USER MOD reduce.3.24.130724 H: found=0, std=0, add=1033, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1033 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 56 THR OG1 : rot 154:sc= 2.01 USER MOD Set 1.2: A 108 SER OG : rot -93:sc= 0.494 USER MOD Set 1.3: A 110 THR OG1 : rot 180:sc= 0.934 USER MOD Set 2.1: A 89 ASN : amide:sc= 0.00836 K(o=0.37,f=-4!) USER MOD Set 2.2: A 123 GLN : amide:sc= 0.364 K(o=0.37,f=-4) USER MOD Set 3.1: A 82 CYS SG : rot 89:sc= -0.501 USER MOD Set 3.2: A 102 THR OG1 : rot 12:sc= 0.597 USER MOD Set 4.1: A 59 ASN : amide:sc= 0.515 K(o=1.9,f=-5) USER MOD Set 4.2: A 75 LYS NZ :NH3+ 155:sc= 1.34 (180deg=-0.202) USER MOD Set 5.1: A 9 GLN : amide:sc= 1.19 K(o=2.2,f=-0.77) USER MOD Set 5.2: A 11 GLN : amide:sc= 1.05 K(o=2.2,f=-0.77) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 HIS :FLIP no HD1:sc=-0.00421 F(o=-0.63,f=-0.0042) USER MOD Single : A 16 HIS : no HD1:sc= 0 X(o=0,f=-0.0079) USER MOD Single : A 17 ASN :FLIP amide:sc= -0.0536 F(o=-0.63,f=-0.054) USER MOD Single : A 25 LYS NZ :NH3+ 179:sc= 1.3 (180deg=1.24) USER MOD Single : A 28 LYS NZ :NH3+ -144:sc= 1.27 (180deg=-0.0049) USER MOD Single : A 29 THR OG1 : rot 171:sc= 0.713 USER MOD Single : A 32 SER OG : rot 77:sc= 1.08 USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 96:sc= 2.31 USER MOD Single : A 40 TYR OH : rot 151:sc= 0 USER MOD Single : A 41 THR OG1 : rot 160:sc= 0.249 USER MOD Single : A 47 SER OG : rot 87:sc= 1.3 USER MOD Single : A 51 ASN :FLIP amide:sc= 0 F(o=-0.77,f=0) USER MOD Single : A 54 THR OG1 : rot -48:sc= 1.23 USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= -0.0875 USER MOD Single : A 71 HIS : no HE2:sc= 1.1 K(o=1.1,f=-5.4!) USER MOD Single : A 76 SER OG : rot 96:sc= 1.08 USER MOD Single : A 81 ASN : amide:sc= -0.369 X(o=-0.37,f=-0.66) USER MOD Single : A 85 THR OG1 : rot 87:sc= 1.27 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 GLN : amide:sc= 1.19 K(o=1.2,f=0) USER MOD Single : A 91 GLN : amide:sc= 0.258 X(o=0.26,f=0) USER MOD Single : A 94 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 MET CE :methyl 173:sc= -0.736 (180deg=-0.843) USER MOD Single : A 104 SER OG : rot 27:sc= 2.53 USER MOD Single : A 106 ASN : amide:sc=-0.00475 X(o=-0.0048,f=-0.3) USER MOD Single : A 107 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0.628 USER MOD Single : A 113 GLN :FLIP amide:sc= -2.5! C(o=-7!,f=-2.5!) USER MOD Single : A 114 MET CE :methyl 162:sc= -0.114 (180deg=-0.609) USER MOD Single : A 115 GLN :FLIP amide:sc= -0.396 F(o=-2.9,f=-0.4) USER MOD Single : A 116 TYR OH : rot -166:sc= 1.28 USER MOD Single : A 125 GLN : amide:sc= -1.49 X(o=-1.5,f=-1.1) USER MOD Single : A 129 THR OG1 : rot -150:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 LYS NZ :NH3+ 161:sc= 0.193 (180deg=-0.486) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 3.679 9.764 0.803 1.00 0.00 N ATOM 2 CA PRO A 1 4.268 10.301 2.014 1.00 0.00 C ATOM 3 C PRO A 1 5.801 10.309 1.943 1.00 0.00 C ATOM 4 O PRO A 1 6.471 10.438 2.960 1.00 0.00 O ATOM 5 CB PRO A 1 3.807 9.444 3.181 1.00 0.00 C ATOM 6 CG PRO A 1 2.875 8.458 2.551 1.00 0.00 C ATOM 7 CD PRO A 1 2.511 9.007 1.193 1.00 0.00 C ATOM 0 H2 PRO A 1 4.346 9.169 0.312 1.00 0.00 H new ATOM 0 H3 PRO A 1 3.423 10.516 0.163 1.00 0.00 H new ATOM 0 HA PRO A 1 3.946 11.335 2.140 1.00 0.00 H new ATOM 0 HB2 PRO A 1 4.646 8.947 3.669 1.00 0.00 H new ATOM 0 HB3 PRO A 1 3.304 10.041 3.942 1.00 0.00 H new ATOM 0 HG2 PRO A 1 3.350 7.482 2.458 1.00 0.00 H new ATOM 0 HG3 PRO A 1 1.984 8.322 3.164 1.00 0.00 H new ATOM 0 HD2 PRO A 1 2.296 8.208 0.483 1.00 0.00 H new ATOM 0 HD3 PRO A 1 1.623 9.638 1.241 1.00 0.00 H new ATOM 17 N VAL A 2 6.365 10.202 0.750 1.00 0.00 N ATOM 18 CA VAL A 2 7.810 10.166 0.609 1.00 0.00 C ATOM 19 C VAL A 2 8.249 11.055 -0.551 1.00 0.00 C ATOM 20 O VAL A 2 7.536 11.199 -1.546 1.00 0.00 O ATOM 21 CB VAL A 2 8.374 8.696 0.400 1.00 0.00 C ATOM 22 CG1 VAL A 2 9.899 8.663 0.358 1.00 0.00 C ATOM 23 CG2 VAL A 2 7.888 7.752 1.478 1.00 0.00 C ATOM 0 H VAL A 2 5.848 10.139 -0.127 1.00 0.00 H new ATOM 0 HA VAL A 2 8.225 10.541 1.545 1.00 0.00 H new ATOM 0 HB VAL A 2 7.992 8.365 -0.566 1.00 0.00 H new ATOM 0 HG11 VAL A 2 10.237 7.637 0.214 1.00 0.00 H new ATOM 0 HG12 VAL A 2 10.254 9.281 -0.467 1.00 0.00 H new ATOM 0 HG13 VAL A 2 10.297 9.047 1.297 1.00 0.00 H new ATOM 0 HG21 VAL A 2 8.295 6.757 1.301 1.00 0.00 H new ATOM 0 HG22 VAL A 2 8.219 8.111 2.452 1.00 0.00 H new ATOM 0 HG23 VAL A 2 6.799 7.707 1.459 1.00 0.00 H new ATOM 33 N THR A 3 9.365 11.696 -0.365 1.00 0.00 N ATOM 34 CA THR A 3 10.053 12.437 -1.400 1.00 0.00 C ATOM 35 C THR A 3 11.489 11.881 -1.454 1.00 0.00 C ATOM 36 O THR A 3 12.049 11.536 -0.394 1.00 0.00 O ATOM 37 CB THR A 3 10.059 13.983 -1.127 1.00 0.00 C ATOM 38 OG1 THR A 3 10.869 14.671 -2.095 1.00 0.00 O ATOM 39 CG2 THR A 3 10.547 14.315 0.268 1.00 0.00 C ATOM 0 H THR A 3 9.842 11.723 0.536 1.00 0.00 H new ATOM 0 HA THR A 3 9.539 12.312 -2.353 1.00 0.00 H new ATOM 0 HB THR A 3 9.026 14.319 -1.213 1.00 0.00 H new ATOM 0 HG1 THR A 3 10.857 15.633 -1.907 1.00 0.00 H new ATOM 0 HG21 THR A 3 10.534 15.396 0.411 1.00 0.00 H new ATOM 0 HG22 THR A 3 9.895 13.844 1.003 1.00 0.00 H new ATOM 0 HG23 THR A 3 11.564 13.945 0.395 1.00 0.00 H new ATOM 47 N GLU A 4 12.074 11.753 -2.645 1.00 0.00 N ATOM 48 CA GLU A 4 13.399 11.143 -2.769 1.00 0.00 C ATOM 49 C GLU A 4 14.365 11.938 -3.660 1.00 0.00 C ATOM 50 O GLU A 4 13.985 12.868 -4.390 1.00 0.00 O ATOM 51 CB GLU A 4 13.345 9.694 -3.267 1.00 0.00 C ATOM 52 CG GLU A 4 12.644 9.544 -4.601 1.00 0.00 C ATOM 53 CD GLU A 4 12.885 8.220 -5.269 1.00 0.00 C ATOM 54 OE1 GLU A 4 12.599 7.187 -4.686 1.00 0.00 O ATOM 55 OE2 GLU A 4 13.323 8.206 -6.442 1.00 0.00 O ATOM 0 H GLU A 4 11.660 12.058 -3.526 1.00 0.00 H new ATOM 0 HA GLU A 4 13.786 11.156 -1.750 1.00 0.00 H new ATOM 0 HB2 GLU A 4 14.361 9.309 -3.353 1.00 0.00 H new ATOM 0 HB3 GLU A 4 12.834 9.081 -2.525 1.00 0.00 H new ATOM 0 HG2 GLU A 4 11.572 9.676 -4.454 1.00 0.00 H new ATOM 0 HG3 GLU A 4 12.975 10.341 -5.266 1.00 0.00 H new ATOM 62 N THR A 5 15.594 11.563 -3.553 1.00 0.00 N ATOM 63 CA THR A 5 16.664 12.137 -4.283 1.00 0.00 C ATOM 64 C THR A 5 17.670 11.035 -4.556 1.00 0.00 C ATOM 65 O THR A 5 17.642 9.984 -3.881 1.00 0.00 O ATOM 66 CB THR A 5 17.329 13.311 -3.502 1.00 0.00 C ATOM 67 OG1 THR A 5 18.247 13.990 -4.327 1.00 0.00 O ATOM 68 CG2 THR A 5 18.062 12.849 -2.242 1.00 0.00 C ATOM 0 H THR A 5 15.890 10.815 -2.926 1.00 0.00 H new ATOM 0 HA THR A 5 16.291 12.559 -5.216 1.00 0.00 H new ATOM 0 HB THR A 5 16.517 13.972 -3.199 1.00 0.00 H new ATOM 0 HG1 THR A 5 18.656 14.726 -3.825 1.00 0.00 H new ATOM 0 HG21 THR A 5 18.504 13.711 -1.742 1.00 0.00 H new ATOM 0 HG22 THR A 5 17.357 12.361 -1.569 1.00 0.00 H new ATOM 0 HG23 THR A 5 18.848 12.146 -2.516 1.00 0.00 H new ATOM 76 N VAL A 6 18.484 11.217 -5.546 1.00 0.00 N ATOM 77 CA VAL A 6 19.493 10.252 -5.872 1.00 0.00 C ATOM 78 C VAL A 6 20.838 10.840 -5.661 1.00 0.00 C ATOM 79 O VAL A 6 21.194 11.853 -6.263 1.00 0.00 O ATOM 80 CB VAL A 6 19.322 9.615 -7.304 1.00 0.00 C ATOM 81 CG1 VAL A 6 18.163 8.628 -7.297 1.00 0.00 C ATOM 82 CG2 VAL A 6 19.032 10.682 -8.344 1.00 0.00 C ATOM 0 H VAL A 6 18.471 12.037 -6.153 1.00 0.00 H new ATOM 0 HA VAL A 6 19.373 9.410 -5.190 1.00 0.00 H new ATOM 0 HB VAL A 6 20.254 9.109 -7.555 1.00 0.00 H new ATOM 0 HG11 VAL A 6 18.051 8.192 -8.290 1.00 0.00 H new ATOM 0 HG12 VAL A 6 18.363 7.837 -6.574 1.00 0.00 H new ATOM 0 HG13 VAL A 6 17.245 9.147 -7.023 1.00 0.00 H new ATOM 0 HG21 VAL A 6 18.919 10.215 -9.322 1.00 0.00 H new ATOM 0 HG22 VAL A 6 18.112 11.204 -8.082 1.00 0.00 H new ATOM 0 HG23 VAL A 6 19.857 11.394 -8.375 1.00 0.00 H new ATOM 92 N ASP A 7 21.554 10.291 -4.726 1.00 0.00 N ATOM 93 CA ASP A 7 22.875 10.801 -4.422 1.00 0.00 C ATOM 94 C ASP A 7 23.900 10.053 -5.204 1.00 0.00 C ATOM 95 O ASP A 7 23.812 8.829 -5.275 1.00 0.00 O ATOM 96 CB ASP A 7 23.174 10.674 -2.931 1.00 0.00 C ATOM 97 CG ASP A 7 24.537 11.201 -2.535 1.00 0.00 C ATOM 98 OD1 ASP A 7 24.654 12.405 -2.193 1.00 0.00 O ATOM 99 OD2 ASP A 7 25.504 10.423 -2.511 1.00 0.00 O ATOM 0 H ASP A 7 21.257 9.496 -4.160 1.00 0.00 H new ATOM 0 HA ASP A 7 22.907 11.856 -4.695 1.00 0.00 H new ATOM 0 HB2 ASP A 7 22.410 11.211 -2.369 1.00 0.00 H new ATOM 0 HB3 ASP A 7 23.103 9.625 -2.643 1.00 0.00 H new ATOM 104 N GLY A 8 24.806 10.820 -5.832 1.00 0.00 N ATOM 105 CA GLY A 8 26.003 10.367 -6.591 1.00 0.00 C ATOM 106 C GLY A 8 26.103 8.892 -6.927 1.00 0.00 C ATOM 107 O GLY A 8 25.977 8.493 -8.101 1.00 0.00 O ATOM 0 H GLY A 8 24.725 11.837 -5.828 1.00 0.00 H new ATOM 0 HA2 GLY A 8 26.041 10.928 -7.525 1.00 0.00 H new ATOM 0 HA3 GLY A 8 26.888 10.642 -6.018 1.00 0.00 H new ATOM 111 N GLN A 9 26.319 8.090 -5.898 1.00 0.00 N ATOM 112 CA GLN A 9 26.492 6.645 -6.004 1.00 0.00 C ATOM 113 C GLN A 9 25.238 5.886 -6.477 1.00 0.00 C ATOM 114 O GLN A 9 25.219 4.661 -6.474 1.00 0.00 O ATOM 115 CB GLN A 9 27.019 6.074 -4.685 1.00 0.00 C ATOM 116 CG GLN A 9 26.196 6.448 -3.441 1.00 0.00 C ATOM 117 CD GLN A 9 26.814 5.897 -2.176 1.00 0.00 C ATOM 118 OE1 GLN A 9 28.030 5.737 -2.081 1.00 0.00 O ATOM 119 NE2 GLN A 9 26.017 5.640 -1.198 1.00 0.00 N ATOM 0 H GLN A 9 26.381 8.432 -4.939 1.00 0.00 H new ATOM 0 HA GLN A 9 27.230 6.489 -6.791 1.00 0.00 H new ATOM 0 HB2 GLN A 9 27.055 4.988 -4.765 1.00 0.00 H new ATOM 0 HB3 GLN A 9 28.044 6.417 -4.541 1.00 0.00 H new ATOM 0 HG2 GLN A 9 26.121 7.533 -3.367 1.00 0.00 H new ATOM 0 HG3 GLN A 9 25.181 6.065 -3.547 1.00 0.00 H new ATOM 0 HE21 GLN A 9 25.013 5.783 -1.307 1.00 0.00 H new ATOM 0 HE22 GLN A 9 26.390 5.294 -0.314 1.00 0.00 H new ATOM 128 N GLY A 10 24.213 6.607 -6.857 1.00 0.00 N ATOM 129 CA GLY A 10 23.058 6.014 -7.438 1.00 0.00 C ATOM 130 C GLY A 10 22.178 5.372 -6.410 1.00 0.00 C ATOM 131 O GLY A 10 21.778 4.208 -6.557 1.00 0.00 O ATOM 0 H GLY A 10 24.166 7.622 -6.768 1.00 0.00 H new ATOM 0 HA2 GLY A 10 22.492 6.775 -7.976 1.00 0.00 H new ATOM 0 HA3 GLY A 10 23.364 5.267 -8.171 1.00 0.00 H new ATOM 135 N GLN A 11 21.867 6.097 -5.366 1.00 0.00 N ATOM 136 CA GLN A 11 20.984 5.583 -4.364 1.00 0.00 C ATOM 137 C GLN A 11 19.769 6.479 -4.320 1.00 0.00 C ATOM 138 O GLN A 11 19.871 7.650 -4.690 1.00 0.00 O ATOM 139 CB GLN A 11 21.655 5.525 -2.994 1.00 0.00 C ATOM 140 CG GLN A 11 21.979 6.874 -2.394 1.00 0.00 C ATOM 141 CD GLN A 11 22.395 6.748 -0.967 1.00 0.00 C ATOM 142 OE1 GLN A 11 23.567 6.629 -0.659 1.00 0.00 O ATOM 143 NE2 GLN A 11 21.437 6.714 -0.102 1.00 0.00 N ATOM 0 H GLN A 11 22.213 7.041 -5.193 1.00 0.00 H new ATOM 0 HA GLN A 11 20.702 4.561 -4.617 1.00 0.00 H new ATOM 0 HB2 GLN A 11 21.004 4.984 -2.308 1.00 0.00 H new ATOM 0 HB3 GLN A 11 22.577 4.949 -3.080 1.00 0.00 H new ATOM 0 HG2 GLN A 11 22.777 7.347 -2.967 1.00 0.00 H new ATOM 0 HG3 GLN A 11 21.107 7.524 -2.465 1.00 0.00 H new ATOM 0 HE21 GLN A 11 20.470 6.818 -0.408 1.00 0.00 H new ATOM 0 HE22 GLN A 11 21.648 6.583 0.887 1.00 0.00 H new ATOM 152 N ALA A 12 18.685 5.963 -3.819 1.00 0.00 N ATOM 153 CA ALA A 12 17.415 6.665 -3.782 1.00 0.00 C ATOM 154 C ALA A 12 16.959 6.742 -2.351 1.00 0.00 C ATOM 155 O ALA A 12 16.726 5.707 -1.700 1.00 0.00 O ATOM 156 CB ALA A 12 16.378 5.929 -4.609 1.00 0.00 C ATOM 0 H ALA A 12 18.648 5.027 -3.415 1.00 0.00 H new ATOM 0 HA ALA A 12 17.537 7.665 -4.197 1.00 0.00 H new ATOM 0 HB1 ALA A 12 15.432 6.469 -4.570 1.00 0.00 H new ATOM 0 HB2 ALA A 12 16.717 5.864 -5.643 1.00 0.00 H new ATOM 0 HB3 ALA A 12 16.239 4.925 -4.209 1.00 0.00 H new ATOM 162 N TRP A 13 16.887 7.935 -1.861 1.00 0.00 N ATOM 163 CA TRP A 13 16.586 8.201 -0.472 1.00 0.00 C ATOM 164 C TRP A 13 16.213 9.640 -0.337 1.00 0.00 C ATOM 165 O TRP A 13 16.450 10.398 -1.242 1.00 0.00 O ATOM 166 CB TRP A 13 17.849 7.965 0.376 1.00 0.00 C ATOM 167 CG TRP A 13 18.961 8.924 0.051 1.00 0.00 C ATOM 168 CD1 TRP A 13 19.501 9.161 -1.169 1.00 0.00 C ATOM 169 CD2 TRP A 13 19.641 9.781 0.958 1.00 0.00 C ATOM 170 NE1 TRP A 13 20.473 10.087 -1.077 1.00 0.00 N ATOM 171 CE2 TRP A 13 20.591 10.487 0.215 1.00 0.00 C ATOM 172 CE3 TRP A 13 19.544 10.010 2.328 1.00 0.00 C ATOM 173 CZ2 TRP A 13 21.442 11.413 0.785 1.00 0.00 C ATOM 174 CZ3 TRP A 13 20.389 10.939 2.904 1.00 0.00 C ATOM 175 CH2 TRP A 13 21.329 11.625 2.133 1.00 0.00 C ATOM 0 H TRP A 13 17.037 8.777 -2.417 1.00 0.00 H new ATOM 0 HA TRP A 13 15.777 7.550 -0.140 1.00 0.00 H new ATOM 0 HB2 TRP A 13 17.594 8.057 1.432 1.00 0.00 H new ATOM 0 HB3 TRP A 13 18.199 6.945 0.221 1.00 0.00 H new ATOM 0 HD1 TRP A 13 19.195 8.676 -2.084 1.00 0.00 H new ATOM 0 HE1 TRP A 13 21.033 10.434 -1.856 1.00 0.00 H new ATOM 0 HE3 TRP A 13 18.824 9.473 2.927 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 22.168 11.949 0.191 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 20.321 11.137 3.964 1.00 0.00 H new ATOM 0 HH2 TRP A 13 21.982 12.340 2.611 1.00 0.00 H new ATOM 186 N ARG A 14 15.655 9.998 0.775 1.00 0.00 N ATOM 187 CA ARG A 14 15.414 11.380 1.152 1.00 0.00 C ATOM 188 C ARG A 14 14.642 11.401 2.429 1.00 0.00 C ATOM 189 O ARG A 14 15.080 10.833 3.414 1.00 0.00 O ATOM 190 CB ARG A 14 14.806 12.337 0.074 1.00 0.00 C ATOM 191 CG ARG A 14 14.935 13.820 0.412 1.00 0.00 C ATOM 192 CD ARG A 14 14.217 14.744 -0.577 1.00 0.00 C ATOM 193 NE ARG A 14 14.729 14.680 -1.954 1.00 0.00 N ATOM 194 CZ ARG A 14 14.777 15.762 -2.794 1.00 0.00 C ATOM 195 NH1 ARG A 14 14.584 17.000 -2.318 1.00 0.00 N ATOM 196 NH2 ARG A 14 15.053 15.603 -4.084 1.00 0.00 N ATOM 0 H ARG A 14 15.340 9.327 1.476 1.00 0.00 H new ATOM 0 HA ARG A 14 16.405 11.816 1.276 1.00 0.00 H new ATOM 0 HB2 ARG A 14 15.297 12.149 -0.881 1.00 0.00 H new ATOM 0 HB3 ARG A 14 13.751 12.096 -0.057 1.00 0.00 H new ATOM 0 HG2 ARG A 14 14.535 13.992 1.411 1.00 0.00 H new ATOM 0 HG3 ARG A 14 15.992 14.086 0.442 1.00 0.00 H new ATOM 0 HD2 ARG A 14 13.156 14.492 -0.585 1.00 0.00 H new ATOM 0 HD3 ARG A 14 14.298 15.771 -0.220 1.00 0.00 H new ATOM 0 HE ARG A 14 15.066 13.783 -2.303 1.00 0.00 H new ATOM 0 HH11 ARG A 14 14.400 17.142 -1.325 1.00 0.00 H new ATOM 0 HH12 ARG A 14 14.621 17.801 -2.949 1.00 0.00 H new ATOM 0 HH21 ARG A 14 15.231 14.670 -4.456 1.00 0.00 H new ATOM 0 HH22 ARG A 14 15.087 16.414 -4.702 1.00 0.00 H new ATOM 210 N HIS A 15 13.484 12.015 2.439 1.00 0.00 N ATOM 211 CA HIS A 15 12.780 12.228 3.682 1.00 0.00 C ATOM 212 C HIS A 15 11.360 11.815 3.588 1.00 0.00 C ATOM 213 O HIS A 15 10.827 11.621 2.485 1.00 0.00 O ATOM 214 CB HIS A 15 12.856 13.688 4.135 1.00 0.00 C ATOM 215 CG HIS A 15 14.188 14.108 4.663 1.00 0.00 C ATOM 216 ND1 HIS A 15 15.369 14.334 4.032 1.00 0.00 N flip ATOM 217 CD2 HIS A 15 14.421 14.359 5.989 1.00 0.00 C flip ATOM 218 CE1 HIS A 15 16.272 14.717 4.983 1.00 0.00 C flip ATOM 219 NE2 HIS A 15 15.674 14.724 6.147 1.00 0.00 N flip ATOM 0 H HIS A 15 13.012 12.374 1.609 1.00 0.00 H new ATOM 0 HA HIS A 15 13.278 11.604 4.424 1.00 0.00 H new ATOM 0 HB2 HIS A 15 12.595 14.330 3.293 1.00 0.00 H new ATOM 0 HB3 HIS A 15 12.105 13.854 4.907 1.00 0.00 H new ATOM 0 HD2 HIS A 15 13.691 14.271 6.780 1.00 0.00 H new ATOM 0 HE1 HIS A 15 17.306 14.971 4.804 1.00 0.00 H new ATOM 0 HE2 HIS A 15 16.110 14.973 7.035 1.00 0.00 H new ATOM 228 N HIS A 16 10.735 11.695 4.731 1.00 0.00 N ATOM 229 CA HIS A 16 9.356 11.312 4.789 1.00 0.00 C ATOM 230 C HIS A 16 8.539 12.576 4.924 1.00 0.00 C ATOM 231 O HIS A 16 8.988 13.526 5.568 1.00 0.00 O ATOM 232 CB HIS A 16 9.046 10.443 6.010 1.00 0.00 C ATOM 233 CG HIS A 16 9.949 9.302 6.244 1.00 0.00 C ATOM 234 ND1 HIS A 16 10.233 8.858 7.489 1.00 0.00 N ATOM 235 CD2 HIS A 16 10.655 8.526 5.403 1.00 0.00 C ATOM 236 CE1 HIS A 16 11.065 7.874 7.419 1.00 0.00 C ATOM 237 NE2 HIS A 16 11.347 7.642 6.163 1.00 0.00 N ATOM 0 H HIS A 16 11.168 11.860 5.640 1.00 0.00 H new ATOM 0 HA HIS A 16 9.123 10.742 3.889 1.00 0.00 H new ATOM 0 HB2 HIS A 16 9.061 11.079 6.895 1.00 0.00 H new ATOM 0 HB3 HIS A 16 8.030 