.00 0.00 O ATOM 955 CB PHE A 66 179.527 -4.342 2.191 1.00 0.00 C ATOM 956 CG PHE A 66 179.555 -4.908 0.799 1.00 0.00 C ATOM 957 CD1 PHE A 66 179.159 -6.214 0.559 1.00 0.00 C ATOM 958 CD2 PHE A 66 179.980 -4.133 -0.269 1.00 0.00 C ATOM 959 CE1 PHE A 66 179.185 -6.737 -0.720 1.00 0.00 C ATOM 960 CE2 PHE A 66 180.007 -4.652 -1.550 1.00 0.00 C ATOM 961 CZ PHE A 66 179.611 -5.955 -1.775 1.00 0.00 C ATOM 0 H PHE A 66 180.514 -3.781 4.636 1.00 0.00 H new ATOM 0 HA PHE A 66 179.481 -6.198 3.268 1.00 0.00 H new ATOM 0 HB2 PHE A 66 178.499 -4.091 2.452 1.00 0.00 H new ATOM 0 HB3 PHE A 66 180.097 -3.413 2.209 1.00 0.00 H new ATOM 0 HD1 PHE A 66 178.826 -6.830 1.381 1.00 0.00 H new ATOM 0 HD2 PHE A 66 180.293 -3.114 -0.099 1.00 0.00 H new ATOM 0 HE1 PHE A 66 178.872 -7.756 -0.894 1.00 0.00 H new ATOM 0 HE2 PHE A 66 180.338 -4.038 -2.375 1.00 0.00 H new ATOM 0 HZ PHE A 66 179.634 -6.362 -2.775 1.00 0.00 H new ATOM 971 N ARG A 67 181.805 -6.981 2.918 1.00 0.00 N ATOM 972 CA ARG A 67 183.137 -7.481 2.601 1.00 0.00 C ATOM 973 C ARG A 67 183.177 -8.074 1.195 1.00 0.00 C ATOM 974 O ARG A 67 182.247 -8.759 0.771 1.00 0.00 O ATOM 975 CB ARG A 67 183.564 -8.535 3.626 1.00 0.00 C ATOM 976 CG ARG A 67 184.536 -8.006 4.670 1.00 0.00 C ATOM 977 CD ARG A 67 185.896 -8.680 4.560 1.00 0.00 C ATOM 978 NE ARG A 67 185.924 -9.970 5.245 1.00 0.00 N ATOM 979 CZ ARG A 67 185.961 -10.108 6.567 1.00 0.00 C ATOM 980 NH1 ARG A 67 185.977 -9.038 7.352 1.00 0.00 N ATOM 981 NH2 ARG A 67 185.984 -11.319 7.107 1.00 0.00 N ATOM 0 H ARG A 67 181.128 -7.706 3.158 1.00 0.00 H new ATOM 0 HA ARG A 67 183.832 -6.643 2.640 1.00 0.00 H new ATOM 0 HB2 ARG A 67 182.678 -8.922 4.129 1.00 0.00 H new ATOM 0 HB3 ARG A 67 184.025 -9.373 3.103 1.00 0.00 H new ATOM 0 HG2 ARG A 67 184.652 -6.929 4.548 1.00 0.00 H new ATOM 0 HG3 ARG A 67 184.127 -8.172 5.667 1.00 0.00 H new ATOM 0 HD2 ARG A 67 186.146 -8.822 3.509 1.00 0.00 H new ATOM 0 HD3 ARG A 67 186.659 -8.028 4.984 1.00 0.00 H new ATOM 0 HE ARG A 67 185.915 -10.816 4.675 1.00 0.00 H new ATOM 0 HH11 ARG A 67 185.961 -8.104 6.942 1.00 0.00 H new ATOM 0 HH12 ARG A 67 186.005 -9.149 8.366 1.00 0.00 H new ATOM 0 HH21 ARG A 67 185.973 -12.145 6.508 1.00 0.00 H new ATOM 0 HH22 ARG A 67 186.012 -11.425 8.121 1.00 0.00 H new ATOM 995 N ASP A 68 184.263 -7.803 0.478 1.00 0.00 N ATOM 996 CA ASP A 68 184.433 -8.309 -0.878 1.00 0.00 C ATOM 997 C ASP A 68 185.856 -8.811 -1.092 1.00 0.00 C ATOM 998 O ASP A 68 186.787 -8.020 -1.224 1.00 0.00 O ATOM 999 CB ASP A 68 184.103 -7.215 -1.898 1.00 0.00 C ATOM 1000 CG ASP A 68 183.316 -7.744 -3.080 1.00 0.00 C ATOM 1001 OD1 ASP A 68 183.946 -8.168 -4.071 1.00 0.00 O ATOM 1002 OD2 ASP A 68 182.069 -7.733 -3.015 1.00 0.00 O ATOM 0 H ASP A 68 185.040 -7.234 0.815 1.00 0.00 H new ATOM 0 HA ASP A 68 183.747 -9.144 -1.020 1.00 0.00 H new ATOM 0 HB2 ASP A 68 183.532 -6.426 -1.408 1.00 0.00 H new ATOM 0 HB3 ASP A 68 185.029 -6.763 -2.254 1.00 0.00 H new ATOM 1007 N ARG A 69 186.017 -10.131 -1.121 1.00 0.00 N ATOM 1008 CA ARG A 69 187.330 -10.743 -1.313 1.00 0.00 C ATOM 1009 C ARG A 69 187.641 -10.957 -2.795 1.00 0.00 C ATOM 1010 O ARG A 69 188.463 -11.803 -3.147 1.00 0.00 O ATOM 1011 CB ARG A 69 187.400 -12.080 -0.571 1.00 0.00 C ATOM 1012 CG ARG A 69 186.867 -12.015 0.852 1.00 0.00 C ATOM 1013 CD ARG A 69 185.671 -12.934 1.044 1.00 0.00 C ATOM 1014 NE ARG A 69 184.408 -12.255 0.768 1.00 0.00 N ATOM 1015 CZ ARG A 69 183.254 -12.888 0.566 1.00 0.00 C ATOM 1016 NH1 ARG A 69 183.200 -14.213 0.612 1.00 0.00 N ATOM 1017 NH2 ARG A 69 182.152 -12.194 0.320 1.00 0.00 N ATOM 0 H ARG A 69 185.254 -10.799 -1.014 1.00 0.00 H new ATOM 0 HA ARG A 69 188.076 -10.060 -0.907 1.00 0.00 H new ATOM 0 HB2 ARG A 69 186.833 -12.826 -1.129 1.00 0.00 H new ATOM 0 HB3 ARG A 69 188.436 -12.419 -0.547 1.00 0.00 H new ATOM 0 HG2 ARG A 69 187.656 -12.294 1.550 1.00 0.00 H new ATOM 0 HG3 ARG A 69 186.581 -10.990 1.087 1.00 0.00 H new ATOM 0 HD2 ARG A 69 185.769 -13.798 0.387 1.00 0.00 H new ATOM 0 HD3 ARG A 69 185.664 -13.311 2.067 1.00 0.00 H new ATOM 0 HE ARG A 69 184.410 -11.236 0.728 1.00 0.00 H new ATOM 0 HH11 ARG A 69 184.045 -14.752 0.803 1.00 0.00 H new ATOM 0 HH12 ARG A 69 182.314 -14.693 0.457 1.00 0.00 H new ATOM 0 HH21 ARG A 69 182.188 -11.175 0.285 1.00 0.00 H new ATOM 0 HH22 ARG A 69 181.268 -12.679 0.165 1.00 0.00 H new ATOM 1031 N ASN A 70 186.983 -10.190 -3.658 1.00 0.00 N ATOM 1032 CA ASN A 70 187.194 -10.304 -5.096 1.00 0.00 C ATOM 1033 C ASN A 70 187.354 -8.927 -5.733 1.00 0.00 C ATOM 1034 O ASN A 70 187.005 -8.724 -6.898 1.00 0.00 O ATOM 1035 CB ASN A 70 186.027 -11.051 -5.746 1.00 0.00 C ATOM 1036 CG ASN A 70 186.348 -12.509 -6.005 1.00 0.00 C ATOM 1037 OD1 ASN A 70 186.691 -13.254 -5.088 1.00 0.00 O ATOM 1038 ND2 ASN A 70 186.240 -12.923 -7.263 1.00 0.00 N ATOM 0 H ASN A 70 186.300 -9.483 -3.387 1.00 0.00 H new ATOM 0 HA ASN A 70 188.112 -10.868 -5.261 1.00 0.00 H new ATOM 0 HB2 ASN A 70 185.151 -10.984 -5.101 1.00 0.00 H new ATOM 0 HB3 ASN A 70 185.768 -10.566 -6.687 1.00 0.00 H new ATOM 0 HD21 ASN A 70 186.445 -13.894 -7.500 1.00 0.00 H new ATOM 0 HD22 ASN A 70 185.952 -12.270 -7.992 1.00 0.00 H new ATOM 1045 N ALA A 71 187.883 -7.982 -4.964 1.00 0.00 N ATOM 1046 CA ALA A 71 188.091 -6.625 -5.452 1.00 0.00 C ATOM 1047 C ALA A 71 189.534 -6.417 -5.894 1.00 0.00 C ATOM 1048 O ALA A 71 190.417 -6.181 -5.069 1.00 0.00 O ATOM 1049 CB ALA A 71 187.714 -5.615 -4.378 1.00 0.00 C ATOM 0 H ALA A 71 188.176 -8.132 -3.998 1.00 0.00 H new ATOM 0 HA ALA A 71 187.448 -6.474 -6.319 1.00 0.00 H new ATOM 0 HB1 ALA A 71 187.874 -4.605 -4.756 1.00 0.00 H new ATOM 0 HB2 ALA A 71 186.664 -5.741 -4.113 1.00 0.00 H new ATOM 0 HB3 ALA A 71 188.333 -5.775 -3.495 1.00 0.00 H new ATOM 1055 N LYS A 72 189.768 -6.505 -7.199 1.00 0.00 N ATOM 1056 CA LYS A 72 191.107 -6.327 -7.746 1.00 0.00 C ATOM 1057 C LYS A 72 191.510 -4.857 -7.721 1.00 0.00 C ATOM 1058 O LYS A 72 191.503 -4.181 -8.750 1.00 0.00 O ATOM 1059 CB LYS A 72 191.173 -6.863 -9.177 1.00 0.00 C ATOM 1060 CG LYS A 72 192.556 -6.765 -9.800 1.00 0.00 C ATOM 1061 CD LYS A 72 192.569 -7.322 -11.214 1.00 0.00 C ATOM 1062 CE LYS A 72 192.320 -8.821 -11.226 1.00 0.00 C ATOM 1063 NZ LYS A 72 192.852 -9.463 -12.459 1.00 0.00 N ATOM 0 H LYS A 72 189.049 -6.698 -7.896 1.00 0.00 H new ATOM 0 HA LYS A 72 191.805 -6.888 -7.125 1.00 0.00 H new ATOM 0 HB2 LYS A 72 190.855 -7.906 -9.181 1.00 0.00 H new ATOM 0 HB3 LYS A 72 190.465 -6.312 -9.796 1.00 0.00 H new ATOM 0 HG2 LYS A 72 192.877 -5.723 -9.815 1.00 0.00 H new ATOM 0 HG3 LYS A 72 193.273 -7.311 -9.186 1.00 0.00 H new ATOM 0 HD2 LYS A 72 191.806 -6.821 -11.810 1.00 0.00 H new ATOM 0 HD3 LYS A 72 193.530 -7.108 -11.681 1.00 0.00 H new ATOM 0 HE2 LYS A 72 192.787 -9.273 -10.351 1.00 0.00 H new ATOM 0 HE3 LYS A 72 191.249 -9.012 -11.151 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 192.662 -10.485 -12.428 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 192.388 -9.050 -13.293 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 193.878 -9.303 -12.518 1.00 0.00 H new ATOM 1077 N LEU A 73 191.859 -4.367 -6.536 1.00 0.00 N ATOM 1078 CA LEU A 73 192.264 -2.977 -6.372 1.00 0.00 C ATOM 1079 C LEU A 73 193.772 -2.829 -6.518 1.00 0.00 C ATOM 1080 O LEU A 73 194.534 -3.718 -6.138 1.00 0.00 O ATOM 1081 CB LEU A 73 191.823 -2.452 -5.005 1.00 0.00 C ATOM 1082 CG LEU A 73 190.382 -2.793 -4.615 1.00 0.00 C ATOM 1083 CD1 LEU A 73 190.338 -3.443 -3.240 1.00 0.00 C ATOM 1084 CD2 LEU A 73 189.511 -1.545 -4.644 1.00 0.00 C ATOM 0 H LEU A 73 191.869 -4.913 -5.675 1.00 0.00 H new ATOM 0 HA LEU A 73 191.780 -2.391 -7.154 1.00 0.00 H new ATOM 0 HB2 LEU A 73 192.494 -2.853 -4.245 1.00 0.00 H new ATOM 0 HB3 LEU A 73 191.940 -1.368 -4.994 1.00 0.00 H new ATOM 0 HG LEU A 73 189.990 -3.504 -5.342 1.00 0.00 H new ATOM 0 HD11 LEU A 73 189.305 -3.678 -2.981 1.00 0.00 H new ATOM 0 HD12 LEU A 73 190.926 -4.360 -3.252 1.00 0.00 H new ATOM 0 HD13 LEU A 73 190.751 -2.757 -2.500 1.00 0.00 H new ATOM 0 HD21 LEU A 73 188.491 -1.807 -4.364 1.00 0.00 H new ATOM 0 HD22 LEU A 73 189.903 -0.811 -3.940 1.00 0.00 H new ATOM 0 HD23 LEU A 73 189.514 -1.122 -5.649 1.00 0.00 H new ATOM 1096 N LYS A 74 194.200 -1.697 -7.066 1.00 0.00 N ATOM 1097 CA LYS A 74 195.619 -1.432 -7.258 1.00 0.00 C ATOM 1098 C LYS A 74 195.986 -0.050 -6.730 1.00 0.00 C ATOM 1099 O LYS A 74 195.236 0.912 -6.899 1.00 0.00 O ATOM 1100 CB LYS A 74 195.987 -1.542 -8.738 1.00 0.00 C ATOM 1101 CG LYS A 74 197.450 -1.885 -8.977 1.00 0.00 C ATOM 1102 CD LYS A 74 197.689 -2.335 -10.409 1.00 0.00 C ATOM 1103 CE LYS A 74 198.234 -1.201 -11.265 1.00 0.00 C ATOM 1104 NZ LYS A 74 199.720 -1.119 -11.197 1.00 0.00 N ATOM 0 H LYS A 74 193.584 -0.949 -7.385 1.00 0.00 H new ATOM 0 HA LYS A 74 196.183 -2.178 -6.698 1.00 0.00 H new ATOM 0 HB2 LYS A 74 195.363 -2.305 -9.203 1.00 0.00 H new ATOM 0 HB3 LYS A 74 195.758 -0.598 -9.232 1.00 0.00 H new ATOM 0 HG2 LYS A 74 198.069 -1.015 -8.760 1.00 0.00 H new ATOM 0 HG3 LYS A 74 197.757 -2.674 -8.290 1.00 0.00 H new ATOM 0 HD2 LYS A 74 198.391 -3.169 -10.417 1.00 0.00 H new ATOM 0 HD3 LYS A 74 196.756 -2.700 -10.838 1.00 0.00 H new ATOM 0 HE2 LYS A 74 197.925 -1.347 -12.300 1.00 0.00 H new ATOM 0 HE3 LYS A 74 197.803 -0.256 -10.934 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 200.052 -0.334 -11.793 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 200.014 -0.954 -10.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 200.133 -2.011 -11.537 1.00 0.00 H new ATOM 1118 N LEU A 75 197.144 0.038 -6.085 1.00 0.00 N ATOM 1119 CA LEU A 75 197.617 1.298 -5.521 1.00 0.00 C ATOM 1120 C LEU A 75 197.609 2.408 -6.567 1.00 0.00 C ATOM 1121 O LEU A 75 198.080 2.223 -7.689 1.00 0.00 O ATOM 1122 CB LEU A 75 199.030 1.120 -4.959 1.00 0.00 C ATOM 1123 CG LEU A 75 199.350 1.945 -3.712 1.00 0.00 C ATOM 1124 CD1 LEU A 75 200.452 1.279 -2.902 1.00 0.00 C ATOM 1125 CD2 LEU A 75 199.753 3.360 -4.098 1.00 0.00 C ATOM 0 H LEU A 75 197.774 -0.750 -5.939 1.00 0.00 H new ATOM 0 HA LEU A 75 196.940 1.585 -4.717 1.00 0.00 H new ATOM 0 HB2 LEU A 75 199.179 0.066 -4.724 1.00 0.00 H new ATOM 0 HB3 LEU A 75 199.747 1.378 -5.738 1.00 0.00 H new ATOM 0 HG LEU A 75 198.453 1.999 -3.095 1.00 0.00 H new ATOM 0 HD11 LEU A 75 200.667 1.879 -2.018 1.00 0.00 H new ATOM 0 HD12 LEU A 75 200.128 0.285 -2.595 1.00 0.00 H new ATOM 0 HD13 LEU A 75 201.352 1.195 -3.512 1.00 0.00 H new ATOM 0 HD21 LEU A 75 199.977 3.933 -3.198 1.00 0.00 H new ATOM 0 HD22 LEU A 75 200.636 3.326 -4.736 1.00 0.00 H new ATOM 0 HD23 LEU A 75 198.935 3.837 -4.637 1.00 0.00 H new ATOM 1137 N GLY A 76 197.064 3.558 -6.188 1.00 0.00 N ATOM 1138 CA GLY A 76 196.996 4.681 -7.098 1.00 0.00 C ATOM 1139 C GLY A 76 195.604 4.876 -7.657 1.00 0.00 C ATOM 1140 O GLY A 76 195.209 5.994 -7.989 1.00 0.00 O ATOM 0 H GLY A 76 196.668 3.731 -5.264 1.00 0.00 H new ATOM 0 HA2 GLY A 76 197.308 5.587 -6.579 1.00 0.00 H new ATOM 0 HA3 GLY A 76 197.697 4.526 -7.918 1.00 0.00 H new ATOM 1144 N ASP A 77 194.861 3.782 -7.766 1.00 0.00 N ATOM 1145 CA ASP A 77 193.511 3.824 -8.290 1.00 0.00 C ATOM 1146 C ASP A 77 192.583 4.597 -7.359 1.00 0.00 C ATOM 1147 O ASP A 77 192.822 4.684 -6.151 1.00 0.00 O ATOM 1148 CB ASP A 77 192.983 2.404 -8.500 1.00 0.00 C ATOM 1149 CG ASP A 77 191.792 2.360 -9.438 1.00 0.00 C ATOM 1150 OD1 ASP A 77 190.782 3.035 -9.148 1.00 0.00 O ATOM 1151 OD2 ASP A 77 191.871 1.652 -10.464 1.00 0.00 O ATOM 0 H ASP A 77 195.178 2.851 -7.495 1.00 0.00 H new ATOM 0 HA ASP A 77 193.536 4.341 -9.249 1.00 0.00 H new ATOM 0 HB2 ASP A 77 193.781 1.779 -8.901 1.00 0.00 H new ATOM 0 HB3 ASP A 77 192.699 1.979 -7.537 1.00 0.00 H new ATOM 1156 N LYS A 78 191.524 5.159 -7.933 1.00 0.00 N ATOM 1157 CA LYS A 78 190.551 5.927 -7.168 1.00 0.00 C ATOM 1158 C LYS A 78 189.223 5.182 -7.085 1.00 0.00 C ATOM 1159 O LYS A 78 188.953 4.279 -7.874 1.00 0.00 O ATOM 1160 CB LYS A 78 190.340 7.299 -7.810 1.00 0.00 C ATOM 1161 CG LYS A 78 189.993 8.392 -6.814 1.00 0.00 C ATOM 1162 CD LYS A 78 191.203 9.250 -6.482 1.00 0.00 C ATOM 1163 CE LYS A 78 191.244 10.511 -7.332 1.00 0.00 C ATOM 1164 NZ LYS A 78 