10.061 5.909 1.00 0.00 H new ATOM 0 HD2 HIS A 16 10.668 8.594 4.325 1.00 0.00 H new ATOM 0 HE1 HIS A 16 11.464 7.330 8.262 1.00 0.00 H new ATOM 0 HE2 HIS A 16 11.979 6.920 5.815 1.00 0.00 H new ATOM 246 N ASN A 17 7.386 12.594 4.350 1.00 0.00 N ATOM 247 CA ASN A 17 6.484 13.698 4.464 1.00 0.00 C ATOM 248 C ASN A 17 5.340 13.367 5.378 1.00 0.00 C ATOM 249 O ASN A 17 5.142 12.202 5.780 1.00 0.00 O ATOM 250 CB ASN A 17 5.925 14.048 3.075 1.00 0.00 C ATOM 251 CG ASN A 17 6.964 14.537 2.080 1.00 0.00 C ATOM 252 OD1 ASN A 17 7.969 15.233 2.551 1.00 0.00 O flip ATOM 253 ND2 ASN A 17 6.844 14.289 0.879 1.00 0.00 N flip ATOM 0 H ASN A 17 7.032 11.829 3.776 1.00 0.00 H new ATOM 0 HA ASN A 17 7.032 14.544 4.878 1.00 0.00 H new ATOM 0 HB2 ASN A 17 5.433 13.167 2.663 1.00 0.00 H new ATOM 0 HB3 ASN A 17 5.160 14.816 3.189 1.00 0.00 H new ATOM 0 HD21 ASN A 17 6.048 13.744 0.548 1.00 0.00 H new ATOM 0 HD22 ASN A 17 7.541 14.629 0.216 1.00 0.00 H new ATOM 260 N GLY A 18 4.589 14.373 5.696 1.00 0.00 N ATOM 261 CA GLY A 18 3.398 14.205 6.462 1.00 0.00 C ATOM 262 C GLY A 18 2.305 13.695 5.578 1.00 0.00 C ATOM 263 O GLY A 18 2.297 13.979 4.375 1.00 0.00 O ATOM 0 H GLY A 18 4.786 15.338 5.430 1.00 0.00 H new ATOM 0 HA2 GLY A 18 3.574 13.507 7.280 1.00 0.00 H new ATOM 0 HA3 GLY A 18 3.104 15.154 6.911 1.00 0.00 H new ATOM 267 N PHE A 19 1.410 12.944 6.142 1.00 0.00 N ATOM 268 CA PHE A 19 0.328 12.350 5.394 1.00 0.00 C ATOM 269 C PHE A 19 -0.644 13.431 4.996 1.00 0.00 C ATOM 270 O PHE A 19 -1.194 14.130 5.882 1.00 0.00 O ATOM 271 CB PHE A 19 -0.396 11.291 6.248 1.00 0.00 C ATOM 272 CG PHE A 19 0.520 10.240 6.829 1.00 0.00 C ATOM 273 CD1 PHE A 19 1.260 9.415 6.004 1.00 0.00 C ATOM 274 CD2 PHE A 19 0.638 10.085 8.201 1.00 0.00 C ATOM 275 CE1 PHE A 19 2.106 8.456 6.536 1.00 0.00 C ATOM 276 CE2 PHE A 19 1.484 9.125 8.742 1.00 0.00 C ATOM 277 CZ PHE A 19 2.222 8.310 7.904 1.00 0.00 C ATOM 0 H PHE A 19 1.403 12.721 7.137 1.00 0.00 H new ATOM 0 HA PHE A 19 0.730 11.864 4.505 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -0.920 11.792 7.062 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -1.153 10.801 5.636 1.00 0.00 H new ATOM 0 HD1 PHE A 19 1.178 9.519 4.932 1.00 0.00 H new ATOM 0 HD2 PHE A 19 0.064 10.720 8.859 1.00 0.00 H new ATOM 0 HE1 PHE A 19 2.678 7.819 5.877 1.00 0.00 H new ATOM 0 HE2 PHE A 19 1.565 9.016 9.813 1.00 0.00 H new ATOM 0 HZ PHE A 19 2.885 7.564 8.317 1.00 0.00 H new ATOM 287 N ASP A 20 -0.859 13.607 3.706 1.00 0.00 N ATOM 288 CA ASP A 20 -1.772 14.634 3.240 1.00 0.00 C ATOM 289 C ASP A 20 -3.147 14.143 3.501 1.00 0.00 C ATOM 290 O ASP A 20 -3.523 13.058 3.030 1.00 0.00 O ATOM 291 CB ASP A 20 -1.623 14.914 1.731 1.00 0.00 C ATOM 292 CG ASP A 20 -0.287 15.482 1.336 1.00 0.00 C ATOM 293 OD1 ASP A 20 0.014 16.643 1.684 1.00 0.00 O ATOM 294 OD2 ASP A 20 0.473 14.793 0.629 1.00 0.00 O ATOM 0 H ASP A 20 -0.419 13.058 2.968 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.553 15.565 3.763 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -1.786 13.986 1.183 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -2.405 15.608 1.423 1.00 0.00 H new ATOM 299 N PHE A 21 -3.899 14.885 4.249 1.00 0.00 N ATOM 300 CA PHE A 21 -5.191 14.416 4.631 1.00 0.00 C ATOM 301 C PHE A 21 -6.139 14.344 3.427 1.00 0.00 C ATOM 302 O PHE A 21 -6.903 13.421 3.325 1.00 0.00 O ATOM 303 CB PHE A 21 -5.797 15.243 5.776 1.00 0.00 C ATOM 304 CG PHE A 21 -7.064 14.634 6.296 1.00 0.00 C ATOM 305 CD1 PHE A 21 -7.047 13.368 6.852 1.00 0.00 C ATOM 306 CD2 PHE A 21 -8.262 15.296 6.205 1.00 0.00 C ATOM 307 CE1 PHE A 21 -8.204 12.781 7.311 1.00 0.00 C ATOM 308 CE2 PHE A 21 -9.421 14.719 6.656 1.00 0.00 C ATOM 309 CZ PHE A 21 -9.393 13.457 7.213 1.00 0.00 C ATOM 0 H PHE A 21 -3.645 15.807 4.604 1.00 0.00 H new ATOM 0 HA PHE A 21 -5.059 13.403 5.011 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -5.074 15.324 6.587 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -5.998 16.255 5.426 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -6.112 12.832 6.927 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -8.293 16.285 5.772 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -8.176 11.793 7.746 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -10.356 15.253 6.575 1.00 0.00 H new ATOM 0 HZ PHE A 21 -10.305 13.003 7.571 1.00 0.00 H new ATOM 319 N ALA A 22 -5.998 15.294 2.502 1.00 0.00 N ATOM 320 CA ALA A 22 -6.824 15.421 1.292 1.00 0.00 C ATOM 321 C ALA A 22 -7.041 14.095 0.580 1.00 0.00 C ATOM 322 O ALA A 22 -8.165 13.773 0.220 1.00 0.00 O ATOM 323 CB ALA A 22 -6.190 16.415 0.334 1.00 0.00 C ATOM 0 H ALA A 22 -5.285 16.020 2.573 1.00 0.00 H new ATOM 0 HA ALA A 22 -7.802 15.777 1.615 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -6.808 16.504 -0.560 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -6.111 17.388 0.819 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -5.195 16.067 0.055 1.00 0.00 H new ATOM 329 N VAL A 23 -5.988 13.304 0.433 1.00 0.00 N ATOM 330 CA VAL A 23 -6.095 12.057 -0.294 1.00 0.00 C ATOM 331 C VAL A 23 -6.844 10.963 0.522 1.00 0.00 C ATOM 332 O VAL A 23 -7.763 10.325 -0.005 1.00 0.00 O ATOM 333 CB VAL A 23 -4.704 11.580 -0.848 1.00 0.00 C ATOM 334 CG1 VAL A 23 -3.695 11.305 0.266 1.00 0.00 C ATOM 335 CG2 VAL A 23 -4.858 10.374 -1.763 1.00 0.00 C ATOM 0 H VAL A 23 -5.060 13.505 0.805 1.00 0.00 H new ATOM 0 HA VAL A 23 -6.716 12.245 -1.170 1.00 0.00 H new ATOM 0 HB VAL A 23 -4.303 12.403 -1.439 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -2.751 10.978 -0.170 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -3.532 12.216 0.843 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -4.081 10.524 0.922 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -3.878 10.068 -2.130 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -5.311 9.552 -1.208 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -5.496 10.637 -2.607 1.00 0.00 H new ATOM 345 N ILE A 24 -6.481 10.787 1.803 1.00 0.00 N ATOM 346 CA ILE A 24 -7.145 9.812 2.710 1.00 0.00 C ATOM 347 C ILE A 24 -8.629 10.208 2.891 1.00 0.00 C ATOM 348 O ILE A 24 -9.538 9.374 2.874 1.00 0.00 O ATOM 349 CB ILE A 24 -6.469 9.840 4.124 1.00 0.00 C ATOM 350 CG1 ILE A 24 -4.939 9.677 4.043 1.00 0.00 C ATOM 351 CG2 ILE A 24 -7.069 8.802 5.069 1.00 0.00 C ATOM 352 CD1 ILE A 24 -4.466 8.409 3.378 1.00 0.00 C ATOM 0 H ILE A 24 -5.725 11.309 2.245 1.00 0.00 H new ATOM 0 HA ILE A 24 -7.057 8.818 2.272 1.00 0.00 H new ATOM 0 HB ILE A 24 -6.676 10.827 4.536 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -4.526 10.529 3.502 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -4.531 9.713 5.053 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -6.569 8.859 6.036 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -8.133 9.000 5.198 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -6.933 7.806 4.648 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -3.376 8.387 3.370 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -4.842 7.547 3.929 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -4.837 8.375 2.354 1.00 0.00 H new ATOM 364 N LYS A 25 -8.820 11.491 3.049 1.00 0.00 N ATOM 365 CA LYS A 25 -10.109 12.121 3.213 1.00 0.00 C ATOM 366 C LYS A 25 -10.988 11.824 1.992 1.00 0.00 C ATOM 367 O LYS A 25 -12.117 11.373 2.117 1.00 0.00 O ATOM 368 CB LYS A 25 -9.896 13.644 3.282 1.00 0.00 C ATOM 369 CG LYS A 25 -11.152 14.456 3.456 1.00 0.00 C ATOM 370 CD LYS A 25 -11.094 15.771 2.690 1.00 0.00 C ATOM 371 CE LYS A 25 -11.105 15.522 1.182 1.00 0.00 C ATOM 372 NZ LYS A 25 -11.390 16.737 0.397 1.00 0.00 N ATOM 0 H LYS A 25 -8.048 12.158 3.068 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.588 11.745 4.117 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -9.222 13.864 4.110 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -9.396 13.967 2.369 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -12.009 13.875 3.114 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -11.307 14.660 4.515 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.944 16.396 2.966 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -10.193 16.318 2.966 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -10.138 15.120 0.879 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -11.853 14.763 0.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -11.367 16.508 -0.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -12.331 17.100 0.649 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -10.673 17.461 0.605 1.00 0.00 H new ATOM 386 N GLU A 26 -10.424 12.048 0.806 1.00 0.00 N ATOM 387 CA GLU A 26 -11.182 11.941 -0.420 1.00 0.00 C ATOM 388 C GLU A 26 -11.543 10.501 -0.709 1.00 0.00 C ATOM 389 O GLU A 26 -12.648 10.212 -1.207 1.00 0.00 O ATOM 390 CB GLU A 26 -10.431 12.556 -1.602 1.00 0.00 C ATOM 391 CG GLU A 26 -11.365 13.170 -2.609 1.00 0.00 C ATOM 392 CD GLU A 26 -12.153 14.296 -1.977 1.00 0.00 C ATOM 393 OE1 GLU A 26 -11.654 15.443 -1.960 1.00 0.00 O ATOM 394 OE2 GLU A 26 -13.264 14.047 -1.449 1.00 0.00 O ATOM 0 H GLU A 26 -9.445 12.304 0.678 1.00 0.00 H new ATOM 0 HA GLU A 26 -12.104 12.506 -0.283 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -9.742 13.317 -1.236 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -9.829 11.788 -2.088 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -10.797 13.547 -3.459 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -12.047 12.411 -2.993 1.00 0.00 H new ATOM 401 N LEU A 27 -10.608 9.597 -0.417 1.00 0.00 N ATOM 402 CA LEU A 27 -10.868 8.188 -0.599 1.00 0.00 C ATOM 403 C LEU A 27 -11.992 7.754 0.348 1.00 0.00 C ATOM 404 O LEU A 27 -12.809 6.941 -0.009 1.00 0.00 O ATOM 405 CB LEU A 27 -9.592 7.317 -0.435 1.00 0.00 C ATOM 406 CG LEU A 27 -9.748 5.826 -0.797 1.00 0.00 C ATOM 407 CD1 LEU A 27 -10.436 5.677 -2.126 1.00 0.00 C ATOM 408 CD2 LEU A 27 -8.385 5.141 -0.862 1.00 0.00 C ATOM 0 H LEU A 27 -9.679 9.820 -0.059 1.00 0.00 H new ATOM 0 HA LEU A 27 -11.192 8.029 -1.627 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -8.803 7.742 -1.055 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -9.257 7.387 0.600 1.00 0.00 H new ATOM 0 HG LEU A 27 -10.351 5.355 -0.020 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -10.538 4.619 -2.366 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -11.424 6.135 -2.078 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -9.845 6.169 -2.899 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -8.518 4.090 -1.119 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -7.770 5.625 -1.621 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -7.892 5.218 0.107 1.00 0.00 H new ATOM 420 N LYS A 28 -12.040 8.361 1.534 1.00 0.00 N ATOM 421 CA LYS A 28 -13.123 8.132 2.505 1.00 0.00 C ATOM 422 C LYS A 28 -14.464 8.657 1.946 1.00 0.00 C ATOM 423 O LYS A 28 -15.527 8.018 2.132 1.00 0.00 O ATOM 424 CB LYS A 28 -12.800 8.826 3.854 1.00 0.00 C ATOM 425 CG LYS A 28 -13.918 8.753 4.905 1.00 0.00 C ATOM 426 CD LYS A 28 -13.620 9.650 6.103 1.00 0.00 C ATOM 427 CE LYS A 28 -12.499 9.131 6.990 1.00 0.00 C ATOM 428 NZ LYS A 28 -12.860 7.871 7.678 1.00 0.00 N ATOM 0 H LYS A 28 -11.334 9.024 1.853 1.00 0.00 H new ATOM 0 HA LYS A 28 -13.209 7.059 2.677 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -11.900 8.375 4.271 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -12.571 9.874 3.661 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -14.864 9.051 4.453 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -14.036 7.723 5.241 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -13.357 10.645 5.744 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -14.525 9.756 6.701 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -11.607 8.969 6.385 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -12.247 9.888 7.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -12.443 7.864 8.631 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -13.895 7.800 7.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -12.496 7.062 7.135 1.00 0.00 H new ATOM 442 N THR A 29 -14.411 9.811 1.254 1.00 0.00 N ATOM 443 CA THR A 29 -15.584 10.398 0.622 1.00 0.00 C ATOM 444 C THR A 29 -16.149 9.376 -0.383 1.00 0.00 C ATOM 445 O THR A 29 -17.311 8.931 -0.282 1.00 0.00 O ATOM 446 CB THR A 29 -15.201 11.672 -0.169 1.00 0.00 C ATOM 447 OG1 THR A 29 -14.359 12.524 0.620 1.00 0.00 O ATOM 448 CG2 THR A 29 -16.451 12.441 -0.579 1.00 0.00 C ATOM 0 H THR A 29 -13.555 10.351 1.124 1.00 0.00 H new ATOM 0 HA THR A 29 -16.310 10.655 1.393 1.00 0.00 H new ATOM 0 HB THR A 29 -14.659 11.361 -1.062 1.00 0.00 H new ATOM 0 HG1 THR A 29 -14.004 13.244 0.058 1.00 0.00 H new ATOM 0 HG21 THR A 29 -16.163 13.334 -1.134 1.00 0.00 H new ATOM 0 HG22 THR A 29 -17.077 11.809 -1.208 1.00 0.00 H new ATOM 0 HG23 THR A 29 -17.008 12.732 0.312 1.00 0.00 H new ATOM 456 N ALA A 30 -15.294 8.988 -1.339 1.00 0.00 N ATOM 457 CA ALA A 30 -15.575 8.005 -2.334 1.00 0.00 C ATOM 458 C ALA A 30 -16.090 6.738 -1.694 1.00 0.00 C ATOM 459 O ALA A 30 -17.115 6.303 -2.008 1.00 0.00 O ATOM 460 CB ALA A 30 -14.326 7.723 -3.144 1.00 0.00 C ATOM 0 H ALA A 30 -14.356 9.380 -1.423 1.00 0.00 H new ATOM 0 HA ALA A 30 -16.348 8.387 -3.001 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -14.546 6.972 -3.902 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -13.992 8.640 -3.628 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -13.540 7.354 -2.485 1.00 0.00 H new ATOM 466 N ALA A 31 -15.390 6.232 -0.745 1.00 0.00 N ATOM 467 CA ALA A 31 -15.739 5.017 -0.025 1.00 0.00 C ATOM 468 C ALA A 31 -17.162 5.010 0.586 1.00 0.00 C ATOM 469 O ALA A 31 -17.805 3.950 0.658 1.00 0.00 O ATOM 470 CB ALA A 31 -14.767 4.862 1.086 1.00 0.00 C ATOM 0 H ALA A 31 -14.520 6.654 -0.420 1.00 0.00 H new ATOM 0 HA ALA A 31 -15.712 4.204 -0.751 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -14.999 3.958 1.649 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -13.758 4.787 0.679 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -14.829 5.727 1.747 1.00 0.00 H new ATOM 476 N SER A 32 -17.643 6.153 1.038 1.00 0.00 N ATOM 477 CA SER A 32 -18.889 6.165 1.754 1.00 0.00 C ATOM 478 C SER A 32 -20.052 6.261 0.804 1.00 0.00 C ATOM 479 O SER A 32 -21.084 5.603 0.952 1.00 0.00 O ATOM 480 CB SER A 32 -18.888 7.290 2.778 1.00 0.00 C ATOM 481 OG SER A 32 -17.737 7.177 3.633 1.00 0.00 O ATOM 0 H SER A 32 -17.196 7.063 0.922 1.00 0.00 H new ATOM 0 HA SER A 32 -19.001 5.225 2.294 1.00 0.00 H new ATOM 0 HB2 SER A 32 -18.881 8.255 2.270 1.00 0.00 H new ATOM 0 HB3 SER A 32 -19.799 7.251 3.374 1.00 0.00 H new ATOM 0 HG SER A 32 -16.942 7.491 3.154 1.00 0.00 H new ATOM 487 N GLN A 33 -19.834 7.065 -0.162 1.00 0.00 N ATOM 488 CA GLN A 33 -20.784 7.452 -1.138 1.00 0.00 C ATOM 489 C GLN A 33 -20.750 6.507 -2.389 1.00 0.00 C ATOM 490 O GLN A 33 -21.749 5.877 -2.759 1.00 0.00 O ATOM 491 CB GLN A 33 -20.370 8.895 -1.451 1.00 0.00 C ATOM 492 CG GLN A 33 -20.681 9.405 -2.782 1.00 0.00 C ATOM 493 CD GLN A 33 -22.148 9.644 -3.018 1.00 0.00 C ATOM 494 OE1 GLN A 33 -22.865 8.753 -3.468 1.00 0.00 O ATOM 495 NE2 GLN A 33 -22.602 10.835 -2.731 1.00 0.00 N ATOM 0 H GLN A 33 -18.924 7.503 -0.305 1.00 0.00 H new ATOM 0 HA GLN A 33 -21.819 7.382 -0.802 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -20.845 9.549 -0.719 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -19.294 8.978 -1.301 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -20.141 10.339 -2.937 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -20.314 8.698 -3.526 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -21.971 11.545 -2.359 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -23.587 11.055 -2.879 1.00 0.00 H new ATOM 504 N TYR A 34 -19.599 6.409 -2.972 1.00 0.00 N ATOM 505 CA TYR A 34 -19.332 5.649 -4.180 1.00 0.00 C ATOM 506 C TYR A 34 -18.982 4.207 -3.843 1.00 0.00 C ATOM 507 O TYR A 34 -19.408 3.284 -4.527 1.00 0.00 O ATOM 508 CB TYR A 34 -18.196 6.372 -4.963 1.00 0.00 C ATOM 509 CG TYR A 34 -18.592 7.754 -5.418 1.00 0.00 C ATOM 510 CD1 TYR A 34 -19.816 7.962 -6.036 1.00 0.00 C ATOM 511 CD2 TYR A 34 -17.766 8.872 -5.202 1.00 0.00 C ATOM 512 CE1 TYR A 34 -20.212 9.213 -6.410 1.00 0.00 C ATOM 513 CE2 TYR A 34 -18.163 10.131 -5.593 1.00 0.00 C ATOM 514 CZ TYR A 34 -19.390 10.296 -6.194 1.00 0.00 C ATOM 515 OH TYR A 34 -19.818 11.550 -6.547 1.00 0.00 O ATOM 0 H TYR A 34 -18.768 6.876 -2.610 1.00 0.00 H new ATOM 0 HA TYR A 34 -20.220 5.603 -4.811 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -17.311 6.442 -4.330 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -17.920 5.773 -5.831 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -20.466 7.120 -6.224 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -16.807 8.741 -4.723 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -21.175 9.354 -6.878 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -17.517 10.981 -5.430 1.00 0.00 H new ATOM 0 HH TYR A 34 -19.123 12.206 -6.329 1.00 0.00 H new ATOM 525 N GLY A 35 -18.235 4.021 -2.770 1.00 0.00 N ATOM 526 CA GLY A 35 -17.826 2.717 -2.343 1.00 0.00 C ATOM 527 C GLY A 35 -16.869 2.089 -3.316 1.00 0.00 C ATOM 528 O GLY A 35 -16.416 2.735 -4.264 1.00 0.00 O ATOM 0 H GLY A 35 -17.900 4.779 -2.176 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -17.355 2.786 -1.362 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -18.703 2.079 -2.231 1.00 0.00 H new ATOM 532 N ALA A 36 -16.577 0.847 -3.112 1.00 0.00 N ATOM 533 CA ALA A 36 -15.693 0.132 -3.960 1.00 0.00 C ATOM 534 C ALA A 36 -16.455 -0.366 -5.159 1.00 0.00 C ATOM 535 O ALA A 36 -17.691 -0.426 -5.136 1.00 0.00 O ATOM 536 CB ALA A 36 -15.054 -0.990 -3.242 1.00 0.00 C ATOM 0 H ALA A 36 -16.953 0.296 -2.340 1.00 0.00 H new ATOM 0 HA ALA A 36 -14.897 0.801 -4.288 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -14.382 -1.519 -3.918 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -14.487 -0.604 -2.395 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -15.821 -1.676 -2.882 1.00 0.00 H new ATOM 542 N THR A 37 -15.725 -0.647 -6.205 1.00 0.00 N ATOM 543 CA THR A 37 -16.255 -1.017 -7.495 1.00 0.00 C ATOM 544 C THR A 37 -16.796 0.236 -8.256 1.00 0.00 C ATOM 545 O THR A 37 -16.976 0.212 -9.472 1.00 0.00 O ATOM 546 CB THR A 37 -17.255 -2.226 -7.399 1.00 0.00 C ATOM 547 OG1 THR A 37 -16.539 -3.380 -6.876 1.00 0.00 O ATOM 548 CG2 THR A 37 -17.871 -2.592 -8.748 1.00 0.00 C ATOM 0 H THR A 37 -14.705 -0.624 -6.184 1.00 0.00 H new ATOM 0 HA THR A 37 -15.443 -1.399 -8.113 1.00 0.00 H new ATOM 0 HB THR A 37 -18.071 -1.929 -6.740 1.00 0.00 H new ATOM 0 HG1 THR A 37 -16.673 -3.436 -5.907 1.00 0.00 H new ATOM 0 HG21 THR A 37 -18.553 -3.433 -8.621 1.00 0.00 H new ATOM 0 HG22 THR A 37 -18.420 -1.736 -9.142 1.00 0.00 H new ATOM 0 HG23 THR A 37 -17.081 -2.868 -9.446 1.00 0.00 H new ATOM 556 N ALA A 38 -17.039 1.346 -7.531 1.00 0.00 N ATOM 557 CA ALA A 38 -17.305 2.603 -8.189 1.00 0.00 C ATOM 558 C ALA A 38 -15.982 3.131 -8.686 1.00 0.00 C ATOM 559 O ALA A 38 -15.071 3.349 -7.875 1.00 0.00 O ATOM 560 CB ALA A 38 -17.927 3.593 -7.253 1.00 0.00 C ATOM 0 H ALA A 38 -17.053 1.381 -6.512 1.00 0.00 H new ATOM 0 HA ALA A 38 -18.009 2.450 -9.007 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -18.113 4.527 -7.783 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -18.869 3.195 -6.876 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -17.252 3.778 -6.418 1.00 0.00 H new ATOM 566 N PRO A 39 -15.852 3.311 -10.023 1.00 0.00 N ATOM 567 CA PRO A 39 -14.609 3.710 -10.720 1.00 0.00 C ATOM 568 C PRO A 39 -13.730 4.731 -9.984 1.00 0.00 C ATOM 569 O PRO A 39 -12.502 4.605 -9.977 1.00 0.00 O ATOM 570 CB PRO A 39 -15.147 4.344 -11.985 1.00 0.00 C ATOM 571 CG PRO A 39 -16.341 3.543 -12.312 1.00 0.00 C ATOM 572 CD PRO A 39 -16.945 3.117 -11.004 1.00 0.00 C ATOM 0 HA PRO A 39 -13.951 2.850 -10.841 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -15.401 5.392 -11.828 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -14.413 4.311 -12.790 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -17.052 4.128 -12.895 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -16.072 2.676 -12.915 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -17.818 3.719 -10.753 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -17.273 2.078 -11.036 1.00 0.00 H new ATOM 580 N TYR A 40 -14.362 5.735 -9.399 1.00 0.00 N ATOM 581 CA TYR A 40 -13.653 6.795 -8.686 1.00 0.00 C ATOM 582 C TYR A 40 -12.772 6.239 -7.556 1.00 0.00 C ATOM 583 O TYR A 40 -11.545 6.358 -7.597 1.00 0.00 O ATOM 584 CB TYR A 40 -14.642 7.814 -8.120 1.00 0.00 C ATOM 585 CG TYR A 40 -13.995 9.048 -7.528 1.00 0.00 C ATOM 586 CD1 TYR A 40 -13.208 9.902 -8.306 1.00 0.00 C ATOM 587 CD2 TYR A 40 -14.158 9.356 -6.192 1.00 0.00 C ATOM 588 CE1 TYR A 40 -12.616 11.018 -7.751 1.00 0.00 C ATOM 589 CE2 TYR A 40 -13.569 10.471 -5.629 1.00 0.00 C ATOM 590 CZ TYR A 40 -12.799 11.301 -6.412 1.00 0.00 C ATOM 591 OH TYR A 40 -12.197 12.413 -5.851 1.00 0.00 O ATOM 0 H TYR A 40 -15.376 5.842 -9.402 1.00 0.00 H new ATOM 0 HA TYR A 40 -13.000 7.286 -9.407 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -15.324 8.121 -8.913 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -15.245 7.330 -7.351 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -13.062 9.686 -9.354 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -14.761 8.709 -5.572 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -12.010 11.669 -8.363 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -13.712 10.690 -4.581 1.00 0.00 H new ATOM 0 HH TYR A 40 -12.745 12.742 -5.108 1.00 0.00 H new ATOM 601 N THR A 41 -13.410 5.650 -6.560 1.00 0.00 N ATOM 602 CA THR A 41 -12.806 5.131 -5.372 1.00 0.00 C ATOM 603 C THR A 41 -11.551 4.261 -5.649 1.00 0.00 C ATOM 604 O THR A 41 -10.479 4.522 -5.108 1.00 0.00 O ATOM 605 CB THR A 41 -13.875 4.317 -4.671 1.00 0.00 C ATOM 606 OG1 THR A 41 -15.112 5.022 -4.803 1.00 0.00 O ATOM 607 CG2 THR A 41 -13.580 4.152 -3.205 1.00 0.00 C ATOM 0 H THR A 41 -14.422 5.520 -6.571 1.00 0.00 H new ATOM 0 HA THR A 41 -12.447 5.957 -4.758 1.00 0.00 H new ATOM 0 HB THR A 41 -13.914 3.326 -5.123 1.00 0.00 H new ATOM 0 HG1 THR A 41 -15.858 4.405 -4.651 1.00 0.00 H new ATOM 0 HG21 THR A 41 -14.370 3.563 -2.739 1.00 0.00 H new ATOM 0 HG22 THR A 41 -12.625 3.641 -3.081 1.00 0.00 H new ATOM 0 HG23 THR A 41 -13.531 5.132 -2.731 1.00 0.00 H new ATOM 615 N LEU A 42 -11.654 3.280 -6.531 1.00 0.00 N ATOM 616 CA LEU A 42 -10.492 2.429 -6.780 1.00 0.00 C ATOM 617 C LEU A 42 -9.432 3.064 -7.637 1.00 0.00 C ATOM 618 O LEU A 42 -8.279 2.682 -7.546 1.00 0.00 O ATOM 619 CB LEU A 42 -10.753 0.935 -7.142 1.00 0.00 C ATOM 620 CG LEU A 42 -11.856 0.544 -8.128 1.00 0.00 C ATOM 621 CD1 LEU A 42 -13.208 0.731 -7.496 1.00 0.00 C ATOM 622 CD2 LEU A 42 -11.736 1.292 -9.454 1.00 0.00 C ATOM 0 H LEU A 42 -12.491 3.055 -7.069 1.00 0.00 H new ATOM 0 HA LEU A 42 -10.082 2.355 -5.773 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -9.818 0.533 -7.533 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -10.959 0.412 -6.208 1.00 0.00 H new ATOM 0 HG LEU A 42 -11.735 -0.513 -8.366 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -13.984 0.449 -8.207 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -13.285 0.103 -6.608 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -13.336 1.776 -7.214 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -12.540 0.981 -10.121 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -11.807 2.365 -9.274 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -10.775 1.065 -9.914 1.00 0.00 H new ATOM 634 N ALA A 43 -9.804 4.067 -8.440 1.00 0.00 N ATOM 635 CA ALA A 43 -8.814 4.813 -9.203 1.00 0.00 C ATOM 636 C ALA A 43 -7.904 5.527 -8.221 1.00 0.00 C ATOM 637 O ALA A 43 -6.704 5.643 -8.420 1.00 0.00 O ATOM 638 CB ALA A 43 -9.473 5.792 -10.179 1.00 0.00 C ATOM 0 H ALA A 43 -10.768 4.373 -8.573 1.00 0.00 H new ATOM 0 HA ALA A 43 -8.228 4.128 -9.816 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -8.702 6.330 -10.730 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -10.101 5.241 -10.879 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -10.085 6.503 -9.624 1.00 0.00 H new ATOM 644 N ILE A 44 -8.482 5.921 -7.116 1.00 0.00 N ATOM 645 CA ILE A 44 -7.766 6.564 -6.056 1.00 0.00 C ATOM 646 C ILE A 44 -6.877 5.529 -5.330 1.00 0.00 C ATOM 647 O ILE A 44 -5.777 5.841 -4.943 1.00 0.00 O ATOM 648 CB ILE A 44 -8.745 7.215 -5.074 1.00 0.00 C ATOM 649 CG1 ILE A 44 -9.686 8.166 -5.814 1.00 0.00 C ATOM 650 CG2 ILE A 44 -7.997 7.973 -3.964 1.00 0.00 C ATOM 651 CD1 ILE A 44 -10.855 8.582 -4.963 1.00 0.00 C ATOM 0 H ILE A 44 -9.477 5.800 -6.929 1.00 0.00 H new ATOM 0 HA ILE A 44 -7.131 7.345 -6.473 1.00 0.00 H new ATOM 0 HB ILE A 44 -9.331 6.422 -4.610 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -9.133 9.052 -6.127 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -10.052 7.682 -6.719 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -8.718 8.424 -3.282 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -7.362 7.279 -3.413 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -7.380 8.754 -4.409 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -11.496 9.257 -5.530 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -11.425 7.700 -4.671 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -10.492 9.091 -4.070 1.00 0.00 H new ATOM 663 N VAL A 45 -7.368 4.300 -5.176 1.00 0.00 N ATOM 664 CA VAL A 45 -6.568 3.192 -4.587 1.00 0.00 C ATOM 665 C VAL A 45 -5.311 2.947 -5.442 1.00 0.00 C ATOM 666 O VAL A 45 -4.205 2.751 -4.921 1.00 0.00 O ATOM 667 CB VAL A 45 -7.404 1.866 -4.454 1.00 0.00 C ATOM 668 CG1 VAL A 45 -6.568 0.713 -3.871 1.00 0.00 C ATOM 669 CG2 VAL A 45 -8.655 2.084 -3.607 1.00 0.00 C ATOM 0 H VAL A 45 -8.314 4.032 -5.446 1.00 0.00 H new ATOM 0 HA VAL A 45 -6.275 3.491 -3.581 1.00 0.00 H new ATOM 0 HB VAL A 45 -7.707 1.585 -5.463 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -7.185 -0.182 -3.797 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -5.717 0.515 -4.523 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -6.209 0.989 -2.880 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -9.212 1.150 -3.533 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -8.366 2.414 -2.609 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -9.282 2.844 -4.073 1.00 0.00 H new ATOM 679 N GLU A 46 -5.485 3.037 -6.752 1.00 0.00 N ATOM 680 CA GLU A 46 -4.382 2.896 -7.699 1.00 0.00 C ATOM 681 C GLU A 46 -3.479 4.126 -7.611 1.00 0.00 C ATOM 682 O GLU A 46 -2.262 4.016 -7.668 1.00 0.00 O ATOM 683 CB GLU A 46 -4.925 2.753 -9.111 1.00 0.00 C ATOM 684 CG GLU A 46 -6.015 1.723 -9.216 1.00 0.00 C ATOM 685 CD GLU A 46 -6.458 1.459 -10.623 1.00 0.00 C ATOM 686 OE1 GLU A 46 -6.941 2.400 -11.309 1.00 0.00 O ATOM 687 OE2 GLU A 46 -6.318 0.283 -11.080 1.00 0.00 O ATOM 0 H GLU A 46 -6.390 3.209 -7.190 1.00 0.00 H new ATOM 0 HA GLU A 46 -3.806 2.004 -7.452 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -5.309 3.716 -9.447 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -4.110 2.483 -9.783 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -5.666 0.790 -8.773 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -6.873 2.053 -8.630 1.00 0.00 H new ATOM 694 N SER A 47 -4.083 5.286 -7.409 1.00 0.00 N ATOM 695 CA SER A 47 -3.353 6.526 -7.290 1.00 0.00 C ATOM 696 C SER A 47 -2.477 6.540 -6.019 1.00 0.00 C ATOM 697 O SER A 47 -1.315 6.946 -6.071 1.00 0.00 O ATOM 698 CB SER A 47 -4.321 7.720 -7.303 1.00 0.00 C ATOM 699 OG SER A 47 -5.120 7.730 -8.488 1.00 0.00 O ATOM 0 H SER A 47 -5.094 5.388 -7.324 1.00 0.00 H new ATOM 0 HA SER A 47 -2.687 6.612 -8.149 1.00 0.00 H new ATOM 0 HB2 SER A 47 -4.968 7.676 -6.427 1.00 0.00 H new ATOM 0 HB3 SER A 47 -3.756 8.650 -7.236 1.00 0.00 H new ATOM 0 HG SER A 47 -5.915 7.173 -8.351 1.00 0.00 H new ATOM 705 N VAL A 48 -3.023 6.072 -4.903 1.00 0.00 N ATOM 706 CA VAL A 48 -2.287 6.063 -3.651 1.00 0.00 C ATOM 707 C VAL A 48 -1.129 5.081 -3.680 1.00 0.00 C ATOM 708 O VAL A 48 -0.068 5.384 -3.197 1.00 0.00 O ATOM 709 CB VAL A 48 -3.183 5.864 -2.385 1.00 0.00 C ATOM 710 CG1 VAL A 48 -4.140 7.020 -2.237 1.00 0.00 C ATOM 711 CG2 VAL A 48 -3.953 4.551 -2.413 1.00 0.00 C ATOM 0 H VAL A 48 -3.969 5.696 -4.842 1.00 0.00 H new ATOM 0 HA VAL A 48 -1.872 7.067 -3.557 1.00 0.00 H new ATOM 0 HB VAL A 48 -2.514 5.827 -1.525 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -4.758 6.870 -1.352 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -3.577 7.947 -2.133 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -4.778 7.080 -3.119 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -4.558 4.465 -1.511 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -4.602 4.528 -3.289 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -3.251 3.718 -2.460 1.00 0.00 H new ATOM 721 N ALA A 49 -1.317 3.941 -4.323 1.00 0.00 N ATOM 722 CA ALA A 49 -0.251 2.949 -4.453 1.00 0.00 C ATOM 723 C ALA A 49 0.799 3.407 -5.457 1.00 0.00 C ATOM 724 O ALA A 49 1.872 2.842 -5.553 1.00 0.00 O ATOM 725 CB ALA A 49 -0.811 1.590 -4.836 1.00 0.00 C ATOM 0 H ALA A 49 -2.197 3.675 -4.765 1.00 0.00 H new ATOM 0 HA ALA A 49 0.232 2.849 -3.481 1.00 0.00 H new ATOM 0 HB1 ALA A 49 0.005 0.872 -4.926 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -1.507 1.254 -4.068 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -1.333 1.667 -5.790 1.00 0.00 H new ATOM 731 N ASP A 50 0.480 4.467 -6.178 1.00 0.00 N ATOM 732 CA ASP A 50 1.388 5.043 -7.157 1.00 0.00 C ATOM 733 C ASP A 50 2.254 6.078 -6.460 1.00 0.00 C ATOM 734 O ASP A 50 3.232 6.605 -6.996 1.00 0.00 O ATOM 735 CB ASP A 50 0.591 5.647 -8.309 1.00 0.00 C ATOM 736 CG ASP A 50 1.408 6.429 -9.308 1.00 0.00 C ATOM 737 OD1 ASP A 50 2.222 5.833 -10.042 1.00 0.00 O ATOM 738 OD2 ASP A 50 1.193 7.670 -9.419 1.00 0.00 O ATOM 0 H ASP A 50 -0.414 4.953 -6.103 1.00 0.00 H new ATOM 0 HA ASP A 50 2.037 4.277 -7.581 1.00 0.00 H new ATOM 0 HB2 ASP A 50 0.074 4.844 -8.834 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -0.176 6.303 -7.896 1.00 0.00 H new ATOM 743 N ASN A 51 1.906 6.319 -5.229 1.00 0.00 N ATOM 744 CA ASN A 51 2.660 7.201 -4.357 1.00 0.00 C ATOM 745 C ASN A 51 3.590 6.314 -3.588 1.00 0.00 C ATOM 746 O ASN A 51 3.340 5.116 -3.494 1.00 0.00 O ATOM 747 CB ASN A 51 1.766 7.927 -3.302 1.00 0.00 C ATOM 748 CG ASN A 51 0.895 9.071 -3.818 1.00 0.00 C ATOM 749 OD1 ASN A 51 0.453 8.998 -5.053 1.00 0.00 O flip ATOM 750 ND2 ASN A 51 0.610 10.024 -3.076 1.00 0.00 N flip ATOM 0 H ASN A 51 1.083 5.908 -4.788 1.00 0.00 H new ATOM 0 HA ASN A 51 3.148 7.962 -4.966 1.00 0.00 H new ATOM 0 HB2 ASN A 51 1.116 7.186 -2.838 1.00 0.00 H new ATOM 0 HB3 ASN A 51 2.414 8.318 -2.518 1.00 0.00 H new ATOM 0 HD21 ASN A 51 0.969 10.052 -2.122 1.00 0.00 H new ATOM 0 HD22 ASN A 51 0.017 10.779 -3.421 1.00 0.00 H new ATOM 757 N TRP A 52 4.640 6.858 -3.068 1.00 0.00 N ATOM 758 CA TRP A 52 5.479 6.096 -2.203 1.00 0.00 C ATOM 759 C TRP A 52 4.769 5.946 -0.871 1.00 0.00 C ATOM 760 O TRP A 52 4.564 6.926 -0.124 1.00 0.00 O ATOM 761 CB TRP A 52 6.860 6.723 -2.086 1.00 0.00 C ATOM 762 CG TRP A 52 7.568 6.739 -3.409 1.00 0.00 C ATOM 763 CD1 TRP A 52 7.750 5.671 -4.230 1.00 0.00 C ATOM 764 CD2 TRP A 52 8.186 7.849 -4.059 1.00 0.00 C ATOM 765 NE1 TRP A 52 8.401 6.048 -5.360 1.00 0.00 N ATOM 766 CE2 TRP A 52 8.690 7.380 -5.283 1.00 0.00 C ATOM 767 CE3 TRP A 52 8.345 9.191 -3.741 1.00 0.00 C ATOM 768 CZ2 TRP A 52 9.345 8.203 -6.181 1.00 0.00 C ATOM 769 CZ3 TRP A 52 9.002 10.012 -4.632 1.00 0.00 C ATOM 770 CH2 TRP A 52 9.488 9.514 -5.843 1.00 0.00 C ATOM 0 H TRP A 52 4.937 7.821 -3.225 1.00 0.00 H new ATOM 0 HA TRP A 52 5.654 5.101 -2.612 1.00 0.00 H new ATOM 0 HB2 TRP A 52 6.768 