192.288 10.433 -8.389 1.00 0.00 N ATOM 0 H LYS A 78 191.318 5.096 -8.930 1.00 0.00 H new ATOM 0 HA LYS A 78 190.938 6.062 -6.158 1.00 0.00 H new ATOM 0 HB2 LYS A 78 191.246 7.583 -8.346 1.00 0.00 H new ATOM 0 HB3 LYS A 78 189.542 7.226 -8.549 1.00 0.00 H new ATOM 0 HG2 LYS A 78 189.202 9.020 -7.223 1.00 0.00 H new ATOM 0 HG3 LYS A 78 189.603 7.943 -5.901 1.00 0.00 H new ATOM 0 HD2 LYS A 78 191.179 9.522 -5.427 1.00 0.00 H new ATOM 0 HD3 LYS A 78 192.114 8.673 -6.641 1.00 0.00 H new ATOM 0 HE2 LYS A 78 190.270 10.669 -7.795 1.00 0.00 H new ATOM 0 HE3 LYS A 78 191.437 11.373 -6.694 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 192.284 11.311 -8.946 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 193.221 10.308 -7.947 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 192.090 9.626 -9.014 1.00 0.00 H new ATOM 1178 N ILE A 79 188.408 5.559 -6.109 1.00 0.00 N ATOM 1179 CA ILE A 79 187.111 4.925 -5.897 1.00 0.00 C ATOM 1180 C ILE A 79 185.956 5.917 -6.042 1.00 0.00 C ATOM 1181 O ILE A 79 186.078 7.089 -5.687 1.00 0.00 O ATOM 1182 CB ILE A 79 187.040 4.222 -4.531 1.00 0.00 C ATOM 1183 CG1 ILE A 79 187.924 2.972 -4.543 1.00 0.00 C ATOM 1184 CG2 ILE A 79 185.602 3.850 -4.185 1.00 0.00 C ATOM 1185 CD1 ILE A 79 189.182 3.111 -3.718 1.00 0.00 C ATOM 0 H ILE A 79 188.623 6.305 -5.447 1.00 0.00 H new ATOM 0 HA ILE A 79 187.006 4.171 -6.677 1.00 0.00 H new ATOM 0 HB ILE A 79 187.404 4.910 -3.768 1.00 0.00 H new ATOM 0 HG12 ILE A 79 187.347 2.126 -4.170 1.00 0.00 H new ATOM 0 HG13 ILE A 79 188.199 2.742 -5.572 1.00 0.00 H new ATOM 0 HG21 ILE A 79 185.578 3.354 -3.215 1.00 0.00 H new ATOM 0 HG22 ILE A 79 184.992 4.752 -4.147 1.00 0.00 H new ATOM 0 HG23 ILE A 79 185.207 3.177 -4.946 1.00 0.00 H new ATOM 0 HD11 ILE A 79 189.758 2.187 -3.774 1.00 0.00 H new ATOM 0 HD12 ILE A 79 189.781 3.936 -4.104 1.00 0.00 H new ATOM 0 HD13 ILE A 79 188.916 3.310 -2.680 1.00 0.00 H new ATOM 1197 N TYR A 80 184.828 5.418 -6.535 1.00 0.00 N ATOM 1198 CA TYR A 80 183.625 6.228 -6.701 1.00 0.00 C ATOM 1199 C TYR A 80 182.402 5.365 -6.417 1.00 0.00 C ATOM 1200 O TYR A 80 182.289 4.262 -6.951 1.00 0.00 O ATOM 1201 CB TYR A 80 183.557 6.804 -8.114 1.00 0.00 C ATOM 1202 CG TYR A 80 184.535 7.934 -8.349 1.00 0.00 C ATOM 1203 CD1 TYR A 80 184.463 9.103 -7.606 1.00 0.00 C ATOM 1204 CD2 TYR A 80 185.530 7.828 -9.312 1.00 0.00 C ATOM 1205 CE1 TYR A 80 185.354 10.139 -7.815 1.00 0.00 C ATOM 1206 CE2 TYR A 80 186.427 8.858 -9.527 1.00 0.00 C ATOM 1207 CZ TYR A 80 186.334 10.011 -8.775 1.00 0.00 C ATOM 1208 OH TYR A 80 187.225 11.038 -8.987 1.00 0.00 O ATOM 0 H TYR A 80 184.721 4.447 -6.829 1.00 0.00 H new ATOM 0 HA TYR A 80 183.651 7.062 -6.000 1.00 0.00 H new ATOM 0 HB2 TYR A 80 183.753 6.008 -8.833 1.00 0.00 H new ATOM 0 HB3 TYR A 80 182.546 7.163 -8.304 1.00 0.00 H new ATOM 0 HD1 TYR A 80 183.698 9.206 -6.851 1.00 0.00 H new ATOM 0 HD2 TYR A 80 185.604 6.927 -9.902 1.00 0.00 H new ATOM 0 HE1 TYR A 80 185.282 11.043 -7.229 1.00 0.00 H new ATOM 0 HE2 TYR A 80 187.196 8.761 -10.279 1.00 0.00 H new ATOM 0 HH TYR A 80 187.570 11.355 -8.126 1.00 0.00 H new ATOM 1218 N PHE A 81 181.494 5.836 -5.559 1.00 0.00 N ATOM 1219 CA PHE A 81 180.321 5.030 -5.233 1.00 0.00 C ATOM 1220 C PHE A 81 179.177 5.829 -4.632 1.00 0.00 C ATOM 1221 O PHE A 81 179.255 7.043 -4.447 1.00 0.00 O ATOM 1222 CB PHE A 81 180.706 3.927 -4.244 1.00 0.00 C ATOM 1223 CG PHE A 81 181.642 4.383 -3.158 1.00 0.00 C ATOM 1224 CD1 PHE A 81 181.332 5.482 -2.371 1.00 0.00 C ATOM 1225 CD2 PHE A 81 182.830 3.709 -2.920 1.00 0.00 C ATOM 1226 CE1 PHE A 81 182.188 5.901 -1.371 1.00 0.00 C ATOM 1227 CE2 PHE A 81 183.689 4.124 -1.918 1.00 0.00 C ATOM 1228 CZ PHE A 81 183.368 5.221 -1.144 1.00 0.00 C ATOM 0 H PHE A 81 181.545 6.741 -5.092 1.00 0.00 H new ATOM 0 HA PHE A 81 179.972 4.617 -6.179 1.00 0.00 H new ATOM 0 HB2 PHE A 81 179.800 3.530 -3.786 1.00 0.00 H new ATOM 0 HB3 PHE A 81 181.172 3.108 -4.792 1.00 0.00 H new ATOM 0 HD1 PHE A 81 180.410 6.017 -2.542 1.00 0.00 H new ATOM 0 HD2 PHE A 81 183.088 2.851 -3.523 1.00 0.00 H new ATOM 0 HE1 PHE A 81 181.934 6.760 -0.767 1.00 0.00 H new ATOM 0 HE2 PHE A 81 184.611 3.590 -1.741 1.00 0.00 H new ATOM 0 HZ PHE A 81 184.038 5.547 -0.362 1.00 0.00 H new ATOM 1238 N TRP A 82 178.128 5.086 -4.295 1.00 0.00 N ATOM 1239 CA TRP A 82 176.936 5.629 -3.665 1.00 0.00 C ATOM 1240 C TRP A 82 176.308 4.541 -2.800 1.00 0.00 C ATOM 1241 O TRP A 82 176.173 3.397 -3.236 1.00 0.00 O ATOM 1242 CB TRP A 82 175.938 6.148 -4.708 1.00 0.00 C ATOM 1243 CG TRP A 82 175.399 5.095 -5.627 1.00 0.00 C ATOM 1244 CD1 TRP A 82 175.987 4.621 -6.763 1.00 0.00 C ATOM 1245 CD2 TRP A 82 174.152 4.401 -5.499 1.00 0.00 C ATOM 1246 NE1 TRP A 82 175.183 3.671 -7.348 1.00 0.00 N ATOM 1247 CE2 TRP A 82 174.054 3.517 -6.590 1.00 0.00 C ATOM 1248 CE3 TRP A 82 173.111 4.439 -4.567 1.00 0.00 C ATOM 1249 CZ2 TRP A 82 172.957 2.680 -6.774 1.00 0.00 C ATOM 1250 CZ3 TRP A 82 172.022 3.607 -4.751 1.00 0.00 C ATOM 1251 CH2 TRP A 82 171.952 2.738 -5.847 1.00 0.00 C ATOM 0 H TRP A 82 178.084 4.080 -4.454 1.00 0.00 H new ATOM 0 HA TRP A 82 177.212 6.481 -3.043 1.00 0.00 H new ATOM 0 HB2 TRP A 82 175.104 6.623 -4.191 1.00 0.00 H new ATOM 0 HB3 TRP A 82 176.424 6.920 -5.305 1.00 0.00 H new ATOM 0 HD1 TRP A 82 176.943 4.944 -7.147 1.00 0.00 H new ATOM 0 HE1 TRP A 82 175.394 3.164 -8.207 1.00 0.00 H new ATOM 0 HE3 TRP A 82 173.156 5.106 -3.719 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 172.901 2.009 -7.618 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 171.212 3.628 -4.037 1.00 0.00 H new ATOM 0 HH2 TRP A 82 171.088 2.101 -5.963 1.00 0.00 H new ATOM 1262 N THR A 83 175.949 4.886 -1.571 1.00 0.00 N ATOM 1263 CA THR A 83 175.366 3.906 -0.654 1.00 0.00 C ATOM 1264 C THR A 83 173.856 4.042 -0.606 1.00 0.00 C ATOM 1265 O THR A 83 173.324 5.090 -0.927 1.00 0.00 O ATOM 1266 CB THR A 83 175.946 4.077 0.752 1.00 0.00 C ATOM 1267 OG1 THR A 83 176.329 5.421 0.977 1.00 0.00 O ATOM 1268 CG2 THR A 83 177.157 3.206 1.009 1.00 0.00 C ATOM 0 H THR A 83 176.048 