7.741 -1.709 1.00 0.00 H new ATOM 0 HB3 TRP A 52 7.454 6.167 -1.361 1.00 0.00 H new ATOM 0 HD1 TRP A 52 7.423 4.665 -4.014 1.00 0.00 H new ATOM 0 HE1 TRP A 52 8.636 5.435 -6.141 1.00 0.00 H new ATOM 0 HE3 TRP A 52 7.961 9.585 -2.812 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 9.729 7.820 -7.115 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 9.143 11.055 -4.390 1.00 0.00 H new ATOM 0 HH2 TRP A 52 9.988 10.184 -6.527 1.00 0.00 H new ATOM 781 N LEU A 53 4.371 4.741 -0.607 1.00 0.00 N ATOM 782 CA LEU A 53 3.501 4.411 0.476 1.00 0.00 C ATOM 783 C LEU A 53 4.122 3.257 1.240 1.00 0.00 C ATOM 784 O LEU A 53 4.616 2.291 0.631 1.00 0.00 O ATOM 785 CB LEU A 53 2.179 3.968 -0.168 1.00 0.00 C ATOM 786 CG LEU A 53 0.881 4.490 0.420 1.00 0.00 C ATOM 787 CD1 LEU A 53 0.832 6.004 0.303 1.00 0.00 C ATOM 788 CD2 LEU A 53 -0.290 3.888 -0.319 1.00 0.00 C ATOM 0 H LEU A 53 4.654 3.932 -1.160 1.00 0.00 H new ATOM 0 HA LEU A 53 3.340 5.243 1.162 1.00 0.00 H new ATOM 0 HB2 LEU A 53 2.208 4.257 -1.219 1.00 0.00 H new ATOM 0 HB3 LEU A 53 2.143 2.879 -0.138 1.00 0.00 H new ATOM 0 HG LEU A 53 0.829 4.210 1.472 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -0.102 6.372 0.727 1.00 0.00 H new ATOM 0 HD12 LEU A 53 1.672 6.438 0.845 1.00 0.00 H new ATOM 0 HD13 LEU A 53 0.891 6.290 -0.747 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -1.221 4.265 0.105 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -0.235 4.162 -1.373 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -0.261 2.803 -0.224 1.00 0.00 H new ATOM 800 N THR A 54 4.096 3.324 2.536 1.00 0.00 N ATOM 801 CA THR A 54 4.733 2.317 3.343 1.00 0.00 C ATOM 802 C THR A 54 3.690 1.348 3.872 1.00 0.00 C ATOM 803 O THR A 54 2.538 1.724 4.007 1.00 0.00 O ATOM 804 CB THR A 54 5.472 2.980 4.540 1.00 0.00 C ATOM 805 OG1 THR A 54 4.539 3.595 5.448 1.00 0.00 O ATOM 806 CG2 THR A 54 6.398 4.041 4.008 1.00 0.00 C ATOM 0 H THR A 54 3.639 4.068 3.064 1.00 0.00 H new ATOM 0 HA THR A 54 5.455 1.779 2.728 1.00 0.00 H new ATOM 0 HB THR A 54 6.026 2.210 5.077 1.00 0.00 H new ATOM 0 HG1 THR A 54 3.907 4.149 4.943 1.00 0.00 H new ATOM 0 HG21 THR A 54 6.923 4.515 4.837 1.00 0.00 H new ATOM 0 HG22 THR A 54 7.122 3.586 3.332 1.00 0.00 H new ATOM 0 HG23 THR A 54 5.820 4.791 3.469 1.00 0.00 H new ATOM 814 N PRO A 55 4.066 0.089 4.178 1.00 0.00 N ATOM 815 CA PRO A 55 3.154 -0.899 4.777 1.00 0.00 C ATOM 816 C PRO A 55 2.446 -0.372 6.051 1.00 0.00 C ATOM 817 O PRO A 55 1.290 -0.722 6.331 1.00 0.00 O ATOM 818 CB PRO A 55 4.085 -2.084 5.116 1.00 0.00 C ATOM 819 CG PRO A 55 5.473 -1.573 4.922 1.00 0.00 C ATOM 820 CD PRO A 55 5.372 -0.507 3.898 1.00 0.00 C ATOM 0 HA PRO A 55 2.339 -1.159 4.101 1.00 0.00 H new ATOM 0 HB2 PRO A 55 3.932 -2.422 6.141 1.00 0.00 H new ATOM 0 HB3 PRO A 55 3.887 -2.936 4.466 1.00 0.00 H new ATOM 0 HG2 PRO A 55 5.879 -1.182 5.855 1.00 0.00 H new ATOM 0 HG3 PRO A 55 6.140 -2.369 4.593 1.00 0.00 H new ATOM 0 HD2 PRO A 55 6.177 0.221 3.992 1.00 0.00 H new ATOM 0 HD3 PRO A 55 5.424 -0.911 2.887 1.00 0.00 H new ATOM 828 N THR A 56 3.139 0.485 6.776 1.00 0.00 N ATOM 829 CA THR A 56 2.653 1.089 7.988 1.00 0.00 C ATOM 830 C THR A 56 1.497 2.075 7.673 1.00 0.00 C ATOM 831 O THR A 56 0.371 1.969 8.228 1.00 0.00 O ATOM 832 CB THR A 56 3.820 1.832 8.661 1.00 0.00 C ATOM 833 OG1 THR A 56 5.003 0.982 8.624 1.00 0.00 O ATOM 834 CG2 THR A 56 3.469 2.146 10.106 1.00 0.00 C ATOM 0 H THR A 56 4.081 0.784 6.526 1.00 0.00 H new ATOM 0 HA THR A 56 2.266 0.320 8.657 1.00 0.00 H new ATOM 0 HB THR A 56 4.013 2.765 8.131 1.00 0.00 H new ATOM 0 HG1 THR A 56 5.808 1.541 8.641 1.00 0.00 H new ATOM 0 HG21 THR A 56 4.300 2.672 10.576 1.00 0.00 H new ATOM 0 HG22 THR A 56 2.578 2.774 10.136 1.00 0.00 H new ATOM 0 HG23 THR A 56 3.277 1.218 10.644 1.00 0.00 H new ATOM 842 N ASP A 57 1.713 2.947 6.696 1.00 0.00 N ATOM 843 CA ASP A 57 0.685 3.919 6.375 1.00 0.00 C ATOM 844 C ASP A 57 -0.391 3.311 5.534 1.00 0.00 C ATOM 845 O ASP A 57 -1.505 3.823 5.485 1.00 0.00 O ATOM 846 CB ASP A 57 1.208 5.261 5.821 1.00 0.00 C ATOM 847 CG ASP A 57 1.675 5.244 4.391 1.00 0.00 C ATOM 848 OD1 ASP A 57 0.866 5.494 3.518 1.00 0.00 O ATOM 849 OD2 ASP A 57 2.886 5.036 4.156 1.00 0.00 O ATOM 0 H ASP A 57 2.561 3.000 6.131 1.00 0.00 H new ATOM 0 HA ASP A 57 0.239 4.201 7.329 1.00 0.00 H new ATOM 0 HB2 ASP A 57 0.416 6.004 5.916 1.00 0.00 H new ATOM 0 HB3 ASP A 57 2.034 5.594 6.449 1.00 0.00 H new ATOM 854 N TRP A 58 -0.039 2.228 4.849 1.00 0.00 N ATOM 855 CA TRP A 58 -0.992 1.375 4.175 1.00 0.00 C ATOM 856 C TRP A 58 -2.107 1.008 5.142 1.00 0.00 C ATOM 857 O TRP A 58 -3.289 1.289 4.899 1.00 0.00 O ATOM 858 CB TRP A 58 -0.319 0.075 3.700 1.00 0.00 C ATOM 859 CG TRP A 58 0.281 0.069 2.318 1.00 0.00 C ATOM 860 CD1 TRP A 58 0.244 1.050 1.390 1.00 0.00 C ATOM 861 CD2 TRP A 58 0.959 -1.034 1.709 1.00 0.00 C ATOM 862 NE1 TRP A 58 0.869 0.625 0.219 1.00 0.00 N ATOM 863 CE2 TRP A 58 1.315 -0.654 0.403 1.00 0.00 C ATOM 864 CE3 TRP A 58 1.303 -2.306 2.153 1.00 0.00 C ATOM 865 CZ2 TRP A 58 1.993 -1.514 -0.465 1.00 0.00 C ATOM 866 CZ3 TRP A 58 1.964 -3.159 1.312 1.00 0.00 C ATOM 867 CH2 TRP A 58 2.305 -2.774 0.020 1.00 0.00 C ATOM 0 H TRP A 58 0.928 1.921 4.749 1.00 0.00 H new ATOM 0 HA TRP A 58 -1.387 1.914 3.313 1.00 0.00 H new ATOM 0 HB2 TRP A 58 0.469 -0.175 4.410 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -1.058 -0.724 3.750 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -0.204 2.022 1.534 1.00 0.00 H new ATOM 0 HE1 TRP A 58 0.976 1.176 -0.633 1.00 0.00 H new ATOM 0 HE3 TRP A 58 1.050 -2.619 3.155 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 2.261 -1.211 -1.466 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 2.225 -4.148 1.657 1.00 0.00 H new ATOM 0 HH2 TRP A 58 2.824 -3.472 -0.619 1.00 0.00 H new ATOM 878 N ASN A 59 -1.726 0.406 6.245 1.00 0.00 N ATOM 879 CA ASN A 59 -2.679 -0.011 7.265 1.00 0.00 C ATOM 880 C ASN A 59 -3.514 1.148 7.766 1.00 0.00 C ATOM 881 O ASN A 59 -4.737 1.012 7.911 1.00 0.00 O ATOM 882 CB ASN A 59 -1.990 -0.738 8.406 1.00 0.00 C ATOM 883 CG ASN A 59 -1.420 -2.077 7.977 1.00 0.00 C ATOM 884 OD1 ASN A 59 -1.935 -2.739 7.049 1.00 0.00 O ATOM 885 ND2 ASN A 59 -0.374 -2.487 8.619 1.00 0.00 N ATOM 0 H ASN A 59 -0.754 0.189 6.466 1.00 0.00 H new ATOM 0 HA ASN A 59 -3.364 -0.716 6.794 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -1.188 -0.114 8.799 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -2.701 -0.892 9.218 1.00 0.00 H new ATOM 0 HD21 ASN A 59 0.058 -3.378 8.374 1.00 0.00 H new ATOM 0 HD22 ASN A 59 0.018 -1.920 9.370 1.00 0.00 H new ATOM 892 N THR A 60 -2.866 2.300 7.918 1.00 0.00 N ATOM 893 CA THR A 60 -3.571 3.507 8.339 1.00 0.00 C ATOM 894 C THR A 60 -4.627 3.926 7.264 1.00 0.00 C ATOM 895 O THR A 60 -5.793 4.245 7.591 1.00 0.00 O ATOM 896 CB THR A 60 -2.547 4.640 8.572 1.00 0.00 C ATOM 897 OG1 THR A 60 -1.503 4.130 9.434 1.00 0.00 O ATOM 898 CG2 THR A 60 -3.189 5.842 9.265 1.00 0.00 C ATOM 0 H THR A 60 -1.866 2.423 7.758 1.00 0.00 H new ATOM 0 HA THR A 60 -4.102 3.310 9.270 1.00 0.00 H new ATOM 0 HB THR A 60 -2.159 4.962 7.606 1.00 0.00 H new ATOM 0 HG1 THR A 60 -0.839 4.833 9.595 1.00 0.00 H new ATOM 0 HG21 THR A 60 -2.440 6.620 9.413 1.00 0.00 H new ATOM 0 HG22 THR A 60 -3.997 6.230 8.645 1.00 0.00 H new ATOM 0 HG23 THR A 60 -3.588 5.534 10.231 1.00 0.00 H new ATOM 906 N LEU A 61 -4.222 3.826 5.996 1.00 0.00 N ATOM 907 CA LEU A 61 -5.018 4.248 4.850 1.00 0.00 C ATOM 908 C LEU A 61 -6.276 3.414 4.733 1.00 0.00 C ATOM 909 O LEU A 61 -7.365 3.951 4.855 1.00 0.00 O ATOM 910 CB LEU A 61 -4.148 4.184 3.566 1.00 0.00 C ATOM 911 CG LEU A 61 -4.646 4.887 2.290 1.00 0.00 C ATOM 912 CD1 LEU A 61 -3.492 5.106 1.355 1.00 0.00 C ATOM 913 CD2 LEU A 61 -5.726 4.103 1.558 1.00 0.00 C ATOM 0 H LEU A 61 -3.314 3.442 5.736 1.00 0.00 H new ATOM 0 HA LEU A 61 -5.341 5.280 4.988 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -3.170 4.600 3.810 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -3.996 3.132 3.324 1.00 0.00 H new ATOM 0 HG LEU A 61 -5.085 5.834 2.605 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -3.845 5.604 0.452 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -2.742 5.728 1.843 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -3.050 4.145 1.091 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -6.034 4.652 0.668 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -5.334 3.129 1.266 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -6.585 3.966 2.215 1.00 0.00 H new ATOM 925 N VAL A 62 -6.114 2.093 4.606 1.00 0.00 N ATOM 926 CA VAL A 62 -7.263 1.180 4.377 1.00 0.00 C ATOM 927 C VAL A 62 -8.254 1.282 5.511 1.00 0.00 C ATOM 928 O VAL A 62 -9.471 1.446 5.315 1.00 0.00 O ATOM 929 CB VAL A 62 -6.816 -0.319 4.168 1.00 0.00 C ATOM 930 CG1 VAL A 62 -5.880 -0.804 5.257 1.00 0.00 C ATOM 931 CG2 VAL A 62 -8.012 -1.242 4.075 1.00 0.00 C ATOM 0 H VAL A 62 -5.209 1.625 4.656 1.00 0.00 H new ATOM 0 HA VAL A 62 -7.742 1.500 3.452 1.00 0.00 H new ATOM 0 HB VAL A 62 -6.271 -0.343 3.224 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -5.604 -1.841 5.064 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -4.983 -0.185 5.268 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -6.380 -0.735 6.223 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -7.670 -2.267 3.931 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -8.593 -1.179 4.995 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -8.636 -0.946 3.231 1.00 0.00 H new ATOM 941 N ARG A 63 -7.696 1.272 6.680 1.00 0.00 N ATOM 942 CA ARG A 63 -8.447 1.324 7.920 1.00 0.00 C ATOM 943 C ARG A 63 -9.284 2.618 8.091 1.00 0.00 C ATOM 944 O ARG A 63 -10.349 2.597 8.710 1.00 0.00 O ATOM 945 CB ARG A 63 -7.498 1.042 9.116 1.00 0.00 C ATOM 946 CG ARG A 63 -8.074 1.242 10.499 1.00 0.00 C ATOM 947 CD ARG A 63 -7.959 2.681 10.939 1.00 0.00 C ATOM 948 NE ARG A 63 -8.729 2.915 12.156 1.00 0.00 N ATOM 949 CZ ARG A 63 -9.388 4.030 12.478 1.00 0.00 C ATOM 950 NH1 ARG A 63 -9.360 5.105 11.667 1.00 0.00 N ATOM 951 NH2 ARG A 63 -10.101 4.055 13.616 1.00 0.00 N ATOM 0 H ARG A 63 -6.686 1.227 6.815 1.00 0.00 H new ATOM 0 HA ARG A 63 -9.199 0.536 7.887 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -7.149 0.012 9.038 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.623 1.684 9.015 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -9.121 0.940 10.506 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -7.552 0.600 11.209 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -6.912 2.930 11.112 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -8.316 3.338 10.146 1.00 0.00 H new ATOM 0 HE ARG A 63 -8.768 2.149 12.829 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -8.831 5.073 10.796 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -9.868 5.951 11.924 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -10.132 3.231 14.217 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -10.612 4.898 13.880 1.00 0.00 H new ATOM 965 N ALA A 64 -8.839 3.704 7.523 1.00 0.00 N ATOM 966 CA ALA A 64 -9.582 4.949 7.666 1.00 0.00 C ATOM 967 C ALA A 64 -10.532 5.178 6.493 1.00 0.00 C ATOM 968 O ALA A 64 -11.704 5.567 6.677 1.00 0.00 O ATOM 969 CB ALA A 64 -8.639 6.148 7.814 1.00 0.00 C ATOM 0 H ALA A 64 -7.986 3.766 6.966 1.00 0.00 H new ATOM 0 HA ALA A 64 -10.176 4.857 8.575 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -9.225 7.061 7.919 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -8.016 6.014 8.698 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -8.005 6.223 6.931 1.00 0.00 H new ATOM 975 N VAL A 65 -9.987 5.041 5.330 1.00 0.00 N ATOM 976 CA VAL A 65 -10.741 5.300 4.098 1.00 0.00 C ATOM 977 C VAL A 65 -12.059 4.482 3.984 1.00 0.00 C ATOM 978 O VAL A 65 -13.120 5.049 3.745 1.00 0.00 O ATOM 979 CB VAL A 65 -9.889 5.179 2.798 1.00 0.00 C ATOM 980 CG1 VAL A 65 -8.698 6.143 2.835 1.00 0.00 C ATOM 981 CG2 VAL A 65 -9.420 3.748 2.572 1.00 0.00 C ATOM 0 H VAL A 65 -9.020 4.751 5.182 1.00 0.00 H new ATOM 0 HA VAL A 65 -11.027 6.348 4.189 1.00 0.00 H new ATOM 0 HB VAL A 65 -10.527 5.455 1.958 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -8.118 6.041 1.918 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -9.061 7.167 2.922 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -8.066 5.908 3.692 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -8.829 3.699 1.658 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -8.810 3.428 3.416 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -10.285 3.092 2.480 1.00 0.00 H new ATOM 991 N LEU A 66 -11.998 3.197 4.219 1.00 0.00 N ATOM 992 CA LEU A 66 -13.169 2.325 4.099 1.00 0.00 C ATOM 993 C LEU A 66 -13.576 1.850 5.469 1.00 0.00 C ATOM 994 O LEU A 66 -12.906 2.160 6.465 1.00 0.00 O ATOM 995 CB LEU A 66 -12.887 1.126 3.174 1.00 0.00 C ATOM 996 CG LEU A 66 -13.204 1.254 1.667 1.00 0.00 C ATOM 997 CD1 LEU A 66 -14.683 1.377 1.428 1.00 0.00 C ATOM 998 CD2 LEU A 66 -12.455 2.400 1.041 1.00 0.00 C ATOM 0 H LEU A 66 -11.145 2.713 4.499 1.00 0.00 H new ATOM 0 HA LEU A 66 -13.983 2.895 3.652 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -11.830 0.879 3.268 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -13.449 0.275 3.558 1.00 0.00 H new ATOM 0 HG LEU A 66 -12.865 0.337 1.184 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -14.873 1.465 0.358 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -15.189 0.492 1.814 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -15.062 2.263 1.938 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -12.702 2.460 -0.019 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -12.737 3.331 1.533 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -11.383 2.240 1.155 1.00 0.00 H new ATOM 1010 N SER A 67 -14.679 1.142 5.569 1.00 0.00 N ATOM 1011 CA SER A 67 -15.119 0.683 6.845 1.00 0.00 C ATOM 1012 C SER A 67 -15.842 -0.652 6.713 1.00 0.00 C ATOM 1013 O SER A 67 -16.916 -0.761 6.078 1.00 0.00 O ATOM 1014 CB SER A 67 -16.041 1.738 7.471 1.00 0.00 C ATOM 1015 OG SER A 67 -15.380 3.021 7.556 1.00 0.00 O ATOM 0 H SER A 67 -15.275 0.879 4.784 1.00 0.00 H new ATOM 0 HA SER A 67 -14.255 0.533 7.492 1.00 0.00 H new ATOM 0 HB2 SER A 67 -16.949 1.832 6.875 1.00 0.00 H new ATOM 0 HB3 SER A 67 -16.345 1.415 8.467 1.00 0.00 H new ATOM 0 HG SER A 67 -15.988 3.677 7.957 1.00 0.00 H new ATOM 1021 N GLY A 68 -15.247 -1.657 7.287 1.00 0.00 N ATOM 1022 CA GLY A 68 -15.849 -2.952 7.357 1.00 0.00 C ATOM 1023 C GLY A 68 -15.504 -3.835 6.192 1.00 0.00 C ATOM 1024 O GLY A 68 -14.860 -4.879 6.357 1.00 0.00 O ATOM 0 H GLY A 68 -14.326 -1.599 7.721 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -15.535 -3.441 8.279 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -16.932 -2.839 7.409 1.00 0.00 H new ATOM 1028 N GLY A 69 -15.909 -3.411 5.022 1.00 0.00 N ATOM 1029 CA GLY A 69 -15.735 -4.206 3.840 1.00 0.00 C ATOM 1030 C GLY A 69 -14.292 -4.321 3.418 1.00 0.00 C ATOM 1031 O GLY A 69 -13.866 -5.391 2.960 1.00 0.00 O ATOM 0 H GLY A 69 -16.365 -2.512 4.865 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -16.137 -5.204 4.017 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -16.313 -3.769 3.026 1.00 0.00 H new ATOM 1035 N ASP A 70 -13.539 -3.222 3.588 1.00 0.00 N ATOM 1036 CA ASP A 70 -12.126 -3.120 3.213 1.00 0.00 C ATOM 1037 C ASP A 70 -11.353 -4.304 3.690 1.00 0.00 C ATOM 1038 O ASP A 70 -10.711 -4.987 2.914 1.00 0.00 O ATOM 1039 CB ASP A 70 -11.502 -1.840 3.777 1.00 0.00 C ATOM 1040 CG ASP A 70 -11.576 -1.721 5.291 1.00 0.00 C ATOM 1041 OD1 ASP A 70 -12.655 -1.445 5.823 1.00 0.00 O ATOM 1042 OD2 ASP A 70 -10.575 -1.963 5.965 1.00 0.00 O ATOM 0 H ASP A 70 -13.907 -2.364 3.999 1.00 0.00 H new ATOM 0 HA ASP A 70 -12.081 -3.089 2.124 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -10.457 -1.794 3.472 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -12.002 -0.980 3.332 1.00 0.00 H new ATOM 1047 N HIS A 71 -11.505 -4.571 4.948 1.00 0.00 N ATOM 1048 CA HIS A 71 -10.881 -5.639 5.620 1.00 0.00 C ATOM 1049 C HIS A 71 -11.135 -6.964 4.898 1.00 0.00 C ATOM 1050 O HIS A 71 -10.192 -7.602 4.423 1.00 0.00 O ATOM 1051 CB HIS A 71 -11.391 -5.660 7.054 1.00 0.00 C ATOM 1052 CG HIS A 71 -10.536 -4.913 8.046 1.00 0.00 C ATOM 1053 ND1 HIS A 71 -10.294 -3.555 7.992 1.00 0.00 N ATOM 1054 CD2 HIS A 71 -9.858 -5.354 9.126 1.00 0.00 C ATOM 1055 CE1 HIS A 71 -9.527 -3.207 8.988 1.00 0.00 C ATOM 1056 NE2 HIS A 71 -9.244 -4.275 9.696 1.00 0.00 N ATOM 0 H HIS A 71 -12.103 -4.012 5.557 1.00 0.00 H new ATOM 0 HA HIS A 71 -9.800 -5.500 5.628 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -12.396 -5.238 7.073 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -11.475 -6.697 7.378 1.00 0.00 H new ATOM 0 HD1 HIS A 71 -10.659 -2.921 7.282 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -9.810 -6.375 9.476 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -9.182 -2.205 9.196 1.00 0.00 H new ATOM 1065 N LEU A 72 -12.399 -7.294 4.680 1.00 0.00 N ATOM 1066 CA LEU A 72 -12.720 -8.559 4.093 1.00 0.00 C ATOM 1067 C LEU A 72 -12.166 -8.761 2.663 1.00 0.00 C ATOM 1068 O LEU A 72 -11.410 -9.687 2.447 1.00 0.00 O ATOM 1069 CB LEU A 72 -14.191 -9.004 4.349 1.00 0.00 C ATOM 1070 CG LEU A 72 -15.325 -8.022 3.997 1.00 0.00 C ATOM 1071 CD1 LEU A 72 -15.645 -7.995 2.510 1.00 0.00 C ATOM 1072 CD2 LEU A 72 -16.564 -8.323 4.802 1.00 0.00 C ATOM 0 H LEU A 72 -13.200 -6.703 4.902 1.00 0.00 H new ATOM 0 HA LEU A 72 -12.146 -9.301 4.648 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -14.362 -9.923 3.789 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -14.283 -9.253 5.406 1.00 0.00 H new ATOM 0 HG LEU A 72 -14.965 -7.027 4.258 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -16.451 -7.285 2.324 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -14.759 -7.692 1.953 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -15.955 -8.989 2.186 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -17.351 -7.617 4.536 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -16.899 -9.338 4.588 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -16.339 -8.232 5.865 1.00 0.00 H new ATOM 1084 N LEU A 73 -12.447 -7.900 1.724 1.00 0.00 N ATOM 1085 CA LEU A 73 -11.862 -8.139 0.397 1.00 0.00 C ATOM 1086 C LEU A 73 -10.498 -7.533 0.159 1.00 0.00 C ATOM 1087 O LEU A 73 -9.585 -8.269 -0.172 1.00 0.00 O ATOM 1088 CB LEU A 73 -12.801 -7.988 -0.783 1.00 0.00 C ATOM 1089 CG LEU A 73 -13.535 -9.282 -1.276 1.00 0.00 C ATOM 1090 CD1 LEU A 73 -12.543 -10.346 -1.755 1.00 0.00 C ATOM 1091 CD2 LEU A 73 -14.460 -9.845 -0.212 1.00 0.00 C ATOM 0 H LEU A 73 -13.036 -7.073 1.820 1.00 0.00 H new ATOM 0 HA LEU A 73 -11.676 -9.212 0.451 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -13.557 -7.248 -0.522 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -12.232 -7.581 -1.619 1.00 0.00 H new ATOM 0 HG LEU A 73 -14.149 -8.991 -2.128 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -13.089 -11.228 -2.089 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -11.955 -9.949 -2.582 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -11.879 -10.619 -0.935 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -14.950 -10.741 -0.593 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -13.881 -10.097 0.677 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -15.214 -9.101 0.045 1.00 0.00 H new ATOM 1103 N TRP A 74 -10.346 -6.212 0.349 1.00 0.00 N ATOM 1104 CA TRP A 74 -9.068 -5.534 0.163 1.00 0.00 C ATOM 1105 C TRP A 74 -7.984 -6.266 0.968 1.00 0.00 C ATOM 1106 O TRP A 74 -6.920 -6.579 0.490 1.00 0.00 O ATOM 1107 CB TRP A 74 -9.109 -4.062 0.694 1.00 0.00 C ATOM 1108 CG TRP A 74 -9.849 -2.916 -0.073 1.00 0.00 C ATOM 1109 CD1 TRP A 74 -10.853 -2.955 -1.013 1.00 0.00 C ATOM 1110 CD2 TRP A 74 -9.535 -1.528 0.069 1.00 0.00 C ATOM 1111 NE1 TRP A 74 -11.212 -1.671 -1.395 1.00 0.00 N ATOM 1112 CE2 TRP A 74 -10.414 -0.782 -0.725 1.00 0.00 C ATOM 1113 CE3 TRP A 74 -8.593 -0.875 0.810 1.00 0.00 C ATOM 1114 CZ2 TRP A 74 -10.377 0.620 -0.772 1.00 0.00 C ATOM 1115 CZ3 TRP A 74 -8.530 0.526 0.773 1.00 0.00 C ATOM 1116 CH2 TRP A 74 -9.430 1.264 -0.012 1.00 0.00 C ATOM 0 H TRP A 74 -11.105 -5.594 0.634 1.00 0.00 H new ATOM 0 HA TRP A 74 -8.856 -5.533 -0.906 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -9.544 -4.102 1.693 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -8.073 -3.743 0.810 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -11.299 -3.859 -1.399 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -11.945 -1.430 -2.061 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -7.900 -1.434 1.421 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -11.071 1.175 -1.386 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -7.781 1.042 1.355 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -9.378 2.343 -0.019 1.00 0.00 H new ATOM 1127 N LYS A 75 -8.305 -6.554 2.170 1.00 0.00 N ATOM 1128 CA LYS A 75 -7.360 -7.072 3.099 1.00 0.00 C ATOM 1129 C LYS A 75 -7.177 -8.565 3.119 1.00 0.00 C ATOM 1130 O LYS A 75 -6.054 -9.006 3.326 1.00 0.00 O ATOM 1131 CB LYS A 75 -7.470 -6.421 4.444 1.00 0.00 C ATOM 1132 CG LYS A 75 -7.401 -4.926 4.309 1.00 0.00 C ATOM 1133 CD LYS A 75 -6.000 -4.425 3.944 1.00 0.00 C ATOM 1134 CE LYS A 75 -5.119 -4.408 5.219 1.00 0.00 C ATOM 1135 NZ LYS A 75 -3.808 -3.724 5.081 1.00 0.00 N ATOM 0 H LYS A 75 -9.245 -6.437 2.549 1.00 0.00 H new ATOM 0 HA LYS A 75 -6.395 -6.768 2.695 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -8.409 -6.707 4.918 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -6.666 -6.772 5.092 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -8.108 -4.602 3.545 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -7.713 -4.467 5.247 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -5.555 -5.072 3.188 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -6.058 -3.425 3.514 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -5.679 -3.925 6.020 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -4.941 -5.437 5.530 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -3.490 -3.391 6.014 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -3.108 -4.389 4.694 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -3.906 -2.912 4.438 1.00 0.00 H new ATOM 1149 N SER A 76 -8.235 -9.375 2.923 1.00 0.00 N ATOM 1150 CA SER A 76 -7.990 -10.818 2.861 1.00 0.00 C ATOM 1151 C SER A 76 -7.145 -11.117 1.639 1.00 0.00 C ATOM 1152 O SER A 76 -6.182 -11.882 1.697 1.00 0.00 O ATOM 1153 CB SER A 76 -9.266 -11.648 2.845 1.00 0.00 C ATOM 1154 OG SER A 76 -10.068 -11.398 4.001 1.00 0.00 O ATOM 0 H SER A 76 -9.204 -9.077 2.812 1.00 0.00 H new ATOM 0 HA SER A 76 -7.463 -11.103 3.772 1.00 0.00 H new ATOM 0 HB2 SER A 76 -9.839 -11.419 1.947 1.00 0.00 H new ATOM 0 HB3 SER A 76 -9.012 -12.707 2.799 1.00 0.00 H new ATOM 0 HG SER A 76 -10.745 -10.722 3.789 1.00 0.00 H new ATOM 1160 N GLU A 77 -7.447 -10.426 0.560 1.00 0.00 N ATOM 1161 CA GLU A 77 -6.671 -10.597 -0.640 1.00 0.00 C ATOM 1162 C GLU A 77 -5.310 -9.942 -0.469 1.00 0.00 C ATOM 1163 O GLU A 77 -4.397 -10.276 -1.170 1.00 0.00 O ATOM 1164 CB GLU A 77 -7.345 -10.008 -1.871 1.00 0.00 C ATOM 1165 CG GLU A 77 -8.683 -10.586 -2.250 1.00 0.00 C ATOM 1166 CD GLU A 77 -8.609 -11.992 -2.729 1.00 0.00 C ATOM 1167 OE1 GLU A 77 -7.664 -12.342 -3.467 1.00 0.00 O ATOM 1168 OE2 GLU A 77 -9.543 -12.753 -2.456 1.00 0.00 O ATOM 0 H GLU A 77 -8.211 -9.753 0.493 1.00 0.00 H new ATOM 0 HA GLU A 77 -6.572 -11.671 -0.798 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -7.470 -8.937 -1.711 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -6.670 -10.127 -2.719 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -9.347 -10.539 -1.387 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -9.129 -9.968 -3.029 1.00 0.00 H new ATOM 1175 N PHE A 78 -5.179 -8.999 0.448 1.00 0.00 N ATOM 1176 CA PHE A 78 -3.892 -8.392 0.727 1.00 0.00 C ATOM 1177 C PHE A 78 -2.956 -9.436 1.255 1.00 0.00 C ATOM 1178 O PHE A 78 -1.860 -9.602 0.751 1.00 0.00 O ATOM 1179 CB PHE A 78 -4.081 -7.263 1.724 1.00 0.00 C ATOM 1180 CG PHE A 78 -2.876 -6.483 2.058 1.00 0.00 C ATOM 1181 CD1 PHE A 78 -2.172 -5.823 1.087 1.00 0.00 C ATOM 1182 CD2 PHE A 78 -2.462 -6.378 3.368 1.00 0.00 C ATOM 1183 CE1 PHE A 78 -1.077 -5.080 1.415 1.00 0.00 C ATOM 1184 CE2 PHE A 78 -1.365 -5.639 3.698 1.00 0.00 C ATOM 1185 CZ PHE A 78 -0.669 -4.989 2.723 1.00 0.00 C ATOM 0 H PHE A 78 -5.949 -8.638 1.011 1.00 0.00 H new ATOM 0 HA PHE A 78 -3.460 -7.978 -0.184 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -4.833 -6.580 1.330 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -4.484 -7.683 2.646 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -2.486 -5.891 0.056 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -3.014 -6.888 4.144 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -0.528 -4.561 0.643 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -1.049 -5.569 4.728 1.00 0.00 H new ATOM 0 HZ PHE A 78 0.202 -4.403 2.979 1.00 0.00 H new ATOM 1195 N PHE A 79 -3.415 -10.170 2.218 1.00 0.00 N ATOM 1196 CA PHE A 79 -2.641 -11.220 2.797 1.00 0.00 C ATOM 1197 C PHE A 79 -2.370 -12.316 1.780 1.00 0.00 C ATOM 1198 O PHE A 79 -1.231 -12.799 1.659 1.00 0.00 O ATOM 1199 CB PHE A 79 -3.332 -11.755 4.040 1.00 0.00 C ATOM 1200 CG PHE A 79 -3.268 -10.781 5.194 1.00 0.00 C ATOM 1201 CD1 PHE A 79 -2.077 -10.576 5.883 1.00 0.00 C ATOM 1202 CD2 PHE A 79 -4.379 -10.042 5.566 1.00 0.00 C ATOM 1203 CE1 PHE A 79 -2.004 -9.659 6.919 1.00 0.00 C ATOM 1204 CE2 PHE A 79 -4.307 -9.117 6.599 1.00 0.00 C ATOM 1205 CZ PHE A 79 -3.120 -8.927 7.271 1.00 0.00 C ATOM 0 H PHE A 79 -4.343 -10.057 2.627 1.00 0.00 H new ATOM 0 HA PHE A 79 -1.673 -10.821 3.101 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -4.375 -11.973 3.808 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -2.868 -12.696 4.335 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -1.198 -11.139 5.607 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -5.314 -10.187 5.045 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -1.075 -9.517 7.451 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -5.182 -8.547 6.875 1.00 0.00 H new ATOM 0 HZ PHE A 79 -3.062 -8.206 8.073 1.00 0.00 H new ATOM 1215 N GLU A 80 -3.407 -12.657 1.013 1.00 0.00 N ATOM 1216 CA GLU A 80 -3.298 -13.673 -0.017 1.00 0.00 C ATOM 1217 C GLU A 80 -2.298 -13.310 -1.095 1.00 0.00 C ATOM 1218 O GLU A 80 -1.323 -14.026 -1.276 1.00 0.00 O ATOM 1219 CB GLU A 80 -4.648 -14.040 -0.618 1.00 0.00 C ATOM 1220 CG GLU A 80 -5.591 -14.661 0.396 1.00 0.00 C ATOM 1221 CD GLU A 80 -6.888 -15.130 -0.193 1.00 0.00 C ATOM 1222 OE1 GLU A 80 -6.875 -15.803 -1.247 1.00 0.00 O ATOM 1223 OE2 GLU A 80 -7.954 -14.837 0.382 1.00 0.00 O ATOM 0 H GLU A 80 -4.333 -12.238 1.092 1.00 0.00 H new ATOM 0 HA GLU A 80 -2.915 -14.561 0.487 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -5.110 -13.146 -1.037 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -4.497 -14.737 -1.442 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -5.093 -15.505 0.873 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -5.800 -13.931 1.178 1.00 0.00 H new ATOM 1230 N ASN A 81 -2.500 -12.173 -1.744 1.00 0.00 N ATOM 1231 CA ASN A 81 -1.660 -11.729 -2.870 1.00 0.00 C ATOM 1232 C ASN A 81 -0.233 -11.458 -2.473 1.00 0.00 C ATOM 1233 O ASN A 81 0.691 -11.787 -3.222 1.00 0.00 O ATOM 1234 CB ASN A 81 -2.222 -10.474 -3.532 1.00 0.00 C ATOM 1235 CG ASN A 81 -3.545 -10.691 -4.203 1.00 0.00 C ATOM 1236 OD1 ASN A 81 -3.851 -11.783 -4.697 1.00 0.00 O ATOM 1237 ND2 ASN A 81 -4.341 -9.667 -4.229 1.00 0.00 N ATOM 0 H ASN A 81 -3.251 -11.523 -1.511 1.00 0.00 H new ATOM 0 HA ASN A 81 -1.671 -12.560 -3.575 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -2.330 -9.693 -2.779 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -1.506 -10.110 -4.269 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -5.258 -9.745 -4.669 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -4.050 -8.784 -3.810 1.00 0.00 H new ATOM 1244 N CYS A 82 -0.036 -10.855 -1.317 1.00 0.00 N ATOM 1245 CA CYS A 82 1.297 -10.544 -0.863 1.00 0.00 C ATOM 1246 C CYS A 82 2.083 -11.807 -0.586 1.00 0.00 C ATOM 1247 O CYS A 82 3.166 -11.982 -1.110 1.00 0.00 O ATOM 1248 CB CYS A 82 1.265 -9.642 0.348 1.00 0.00 C ATOM 1249 SG CYS A 82 0.630 -7.970 0.032 1.00 0.00 S ATOM 0 H CYS A 82 -0.781 -10.573 -0.680 1.00 0.00 H new ATOM 0 HA CYS A 82 1.805 -10.004 -1.662 1.00 0.00 H new ATOM 0 HB2 CYS A 82 0.650 -10.110 1.117 1.00 0.00 H new ATOM 0 HB3 CYS A 82 2.274 -9.562 0.752 1.00 0.00 H new ATOM 0 HG CYS A 82 -0.659 -7.957 0.197 1.00 0.00 H new ATOM 1255 N ARG A 83 1.512 -12.731 0.166 1.00 0.00 N ATOM 1256 CA ARG A 83 2.242 -13.945 0.476 1.00 0.00 C ATOM 1257 C ARG A 83 2.326 -14.873 -0.717 1.00 0.00 C ATOM 1258 O ARG A 83 3.270 -15.629 -0.840 1.00 0.00 O ATOM 1259 CB ARG A 83 1.752 -14.656 1.740 1.00 0.00 C ATOM 1260 CG ARG A 83 2.153 -13.963 3.044 1.00 0.00 C ATOM 1261 CD ARG A 83 1.477 -12.607 3.229 1.00 0.00 C ATOM 1262 NE ARG A 83 2.027 -11.852 4.352 1.00 0.00 N ATOM 1263 CZ ARG A 83 1.536 -11.901 5.617 1.00 0.00 C ATOM 1264 NH1 ARG A 83 0.502 -12.693 5.913 1.00 0.00 N ATOM 1265 NH2 ARG A 83 2.082 -11.174 6.574 1.00 0.00 N ATOM 0 H ARG A 83 0.574 -12.669 0.562 1.00 0.00 H new ATOM 0 HA ARG A 83 3.258 -13.627 0.709 1.00 0.00 H new ATOM 0 HB2 ARG A 83 0.665 -14.733 1.702 1.00 0.00 H new ATOM 0 HB3 ARG A 83 2.144 -15.673 1.747 1.00 0.00 H new ATOM 0 HG2 ARG A 83 1.899 -14.608 3.885 1.00 0.00 H new ATOM 0 HG3 ARG A 83 3.235 -13.829 3.061 1.00 0.00 H new ATOM 0 HD2 ARG A 83 1.587 -12.023 2.315 1.00 0.00 H new ATOM 0 HD3 ARG A 83 0.409 -12.756 3.385 1.00 0.00 H new ATOM 0 HE ARG A 83 2.831 -11.250 4.175 1.00 0.00 H new ATOM 0 HH11 ARG A 83 0.075 -13.267 5.186 1.00 0.00 H new ATOM 0 HH12 ARG A 83 0.140 -12.724 6.866 1.00 0.00 H new ATOM 0 HH21 ARG A 83 2.878 -10.571 6.365 1.00 0.00 H new ATOM 0 HH22 ARG A 83 1.708 -11.215 7.522 1.00 0.00 H new ATOM 1279 N ASP A 84 1.351 -14.771 -1.604 1.00 0.00 N ATOM 1280 CA ASP A 84 1.315 -15.500 -2.891 1.00 0.00 C ATOM 1281 C ASP A 84 2.599 -15.201 -3.653 1.00 0.00 C ATOM 1282 O ASP A 84 3.458 -16.081 -3.944 1.00 0.00 O ATOM 1283 CB ASP A 84 0.146 -14.925 -3.716 1.00 0.00 C ATOM 1284 CG ASP A 84 -0.183 -15.680 -4.984 1.00 0.00 C ATOM 1285 OD1 ASP A 84 -0.957 -16.656 -4.945 1.00 0.00 O ATOM 1286 OD2 ASP A 84 0.316 -15.313 -6.042 1.00 0.00 O ATOM 0 H ASP A 84 0.539 -14.171 -1.461 1.00 0.00 H new ATOM 0 HA ASP A 84 1.205 -16.571 -2.724 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -0.743 -14.900 -3.087 1.00 0.00 H new ATOM 0 HB3 ASP A 84 0.381 -13.893 -3.978 1.00 0.00 H new ATOM 1291 N THR A 85 2.771 -13.944 -3.853 1.00 0.00 N ATOM 1292 CA THR A 85 3.865 -13.411 -4.579 1.00 0.00 C ATOM 1293 C THR A 85 5.190 -13.681 -3.825 1.00 0.00 C ATOM 1294 O THR A 85 6.166 -14.170 -4.412 1.00 0.00 O ATOM 1295 CB THR A 85 3.610 -11.905 -4.741 1.00 0.00 C ATOM 1296 OG1 THR A 85 2.313 -11.704 -5.364 1.00 0.00 O ATOM 1297 CG2 THR A 85 4.688 -11.220 -5.552 1.00 0.00 C ATOM 0 H THR A 85 2.130 -13.233 -3.502 1.00 0.00 H new ATOM 0 HA THR A 85 3.955 -13.882 -5.558 1.00 0.00 H new ATOM 0 HB THR A 85 3.626 -11.455 -3.748 1.00 0.00 H new ATOM 0 HG1 THR A 85 1.618 -11.683 -4.673 1.00 0.00 H new ATOM 0 HG21 THR A 85 4.460 -10.157 -5.637 1.00 0.00 H new ATOM 0 HG22 THR A 85 5.651 -11.346 -5.057 1.00 0.00 H new ATOM 0 HG23 THR A 85 4.731 -11.662 -6.547 1.00 0.00 H new ATOM 1305 N ALA A 86 5.168 -13.461 -2.507 1.00 0.00 N ATOM 1306 CA ALA A 86 6.339 -13.581 -1.682 1.00 0.00 C ATOM 1307 C ALA A 86 6.842 -15.006 -1.578 1.00 0.00 C ATOM 1308 O ALA A 86 8.058 -15.234 -1.571 1.00 0.00 O ATOM 1309 CB ALA A 86 6.088 -13.006 -0.327 1.00 0.00 C ATOM 0 H ALA A 86 4.327 -13.194 -1.995 1.00 0.00 H new ATOM 0 HA ALA A 86 7.128 -13.008 -2.170 1.00 0.00 H new ATOM 0 HB1 ALA A 86 6.986 -13.106 0.283 1.00 0.00 H new ATOM 0 HB2 ALA A 86 5.829 -11.951 -0.421 1.00 0.00 H new ATOM 0 HB3 ALA A 86 5.265 -13.540 0.148 1.00 0.00 H new ATOM 1315 N LYS A 87 5.945 -15.978 -1.511 1.00 0.00 N ATOM 1316 CA LYS A 87 6.390 -17.349 -1.481 1.00 0.00 C ATOM 1317 C LYS A 87 7.026 -17.725 -2.825 1.00 0.00 C ATOM 1318 O LYS A 87 7.911 -18.595 -2.889 1.00 0.00 O ATOM 1319 CB LYS A 87 5.290 -18.339 -1.053 1.00 0.00 C ATOM 1320 CG LYS A 87 4.109 -18.432 -1.995 1.00 0.00 C ATOM 1321 CD LYS A 87 3.081 -19.421 -1.497 1.00 0.00 C ATOM 1322 CE LYS A 87 1.861 -19.430 -2.385 1.00 0.00 C ATOM 1323 NZ LYS A 87 0.847 -20.382 -1.924 1.00 0.00 N ATOM 0 H LYS A 87 4.935 -15.843 -1.477 1.00 0.00 H new ATOM 0 HA LYS A 87 7.152 -17.428 -0.705 1.00 0.00 H new ATOM 0 HB2 LYS A 87 5.733 -19.330 -0.952 1.00 0.00 H new ATOM 0 HB3 LYS A 87 4.927 -18.050 -0.067 1.00 0.00 H new ATOM 0 HG2 LYS A 87 3.649 -17.450 -2.102 1.00 0.00 H new ATOM 0 HG3 LYS A 87 4.454 -18.731 -2.985 1.00 0.00 H new ATOM 0 HD2 LYS A 87 3.518 -20.419 -1.464 1.00 0.00 H new ATOM 0 HD3 LYS A 87 2.791 -19.166 -0.478 1.00 0.00 H new ATOM 0 HE2 LYS A 87 1.430 -18.430 -2.417 1.00 0.00 H new ATOM 0 HE3 LYS A 87 2.157 -19.682 -3.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 0.028 -20.354 -2.564 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 1.249 -21.341 -1.918 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 0.544 -20.128 -0.962 1.00 0.00 H new ATOM 1337 N ARG A 88 6.612 -17.037 -3.905 1.00 0.00 N ATOM 1338 CA ARG A 88 7.310 -17.234 -5.170 1.00 0.00 C ATOM 1339 C ARG A 88 8.683 -16.532 -5.153 1.00 0.00 C ATOM 1340 O ARG A 88 9.641 -17.028 -5.740 1.00 0.00 O ATOM 1341 CB ARG A 88 6.485 -16.886 -6.429 1.00 0.00 C ATOM 1342 CG ARG A 88 5.475 -17.977 -6.875 1.00 0.00 C ATOM 1343 CD ARG A 88 4.401 -18.223 -5.838 1.00 0.00 C ATOM 1344 NE ARG A 88 3.389 -19.235 -6.241 1.00 0.00 N ATOM 1345 CZ ARG A 88 2.042 -19.049 -6.168 1.00 0.00 C ATOM 1346 NH1 ARG A 88 1.559 -17.825 -6.029 1.00 0.00 N ATOM 1347 NH2 ARG A 88 1.201 -20.079 -6.320 1.00 0.00 N ATOM 0 H ARG A 88 5.837 -16.374 -3.924 1.00 0.00 H new ATOM 0 HA ARG A 88 7.471 -18.309 -5.254 1.00 0.00 H new ATOM 0 HB2 ARG A 88 5.939 -15.961 -6.243 1.00 0.00 H new ATOM 0 HB3 ARG A 88 7.172 -16.690 -7.252 1.00 0.00 H new ATOM 0 HG2 ARG A 88 5.009 -17.676 -7.813 1.00 0.00 H new ATOM 0 HG3 ARG A 88 6.010 -18.907 -7.069 1.00 0.00 H new ATOM 0 HD2 ARG A 88 4.874 -18.547 -4.911 1.00 0.00 H new ATOM 0 HD3 ARG A 88 3.894 -17.282 -5.626 1.00 0.00 H new ATOM 0 HE ARG A 88 3.727 -20.129 -6.596 1.00 0.00 H new ATOM 0 HH11 ARG A 88 2.194 -17.029 -5.977 1.00 0.00 H new ATOM 0 HH12 ARG A 88 0.551 -17.678 -5.974 1.00 0.00 H new ATOM 0 HH21 ARG A 88 1.567 -21.015 -6.493 1.00 0.00 H new ATOM 0 HH22 ARG A 88 0.194 -19.928 -6.263 1.00 0.00 H new ATOM 1361 N ASN A 89 8.802 -15.426 -4.381 1.00 0.00 N ATOM 1362 CA ASN A 89 10.084 -14.697 -4.238 1.00 0.00 C ATOM 1363 C ASN A 89 11.090 -15.572 -3.496 1.00 0.00 C ATOM 1364 O ASN A 89 12.278 -15.561 -3.812 1.00 0.00 O ATOM 1365 CB ASN A 89 9.937 -13.343 -3.443 1.00 0.00 C ATOM 1366 CG ASN A 89 9.185 -12.223 -4.155 1.00 0.00 C ATOM 1367 OD1 ASN A 89 7.984 -12.110 -4.056 1.00 0.00 O ATOM 1368 ND2 ASN A 89 9.890 -11.353 -4.806 1.00 0.00 N ATOM 0 H ASN A 89 8.031 -15.021 -3.851 1.00 0.00 H new ATOM 0 HA ASN A 89 10.422 -14.463 -5.248 1.00 0.00 H new ATOM 0 HB2 ASN A 89 9.429 -13.552 -2.501 1.00 0.00 H new ATOM 0 HB3 ASN A 89 10.935 -12.982 -3.194 1.00 0.00 H new ATOM 0 HD21 ASN A 89 9.434 -10.554 -5.247 1.00 0.00 H new ATOM 0 HD22 ASN A 89 10.901 -11.467 -4.878 1.00 0.00 H new ATOM 1375 N GLN A 90 10.604 -16.344 -2.513 1.00 0.00 N ATOM 1376 CA GLN A 90 11.482 -17.197 -1.683 1.00 0.00 C ATOM 1377 C GLN A 90 11.973 -18.392 -2.490 1.00 0.00 C ATOM 1378 O GLN A 90 13.163 -18.680 -2.517 1.00 0.00 O ATOM 1379 CB GLN A 90 10.770 -17.733 -0.418 1.00 0.00 C ATOM 1380 CG GLN A 90 9.973 -16.727 0.435 1.00 0.00 C ATOM 1381 CD GLN A 90 10.727 -15.475 0.820 1.00 0.00 C ATOM 1382 OE1 GLN A 90 11.413 -15.418 1.834 1.00 0.00 O ATOM 1383 NE2 GLN A 90 10.543 -14.449 0.052 1.00 0.00 N ATOM 0 H GLN A 90 9.615 -16.399 -2.271 1.00 0.00 H new ATOM 0 HA GLN A 90 12.315 -16.566 -1.372 1.00 0.00 H new ATOM 0 HB2 GLN A 90 10.088 -18.525 -0.727 1.00 0.00 H new ATOM 0 HB3 GLN A 90 11.523 -18.193 0.222 1.00 0.00 H new ATOM 0 HG2 GLN A 90 9.077 -16.438 -0.114 1.00 0.00 H new ATOM 0 HG3 GLN A 90 9.642 -17.228 1.345 1.00 0.00 H new ATOM 0 HE21 GLN A 90 9.965 -14.535 -0.784 1.00 0.00 H new ATOM 0 HE22 GLN A 90 10.976 -13.555 0.283 1.00 0.00 H new ATOM 1392 N GLN A 91 11.055 -19.079 -3.182 1.00 0.00 N ATOM 1393 CA GLN A 91 11.441 -20.270 -3.948 1.00 0.00 C ATOM 1394 C GLN A 91 12.325 -19.901 -5.138 1.00 0.00 C ATOM 1395 O GLN A 91 13.145 -20.712 -5.593 1.00 0.00 O ATOM 1396 CB GLN A 91 10.223 -21.090 -4.385 1.00 0.00 C ATOM 1397 CG GLN A 91 9.268 -20.351 -5.290 1.00 0.00 C ATOM 1398 CD GLN A 91 7.998 -21.123 -5.552 1.00 0.00 C ATOM 1399 OE1 GLN A 91 7.909 -21.907 -6.497 1.00 0.00 O ATOM 1400 NE2 GLN A 91 7.011 -20.915 -4.713 1.00 0.00 N ATOM 0 H GLN A 91 10.065 -18.839 -3.228 1.00 0.00 H new ATOM 0 HA GLN A 91 12.028 -20.904 -3.284 1.00 0.00 H new ATOM 0 HB2 GLN A 91 10.569 -21.988 -4.897 1.00 0.00 H new ATOM 0 HB3 GLN A 91 9.683 -21.418 -3.497 1.00 0.00 H new ATOM 0 HG2 GLN A 91 9.018 -19.390 -4.840 1.00 0.00 H new ATOM 0 HG3 GLN A 91 9.762 -20.140 -6.238 1.00 0.00 H new ATOM 0 HE21 GLN A 91 7.127 -20.256 -3.943 1.00 0.00 H new ATOM 0 HE22 GLN A 91 6.128 -21.412 -4.831 1.00 0.00 H new ATOM 1409 N ALA A 92 12.168 -18.682 -5.641 1.00 0.00 N ATOM 1410 CA ALA A 92 13.034 -18.206 -6.702 1.00 0.00 C ATOM 1411 C ALA A 92 14.373 -17.802 -6.111 1.00 0.00 C ATOM 1412 O ALA A 92 15.430 -18.018 -6.711 1.00 0.00 O ATOM 1413 CB ALA A 92 12.392 -17.044 -7.465 1.00 0.00 C ATOM 0 H ALA A 92 11.458 -18.017 -5.334 1.00 0.00 H new ATOM 0 HA ALA A 92 13.190 -19.010 -7.421 1.00 0.00 H new ATOM 0 HB1 ALA A 92 13.066 -16.710 -8.254 1.00 0.00 H new ATOM 0 HB2 ALA A 92 11.452 -17.374 -7.907 1.00 0.00 H new ATOM 0 HB3 ALA A 92 12.200 -16.220 -6.778 1.00 0.00 H new ATOM 1419 N GLY A 93 14.310 -17.246 -4.928 1.00 0.00 N ATOM 1420 CA GLY A 93 15.486 -16.862 -4.213 1.00 0.00 C ATOM 1421 C GLY A 93 15.873 -15.443 -4.466 1.00 0.00 C ATOM 1422 O GLY A 93 16.997 -15.146 -4.880 1.00 0.00 O ATOM 0 H GLY A 93 13.437 -17.049 -4.438 1.00 0.00 H new ATOM 0 HA2 GLY A 93 15.321 -17.005 -3.145 1.00 0.00 H new ATOM 0 HA3 GLY A 93 16.310 -17.516 -4.498 1.00 0.00 H new ATOM 1426 N ASN A 94 14.924 -14.567 -4.289 1.00 0.00 N ATOM 1427 CA ASN A 94 15.181 -13.150 -4.391 1.00 0.00 C ATOM 1428 C ASN A 94 15.258 -12.617 -2.993 1.00 0.00 C ATOM 1429 O ASN A 94 14.527 -13.097 -2.118 1.00 0.00 O ATOM 1430 CB ASN A 94 14.073 -12.387 -5.186 1.00 0.00 C ATOM 1431 CG ASN A 94 14.111 -12.625 -6.692 1.00 0.00 C ATOM 1432 OD1 ASN A 94 14.800 -11.928 -7.404 1.00 0.00 O ATOM 1433 ND2 ASN A 94 13.342 -13.555 -7.190 1.00 0.00 N ATOM 0 H ASN A 94 13.957 -14.808 -4.072 1.00 0.00 H new ATOM 0 HA ASN A 94 16.110 -12.997 -4.941 1.00 0.00 H new ATOM 0 HB2 ASN A 94 13.096 -12.687 -4.806 1.00 0.00 H new ATOM 0 HB3 ASN A 94 14.175 -11.319 -4.995 1.00 0.00 H new ATOM 0 HD21 ASN A 94 13.313 -13.707 -8.198 1.00 0.00 H new ATOM 0 HD22 ASN A 94 12.770 -14.130 -6.571 1.00 0.00 H new ATOM 1440 N GLY A 95 16.108 -11.646 -2.772 1.00 0.00 N ATOM 1441 CA GLY A 95 16.273 -11.052 -1.455 1.00 0.00 C ATOM 1442 C GLY A 95 15.093 -10.168 -1.045 1.00 0.00 C ATOM 1443 O GLY A 95 15.266 -8.995 -0.722 1.00 0.00 O ATOM 0 H GLY A 95 16.706 -11.241 -3.492 1.00 0.00 H new ATOM 0 HA2 GLY A 95 16.399 -11.845 -0.718 1.00 0.00 H new ATOM 0 HA3 GLY A 95 17.187 -10.458 -1.443 1.00 0.00 H new ATOM 1447 N TRP A 96 13.901 -10.741 -1.060 1.00 0.00 N ATOM 1448 CA TRP A 96 12.697 -10.083 -0.677 1.00 0.00 C ATOM 1449 C TRP A 96 11.948 -10.936 0.248 1.00 0.00 C ATOM 1450 O TRP A 96 12.119 -12.150 0.246 1.00 0.00 O ATOM 1451 CB TRP A 96 11.835 -9.601 -1.852 1.00 0.00 C ATOM 1452 CG TRP A 96 12.494 -8.470 -2.521 1.00 0.00 C ATOM 1453 CD1 TRP A 96 12.896 -7.325 -1.920 1.00 0.00 C ATOM 1454 CD2 TRP A 96 12.855 -8.369 -3.881 1.00 0.00 C ATOM 1455 NE1 TRP A 96 13.532 -6.532 -2.802 1.00 0.00 N ATOM 1456 CE2 TRP A 96 13.504 -7.133 -4.040 1.00 0.00 C ATOM 1457 CE3 TRP A 96 12.697 -9.205 -4.986 1.00 0.00 C ATOM 1458 CZ2 TRP A 96 14.009 -6.715 -5.272 1.00 0.00 C ATOM 1459 CZ3 TRP A 96 13.182 -8.796 -6.202 1.00 0.00 C ATOM 1460 CH2 TRP A 96 13.831 -7.557 -6.340 1.00 0.00 C ATOM 0 H TRP A 96 13.757 -11.708 -1.351 1.00 0.00 H new ATOM 0 HA TRP A 96 12.984 -9.162 -0.169 1.00 0.00 H new ATOM 0 HB2 TRP A 96 11.681 -10.415 -2.560 1.00 0.00 H new ATOM 0 HB3 TRP A 96 10.851 -9.300 -1.494 1.00 0.00 H new ATOM 0 HD1 TRP A 96 12.730 -7.083 -0.881 1.00 0.00 H new ATOM 0 HE1 TRP A 96 13.964 -5.633 -2.588 1.00 0.00 H new ATOM 0 HE3 TRP A 96 12.201 -10.159 -4.886 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 14.518 -5.769 -5.380 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 13.064 -9.435 -7.065 1.00 0.00 H new ATOM 0 HH2 TRP A 96 14.199 -7.261 -7.311 1.00 0.00 H new ATOM 1471 N ASP A 97 11.083 -10.339 0.975 1.00 0.00 N ATOM 1472 CA ASP A 97 10.473 -11.021 2.100 1.00 0.00 C ATOM 1473 C ASP A 97 8.990 -10.782 2.169 1.00 0.00 C ATOM 1474 O ASP A 97 8.502 -9.744 1.700 1.00 0.00 O ATOM 1475 CB ASP A 97 11.164 -10.594 3.402 1.00 0.00 C ATOM 1476 CG ASP A 97 10.467 -11.112 4.618 1.00 0.00 C ATOM 1477 OD1 ASP A 97 10.380 -12.327 4.788 1.00 0.00 O ATOM 1478 OD2 ASP A 97 9.917 -10.306 5.371 1.00 0.00 O ATOM 0 H ASP A 97 10.767 -9.380 0.829 1.00 0.00 H new ATOM 0 HA ASP A 97 10.609 -12.093 1.960 1.00 0.00 H new ATOM 0 HB2 ASP A 97 12.193 -10.952 3.397 1.00 0.00 H new ATOM 0 HB3 ASP A 97 11.205 -9.506 3.447 1.00 0.00 H new ATOM 1483 N PHE A 98 8.274 -11.717 2.784 1.00 0.00 N ATOM 1484 CA PHE A 98 6.849 -11.642 2.854 1.00 0.00 C ATOM 1485 C PHE A 98 6.364 -10.627 3.864 1.00 0.00 C ATOM 1486 O PHE A 98 5.215 -10.266 3.840 1.00 0.00 O ATOM 1487 CB PHE A 98 6.134 -13.007 2.954 1.00 0.00 C ATOM 1488 CG PHE A 98 6.068 -13.648 4.283 1.00 0.00 C ATOM 1489 CD1 PHE A 98 4.993 -13.385 5.109 1.00 0.00 C ATOM 1490 CD2 PHE A 98 7.034 -14.529 4.697 1.00 0.00 C ATOM 1491 CE1 PHE A 98 4.883 -13.975 6.325 1.00 0.00 C ATOM 1492 CE2 PHE A 98 6.937 -15.141 5.919 1.00 0.00 C ATOM 1493 CZ PHE A 98 5.858 -14.861 6.748 1.00 0.00 C ATOM 0 H PHE A 98 8.677 -12.536 3.240 1.00 0.00 H new ATOM 0 HA PHE A 98 6.544 -11.264 1.878 1.00 0.00 H new ATOM 0 HB2 PHE A 98 5.114 -12.879 2.591 1.00 0.00 H new ATOM 0 HB3 PHE A 98 6.631 -13.697 2.272 1.00 0.00 H new ATOM 0 HD1 PHE A 98 4.227 -12.698 4.781 1.00 0.00 H new ATOM 0 HD2 PHE A 98 7.877 -14.742 4.056 1.00 0.00 H new ATOM 0 HE1 PHE A 98 4.038 -13.754 6.960 1.00 0.00 H new ATOM 0 HE2 PHE A 98 7.697 -15.839 6.237 1.00 0.00 H new ATOM 0 HZ PHE A 98 5.781 -15.332 7.717 1.00 0.00 H new ATOM 1503 N ASP A 99 7.209 -10.232 4.806 1.00 0.00 N ATOM 1504 CA ASP A 99 6.826 -9.120 5.704 1.00 0.00 C ATOM 1505 C ASP A 99 7.009 -7.803 5.020 1.00 0.00 C ATOM 1506 O ASP A 99 6.214 -6.881 5.214 1.00 0.00 O ATOM 1507 CB ASP A 99 7.563 -9.082 7.044 1.00 0.00 C ATOM 1508 CG ASP A 99 6.996 -10.021 8.065 1.00 0.00 C ATOM 1509 OD1 ASP A 99 6.076 -9.609 8.790 1.00 0.00 O ATOM 1510 OD2 ASP A 99 7.474 -11.149 8.195 1.00 0.00 O ATOM 0 H ASP A 99 8.130 -10.636 4.976 1.00 0.00 H new ATOM 0 HA ASP A 99 5.777 -9.307 5.933 1.00 0.00 H new ATOM 0 HB2 ASP A 99 8.612 -9.327 6.880 1.00 0.00 H new ATOM 0 HB3 ASP A 99 7.531 -8.066 7.439 1.00 0.00 H new ATOM 1515 N MET A 100 8.085 -7.689 4.241 1.00 0.00 N ATOM 1516 CA MET A 100 8.323 -6.463 3.469 1.00 0.00 C ATOM 1517 C MET A 100 7.250 -6.312 2.385 1.00 0.00 C ATOM 1518 O MET A 100 6.830 -5.205 2.054 1.00 0.00 O ATOM 1519 CB MET A 100 9.757 -6.372 2.861 1.00 0.00 C ATOM 1520 CG MET A 100 10.887 -6.400 3.881 1.00 0.00 C ATOM 1521 SD MET A 100 12.523 -6.079 3.150 1.00 0.00 S ATOM 1522 CE MET A 100 12.709 -7.432 1.989 1.00 0.00 C ATOM 0 H MET A 100 8.794 -8.413 4.127 1.00 0.00 H new ATOM 0 HA MET A 100 8.253 -5.631 4.170 1.00 0.00 H new ATOM 0 HB2 MET A 100 9.894 -7.200 2.165 1.00 0.00 H new ATOM 0 HB3 MET A 100 9.833 -5.452 2.281 1.00 0.00 H new ATOM 0 HG2 MET A 100 10.689 -5.656 4.653 1.00 0.00 H new ATOM 0 HG3 MET A 100 10.900 -7.373 4.372 1.00 0.00 H new ATOM 0 HE1 MET A 100 13.609 -7.279 1.393 1.00 0.00 H new ATOM 0 HE2 MET A 100 12.791 -8.372 2.535 1.00 0.00 H new ATOM 0 HE3 MET A 100 11.841 -7.469 1.331 1.00 0.00 H new ATOM 1532 N LEU A 101 6.810 -7.429 1.845 1.00 0.00 N ATOM 1533 CA LEU A 101 5.722 -7.416 0.905 1.00 0.00 C ATOM 1534 C LEU A 101 4.422 -7.797 1.587 1.00 0.00 C ATOM 1535 O LEU A 101 4.034 -8.963 1.593 1.00 0.00 O ATOM 1536 CB LEU A 101 5.996 -8.355 -0.288 1.00 0.00 C ATOM 1537 CG LEU A 101 4.807 -8.614 -1.240 1.00 0.00 C ATOM 1538 CD1 LEU A 101 4.310 -7.357 -1.906 1.00 0.00 C ATOM 1539 CD2 LEU A 101 5.150 -9.671 -2.248 1.00 0.00 C ATOM 0 H LEU A 101 7.192 -8.354 2.044 1.00 0.00 H new ATOM 0 HA LEU A 101 5.632 -6.401 0.519 1.00 0.00 H new ATOM 0 HB2 LEU A 101 6.817 -7.937 -0.871 1.00 0.00 H new ATOM 0 HB3 LEU A 101 6.338 -9.314 0.102 1.00 0.00 H new ATOM 0 HG LEU A 101 3.984 -8.980 -0.627 1.00 0.00 H new ATOM 0 HD11 LEU A 101 3.475 -7.599 -2.563 1.00 0.00 H new ATOM 0 HD12 LEU A 101 3.980 -6.649 -1.146 1.00 0.00 H new ATOM 0 HD13 LEU A 101 5.115 -6.913 -2.491 1.00 0.00 H new ATOM 0 HD21 LEU A 101 4.297 -9.836 -2.907 1.00 0.00 H new ATOM 0 HD22 LEU A 101 6.007 -9.347 -2.838 1.00 0.00 H new ATOM 0 HD23 LEU A 101 5.395 -10.600 -1.732 1.00 0.00 H new ATOM 1551 N THR A 102 3.820 -6.796 2.204 1.00 0.00 N ATOM 1552 CA THR A 102 2.511 -6.804 2.827 1.00 0.00 C ATOM 1553 C THR A 102 2.598 -5.768 3.945 1.00 0.00 C ATOM 1554 O THR A 102 3.559 -4.993 3.974 1.00 0.00 O ATOM 1555 CB THR A 102 2.085 -8.204 3.424 1.00 0.00 C ATOM 1556 OG1 THR A 102 0.675 -8.204 3.739 1.00 0.00 O ATOM 1557 CG2 THR A 102 2.875 -8.576 4.679 1.00 0.00 C ATOM 0 H THR A 102 4.271 -5.885 2.288 1.00 0.00 H new ATOM 0 HA THR A 102 1.751 -6.582 2.078 1.00 0.00 H new ATOM 0 HB THR A 102 2.305 -8.948 2.658 1.00 0.00 H new ATOM 0 HG1 THR A 102 0.253 -7.410 3.350 1.00 0.00 H new ATOM 0 HG21 THR A 102 2.540 -9.547 5.045 1.00 0.00 H new ATOM 0 HG22 THR A 102 3.937 -8.625 4.439 1.00 0.00 H new ATOM 0 HG23 THR A 102 2.712 -7.822 5.449 1.00 0.00 H new ATOM 1565 N GLY A 103 1.643 -5.767 4.857 1.00 0.00 N ATOM 1566 CA GLY A 103 1.683 -4.867 5.985 1.00 0.00 C ATOM 1567 C GLY A 103 2.339 -5.539 7.153 1.00 0.00 C ATOM 1568 O GLY A 103 1.859 -5.422 8.279 1.00 0.00 O ATOM 0 H GLY A 103 0.830 -6.383 4.835 1.00 0.00 H new ATOM 0 HA2 GLY A 103 2.231 -3.963 5.720 1.00 0.00 H new ATOM 0 HA3 GLY A 103 0.672 -4.560 6.252 1.00 0.00 H new ATOM 1572 N SER A 104 3.465 -6.205 6.864 1.00 0.00 N ATOM 1573 CA SER A 104 4.228 -7.039 7.761 1.00 0.00 C ATOM 1574 C SER A 104 3.388 -7.884 8.740 1.00 0.00 C ATOM 1575 O SER A 104 2.931 -8.978 8.394 1.00 0.00 O ATOM 1576 CB SER A 104 5.335 -6.244 8.447 1.00 0.00 C ATOM 1577 OG SER A 104 6.138 -7.043 9.331 1.00 0.00 O ATOM 0 H SER A 104 3.882 -6.163 5.934 1.00 0.00 H new ATOM 0 HA SER A 104 4.702 -7.790 7.130 1.00 0.00 H new ATOM 0 HB2 SER A 104 5.977 -5.796 7.688 1.00 0.00 H new ATOM 0 HB3 SER A 104 4.890 -5.425 9.011 1.00 0.00 H new ATOM 0 HG SER A 104 6.132 -7.974 9.026 1.00 0.00 H new ATOM 1583 N GLY A 105 3.143 -7.353 9.914 1.00 0.00 N ATOM 1584 CA GLY A 105 2.522 -8.094 10.965 1.00 0.00 C ATOM 1585 C GLY A 105 3.554 -8.432 12.010 1.00 0.00 C ATOM 1586 O GLY A 105 3.224 -8.811 13.135 1.00 0.00 O ATOM 0 H GLY A 105 3.373 -6.390 10.160 1.00 0.00 H new ATOM 0 HA2 GLY A 105 1.715 -7.511 11.409 1.00 0.00 H new ATOM 0 HA3 GLY A 105 2.076 -9.006 10.569 1.00 0.00 