5.825 -1.185 1.00 0.00 H new ATOM 0 HA THR A 83 175.615 2.911 -1.024 1.00 0.00 H new ATOM 0 HB THR A 83 175.149 3.775 1.432 1.00 0.00 H new ATOM 0 HG1 THR A 83 176.696 5.510 1.882 1.00 0.00 H new ATOM 0 HG21 THR A 83 177.519 3.376 2.023 1.00 0.00 H new ATOM 0 HG22 THR A 83 176.882 2.158 0.892 1.00 0.00 H new ATOM 0 HG23 THR A 83 177.943 3.457 0.297 1.00 0.00 H new ATOM 1276 N TYR A 84 173.167 2.977 -0.218 1.00 0.00 N ATOM 1277 CA TYR A 84 171.718 3.001 -0.146 1.00 0.00 C ATOM 1278 C TYR A 84 171.225 2.275 1.100 1.00 0.00 C ATOM 1279 O TYR A 84 171.744 1.221 1.456 1.00 0.00 O ATOM 1280 CB TYR A 84 171.140 2.346 -1.396 1.00 0.00 C ATOM 1281 CG TYR A 84 169.637 2.462 -1.515 1.00 0.00 C ATOM 1282 CD1 TYR A 84 168.984 3.648 -1.203 1.00 0.00 C ATOM 1283 CD2 TYR A 84 168.871 1.385 -1.944 1.00 0.00 C ATOM 1284 CE1 TYR A 84 167.612 3.759 -1.315 1.00 0.00 C ATOM 1285 CE2 TYR A 84 167.497 1.488 -2.060 1.00 0.00 C ATOM 1286 CZ TYR A 84 166.873 2.676 -1.743 1.00 0.00 C ATOM 1287 OH TYR A 84 165.506 2.782 -1.857 1.00 0.00 O ATOM 0 H TYR A 84 173.590 2.089 0.051 1.00 0.00 H new ATOM 0 HA TYR A 84 171.385 4.037 -0.088 1.00 0.00 H new ATOM 0 HB2 TYR A 84 171.599 2.798 -2.275 1.00 0.00 H new ATOM 0 HB3 TYR A 84 171.414 1.291 -1.400 1.00 0.00 H new ATOM 0 HD1 TYR A 84 169.559 4.498 -0.867 1.00 0.00 H new ATOM 0 HD2 TYR A 84 169.357 0.452 -2.191 1.00 0.00 H new ATOM 0 HE1 TYR A 84 167.121 4.689 -1.069 1.00 0.00 H new ATOM 0 HE2 TYR A 84 166.916 0.642 -2.397 1.00 0.00 H new ATOM 0 HH TYR A 84 165.137 1.930 -2.172 1.00 0.00 H new ATOM 1297 N VAL A 85 170.219 2.843 1.755 1.00 0.00 N ATOM 1298 CA VAL A 85 169.653 2.239 2.957 1.00 0.00 C ATOM 1299 C VAL A 85 168.129 2.258 2.882 1.00 0.00 C ATOM 1300 O VAL A 85 167.553 3.030 2.119 1.00 0.00 O ATOM 1301 CB VAL A 85 170.131 2.950 4.258 1.00 0.00 C ATOM 1302 CG1 VAL A 85 170.987 4.165 3.937 1.00 0.00 C ATOM 1303 CG2 VAL A 85 168.963 3.356 5.152 1.00 0.00 C ATOM 0 H VAL A 85 169.779 3.719 1.475 1.00 0.00 H new ATOM 0 HA VAL A 85 170.008 1.209 3.001 1.00 0.00 H new ATOM 0 HB VAL A 85 170.736 2.227 4.805 1.00 0.00 H new ATOM 0 HG11 VAL A 85 171.306 4.641 4.864 1.00 0.00 H new ATOM 0 HG12 VAL A 85 171.864 3.853 3.369 1.00 0.00 H new ATOM 0 HG13 VAL A 85 170.406 4.874 3.347 1.00 0.00 H new ATOM 0 HG21 VAL A 85 169.344 3.848 6.047 1.00 0.00 H new ATOM 0 HG22 VAL A 85 168.311 4.042 4.610 1.00 0.00 H new ATOM 0 HG23 VAL A 85 168.398 2.469 5.438 1.00 0.00 H new ATOM 1313 N ILE A 86 167.486 1.418 3.689 1.00 0.00 N ATOM 1314 CA ILE A 86 166.028 1.351 3.726 1.00 0.00 C ATOM 1315 C ILE A 86 165.524 1.289 5.154 1.00 0.00 C ATOM 1316 O ILE A 86 165.649 0.261 5.815 1.00 0.00 O ATOM 1317 CB ILE A 86 165.481 0.128 2.973 1.00 0.00 C ATOM 1318 CG1 ILE A 86 166.063 0.069 1.572 1.00 0.00 C ATOM 1319 CG2 ILE A 86 163.957 0.167 2.920 1.00 0.00 C ATOM 1320 CD1 ILE A 86 165.644 1.214 0.690 1.00 0.00 C ATOM 0 H ILE A 86 167.953 0.773 4.327 1.00 0.00 H new ATOM 0 HA ILE A 86 165.672 2.258 3.237 1.00 0.00 H new ATOM 0 HB ILE A 86 165.780 -0.772 3.511 1.00 0.00 H new ATOM 0 HG12 ILE A 86 167.151 0.055 1.641 1.00 0.00 H new ATOM 0 HG13 ILE A 86 165.762 -0.868 1.103 1.00 0.00 H new ATOM 0 HG21 ILE A 86 163.589 -0.707 2.383 1.00 0.00 H new ATOM 0 HG22 ILE A 86 163.557 0.164 3.934 1.00 0.00 H new ATOM 0 HG23 ILE A 86 163.634 1.072 2.405 1.00 0.00 H new ATOM 0 HD11 ILE A 86 166.100 1.101 -0.294 1.00 0.00 H new ATOM 0 HD12 ILE A 86 164.559 1.217 0.589 1.00 0.00 H new ATOM 0 HD13 ILE A 86 165.969 2.154 1.135 1.00 0.00 H new ATOM 1332 N LYS A 87 164.948 2.389 5.615 1.00 0.00 N ATOM 1333 CA LYS A 87 164.410 2.471 6.966 1.00 0.00 C ATOM 1334 C LYS A 87 162.895 2.288 6.951 1.00 0.00 C ATOM 1335 O LYS A 87 162.147 3.155 7.404 1.00 0.00 O ATOM 1336 CB LYS A 87 164.771 3.817 7.597 1.00 0.00 C ATOM 1337 CG LYS A 87 164.782 3.794 9.118 1.00 0.00 C ATOM 1338 CD LYS A 87 163.664 4.644 9.699 1.00 0.00 C ATOM 1339 CE LYS A 87 163.389 4.286 11.151 1.00 0.00 C ATOM 1340 NZ LYS A 87 162.009 4.665 11.566 1.00 0.00 N ATOM 0 H LYS A 87 164.840 3.244 5.069 1.00 0.00 H new ATOM 0 HA LYS A 87 164.850 1.672 7.562 1.00 0.00 H new ATOM 0 HB2 LYS A 87 165.754 4.124 7.240 1.00 0.00 H new ATOM 0 HB3 LYS A 87 164.059 4.570 7.259 1.00 0.00 H new ATOM 0 HG2 LYS A 87 164.678 2.767 9.468 1.00 0.00 H new ATOM 0 HG3 LYS A 87 165.743 4.158 9.481 1.00 0.00 H new ATOM 0 HD2 LYS A 87 163.932 5.698 9.628 1.00 0.00 H new ATOM 0 HD3 LYS A 87 162.757 4.505 9.111 1.00 0.00 H new ATOM 0 HE2 LYS A 87 163.529 3.214 11.293 1.00 0.00 H new ATOM 0 HE3 LYS A 87 164.112 4.790 11.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 161.862 4.404 12.562 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 161.883 5.691 11.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 161.318 4.165 10.971 1.00 0.00 H new ATOM 1354 N ASP A 88 162.449 1.151 6.421 1.00 0.00 N ATOM 1355 CA ASP A 88 161.024 0.846 6.337 1.00 0.00 C ATOM 1356 C ASP A 88 160.332 1.768 5.337 1.00 0.00 C ATOM 1357 O ASP A 88 159.530 2.623 5.713 1.00 0.00 O ATOM 1358 CB ASP A 88 160.365 0.976 7.715 1.00 0.00 C ATOM 1359 CG ASP A 88 159.249 -0.031 7.918 1.00 0.00 C ATOM 1360 OD1 ASP A 88 158.129 0.218 7.427 1.00 0.00 O ATOM 1361 OD2 ASP A 88 159.497 -1.067 8.567 1.00 0.00 O ATOM 0 H ASP A 88 163.057 0.424 6.043 1.00 0.00 H new ATOM 0 HA ASP A 88 160.918 -0.182 5.992 1.00 0.00 H new ATOM 0 HB2 ASP A 88 161.119 0.840 8.490 1.00 0.00 H new ATOM 0 HB3 ASP A 88 159.967 1.984 7.831 1.00 0.00 H new ATOM 1366 N GLY A 89 160.650 1.587 4.058 1.00 0.00 N ATOM 1367 CA GLY A 89 160.053 2.409 3.021 1.00 0.00 C ATOM 1368 C GLY A 89 160.566 3.836 3.048 1.00 0.00 C ATOM 1369 O GLY A 89 159.884 4.756 2.596 1.00 0.00 O ATOM 0 H GLY A 89 161.310 0.886 3.722 1.00 0.00 H new ATOM 0 HA2 GLY A 89 160.263 1.969 2.046 1.00 0.00 H new ATOM 0 HA3 GLY A 89 158.970 2.413 3.143 1.00 0.00 H new ATOM 1373 N LEU A 90 161.772 4.019 3.577 1.00 0.00 N ATOM 1374 CA LEU A 90 162.381 5.344 3.665 1.00 0.00 C ATOM 1375 C LEU A 90 163.879 5.252 3.438 1.00 0.00 C ATOM 1376 O LEU A 90 164.673 5.363 4.373 1.00 0.00 O ATOM 1377 CB LEU A 90 162.094 5.966 5.028 1.00 0.00 C ATOM 1378 CG LEU A 90 160.691 5.692 5.555 1.00 0.00 C ATOM 1379 CD1 LEU A 90 160.581 6.084 7.021 1.00 0.00 C ATOM 1380 CD2 LEU A 90 159.664 6.434 4.717 1.00 0.00 C ATOM 0 H LEU A 90 162.348 3.266 3.952 1.00 0.00 H new ATOM 0 HA LEU A 90 161.949 5.978 2.891 1.00 0.00 H new ATOM 0 HB2 LEU A 90 162.821 5.589 5.748 1.00 0.00 H new ATOM 0 HB3 LEU A 90 162.241 7.044 4.962 1.00 0.00 H new ATOM 0 HG LEU A 90 160.492 4.623 5.479 1.00 0.00 H new ATOM 0 HD11 LEU A 90 159.571 5.880 7.377 1.00 0.00 H new ATOM 0 HD12 LEU A 90 161.296 5.506 7.607 1.00 0.00 H new ATOM 0 HD13 LEU A 90 160.797 7.147 7.131 1.00 0.00 H new ATOM 0 HD21 LEU A 90 158.665 6.231 5.102 1.00 0.00 H new ATOM 0 HD22 LEU A 90 159.861 7.505 4.765 1.00 0.00 H new ATOM 0 HD23 LEU A 90 159.729 6.099 3.682 1.00 0.00 H new ATOM 1392 N GLY A 91 164.252 5.021 2.192 1.00 0.00 N ATOM 1393 CA GLY A 91 165.642 4.885 1.855 1.00 0.00 C ATOM 1394 C GLY A 91 166.336 6.192 1.535 1.00 0.00 C ATOM 1395 O GLY A 91 165.696 7.197 1.221 1.00 0.00 O ATOM 0 H GLY A 91 163.609 4.925 1.406 1.00 0.00 H new ATOM 0 HA2 GLY A 91 166.160 4.406 2.686 1.00 0.00 H new ATOM 0 HA3 GLY A 91 165.732 4.219 0.997 1.00 0.00 H new ATOM 1399 N TYR A 92 167.660 6.155 1.611 1.00 0.00 N ATOM 1400 CA TYR A 92 168.502 7.313 1.324 1.00 0.00 C ATOM 1401 C TYR A 92 169.862 6.835 0.829 1.00 0.00 C ATOM 1402 O TYR A 92 170.280 5.725 1.161 1.00 0.00 O ATOM 1403 CB TYR A 92 168.665 8.181 2.574 1.00 0.00 C ATOM 1404 CG TYR A 92 167.382 8.845 3.023 1.00 0.00 C ATOM 1405 CD1 TYR A 92 166.453 8.157 3.794 1.00 0.00 C ATOM 1406 CD2 TYR A 92 167.099 10.161 2.675 1.00 0.00 C ATOM 1407 CE1 TYR A 92 165.279 8.759 4.204 1.00 0.00 C ATOM 1408 CE2 TYR A 92 165.928 10.770 3.082 1.00 0.00 C ATOM 1409 CZ TYR A 92 165.021 10.066 3.846 1.00 0.00 C ATOM 1410 OH TYR A 92 163.853 10.669 4.253 1.00 0.00 O ATOM 0 H TYR A 92 168.183 5.320 1.874 1.00 0.00 H new ATOM 0 HA TYR A 92 168.028 7.918 0.551 1.00 0.00 H new ATOM 0 HB2 TYR A 92 169.049 7.564 3.387 1.00 0.00 H new ATOM 0 HB3 TYR A 92 169.412 8.950 2.377 1.00 0.00 H new ATOM 0 HD1 TYR A 92 166.652 7.134 4.078 1.00 0.00 H new ATOM 0 HD2 TYR A 92 167.806 10.716 2.077 1.00 0.00 H new ATOM 0 HE1 TYR A 92 164.567 8.209 4.802 1.00 0.00 H new ATOM 0 HE2 TYR A 92 165.724 11.793 2.803 1.00 0.00 H new ATOM 0 HH TYR A 92 163.442 10.137 4.966 1.00 0.00 H new ATOM 1420 N ARG A 93 170.551 7.644 0.026 1.00 0.00 N ATOM 1421 CA ARG A 93 171.842 7.229 -0.493 1.00 0.00 C ATOM 1422 C ARG A 93 172.908 8.298 -0.356 1.00 0.00 C ATOM 1423 O ARG A 93 172.636 9.494 -0.464 1.00 0.00 O ATOM 1424 CB ARG A 93 171.721 6.840 -1.965 1.00 0.00 C ATOM 1425 CG ARG A 93 171.330 7.996 -2.872 1.00 0.00 C ATOM 1426 CD ARG A 93 169.824 8.073 -3.059 1.00 0.00 C ATOM 1427 NE ARG A 93 169.419 9.303 -3.732 1.00 0.00 N ATOM 1428 CZ ARG A 93 168.243 9.468 -4.333 1.00 0.00 C ATOM 1429 NH1 ARG A 93 167.353 8.483 -4.346 1.00 0.00 N ATOM 1430 NH2 ARG A 93 167.956 10.621 -4.920 1.00 0.00 N ATOM 0 H ARG A 93 170.242 8.569 -0.271 1.00 0.00 H new ATOM 0 HA ARG A 93 172.150 6.373 0.107 1.00 0.00 H new ATOM 0 HB2 ARG A 93 172.673 6.430 -2.303 1.00 0.00 H new ATOM 0 HB3 ARG A 93 170.980 6.047 -2.062 1.00 0.00 H new ATOM 0 HG2 ARG A 93 171.693 8.932 -2.447 1.00 0.00 H new ATOM 0 HG3 ARG A 93 171.813 7.878 -3.842 1.00 0.00 H new ATOM 0 HD2 ARG A 93 169.486 7.214 -3.639 1.00 0.00 H new ATOM 0 HD3 ARG A 93 169.334 8.013 -2.087 1.00 0.00 H new ATOM 0 HE ARG A 93 170.076 10.083 -3.742 1.00 0.00 H new ATOM 0 HH11 ARG A 93 167.569 7.595 -3.894 1.00 0.00 H new ATOM 0 HH12 ARG A 93 166.453 8.615 -4.808 1.00 0.00 H new ATOM 0 HH21 ARG A 93 168.636 11.381 -4.911 1.00 0.00 H new ATOM 0 HH22 ARG A 93 167.055 10.748 -5.381 1.00 0.00 H new ATOM 1444 N GLN A 94 174.138 7.839 -0.164 1.00 0.00 N ATOM 1445 CA GLN A 94 175.279 8.725 -0.067 1.00 0.00 C ATOM 1446 C GLN A 94 176.050 8.657 -1.371 1.00 0.00 C ATOM 1447 O GLN A 94 177.079 7.988 -1.465 1.00 0.00 O ATOM 1448 CB GLN A 94 176.185 8.338 1.101 1.00 0.00 C ATOM 1449 CG GLN A 94 177.041 9.490 1.601 1.00 0.00 C ATOM 1450 CD GLN A 94 178.410 9.040 2.074 1.00 0.00 C ATOM 1451 OE1 GLN A 94 178.686 9.009 3.274 1.00 0.00 O ATOM 1452 NE2 GLN A 94 179.278 8.693 1.131 1.00 0.00 N ATOM 0 H GLN A 94 174.367 6.849 -0.072 1.00 0.00 H new ATOM 0 HA GLN A 94 174.929 9.741 0.115 1.00 0.00 H new ATOM 0 HB2 GLN A 94 175.571 7.967 1.922 1.00 0.00 H new ATOM 0 HB3 GLN A 94 176.834 7.518 0.793 1.00 0.00 H new ATOM 0 HG2 GLN A 94 177.160 10.222 0.802 1.00 0.00 H new ATOM 0 HG3 GLN A 94 176.525 9.992 2.420 1.00 0.00 H new ATOM 0 HE21 GLN A 94 179.007 8.734 0.148 1.00 0.00 H new ATOM 0 HE22 GLN A 94 180.216 8.386 1.389 1.00 0.00 H new ATOM 1461 N ASP A 95 175.515 9.325 -2.385 1.00 0.00 N ATOM 1462 CA ASP A 95 176.124 9.330 -3.707 1.00 0.00 C ATOM 1463 C ASP A 95 177.280 10.315 -3.784 1.00 0.00 C ATOM 1464 O ASP A 95 177.573 11.026 -2.821 1.00 0.00 O ATOM 1465 CB ASP A 95 175.082 9.673 -4.769 1.00 0.00 C ATOM 1466 CG ASP A 95 174.399 11.000 -4.502 1.00 0.00 C ATOM 1467 OD1 ASP A 95 175.051 12.050 -4.681 1.00 0.00 O ATOM 1468 OD2 ASP A 95 173.213 10.988 -4.114 1.00 0.00 O ATOM 0 H ASP A 95 174.657 9.872 -2.316 1.00 0.00 H new ATOM 0 HA ASP A 95 176.516 8.330 -3.893 1.00 0.00 H new ATOM 0 HB2 ASP A 95 175.561 9.705 -5.747 1.00 0.00 H new ATOM 0 HB3 ASP A 95 174.332 8.883 -4.807 1.00 0.00 H new ATOM 1473 N ASN A 96 177.932 10.346 -4.938 1.00 0.00 N ATOM 1474 CA ASN A 96 179.061 11.237 -5.154 1.00 0.00 C ATOM 1475 C ASN A 96 180.199 10.915 -4.187 1.00 0.00 C ATOM 1476 O ASN A 96 181.106 11.723 -3.988 1.00 0.00 O ATOM 1477 CB ASN A 96 178.616 12.691 -4.991 1.00 0.00 C ATOM 1478 CG ASN A 96 179.744 13.680 -5.212 1.00 0.00 C ATOM 1479 OD1 ASN A 96 180.169 14.372 -4.287 1.00 0.00 O ATOM 1480 ND2 ASN A 96 180.236 13.750 -6.444 1.00 0.00 N ATOM 0 H ASN A 96 177.697 9.762 -5.741 1.00 0.00 H new ATOM 0 HA ASN A 96 179.430 11.091 -6.169 1.00 0.00 H new ATOM 0 HB2 ASN A 96 177.812 12.901 -5.696 1.00 0.00 H new ATOM 0 HB3 ASN A 96 178.207 12.831 -3.990 