H new ATOM 1590 N ASN A 106 4.810 -8.286 11.635 1.00 0.00 N ATOM 1591 CA ASN A 106 5.905 -8.555 12.535 1.00 0.00 C ATOM 1592 C ASN A 106 6.588 -7.252 12.977 1.00 0.00 C ATOM 1593 O ASN A 106 6.937 -7.103 14.158 1.00 0.00 O ATOM 1594 CB ASN A 106 6.927 -9.548 11.917 1.00 0.00 C ATOM 1595 CG ASN A 106 8.074 -9.918 12.866 1.00 0.00 C ATOM 1596 OD1 ASN A 106 7.907 -9.970 14.098 1.00 0.00 O ATOM 1597 ND2 ASN A 106 9.230 -10.184 12.312 1.00 0.00 N ATOM 0 H ASN A 106 5.095 -7.980 10.705 1.00 0.00 H new ATOM 0 HA ASN A 106 5.490 -9.033 13.422 1.00 0.00 H new ATOM 0 HB2 ASN A 106 6.404 -10.457 11.621 1.00 0.00 H new ATOM 0 HB3 ASN A 106 7.344 -9.110 11.010 1.00 0.00 H new ATOM 0 HD21 ASN A 106 10.027 -10.443 12.894 1.00 0.00 H new ATOM 0 HD22 ASN A 106 9.334 -10.132 11.299 1.00 0.00 H new ATOM 1604 N TYR A 107 6.775 -6.295 12.047 1.00 0.00 N ATOM 1605 CA TYR A 107 7.406 -5.017 12.411 1.00 0.00 C ATOM 1606 C TYR A 107 7.028 -3.851 11.464 1.00 0.00 C ATOM 1607 O TYR A 107 6.800 -2.739 11.920 1.00 0.00 O ATOM 1608 CB TYR A 107 8.953 -5.162 12.547 1.00 0.00 C ATOM 1609 CG TYR A 107 9.696 -5.649 11.299 1.00 0.00 C ATOM 1610 CD1 TYR A 107 10.178 -4.750 10.352 1.00 0.00 C ATOM 1611 CD2 TYR A 107 9.914 -7.004 11.074 1.00 0.00 C ATOM 1612 CE1 TYR A 107 10.840 -5.176 9.225 1.00 0.00 C ATOM 1613 CE2 TYR A 107 10.582 -7.436 9.940 1.00 0.00 C ATOM 1614 CZ TYR A 107 11.039 -6.510 9.018 1.00 0.00 C ATOM 1615 OH TYR A 107 11.714 -6.921 7.890 1.00 0.00 O ATOM 0 H TYR A 107 6.506 -6.380 11.067 1.00 0.00 H new ATOM 0 HA TYR A 107 7.002 -4.752 13.388 1.00 0.00 H new ATOM 0 HB2 TYR A 107 9.364 -4.195 12.836 1.00 0.00 H new ATOM 0 HB3 TYR A 107 9.162 -5.854 13.363 1.00 0.00 H new ATOM 0 HD1 TYR A 107 10.028 -3.692 10.506 1.00 0.00 H new ATOM 0 HD2 TYR A 107 9.558 -7.728 11.792 1.00 0.00 H new ATOM 0 HE1 TYR A 107 11.202 -4.457 8.505 1.00 0.00 H new ATOM 0 HE2 TYR A 107 10.746 -8.491 9.776 1.00 0.00 H new ATOM 0 HH TYR A 107 11.777 -7.899 7.885 1.00 0.00 H new ATOM 1625 N SER A 108 6.983 -4.133 10.160 1.00 0.00 N ATOM 1626 CA SER A 108 6.643 -3.153 9.103 1.00 0.00 C ATOM 1627 C SER A 108 7.584 -1.948 9.093 1.00 0.00 C ATOM 1628 O SER A 108 7.243 -0.870 9.587 1.00 0.00 O ATOM 1629 CB SER A 108 5.156 -2.704 9.170 1.00 0.00 C ATOM 1630 OG SER A 108 4.844 -1.752 8.160 1.00 0.00 O ATOM 0 H SER A 108 7.184 -5.063 9.793 1.00 0.00 H new ATOM 0 HA SER A 108 6.783 -3.676 8.157 1.00 0.00 H new ATOM 0 HB2 SER A 108 4.509 -3.574 9.061 1.00 0.00 H new ATOM 0 HB3 SER A 108 4.950 -2.274 10.150 1.00 0.00 H new ATOM 0 HG SER A 108 4.959 -0.847 8.517 1.00 0.00 H new ATOM 1636 N SER A 109 8.804 -2.168 8.637 1.00 0.00 N ATOM 1637 CA SER A 109 9.751 -1.119 8.514 1.00 0.00 C ATOM 1638 C SER A 109 9.389 -0.164 7.403 1.00 0.00 C ATOM 1639 O SER A 109 9.408 -0.499 6.198 1.00 0.00 O ATOM 1640 CB SER A 109 11.175 -1.666 8.336 1.00 0.00 C ATOM 1641 OG SER A 109 12.134 -0.618 8.165 1.00 0.00 O ATOM 0 H SER A 109 9.148 -3.083 8.347 1.00 0.00 H new ATOM 0 HA SER A 109 9.727 -0.555 9.447 1.00 0.00 H new ATOM 0 HB2 SER A 109 11.444 -2.266 9.205 1.00 0.00 H new ATOM 0 HB3 SER A 109 11.204 -2.328 7.471 1.00 0.00 H new ATOM 0 HG SER A 109 13.027 -1.006 8.057 1.00 0.00 H new ATOM 1647 N THR A 110 9.027 1.009 7.826 1.00 0.00 N ATOM 1648 CA THR A 110 8.786 2.129 6.976 1.00 0.00 C ATOM 1649 C THR A 110 10.132 2.519 6.298 1.00 0.00 C ATOM 1650 O THR A 110 10.196 2.942 5.107 1.00 0.00 O ATOM 1651 CB THR A 110 8.279 3.265 7.902 1.00 0.00 C ATOM 1652 OG1 THR A 110 7.179 2.742 8.684 1.00 0.00 O ATOM 1653 CG2 THR A 110 7.792 4.475 7.133 1.00 0.00 C ATOM 0 H THR A 110 8.886 1.218 8.814 1.00 0.00 H new ATOM 0 HA THR A 110 8.056 1.924 6.193 1.00 0.00 H new ATOM 0 HB THR A 110 9.112 3.590 8.525 1.00 0.00 H new ATOM 0 HG1 THR A 110 6.840 3.442 9.281 1.00 0.00 H new ATOM 0 HG21 THR A 110 7.449 5.237 7.833 1.00 0.00 H new ATOM 0 HG22 THR A 110 8.607 4.876 6.531 1.00 0.00 H new ATOM 0 HG23 THR A 110 6.968 4.184 6.481 1.00 0.00 H new ATOM 1661 N ASP A 111 11.195 2.247 7.035 1.00 0.00 N ATOM 1662 CA ASP A 111 12.537 2.575 6.640 1.00 0.00 C ATOM 1663 C ASP A 111 12.954 1.703 5.472 1.00 0.00 C ATOM 1664 O ASP A 111 13.457 2.202 4.476 1.00 0.00 O ATOM 1665 CB ASP A 111 13.495 2.371 7.794 1.00 0.00 C ATOM 1666 CG ASP A 111 14.809 3.089 7.594 1.00 0.00 C ATOM 1667 OD1 ASP A 111 15.689 2.598 6.861 1.00 0.00 O ATOM 1668 OD2 ASP A 111 14.993 4.151 8.206 1.00 0.00 O ATOM 0 H ASP A 111 11.139 1.783 7.941 1.00 0.00 H new ATOM 0 HA ASP A 111 12.566 3.623 6.342 1.00 0.00 H new ATOM 0 HB2 ASP A 111 13.029 2.724 8.714 1.00 0.00 H new ATOM 0 HB3 ASP A 111 13.684 1.305 7.920 1.00 0.00 H new ATOM 1673 N ALA A 112 12.655 0.408 5.563 1.00 0.00 N ATOM 1674 CA ALA A 112 13.009 -0.557 4.527 1.00 0.00 C ATOM 1675 C ALA A 112 12.410 -0.164 3.182 1.00 0.00 C ATOM 1676 O ALA A 112 13.015 -0.374 2.131 1.00 0.00 O ATOM 1677 CB ALA A 112 12.559 -1.950 4.915 1.00 0.00 C ATOM 0 H ALA A 112 12.161 0.000 6.357 1.00 0.00 H new ATOM 0 HA ALA A 112 14.095 -0.556 4.430 1.00 0.00 H new ATOM 0 HB1 ALA A 112 12.833 -2.653 4.129 1.00 0.00 H new ATOM 0 HB2 ALA A 112 13.042 -2.242 5.847 1.00 0.00 H new ATOM 0 HB3 ALA A 112 11.477 -1.959 5.049 1.00 0.00 H new ATOM 1683 N GLN A 113 11.230 0.435 3.220 1.00 0.00 N ATOM 1684 CA GLN A 113 10.606 0.918 2.014 1.00 0.00 C ATOM 1685 C GLN A 113 11.311 2.174 1.516 1.00 0.00 C ATOM 1686 O GLN A 113 11.284 2.461 0.348 1.00 0.00 O ATOM 1687 CB GLN A 113 9.118 1.169 2.256 1.00 0.00 C ATOM 1688 CG GLN A 113 8.351 1.859 1.101 1.00 0.00 C ATOM 1689 CD GLN A 113 8.253 3.407 1.207 1.00 0.00 C ATOM 1690 OE1 GLN A 113 9.175 4.068 1.907 1.00 0.00 O flip ATOM 1691 NE2 GLN A 113 7.320 4.004 0.698 1.00 0.00 N flip ATOM 0 H GLN A 113 10.693 0.594 4.072 1.00 0.00 H new ATOM 0 HA GLN A 113 10.697 0.159 1.237 1.00 0.00 H new ATOM 0 HB2 GLN A 113 8.638 0.213 2.465 1.00 0.00 H new ATOM 0 HB3 GLN A 113 9.014 1.781 3.152 1.00 0.00 H new ATOM 0 HG2 GLN A 113 8.838 1.605 0.159 1.00 0.00 H new ATOM 0 HG3 GLN A 113 7.342 1.449 1.059 1.00 0.00 H new ATOM 0 HE21 GLN A 113 6.618 3.492 0.164 1.00 0.00 H new ATOM 0 HE22 GLN A 113 7.242 5.015 0.806 1.00 0.00 H new ATOM 1700 N MET A 114 11.910 2.961 2.427 1.00 0.00 N ATOM 1701 CA MET A 114 12.665 4.162 2.000 1.00 0.00 C ATOM 1702 C MET A 114 13.789 3.732 1.078 1.00 0.00 C ATOM 1703 O MET A 114 14.109 4.402 0.113 1.00 0.00 O ATOM 1704 CB MET A 114 13.222 4.948 3.188 1.00 0.00 C ATOM 1705 CG MET A 114 14.167 6.074 2.769 1.00 0.00 C ATOM 1706 SD MET A 114 14.796 7.032 4.148 1.00 0.00 S ATOM 1707 CE MET A 114 15.673 5.760 5.058 1.00 0.00 C ATOM 0 H MET A 114 11.891 2.799 3.434 1.00 0.00 H new ATOM 0 HA MET A 114 11.981 4.829 1.475 1.00 0.00 H new ATOM 0 HB2 MET A 114 12.394 5.369 3.758 1.00 0.00 H new ATOM 0 HB3 MET A 114 13.752 4.265 3.852 1.00 0.00 H new ATOM 0 HG2 MET A 114 15.007 5.647 2.221 1.00 0.00 H new ATOM 0 HG3 MET A 114 13.644 6.740 2.083 1.00 0.00 H new ATOM 0 HE1 MET A 114 16.374 6.226 5.750 1.00 0.00 H new ATOM 0 HE2 MET A 114 14.959 5.155 5.617 1.00 0.00 H new ATOM 0 HE3 MET A 114 16.219 5.125 4.361 1.00 0.00 H new ATOM 1717 N GLN A 115 14.355 2.579 1.358 1.00 0.00 N ATOM 1718 CA GLN A 115 15.342 2.025 0.447 1.00 0.00 C ATOM 1719 C GLN A 115 14.696 0.889 -0.366 1.00 0.00 C ATOM 1720 O GLN A 115 15.323 -0.147 -0.603 1.00 0.00 O ATOM 1721 CB GLN A 115 16.634 1.522 1.165 1.00 0.00 C ATOM 1722 CG GLN A 115 16.413 0.420 2.191 1.00 0.00 C ATOM 1723 CD GLN A 115 16.339 0.901 3.618 1.00 0.00 C ATOM 1724 OE1 GLN A 115 16.011 2.151 3.805 1.00 0.00 O flip ATOM 1725 NE2 GLN A 115 16.658 0.153 4.546 1.00 0.00 N flip ATOM 0 H GLN A 115 14.159 2.016 2.186 1.00 0.00 H new ATOM 0 HA GLN A 115 15.664 2.829 -0.215 1.00 0.00 H new ATOM 0 HB2 GLN A 115 17.333 1.161 0.411 1.00 0.00 H new ATOM 0 HB3 GLN A 115 17.109 2.369 1.660 1.00 0.00 H new ATOM 0 HG2 GLN A 115 15.489 -0.104 1.949 1.00 0.00 H new ATOM 0 HG3 GLN A 115 17.222 -0.305 2.107 1.00 0.00 H new ATOM 0 HE21 GLN A 115 16.907 -0.818 4.356 1.00 0.00 H new ATOM 0 HE22 GLN A 115 16.672 0.505 5.503 1.00 0.00 H new ATOM 1734 N TYR A 116 13.426 1.091 -0.788 1.00 0.00 N ATOM 1735 CA TYR A 116 12.690 0.109 -1.541 1.00 0.00 C ATOM 1736 C TYR A 116 13.503 -0.336 -2.732 1.00 0.00 C ATOM 1737 O TYR A 116 14.098 0.503 -3.440 1.00 0.00 O ATOM 1738 CB TYR A 116 11.314 0.660 -2.065 1.00 0.00 C ATOM 1739 CG TYR A 116 11.359 1.879 -3.023 1.00 0.00 C ATOM 1740 CD1 TYR A 116 11.563 1.713 -4.399 1.00 0.00 C ATOM 1741 CD2 TYR A 116 11.160 3.185 -2.554 1.00 0.00 C ATOM 1742 CE1 TYR A 116 11.578 2.788 -5.266 1.00 0.00 C ATOM 1743 CE2 TYR A 116 11.164 4.262 -3.429 1.00 0.00 C ATOM 1744 CZ TYR A 116 11.375 4.051 -4.777 1.00 0.00 C ATOM 1745 OH TYR A 116 11.374 5.119 -5.645 1.00 0.00 O ATOM 0 H TYR A 116 12.903 1.947 -0.604 1.00 0.00 H new ATOM 0 HA TYR A 116 12.493 -0.723 -0.865 1.00 0.00 H new ATOM 0 HB2 TYR A 116 10.797 -0.152 -2.576 1.00 0.00 H new ATOM 0 HB3 TYR A 116 10.707 0.931 -1.201 1.00 0.00 H new ATOM 0 HD1 TYR A 116 11.712 0.718 -4.792 1.00 0.00 H new ATOM 0 HD2 TYR A 116 11.002 3.355 -1.499 1.00 0.00 H new ATOM 0 HE1 TYR A 116 11.748 2.634 -6.321 1.00 0.00 H new ATOM 0 HE2 TYR A 116 11.002 5.263 -3.056 1.00 0.00 H new ATOM 0 HH TYR A 116 11.441 5.954 -5.136 1.00 0.00 H new ATOM 1755 N ASP A 117 13.601 -1.609 -2.934 1.00 0.00 N ATOM 1756 CA ASP A 117 14.241 -2.094 -4.139 1.00 0.00 C ATOM 1757 C ASP A 117 13.223 -1.975 -5.241 1.00 0.00 C ATOM 1758 O ASP A 117 12.035 -2.132 -4.976 1.00 0.00 O ATOM 1759 CB ASP A 117 14.638 -3.572 -4.032 1.00 0.00 C ATOM 1760 CG ASP A 117 15.570 -3.903 -2.889 1.00 0.00 C ATOM 1761 OD1 ASP A 117 16.795 -3.748 -3.033 1.00 0.00 O ATOM 1762 OD2 ASP A 117 15.080 -4.346 -1.828 1.00 0.00 O ATOM 0 H ASP A 117 13.257 -2.331 -2.300 1.00 0.00 H new ATOM 0 HA ASP A 117 15.147 -1.515 -4.318 1.00 0.00 H new ATOM 0 HB2 ASP A 117 13.732 -4.169 -3.927 1.00 0.00 H new ATOM 0 HB3 ASP A 117 15.112 -3.874 -4.966 1.00 0.00 H new ATOM 1767 N PRO A 118 13.634 -1.695 -6.476 1.00 0.00 N ATOM 1768 CA PRO A 118 12.711 -1.599 -7.643 1.00 0.00 C ATOM 1769 C PRO A 118 11.773 -2.815 -7.792 1.00 0.00 C ATOM 1770 O PRO A 118 10.629 -2.681 -8.226 1.00 0.00 O ATOM 1771 CB PRO A 118 13.668 -1.552 -8.810 1.00 0.00 C ATOM 1772 CG PRO A 118 14.868 -0.863 -8.265 1.00 0.00 C ATOM 1773 CD PRO A 118 15.022 -1.374 -6.863 1.00 0.00 C ATOM 0 HA PRO A 118 12.040 -0.745 -7.553 1.00 0.00 H new ATOM 0 HB2 PRO A 118 13.911 -2.553 -9.168 1.00 0.00 H new ATOM 0 HB3 PRO A 118 13.243 -1.007 -9.653 1.00 0.00 H new ATOM 0 HG2 PRO A 118 15.752 -1.084 -8.862 1.00 0.00 H new ATOM 0 HG3 PRO A 118 14.738 0.219 -8.276 1.00 0.00 H new ATOM 0 HD2 PRO A 118 15.667 -2.252 -6.821 1.00 0.00 H new ATOM 0 HD3 PRO A 118 15.462 -0.624 -6.205 1.00 0.00 H new ATOM 1781 N GLY A 119 12.230 -3.982 -7.347 1.00 0.00 N ATOM 1782 CA GLY A 119 11.438 -5.183 -7.488 1.00 0.00 C ATOM 1783 C GLY A 119 10.491 -5.320 -6.311 1.00 0.00 C ATOM 1784 O GLY A 119 9.388 -5.818 -6.439 1.00 0.00 O ATOM 0 H GLY A 119 13.134 -4.114 -6.893 1.00 0.00 H new ATOM 0 HA2 GLY A 119 10.872 -5.148 -8.419 1.00 0.00 H new ATOM 0 HA3 GLY A 119 12.090 -6.054 -7.544 1.00 0.00 H new ATOM 1788 N LEU A 120 10.936 -4.799 -5.203 1.00 0.00 N ATOM 1789 CA LEU A 120 10.147 -4.791 -3.988 1.00 0.00 C ATOM 1790 C LEU A 120 8.985 -3.805 -4.187 1.00 0.00 C ATOM 1791 O LEU A 120 7.839 -4.169 -4.008 1.00 0.00 O ATOM 1792 CB LEU A 120 11.030 -4.352 -2.828 1.00 0.00 C ATOM 1793 CG LEU A 120 10.373 -4.270 -1.445 1.00 0.00 C ATOM 1794 CD1 LEU A 120 9.730 -5.605 -1.061 1.00 0.00 C ATOM 1795 CD2 LEU A 120 11.418 -3.880 -0.411 1.00 0.00 C ATOM 0 H LEU A 120 11.855 -4.366 -5.109 1.00 0.00 H new ATOM 0 HA LEU A 120 9.752 -5.782 -3.767 1.00 0.00 H new ATOM 0 HB2 LEU A 120 11.871 -5.042 -2.763 1.00 0.00 H new ATOM 0 HB3 LEU A 120 11.440 -3.371 -3.067 1.00 0.00 H new ATOM 0 HG LEU A 120 9.588 -3.515 -1.477 1.00 0.00 H new ATOM 0 HD11 LEU A 120 9.272 -5.518 -0.076 1.00 0.00 H new ATOM 0 HD12 LEU A 120 8.967 -5.866 -1.794 1.00 0.00 H new ATOM 0 HD13 LEU A 120 10.493 -6.383 -1.039 1.00 0.00 H new ATOM 0 HD21 LEU A 120 10.952 -3.821 0.573 1.00 0.00 H new ATOM 0 HD22 LEU A 120 12.210 -4.629 -0.394 1.00 0.00 H new ATOM 0 HD23 LEU A 120 11.842 -2.910 -0.670 1.00 0.00 H new ATOM 1807 N PHE A 121 9.317 -2.561 -4.605 1.00 0.00 N ATOM 1808 CA PHE A 121 8.322 -1.507 -4.899 1.00 0.00 C ATOM 1809 C PHE A 121 7.280 -1.948 -5.937 1.00 0.00 C ATOM 1810 O PHE A 121 6.087 -1.723 -5.753 1.00 0.00 O ATOM 1811 CB PHE A 121 9.006 -0.205 -5.355 1.00 0.00 C ATOM 1812 CG PHE A 121 8.040 0.918 -5.652 1.00 0.00 C ATOM 1813 CD1 PHE A 121 7.306 1.505 -4.631 1.00 0.00 C ATOM 1814 CD2 PHE A 121 7.852 1.375 -6.948 1.00 0.00 C ATOM 1815 CE1 PHE A 121 6.407 2.530 -4.891 1.00 0.00 C ATOM 1816 CE2 PHE A 121 6.950 2.401 -7.213 1.00 0.00 C ATOM 1817 CZ PHE A 121 6.229 2.980 -6.186 1.00 0.00 C ATOM 0 H PHE A 121 10.282 -2.262 -4.747 1.00 0.00 H new ATOM 0 HA PHE A 121 7.792 -1.321 -3.965 1.00 0.00 H new ATOM 0 HB2 PHE A 121 9.700 0.121 -4.580 1.00 0.00 H new ATOM 0 HB3 PHE A 121 9.597 -0.409 -6.248 1.00 0.00 H new ATOM 0 HD1 PHE A 121 7.437 1.158 -3.617 1.00 0.00 H new ATOM 0 HD2 PHE A 121 8.411 0.931 -7.759 1.00 0.00 H new ATOM 0 HE1 PHE A 121 5.847 2.976 -4.082 1.00 0.00 H new ATOM 0 HE2 PHE A 121 6.813 2.747 -8.227 1.00 0.00 H new ATOM 0 HZ PHE A 121 5.532 3.778 -6.394 1.00 0.00 H new ATOM 1827 N ALA A 122 7.727 -2.582 -6.998 1.00 0.00 N ATOM 1828 CA ALA A 122 6.823 -3.018 -8.053 1.00 0.00 C ATOM 1829 C ALA A 122 5.819 -4.038 -7.530 1.00 0.00 C ATOM 1830 O ALA A 122 4.610 -3.895 -7.734 1.00 0.00 O ATOM 1831 CB ALA A 122 7.615 -3.597 -9.211 1.00 0.00 C ATOM 0 H ALA A 122 8.708 -2.810 -7.158 1.00 0.00 H new ATOM 0 HA ALA A 122 6.265 -2.151 -8.405 1.00 0.00 H new ATOM 0 HB1 ALA A 122 6.930 -3.920 -9.995 1.00 0.00 H new ATOM 0 HB2 ALA A 122 8.288 -2.837 -9.608 1.00 0.00 H new ATOM 0 HB3 ALA A 122 8.197 -4.451 -8.863 1.00 0.00 H new ATOM 1837 N GLN A 123 6.314 -5.042 -6.824 1.00 0.00 N ATOM 1838 CA GLN A 123 5.449 -6.070 -6.315 1.00 0.00 C ATOM 1839 C GLN A 123 4.549 -5.565 -5.195 1.00 0.00 C ATOM 1840 O GLN A 123 3.372 -5.935 -5.155 1.00 0.00 O ATOM 1841 CB GLN A 123 6.229 -7.319 -5.893 1.00 0.00 C ATOM 1842 CG GLN A 123 7.196 -7.116 -4.736 1.00 0.00 C ATOM 1843 CD GLN A 123 7.996 -8.350 -4.447 1.00 0.00 C ATOM 1844 OE1 GLN A 123 8.278 -9.133 -5.329 1.00 0.00 O ATOM 1845 NE2 GLN A 123 8.367 -8.542 -3.223 1.00 0.00 N ATOM 0 H GLN A 123 7.302 -5.158 -6.597 1.00 0.00 H new ATOM 0 HA GLN A 123 4.797 -6.361 -7.138 1.00 0.00 H new ATOM 0 HB2 GLN A 123 5.517 -8.098 -5.619 1.00 0.00 H new ATOM 0 HB3 GLN A 123 6.788 -7.687 -6.753 1.00 0.00 H new ATOM 0 HG2 GLN A 123 7.871 -6.293 -4.969 1.00 0.00 H new ATOM 0 HG3 GLN A 123 6.639 -6.829 -3.844 1.00 0.00 H new ATOM 0 HE21 GLN A 123 8.115 -7.866 -2.502 1.00 0.00 H new ATOM 0 HE22 GLN A 123 8.911 -9.369 -2.979 1.00 0.00 H new ATOM 1854 N ILE A 124 5.085 -4.708 -4.295 1.00 0.00 N ATOM 1855 CA ILE A 124 4.278 -4.185 -3.184 1.00 0.00 C ATOM 1856 C ILE A 124 3.119 -3.368 -3.680 1.00 0.00 C ATOM 1857 O ILE A 124 1.996 -3.516 -3.193 1.00 0.00 O ATOM 1858 CB ILE A 124 5.079 -3.388 -2.104 1.00 0.00 C ATOM 1859 CG1 ILE A 124 5.787 -2.164 -2.688 1.00 0.00 C ATOM 1860 CG2 ILE A 124 6.049 -4.297 -1.372 1.00 0.00 C ATOM 1861 CD1 ILE A 124 6.490 -1.288 -1.657 1.00 0.00 C ATOM 0 H ILE A 124 6.049 -4.375 -4.319 1.00 0.00 H new ATOM 0 HA ILE A 124 3.907 -5.077 -2.679 1.00 0.00 H new ATOM 0 HB ILE A 124 4.357 -3.010 -1.381 1.00 0.00 H new ATOM 0 HG12 ILE A 124 6.520 -2.500 -3.421 1.00 0.00 H new ATOM 0 HG13 ILE A 124 5.056 -1.558 -3.223 1.00 0.00 H new ATOM 0 HG21 ILE A 124 6.595 -3.720 -0.625 1.00 0.00 H new ATOM 0 HG22 ILE A 124 5.497 -5.097 -0.880 1.00 0.00 H new ATOM 0 HG23 ILE A 124 6.753 -4.727 -2.085 1.00 0.00 H new ATOM 0 HD11 ILE A 124 6.964 -0.445 -2.159 1.00 0.00 H new ATOM 0 HD12 ILE A 124 5.761 -0.918 -0.936 1.00 0.00 