1.00 0.00 H new ATOM 0 HD21 ASN A 96 180.997 14.396 -6.653 1.00 0.00 H new ATOM 0 HD22 ASN A 96 179.853 13.157 -7.181 1.00 0.00 H new ATOM 1487 N GLY A 97 180.151 9.723 -3.592 1.00 0.00 N ATOM 1488 CA GLY A 97 181.191 9.326 -2.664 1.00 0.00 C ATOM 1489 C GLY A 97 182.482 8.993 -3.372 1.00 0.00 C ATOM 1490 O GLY A 97 182.498 8.785 -4.586 1.00 0.00 O ATOM 0 H GLY A 97 179.415 9.032 -3.737 1.00 0.00 H new ATOM 0 HA2 GLY A 97 181.366 10.130 -1.950 1.00 0.00 H new ATOM 0 HA3 GLY A 97 180.856 8.460 -2.093 1.00 0.00 H new ATOM 1494 N GLU A 98 183.569 8.942 -2.616 1.00 0.00 N ATOM 1495 CA GLU A 98 184.872 8.634 -3.184 1.00 0.00 C ATOM 1496 C GLU A 98 185.774 7.962 -2.158 1.00 0.00 C ATOM 1497 O GLU A 98 185.617 8.153 -0.953 1.00 0.00 O ATOM 1498 CB GLU A 98 185.536 9.908 -3.707 1.00 0.00 C ATOM 1499 CG GLU A 98 186.732 9.647 -4.611 1.00 0.00 C ATOM 1500 CD GLU A 98 187.584 10.885 -4.820 1.00 0.00 C ATOM 1501 OE1 GLU A 98 188.082 11.438 -3.817 1.00 0.00 O ATOM 1502 OE2 GLU A 98 187.754 11.296 -5.986 1.00 0.00 O ATOM 0 H GLU A 98 183.574 9.110 -1.610 1.00 0.00 H new ATOM 0 HA GLU A 98 184.722 7.942 -4.012 1.00 0.00 H new ATOM 0 HB2 GLU A 98 184.798 10.493 -4.256 1.00 0.00 H new ATOM 0 HB3 GLU A 98 185.857 10.514 -2.860 1.00 0.00 H new ATOM 0 HG2 GLU A 98 187.345 8.857 -4.178 1.00 0.00 H new ATOM 0 HG3 GLU A 98 186.381 9.284 -5.577 1.00 0.00 H new ATOM 1509 N TRP A 99 186.724 7.174 -2.648 1.00 0.00 N ATOM 1510 CA TRP A 99 187.660 6.468 -1.787 1.00 0.00 C ATOM 1511 C TRP A 99 188.973 6.212 -2.538 1.00 0.00 C ATOM 1512 O TRP A 99 189.044 6.411 -3.750 1.00 0.00 O ATOM 1513 CB TRP A 99 187.021 5.169 -1.287 1.00 0.00 C ATOM 1514 CG TRP A 99 187.889 4.383 -0.363 1.00 0.00 C ATOM 1515 CD1 TRP A 99 188.529 4.834 0.755 1.00 0.00 C ATOM 1516 CD2 TRP A 99 188.204 2.997 -0.477 1.00 0.00 C ATOM 1517 NE1 TRP A 99 189.238 3.812 1.333 1.00 0.00 N ATOM 1518 CE2 TRP A 99 189.051 2.673 0.595 1.00 0.00 C ATOM 1519 CE3 TRP A 99 187.853 1.997 -1.387 1.00 0.00 C ATOM 1520 CZ2 TRP A 99 189.553 1.392 0.780 1.00 0.00 C ATOM 1521 CZ3 TRP A 99 188.350 0.725 -1.202 1.00 0.00 C ATOM 1522 CH2 TRP A 99 189.193 0.431 -0.126 1.00 0.00 C ATOM 0 H TRP A 99 186.865 7.009 -3.645 1.00 0.00 H new ATOM 0 HA TRP A 99 187.896 7.079 -0.916 1.00 0.00 H new ATOM 0 HB2 TRP A 99 186.088 5.408 -0.777 1.00 0.00 H new ATOM 0 HB3 TRP A 99 186.765 4.548 -2.145 1.00 0.00 H new ATOM 0 HD1 TRP A 99 188.484 5.846 1.129 1.00 0.00 H new ATOM 0 HE1 TRP A 99 189.810 3.888 2.174 1.00 0.00 H new ATOM 0 HE3 TRP A 99 187.203 2.217 -2.221 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 190.205 1.162 1.610 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 188.084 -0.056 -1.899 1.00 0.00 H new ATOM 0 HH2 TRP A 99 189.568 -0.575 -0.007 1.00 0.00 H new ATOM 1533 N THR A 100 190.019 5.823 -1.815 1.00 0.00 N ATOM 1534 CA THR A 100 191.333 5.608 -2.423 1.00 0.00 C ATOM 1535 C THR A 100 191.777 4.146 -2.433 1.00 0.00 C ATOM 1536 O THR A 100 191.277 3.319 -1.670 1.00 0.00 O ATOM 1537 CB THR A 100 192.370 6.414 -1.642 1.00 0.00 C ATOM 1538 OG1 THR A 100 193.572 6.542 -2.383 1.00 0.00 O ATOM 1539 CG2 THR A 100 192.718 5.794 -0.296 1.00 0.00 C ATOM 0 H THR A 100 189.985 5.650 -0.810 1.00 0.00 H new ATOM 0 HA THR A 100 191.252 5.927 -3.462 1.00 0.00 H new ATOM 0 HB THR A 100 191.911 7.388 -1.470 1.00 0.00 H new ATOM 0 HG1 THR A 100 194.335 6.321 -1.809 1.00 0.00 H new ATOM 0 HG21 THR A 100 193.459 6.413 0.209 1.00 0.00 H new ATOM 0 HG22 THR A 100 191.820 5.729 0.318 1.00 0.00 H new ATOM 0 HG23 THR A 100 193.125 4.795 -0.450 1.00 0.00 H new ATOM 1547 N VAL A 101 192.770 3.867 -3.278 1.00 0.00 N ATOM 1548 CA VAL A 101 193.361 2.535 -3.379 1.00 0.00 C ATOM 1549 C VAL A 101 194.865 2.588 -3.095 1.00 0.00 C ATOM 1550 O VAL A 101 195.518 1.553 -2.969 1.00 0.00 O ATOM 1551 CB VAL A 101 193.166 1.907 -4.767 1.00 0.00 C ATOM 1552 CG1 VAL A 101 193.607 0.453 -4.742 1.00 0.00 C ATOM 1553 CG2 VAL A 101 191.718 2.025 -5.216 1.00 0.00 C ATOM 0 H VAL A 101 193.184 4.554 -3.908 1.00 0.00 H new ATOM 0 HA VAL A 101 192.847 1.922 -2.639 1.00 0.00 H new ATOM 0 HB VAL A 101 193.781 2.448 -5.486 1.00 0.00 H new ATOM 0 HG11 VAL A 101 193.466 0.013 -5.729 1.00 0.00 H new ATOM 0 HG12 VAL A 101 194.660 0.397 -4.467 1.00 0.00 H new ATOM 0 HG13 VAL A 101 193.011 -0.095 -4.012 1.00 0.00 H new ATOM 0 HG21 VAL A 101 191.605 1.573 -6.202 1.00 0.00 H new ATOM 0 HG22 VAL A 101 191.073 1.510 -4.504 1.00 0.00 H new ATOM 0 HG23 VAL A 101 191.437 3.077 -5.265 1.00 0.00 H new ATOM 1563 N THR A 102 195.410 3.802 -3.002 1.00 0.00 N ATOM 1564 CA THR A 102 196.835 3.991 -2.745 1.00 0.00 C ATOM 1565 C THR A 102 197.255 3.375 -1.415 1.00 0.00 C ATOM 1566 O THR A 102 198.446 3.202 -1.152 1.00 0.00 O ATOM 1567 CB THR A 102 197.180 5.481 -2.759 1.00 0.00 C ATOM 1568 OG1 THR A 102 196.297 6.208 -1.921 1.00 0.00 O ATOM 1569 CG2 THR A 102 197.117 6.096 -4.139 1.00 0.00 C ATOM 0 H THR A 102 194.883 4.670 -3.101 1.00 0.00 H new ATOM 0 HA THR A 102 197.383 3.482 -3.538 1.00 0.00 H new ATOM 0 HB THR A 102 198.207 5.544 -2.399 1.00 0.00 H new ATOM 0 HG1 THR A 102 196.534 7.159 -1.942 1.00 0.00 H new ATOM 0 HG21 THR A 102 197.373 7.154 -4.078 1.00 0.00 H new ATOM 0 HG22 THR A 102 197.824 5.589 -4.796 1.00 0.00 H new ATOM 0 HG23 THR A 102 196.109 5.989 -4.539 1.00 0.00 H new ATOM 1577 N GLU A 103 196.280 3.043 -0.577 1.00 0.00 N ATOM 1578 CA GLU A 103 196.566 2.446 0.721 1.00 0.00 C ATOM 1579 C GLU A 103 195.851 1.109 0.864 1.00 0.00 C ATOM 1580 O GLU A 103 194.910 0.817 0.128 1.00 0.00 O ATOM 1581 CB GLU A 103 196.144 3.393 1.847 1.00 0.00 C ATOM 1582 CG GLU A 103 197.265 3.719 2.820 1.00 0.00 C ATOM 1583 CD GLU A 103 197.911 5.061 2.538 1.00 0.00 C ATOM 1584 OE1 GLU A 103 197.232 6.094 2.718 1.00 0.00 O ATOM 1585 OE2 GLU A 103 199.094 5.081 2.140 1.00 0.00 O ATOM 0 H GLU A 103 195.288 3.177 -0.772 1.00 0.00 H new ATOM 0 HA GLU A 103 197.640 2.274 0.791 1.00 0.00 H new ATOM 0 HB2 GLU A 103 195.772 4.320 1.411 1.00 0.00 H new ATOM 0 HB3 GLU A 103 195.316 2.945 2.396 1.00 0.00 H new ATOM 0 HG2 GLU A 