H new ATOM 0 HD13 ILE A 124 7.248 -1.874 -1.138 1.00 0.00 H new ATOM 1873 N GLN A 125 3.372 -2.564 -4.700 1.00 0.00 N ATOM 1874 CA GLN A 125 2.367 -1.705 -5.256 1.00 0.00 C ATOM 1875 C GLN A 125 1.242 -2.531 -5.867 1.00 0.00 C ATOM 1876 O GLN A 125 0.047 -2.329 -5.551 1.00 0.00 O ATOM 1877 CB GLN A 125 2.952 -0.819 -6.342 1.00 0.00 C ATOM 1878 CG GLN A 125 1.930 0.138 -6.874 1.00 0.00 C ATOM 1879 CD GLN A 125 2.351 0.847 -8.156 1.00 0.00 C ATOM 1880 OE1 GLN A 125 3.123 0.323 -8.964 1.00 0.00 O ATOM 1881 NE2 GLN A 125 1.828 2.019 -8.361 1.00 0.00 N ATOM 0 H GLN A 125 4.281 -2.496 -5.157 1.00 0.00 H new ATOM 0 HA GLN A 125 1.981 -1.085 -4.447 1.00 0.00 H new ATOM 0 HB2 GLN A 125 3.800 -0.263 -5.943 1.00 0.00 H new ATOM 0 HB3 GLN A 125 3.331 -1.439 -7.155 1.00 0.00 H new ATOM 0 HG2 GLN A 125 1.002 -0.403 -7.059 1.00 0.00 H new ATOM 0 HG3 GLN A 125 1.716 0.886 -6.111 1.00 0.00 H new ATOM 0 HE21 GLN A 125 1.194 2.422 -7.672 1.00 0.00 H new ATOM 0 HE22 GLN A 125 2.052 2.536 -9.211 1.00 0.00 H new ATOM 1890 N ALA A 126 1.638 -3.456 -6.727 1.00 0.00 N ATOM 1891 CA ALA A 126 0.714 -4.296 -7.455 1.00 0.00 C ATOM 1892 C ALA A 126 -0.149 -5.111 -6.511 1.00 0.00 C ATOM 1893 O ALA A 126 -1.366 -5.093 -6.613 1.00 0.00 O ATOM 1894 CB ALA A 126 1.472 -5.208 -8.396 1.00 0.00 C ATOM 0 H ALA A 126 2.618 -3.643 -6.938 1.00 0.00 H new ATOM 0 HA ALA A 126 0.055 -3.651 -8.037 1.00 0.00 H new ATOM 0 HB1 ALA A 126 0.767 -5.837 -8.940 1.00 0.00 H new ATOM 0 HB2 ALA A 126 2.043 -4.607 -9.104 1.00 0.00 H new ATOM 0 HB3 ALA A 126 2.153 -5.838 -7.823 1.00 0.00 H new ATOM 1900 N ALA A 127 0.486 -5.793 -5.570 1.00 0.00 N ATOM 1901 CA ALA A 127 -0.223 -6.638 -4.621 1.00 0.00 C ATOM 1902 C ALA A 127 -1.178 -5.831 -3.750 1.00 0.00 C ATOM 1903 O ALA A 127 -2.259 -6.321 -3.397 1.00 0.00 O ATOM 1904 CB ALA A 127 0.762 -7.421 -3.761 1.00 0.00 C ATOM 0 H ALA A 127 1.498 -5.777 -5.443 1.00 0.00 H new ATOM 0 HA ALA A 127 -0.823 -7.345 -5.194 1.00 0.00 H new ATOM 0 HB1 ALA A 127 0.213 -8.047 -3.058 1.00 0.00 H new ATOM 0 HB2 ALA A 127 1.382 -8.050 -4.399 1.00 0.00 H new ATOM 0 HB3 ALA A 127 1.396 -6.726 -3.210 1.00 0.00 H new ATOM 1910 N ALA A 128 -0.785 -4.602 -3.401 1.00 0.00 N ATOM 1911 CA ALA A 128 -1.617 -3.752 -2.589 1.00 0.00 C ATOM 1912 C ALA A 128 -2.937 -3.439 -3.268 1.00 0.00 C ATOM 1913 O ALA A 128 -3.936 -3.833 -2.799 1.00 0.00 O ATOM 1914 CB ALA A 128 -0.897 -2.470 -2.201 1.00 0.00 C ATOM 0 H ALA A 128 0.106 -4.187 -3.675 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.836 -4.306 -1.676 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -1.556 -1.854 -1.589 1.00 0.00 H new ATOM 0 HB2 ALA A 128 0.001 -2.715 -1.634 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.620 -1.921 -3.101 1.00 0.00 H new ATOM 1920 N THR A 129 -2.918 -2.789 -4.386 1.00 0.00 N ATOM 1921 CA THR A 129 -4.198 -2.433 -5.051 1.00 0.00 C ATOM 1922 C THR A 129 -5.052 -3.693 -5.414 1.00 0.00 C ATOM 1923 O THR A 129 -6.336 -3.691 -5.295 1.00 0.00 O ATOM 1924 CB THR A 129 -3.973 -1.513 -6.300 1.00 0.00 C ATOM 1925 OG1 THR A 129 -5.197 -1.350 -7.069 1.00 0.00 O ATOM 1926 CG2 THR A 129 -2.857 -2.042 -7.186 1.00 0.00 C ATOM 0 H THR A 129 -2.074 -2.486 -4.872 1.00 0.00 H new ATOM 0 HA THR A 129 -4.773 -1.860 -4.324 1.00 0.00 H new ATOM 0 HB THR A 129 -3.675 -0.534 -5.925 1.00 0.00 H new ATOM 0 HG1 THR A 129 -4.974 -1.213 -8.013 1.00 0.00 H new ATOM 0 HG21 THR A 129 -2.728 -1.380 -8.042 1.00 0.00 H new ATOM 0 HG22 THR A 129 -1.929 -2.084 -6.616 1.00 0.00 H new ATOM 0 HG23 THR A 129 -3.113 -3.042 -7.536 1.00 0.00 H new ATOM 1934 N LYS A 130 -4.330 -4.793 -5.710 1.00 0.00 N ATOM 1935 CA LYS A 130 -4.906 -6.073 -6.175 1.00 0.00 C ATOM 1936 C LYS A 130 -5.689 -6.690 -5.055 1.00 0.00 C ATOM 1937 O LYS A 130 -6.507 -7.552 -5.237 1.00 0.00 O ATOM 1938 CB LYS A 130 -3.779 -7.038 -6.610 1.00 0.00 C ATOM 1939 CG LYS A 130 -4.254 -8.342 -7.237 1.00 0.00 C ATOM 1940 CD LYS A 130 -4.968 -8.111 -8.565 1.00 0.00 C ATOM 1941 CE LYS A 130 -5.464 -9.431 -9.140 1.00 0.00 C ATOM 1942 NZ LYS A 130 -6.128 -9.266 -10.441 1.00 0.00 N ATOM 0 H LYS A 130 -3.313 -4.818 -5.632 1.00 0.00 H new ATOM 0 HA LYS A 130 -5.558 -5.887 -7.028 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -3.135 -6.523 -7.323 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -3.166 -7.273 -5.740 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -3.400 -9.001 -7.394 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -4.927 -8.852 -6.547 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -5.808 -7.432 -8.420 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -4.290 -7.632 -9.271 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -4.622 -10.115 -9.250 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -6.159 -9.891 -8.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -6.446 -10.193 -10.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -6.948 -8.636 -10.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -5.460 -8.852 -11.122 1.00 0.00 H new ATOM 1956 N ALA A 131 -5.315 -6.323 -3.900 1.00 0.00 N ATOM 1957 CA ALA A 131 -5.998 -6.603 -2.728 1.00 0.00 C ATOM 1958 C ALA A 131 -7.080 -5.546 -2.522 1.00 0.00 C ATOM 1959 O ALA A 131 -8.288 -5.842 -2.614 1.00 0.00 O ATOM 1960 CB ALA A 131 -4.953 -6.550 -1.680 1.00 0.00 C ATOM 0 H ALA A 131 -4.464 -5.782 -3.746 1.00 0.00 H new ATOM 0 HA ALA A 131 -6.506 -7.567 -2.724 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.401 -6.760 -0.709 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -4.185 -7.293 -1.894 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.503 -5.557 -1.665 1.00 0.00 H new ATOM 1966 N TRP A 132 -6.628 -4.305 -2.416 1.00 0.00 N ATOM 1967 CA TRP A 132 -7.394 -3.133 -1.981 1.00 0.00 C ATOM 1968 C TRP A 132 -8.446 -2.629 -2.986 1.00 0.00 C ATOM 1969 O TRP A 132 -8.720 -1.441 -3.068 1.00 0.00 O ATOM 1970 CB TRP A 132 -6.483 -1.958 -1.564 1.00 0.00 C ATOM 1971 CG TRP A 132 -5.532 -2.288 -0.459 1.00 0.00 C ATOM 1972 CD1 TRP A 132 -5.031 -3.488 -0.218 1.00 0.00 C ATOM 1973 CD2 TRP A 132 -4.968 -1.429 0.546 1.00 0.00 C ATOM 1974 NE1 TRP A 132 -4.144 -3.465 0.731 1.00 0.00 N ATOM 1975 CE2 TRP A 132 -4.071 -2.230 1.257 1.00 0.00 C ATOM 1976 CE3 TRP A 132 -5.087 -0.073 0.904 1.00 0.00 C ATOM 1977 CZ2 TRP A 132 -3.307 -1.753 2.279 1.00 0.00 C ATOM 1978 CZ3 TRP A 132 -4.325 0.379 1.929 1.00 0.00 C ATOM 1979 CH2 TRP A 132 -3.442 -0.460 2.594 1.00 0.00 C ATOM 0 H TRP A 132 -5.662 -4.069 -2.643 1.00 0.00 H new ATOM 0 HA TRP A 132 -7.942 -3.502 -1.114 1.00 0.00 H new ATOM 0 HB2 TRP A 132 -5.914 -1.627 -2.433 1.00 0.00 H new ATOM 0 HB3 TRP A 132 -7.107 -1.120 -1.254 1.00 0.00 H new ATOM 0 HD1 TRP A 132 -5.325 -4.382 -0.748 1.00 0.00 H new ATOM 0 HE1 TRP A 132 -3.586 -4.264 1.032 1.00 0.00 H new ATOM 0 HE3 TRP A 132 -5.763 0.585 0.379 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 -2.620 -2.393 2.813 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 -4.406 1.412 2.234 1.00 0.00 H new ATOM 0 HH2 TRP A 132 -2.842 -0.054 3.395 1.00 0.00 H new ATOM 1990 N ARG A 133 -8.962 -3.482 -3.784 1.00 0.00 N ATOM 1991 CA ARG A 133 -10.151 -3.115 -4.553 1.00 0.00 C ATOM 1992 C ARG A 133 -11.477 -3.894 -4.245 1.00 0.00 C ATOM 1993 O ARG A 133 -12.539 -3.281 -4.202 1.00 0.00 O ATOM 1994 CB ARG A 133 -9.877 -2.957 -6.080 1.00 0.00 C ATOM 1995 CG ARG A 133 -11.127 -2.703 -6.948 1.00 0.00 C ATOM 1996 CD ARG A 133 -11.873 -4.003 -7.249 1.00 0.00 C ATOM 1997 NE ARG A 133 -13.257 -3.799 -7.651 1.00 0.00 N ATOM 1998 CZ ARG A 133 -13.752 -4.186 -8.845 1.00 0.00 C ATOM 1999 NH1 ARG A 133 -12.934 -4.404 -9.879 1.00 0.00 N ATOM 2000 NH2 ARG A 133 -15.059 -4.321 -9.001 1.00 0.00 N ATOM 0 H ARG A 133 -8.611 -4.427 -3.941 1.00 0.00 H new ATOM 0 HA ARG A 133 -10.371 -2.123 -4.158 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -9.180 -2.132 -6.224 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -9.382 -3.859 -6.439 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -11.794 -2.010 -6.434 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -10.832 -2.227 -7.883 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -11.348 -4.539 -8.040 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -11.850 -4.639 -6.364 1.00 0.00 H new ATOM 0 HE ARG A 133 -13.887 -3.338 -6.994 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -11.928 -4.278 -9.769 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -13.316 -4.696 -10.779 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -15.688 -4.133 -8.220 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -15.438 -4.613 -9.902 1.00 0.00 H new ATOM 2014 N LYS A 134 -11.393 -5.205 -3.995 1.00 0.00 N ATOM 2015 CA LYS A 134 -12.578 -6.173 -4.157 1.00 0.00 C ATOM 2016 C LYS A 134 -13.866 -6.040 -3.337 1.00 0.00 C ATOM 2017 O LYS A 134 -14.572 -7.030 -3.153 1.00 0.00 O ATOM 2018 CB LYS A 134 -12.150 -7.625 -4.194 1.00 0.00 C ATOM 2019 CG LYS A 134 -11.743 -8.090 -5.573 1.00 0.00 C ATOM 2020 CD LYS A 134 -10.578 -7.319 -6.092 1.00 0.00 C ATOM 2021 CE LYS A 134 -9.367 -7.603 -5.264 1.00 0.00 C ATOM 2022 NZ LYS A 134 -8.843 -8.956 -5.515 1.00 0.00 N ATOM 0 H LYS A 134 -10.536 -5.658 -3.678 1.00 0.00 H new ATOM 0 HA LYS A 134 -12.911 -5.792 -5.122 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -11.315 -7.769 -3.508 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -12.969 -8.248 -3.834 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -11.493 -9.150 -5.541 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -12.585 -7.982 -6.257 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -10.389 -7.586 -7.132 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -10.800 -6.252 -6.073 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -8.594 -6.866 -5.484 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -9.615 -7.499 -4.208 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -7.856 -9.012 -5.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -9.417 -9.652 -4.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -8.885 -9.161 -6.534 1.00 0.00 H new ATOM 2036 N LEU A 135 -14.229 -4.894 -2.938 1.00 0.00 N ATOM 2037 CA LEU A 135 -15.493 -4.756 -2.235 1.00 0.00 C ATOM 2038 C LEU A 135 -16.599 -4.654 -3.281 1.00 0.00 C ATOM 2039 O LEU A 135 -16.476 -3.867 -4.235 1.00 0.00 O ATOM 2040 CB LEU A 135 -15.498 -3.524 -1.330 1.00 0.00 C ATOM 2041 CG LEU A 135 -14.755 -3.547 0.007 1.00 0.00 C ATOM 2042 CD1 LEU A 135 -13.637 -4.546 0.011 1.00 0.00 C ATOM 2043 CD2 LEU A 135 -14.197 -2.170 0.250 1.00 0.00 C ATOM 0 H LEU A 135 -13.701 -4.031 -3.068 1.00 0.00 H new ATOM 0 HA LEU A 135 -15.651 -5.622 -1.592 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -15.093 -2.695 -1.910 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -16.540 -3.284 -1.117 1.00 0.00 H new ATOM 0 HG LEU A 135 -15.453 -3.838 0.792 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -13.137 -4.529 0.979 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -14.039 -5.543 -0.172 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -12.921 -4.294 -0.772 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -13.661 -2.157 1.199 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -13.513 -1.907 -0.557 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -15.013 -1.448 0.284 1.00 0.00 H new ATOM 2055 N PRO A 136 -17.657 -5.481 -3.170 1.00 0.00 N ATOM 2056 CA PRO A 136 -18.778 -5.460 -4.120 1.00 0.00 C ATOM 2057 C PRO A 136 -19.623 -4.173 -4.016 1.00 0.00 C ATOM 2058 O PRO A 136 -19.257 -3.223 -3.299 1.00 0.00 O ATOM 2059 CB PRO A 136 -19.628 -6.684 -3.720 1.00 0.00 C ATOM 2060 CG PRO A 136 -18.744 -7.497 -2.827 1.00 0.00 C ATOM 2061 CD PRO A 136 -17.834 -6.527 -2.146 1.00 0.00 C ATOM 0 HA PRO A 136 -18.423 -5.488 -5.150 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -20.538 -6.380 -3.203 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -19.935 -7.255 -4.597 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -19.333 -8.055 -2.099 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -18.175 -8.227 -3.403 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -18.276 -6.129 -1.232 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -16.886 -6.987 -1.868 1.00 0.00 H new ATOM 2069 N VAL A 137 -20.767 -4.187 -4.698 1.00 0.00 N ATOM 2070 CA VAL A 137 -21.692 -3.068 -4.780 1.00 0.00 C ATOM 2071 C VAL A 137 -22.023 -2.441 -3.407 1.00 0.00 C ATOM 2072 O VAL A 137 -22.620 -3.075 -2.526 1.00 0.00 O ATOM 2073 CB VAL A 137 -22.982 -3.486 -5.542 1.00 0.00 C ATOM 2074 CG1 VAL A 137 -23.664 -4.699 -4.910 1.00 0.00 C ATOM 2075 CG2 VAL A 137 -23.942 -2.326 -5.676 1.00 0.00 C ATOM 0 H VAL A 137 -21.081 -5.003 -5.223 1.00 0.00 H new ATOM 0 HA VAL A 137 -21.187 -2.284 -5.344 1.00 0.00 H new ATOM 0 HB VAL A 137 -22.672 -3.784 -6.544 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -24.559 -4.951 -5.479 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -22.979 -5.547 -4.918 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -23.941 -4.466 -3.882 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -24.833 -2.651 -6.213 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -24.225 -1.972 -4.685 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -23.461 -1.518 -6.227 1.00 0.00 H new ATOM 2085 N LYS A 138 -21.576 -1.216 -3.227 1.00 0.00 N ATOM 2086 CA LYS A 138 -21.847 -0.460 -2.026 1.00 0.00 C ATOM 2087 C LYS A 138 -23.252 0.122 -2.128 1.00 0.00 C ATOM 2088 O LYS A 138 -24.006 0.125 -1.159 1.00 0.00 O ATOM 2089 CB LYS A 138 -20.770 0.650 -1.860 1.00 0.00 C ATOM 2090 CG LYS A 138 -20.922 1.592 -0.649 1.00 0.00 C ATOM 2091 CD LYS A 138 -20.744 0.900 0.695 1.00 0.00 C ATOM 2092 CE LYS A 138 -20.778 1.927 1.813 1.00 0.00 C ATOM 2093 NZ LYS A 138 -20.638 1.339 3.168 1.00 0.00 N ATOM 0 H LYS A 138 -21.012 -0.716 -3.914 1.00 0.00 H new ATOM 0 HA LYS A 138 -21.800 -1.098 -1.143 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -19.794 0.169 -1.796 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -20.767 1.258 -2.765 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -20.191 2.396 -0.732 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -21.909 2.054 -0.681 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -21.534 0.163 0.842 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -19.797 0.360 0.714 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -19.977 2.649 1.655 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -21.718 2.477 1.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -20.670 2.096 3.880 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -21.416 0.671 3.338 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -19.730 0.837 3.237 1.00 0.00 H new ATOM 2107 N GLY A 139 -23.597 0.573 -3.329 1.00 0.00 N ATOM 2108 CA GLY A 139 -24.909 1.106 -3.586 1.00 0.00 C ATOM 2109 C GLY A 139 -25.288 0.981 -5.051 1.00 0.00 C ATOM 2110 O GLY A 139 -26.267 0.287 -5.400 1.00 0.00 O ATOM 0 H GLY A 139 -22.975 0.575 -4.137 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -25.642 0.580 -2.974 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -24.940 2.155 -3.290 1.00 0.00 H new ATOM 2114 N ASP A 140 -24.533 1.655 -5.898 1.00 0.00 N ATOM 2115 CA ASP A 140 -24.761 1.617 -7.350 1.00 0.00 C ATOM 2116 C ASP A 140 -24.241 0.349 -7.946 1.00 0.00 C ATOM 2117 O ASP A 140 -23.021 0.214 -8.089 1.00 0.00 O ATOM 2118 CB ASP A 140 -24.110 2.786 -8.070 1.00 0.00 C ATOM 2119 CG ASP A 140 -24.451 2.810 -9.553 1.00 0.00 C ATOM 2120 OD1 ASP A 140 -25.543 3.305 -9.920 1.00 0.00 O ATOM 2121 OD2 ASP A 140 -23.630 2.388 -10.389 1.00 0.00 O ATOM 2122 OXT ASP A 140 -25.046 -0.517 -8.316 1.00 0.00 O ATOM 0 H ASP A 140 -23.749 2.242 -5.614 1.00 0.00 H new ATOM 0 HA ASP A 140 -25.841 1.679 -7.483 1.00 0.00 H new ATOM 0 HB2 ASP A 140 -24.433 3.720 -7.610 1.00 0.00 H new ATOM 0 HB3 ASP A 140 -23.028 2.728 -7.949 1.00 0.00 H new TER 2127 ASP A 140