103 196.871 3.716 3.836 1.00 0.00 H new ATOM 0 HG3 GLU A 103 198.023 2.937 2.770 1.00 0.00 H new ATOM 1592 N PHE A 104 196.300 0.302 1.819 1.00 0.00 N ATOM 1593 CA PHE A 104 195.700 -0.997 2.063 1.00 0.00 C ATOM 1594 C PHE A 104 195.644 -1.247 3.559 1.00 0.00 C ATOM 1595 O PHE A 104 196.508 -0.781 4.301 1.00 0.00 O ATOM 1596 CB PHE A 104 196.512 -2.094 1.371 1.00 0.00 C ATOM 1597 CG PHE A 104 196.435 -2.045 -0.130 1.00 0.00 C ATOM 1598 CD1 PHE A 104 195.350 -2.587 -0.801 1.00 0.00 C ATOM 1599 CD2 PHE A 104 197.451 -1.463 -0.871 1.00 0.00 C ATOM 1600 CE1 PHE A 104 195.278 -2.547 -2.181 1.00 0.00 C ATOM 1601 CE2 PHE A 104 197.386 -1.420 -2.252 1.00 0.00 C ATOM 1602 CZ PHE A 104 196.298 -1.962 -2.909 1.00 0.00 C ATOM 0 H PHE A 104 197.080 0.529 2.436 1.00 0.00 H new ATOM 0 HA PHE A 104 194.689 -1.012 1.656 1.00 0.00 H new ATOM 0 HB2 PHE A 104 197.555 -2.009 1.676 1.00 0.00 H new ATOM 0 HB3 PHE A 104 196.158 -3.067 1.713 1.00 0.00 H new ATOM 0 HD1 PHE A 104 194.551 -3.046 -0.239 1.00 0.00 H new ATOM 0 HD2 PHE A 104 198.304 -1.038 -0.364 1.00 0.00 H new ATOM 0 HE1 PHE A 104 194.426 -2.972 -2.690 1.00 0.00 H new ATOM 0 HE2 PHE A 104 198.185 -0.963 -2.816 1.00 0.00 H new ATOM 0 HZ PHE A 104 196.244 -1.929 -3.987 1.00 0.00 H new ATOM 1612 N VAL A 105 194.631 -1.973 4.010 1.00 0.00 N ATOM 1613 CA VAL A 105 194.502 -2.252 5.426 1.00 0.00 C ATOM 1614 C VAL A 105 195.055 -3.637 5.759 1.00 0.00 C ATOM 1615 O VAL A 105 195.836 -4.197 4.989 1.00 0.00 O ATOM 1616 CB VAL A 105 193.043 -2.113 5.914 1.00 0.00 C ATOM 1617 CG1 VAL A 105 192.450 -0.800 5.427 1.00 0.00 C ATOM 1618 CG2 VAL A 105 192.194 -3.290 5.452 1.00 0.00 C ATOM 0 H VAL A 105 193.899 -2.373 3.423 1.00 0.00 H new ATOM 0 HA VAL A 105 195.093 -1.505 5.957 1.00 0.00 H new ATOM 0 HB VAL A 105 193.046 -2.114 7.004 1.00 0.00 H new ATOM 0 HG11 VAL A 105 191.421 -0.713 5.777 1.00 0.00 H new ATOM 0 HG12 VAL A 105 193.037 0.031 5.817 1.00 0.00 H new ATOM 0 HG13 VAL A 105 192.466 -0.776 4.337 1.00 0.00 H new ATOM 0 HG21 VAL A 105 191.172 -3.165 5.810 1.00 0.00 H new ATOM 0 HG22 VAL A 105 192.194 -3.333 4.363 1.00 0.00 H new ATOM 0 HG23 VAL A 105 192.608 -4.216 5.852 1.00 0.00 H new ATOM 1628 N ASN A 106 194.673 -4.176 6.908 1.00 0.00 N ATOM 1629 CA ASN A 106 195.159 -5.480 7.335 1.00 0.00 C ATOM 1630 C ASN A 106 194.074 -6.530 7.261 1.00 0.00 C ATOM 1631 O ASN A 106 192.907 -6.255 7.538 1.00 0.00 O ATOM 1632 CB ASN A 106 195.692 -5.393 8.765 1.00 0.00 C ATOM 1633 CG ASN A 106 196.877 -6.310 8.998 1.00 0.00 C ATOM 1634 OD1 ASN A 106 197.680 -6.549 8.097 1.00 0.00 O ATOM 1635 ND2 ASN A 106 196.992 -6.826 10.216 1.00 0.00 N ATOM 0 H ASN A 106 194.028 -3.731 7.561 1.00 0.00 H new ATOM 0 HA ASN A 106 195.961 -5.775 6.658 1.00 0.00 H new ATOM 0 HB2 ASN A 106 195.984 -4.365 8.979 1.00 0.00 H new ATOM 0 HB3 ASN A 106 194.895 -5.649 9.463 1.00 0.00 H new ATOM 0 HD21 ASN A 106 197.770 -7.448 10.435 1.00 0.00 H new ATOM 0 HD22 ASN A 106 196.302 -6.600 10.933 1.00 0.00 H new ATOM 1642 N GLU A 107 194.472 -7.753 6.923 1.00 0.00 N ATOM 1643 CA GLU A 107 193.531 -8.857 6.863 1.00 0.00 C ATOM 1644 C GLU A 107 192.798 -8.958 8.196 1.00 0.00 C ATOM 1645 O GLU A 107 191.715 -9.535 8.286 1.00 0.00 O ATOM 1646 CB GLU A 107 194.259 -10.168 6.557 1.00 0.00 C ATOM 1647 CG GLU A 107 195.518 -10.370 7.385 1.00 0.00 C ATOM 1648 CD GLU A 107 195.734 -11.819 7.773 1.00 0.00 C ATOM 1649 OE1 GLU A 107 196.076 -12.627 6.885 1.00 0.00 O ATOM 1650 OE2 GLU A 107 195.558 -12.147 8.966 1.00 0.00 O ATOM 0 H GLU A 107 195.434 -8.000 6.689 1.00 0.00 H new ATOM 0 HA GLU A 107 192.813 -8.676 6.063 1.00 0.00 H new ATOM 0 HB2 GLU A 107 193.579 -11.002 6.734 1.00 0.00 H new ATOM 0 HB3 GLU A 107 194.522 -10.190 5.499 1.00 0.00 H new ATOM 0 HG2 GLU A 107 196.381 -10.017 6.820 1.00 0.00 H new ATOM 0 HG3 GLU A 107 195.457 -9.761 8.287 1.00 0.00 H new ATOM 1657 N ASP A 108 193.403 -8.364 9.227 1.00 0.00 N ATOM 1658 CA ASP A 108 192.815 -8.354 10.558 1.00 0.00 C ATOM 1659 C ASP A 108 191.537 -7.525 10.555 1.00 0.00 C ATOM 1660 O ASP A 108 190.610 -7.792 11.319 1.00 0.00 O ATOM 1661 CB ASP A 108 193.807 -7.790 11.575 1.00 0.00 C ATOM 1662 CG ASP A 108 193.778 -8.544 12.890 1.00 0.00 C ATOM 1663 OD1 ASP A 108 194.050 -9.763 12.883 1.00 0.00 O ATOM 1664 OD2 ASP A 108 193.481 -7.915 13.928 1.00 0.00 O ATOM 0 H ASP A 108 194.301 -7.884 9.160 1.00 0.00 H new ATOM 0 HA ASP A 108 192.573 -9.378 10.842 1.00 0.00 H new ATOM 0 HB2 ASP A 108 194.813 -7.831 11.158 1.00 0.00 H new ATOM 0 HB3 ASP A 108 193.579 -6.740 11.756 1.00 0.00 H new ATOM 1669 N GLY A 109 191.490 -6.519 9.682 1.00 0.00 N ATOM 1670 CA GLY A 109 190.314 -5.678 9.592 1.00 0.00 C ATOM 1671 C GLY A 109 190.590 -4.226 9.933 1.00 0.00 C ATOM 1672 O GLY A 109 189.659 -3.466 10.204 1.00 0.00 O ATOM 0 H GLY A 109 192.244 -6.275 9.040 1.00 0.00 H new ATOM 0 HA2 GLY A 109 189.910 -5.737 8.581 1.00 0.00 H new ATOM 0 HA3 GLY A 109 189.548 -6.063 10.265 1.00 0.00 H new ATOM 1676 N THR A 110 191.859 -3.828 9.910 1.00 0.00 N ATOM 1677 CA THR A 110 192.209 -2.445 10.210 1.00 0.00 C ATOM 1678 C THR A 110 193.316 -1.939 9.310 1.00 0.00 C ATOM 1679 O THR A 110 194.089 -2.711 8.753 1.00 0.00 O ATOM 1680 CB THR A 110 192.591 -2.263 11.674 1.00 0.00 C ATOM 1681 OG1 THR A 110 193.943 -2.627 11.891 1.00 0.00 O ATOM 1682 CG2 THR A 110 191.735 -3.070 12.627 1.00 0.00 C ATOM 0 H THR A 110 192.650 -4.433 9.690 1.00 0.00 H new ATOM 0 HA THR A 110 191.317 -1.850 10.017 1.00 0.00 H new ATOM 0 HB THR A 110 192.430 -1.205 11.881 1.00 0.00 H new ATOM 0 HG1 THR A 110 194.168 -2.501 12.836 1.00 0.00 H new ATOM 0 HG21 THR A 110 192.063 -2.892 13.651 1.00 0.00 H new ATOM 0 HG22 THR A 110 190.692 -2.770 12.523 1.00 0.00 H new ATOM 0 HG23 THR A 110 191.832 -4.130 12.394 1.00 0.00 H new ATOM 1690 N PRO A 111 193.372 -0.612 9.148 1.00 0.00 N ATOM 1691 CA PRO A 111 194.349 0.056 8.289 1.00 0.00 C ATOM 1692 C PRO A 111 195.792 -0.341 8.567 1.00 0.00 C ATOM 1693 O PRO A 111 196.543 0.403 9.199 1.00 0.00 O ATOM 1694 CB PRO A 111 194.133 1.542 8.591 1.00 0.00 C ATOM 1695 CG PRO A 111 192.725 1.632 9.066 1.00 0.00 C ATOM 1696 CD PRO A 111 192.452 0.342 9.789 1.00 0.00 C ATOM 0 HA PRO A 111 194.199 -0.217 7.244 1.00 0.00 H new ATOM 0 HB2 PRO A 111 194.830 1.897 9.350 1.00 0.00 H new ATOM 0 HB3 PRO A 111 194.291 2.153 7.703 1.00 0.00 H new ATOM 0 HG2 PRO A 111 192.590 2.487 9.728 1.00 0.00 H new ATOM 0 HG3 PRO A 111 192.038 1.764 8.230 1.00 0.00 H new ATOM 0 HD2 PRO A 111 192.647 0.432 10.858 1.00 0.00 H new ATOM 0 HD3 PRO A 111 191.413 0.033 9.680 1.00 0.00 H new ATOM 1704 N ALA A 112 196.176 -1.511 8.064 1.00 0.00 N ATOM 1705 CA ALA A 112 197.531 -2.017 8.215 1.00 0.00 C ATOM 1706 C ALA A 112 197.737 -2.658 9.584 1.00 0.00 C ATOM 1707 O ALA A 112 196.793 -2.801 10.362 1.00 0.00 O ATOM 1708 CB ALA A 112 198.533 -0.899 7.989 1.00 0.00 C ATOM 0 H ALA A 112 195.556 -2.131 7.542 1.00 0.00 H new ATOM 0 HA ALA A 112 197.690 -2.791 7.464 1.00 0.00 H new ATOM 0 HB1 ALA A 112 199.545 -1.288 8.104 1.00 0.00 H new ATOM 0 HB2 ALA A 112 198.411 -0.499 6.983 1.00 0.00 H new ATOM 0 HB3 ALA A 112 198.364 -0.106 8.718 1.00 0.00 H new ATOM 1714 N ASP A 113 198.975 -3.045 9.872 1.00 0.00 N ATOM 1715 CA ASP A 113 199.303 -3.671 11.148 1.00 0.00 C ATOM 1716 C ASP A 113 200.330 -2.845 11.914 1.00 0.00 C ATOM 1717 O ASP A 113 201.531 -2.930 11.652 1.00 0.00 O ATOM 1718 CB ASP A 113 199.838 -5.086 10.921 1.00 0.00 C ATOM 1719 CG ASP A 113 199.785 -5.934 12.178 1.00 0.00 C ATOM 1720 OD1 ASP A 113 200.688 -5.791 13.028 1.00 0.00 O ATOM 1721 OD2 ASP A 113 198.839 -6.738 12.313 1.00 0.00 O ATOM 0 H ASP A 113 199.768 -2.936 9.239 1.00 0.00 H new ATOM 0 HA ASP A 113 198.391 -3.724 11.743 1.00 0.00 H new ATOM 0 HB2 ASP A 113 199.257 -5.569 10.135 1.00 0.00 H new ATOM 0 HB3 ASP A 113 200.867 -5.030 10.567 1.00 0.00 H new ATOM 1726 N THR A 114 199.852 -2.047 12.862 1.00 0.00 N ATOM 1727 CA THR A 114 200.729 -1.205 13.670 1.00 0.00 C ATOM 1728 C THR A 114 201.605 -2.054 14.586 1.00 0.00 C ATOM 1729 O THR A 114 202.710 -1.652 14.949 1.00 0.00 O ATOM 1730 CB THR A 114 199.903 -0.222 14.500 1.00 0.00 C ATOM 1731 OG1 THR A 114 198.652 -0.785 14.849 1.00 0.00 O ATOM 1732 CG2 THR A 114 199.635 1.086 13.787 1.00 0.00 C ATOM 0 H THR A 114 198.861 -1.965 13.091 1.00 0.00 H new ATOM 0 HA THR A 114 201.377 -0.645 12.996 1.00 0.00 H new ATOM 0 HB THR A 114 200.504 -0.018 15.386 1.00 0.00 H new ATOM 0 HG1 THR A 114 198.140 -0.140 15.381 1.00 0.00 H new ATOM 0 HG21 THR A 114 199.045 1.737 14.431 1.00 0.00 H new ATOM 0 HG22 THR A 114 200.582 1.572 13.550 1.00 0.00 H new ATOM 0 HG23 THR A 114 199.086 0.892 12.866 1.00 0.00 H new ATOM 1740 N SER A 115 201.105 -3.229 14.956 1.00 0.00 N ATOM 1741 CA SER A 115 201.842 -4.136 15.829 1.00 0.00 C ATOM 1742 C SER A 115 202.061 -3.512 17.204 1.00 0.00 C ATOM 1743 O SER A 115 201.564 -2.421 17.488 1.00 0.00 O ATOM 1744 CB SER A 115 203.189 -4.502 15.202 1.00 0.00 C ATOM 1745 OG SER A 115 203.100 -5.717 14.476 1.00 0.00 O ATOM 0 H SER A 115 200.191 -3.576 14.664 1.00 0.00 H new ATOM 0 HA SER A 115 201.248 -5.042 15.951 1.00 0.00 H new ATOM 0 HB2 SER A 115 203.514 -3.701 14.538 1.00 0.00 H new ATOM 0 HB3 SER A 115 203.944 -4.596 15.983 1.00 0.00 H new ATOM 0 HG SER A 115 202.265 -5.731 13.963 1.00 0.00 H new ATOM 1751 N LEU A 116 202.806 -4.211 18.053 1.00 0.00 N ATOM 1752 CA LEU A 116 203.092 -3.728 19.399 1.00 0.00 C ATOM 1753 C LEU A 116 201.811 -3.610 20.218 1.00 0.00 C ATOM 1754 O LEU A 116 201.177 -2.555 20.251 1.00 0.00 O ATOM 1755 CB LEU A 116 203.806 -2.374 19.339 1.00 0.00 C ATOM 1756 CG LEU A 116 205.044 -2.255 20.230 1.00 0.00 C ATOM 1757 CD1 LEU A 116 205.836 -1.005 19.877 1.00 0.00 C ATOM 1758 CD2 LEU A 116 204.644 -2.238 21.697 1.00 0.00 C ATOM 0 H LEU A 116 203.223 -5.115 17.833 1.00 0.00 H new ATOM 0 HA LEU A 116 203.746 -4.451 19.887 1.00 0.00 H new ATOM 0 HB2 LEU A 116 204.100 -2.181 18.307 1.00 0.00 H new ATOM 0 HB3 LEU A 116 203.098 -1.594 19.620 1.00 0.00 H new ATOM 0 HG LEU A 116 205.679 -3.124 20.057 1.00 0.00 H new ATOM 0 HD11 LEU A 116 206.713 -0.936 20.520 1.00 0.00 H new ATOM 0 HD12 LEU A 116 206.153 -1.057 18.835 1.00 0.00 H new ATOM 0 HD13 LEU A 116 205.210 -0.125 20.022 1.00 0.00 H new ATOM 0 HD21 LEU A 116 205.537 -2.153 22.317 1.00 0.00 H new ATOM 0 HD22 LEU A 116 203.989 -1.387 21.886 1.00 0.00 H new ATOM 0 HD23 LEU A 116 204.119 -3.161 21.942 1.00 0.00 H new ATOM 1770 N GLU A 117 201.435 -4.699 20.881 1.00 0.00 N ATOM 1771 CA GLU A 117 200.230 -4.718 21.701 1.00 0.00 C ATOM 1772 C GLU A 117 200.345 -5.762 22.812 1.00 0.00 C ATOM 1773 O GLU A 117 200.916 -6.833 22.609 1.00 0.00 O ATOM 1774 CB GLU A 117 199.003 -5.009 20.833 1.00 0.00 C ATOM 1775 CG GLU A 117 197.890 -3.986 20.992 1.00 0.00 C ATOM 1776 CD GLU A 117 196.512 -4.586 20.784 1.00 0.00 C ATOM 1777 OE1 GLU A 117 196.238 -5.068 19.666 1.00 0.00 O ATOM 1778 OE2 GLU A 117 195.709 -4.577 21.741 1.00 0.00 O ATOM 0 H GLU A 117 201.948 -5.580 20.866 1.00 0.00 H new ATOM 0 HA GLU A 117 200.115 -3.736 22.161 1.00 0.00 H new ATOM 0 HB2 GLU A 117 199.308 -5.043 19.787 1.00 0.00 H new ATOM 0 HB3 GLU A 117 198.616 -5.997 21.084 1.00 0.00 H new ATOM 0 HG2 GLU A 117 197.945 -3.547 21.988 1.00 0.00 H new ATOM 0 HG3 GLU A 117 198.041 -3.176 20.278 1.00 0.00 H new ATOM 1785 N PRO A 118 199.803 -5.463 24.007 1.00 0.00 N ATOM 1786 CA PRO A 118 199.852 -6.383 25.147 1.00 0.00 C ATOM 1787 C PRO A 118 199.320 -7.769 24.794 1.00 0.00 C ATOM 1788 O PRO A 118 200.016 -8.763 25.090 1.00 0.00 O ATOM 1789 CB PRO A 118 198.949 -5.714 26.187 1.00 0.00 C ATOM 1790 CG PRO A 118 198.975 -4.267 25.836 1.00 0.00 C ATOM 1791 CD PRO A 118 199.102 -4.207 24.339 1.00 0.00 C ATOM 0 HA PRO A 118 200.872 -6.547 25.493 1.00 0.00 H new ATOM 0 HB2 PRO A 118 197.935 -6.113 26.147 1.00 0.00 H new ATOM 0 HB3 PRO A 118 199.318 -5.883 27.199 1.00 0.00 H new ATOM 0 HG2 PRO A 118 198.066 -3.768 26.171 1.00 0.00 H new ATOM 0 HG3 PRO A 118 199.812 -3.763 26.319 1.00 0.00 H new ATOM 0 HD2 PRO A 118 198.127 -4.150 23.855 1.00 0.00 H new ATOM 0 HD3 PRO A 118 199.669 -3.333 24.018 1.00 0.00 H new TER 1799 PRO A 118