USER MOD reduce.3.24.130724 H: found=0, std=0, add=966, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 966 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 113 THR OG1 : rot -142:sc= 0.777 USER MOD Set 1.2: A 115 GLN : amide:sc= 0.647 K(o=1.4,f=-0.067) USER MOD Set 2.1: A 40 ASN : amide:sc= -1.08 K(o=0.29,f=-8.3!) USER MOD Set 2.2: A 44 THR OG1 : rot 180:sc= 0 USER MOD Set 2.3: A 91 GLN : amide:sc= 1.37 K(o=0.29,f=-5!) USER MOD Single : A 1 SER N :NH3+ 142:sc= 0.241 (180deg=0.012) USER MOD Single : A 1 SER OG : rot 180:sc= 0.0938 USER MOD Single : A 2 ASN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 TYR OH : rot 180:sc= 0 USER MOD Single : A 7 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ -173:sc=-0.00356 (180deg=-0.0704) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= -0.0254 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 164:sc= -0.0441 (180deg=-0.307) USER MOD Single : A 21 LYS NZ :NH3+ 167:sc= -0.0386 (180deg=-0.218) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 180:sc= 0.0225 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0.324 USER MOD Single : A 34 THR OG1 : rot 180:sc=-0.00305 USER MOD Single : A 36 SER OG : rot -1:sc= 0.405 USER MOD Single : A 38 LYS NZ :NH3+ 174:sc= 1.24 (180deg=1.12) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 GLN : amide:sc= -0.185 X(o=-0.18,f=-0.26) USER MOD Single : A 42 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 176:sc= 2.17 (180deg=2.13) USER MOD Single : A 50 ASN : amide:sc=-0.00118 X(o=-0.0012,f=0) USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 ASN : amide:sc= 1.64 K(o=1.6,f=-2.8) USER MOD Single : A 57 ASN : amide:sc= 0.0402 K(o=0.04,f=-2.6!) USER MOD Single : A 58 GLN : amide:sc= -0.433 X(o=-0.43,f=-0.39) USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 SER OG : rot -104:sc= 0.553 USER MOD Single : A 70 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 ASN : amide:sc= -0.176 K(o=-0.18,f=-0.69) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 TYR OH : rot 30:sc= -0.0674 USER MOD Single : A 89 CYS SG : rot 164:sc= -1.36! USER MOD Single : A 94 HIS : no HD1:sc= -0.0654 X(o=-0.065,f=-0.065) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 ASN : amide:sc= -0.116 X(o=-0.12,f=0) USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc= -0.945 K(o=-0.95,f=-7.9!) USER MOD Single : A 105 ASN :FLIP amide:sc= -0.536 F(o=-1.3,f=-0.54) USER MOD Single : A 108 TYR OH : rot -136:sc= 1.24 USER MOD Single : A 109 CYS SG : rot -170:sc= -0.757 USER MOD Single : A 114 CYS SG : rot 13:sc= 0.229 USER MOD Single : A 120 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 121 HIS : no HE2:sc= 0.725 K(o=0.73,f=-2.6!) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 15.982 9.749 16.046 1.00 0.00 N ATOM 2 CA SER A 1 16.425 11.052 15.622 1.00 0.00 C ATOM 3 C SER A 1 17.091 11.740 16.806 1.00 0.00 C ATOM 4 O SER A 1 16.736 11.465 17.949 1.00 0.00 O ATOM 5 CB SER A 1 15.212 11.835 15.154 1.00 0.00 C ATOM 6 OG SER A 1 14.440 11.055 14.240 1.00 0.00 O ATOM 0 H1 SER A 1 15.066 9.533 15.603 1.00 0.00 H new ATOM 0 H2 SER A 1 16.682 9.035 15.761 1.00 0.00 H new ATOM 0 H3 SER A 1 15.878 9.737 17.081 1.00 0.00 H new ATOM 0 HA SER A 1 17.142 10.985 14.804 1.00 0.00 H new ATOM 0 HB2 SER A 1 14.599 12.116 16.011 1.00 0.00 H new ATOM 0 HB3 SER A 1 15.531 12.760 14.674 1.00 0.00 H new ATOM 0 HG SER A 1 13.660 11.571 13.947 1.00 0.00 H new ATOM 14 N ASN A 2 18.058 12.594 16.557 1.00 0.00 N ATOM 15 CA ASN A 2 18.742 13.275 17.644 1.00 0.00 C ATOM 16 C ASN A 2 19.077 14.698 17.269 1.00 0.00 C ATOM 17 O ASN A 2 19.960 14.938 16.433 1.00 0.00 O ATOM 18 CB ASN A 2 20.036 12.550 18.042 1.00 0.00 C ATOM 19 CG ASN A 2 20.744 13.225 19.217 1.00 0.00 C ATOM 20 OD1 ASN A 2 20.105 13.795 20.108 1.00 0.00 O ATOM 21 ND2 ASN A 2 22.053 13.195 19.215 1.00 0.00 N ATOM 0 H ASN A 2 18.389 12.835 15.623 1.00 0.00 H new ATOM 0 HA ASN A 2 18.058 13.272 18.493 1.00 0.00 H new ATOM 0 HB2 ASN A 2 19.805 11.518 18.305 1.00 0.00 H new ATOM 0 HB3 ASN A 2 20.709 12.518 17.185 1.00 0.00 H new ATOM 0 HD21 ASN A 2 22.575 13.651 19.964 1.00 0.00 H new ATOM 0 HD22 ASN A 2 22.551 12.716 18.465 1.00 0.00 H new ATOM 28 N ALA A 3 18.373 15.628 17.849 1.00 0.00 N ATOM 29 CA ALA A 3 18.679 17.016 17.656 1.00 0.00 C ATOM 30 C ALA A 3 19.777 17.381 18.634 1.00 0.00 C ATOM 31 O ALA A 3 19.580 17.328 19.847 1.00 0.00 O ATOM 32 CB ALA A 3 17.447 17.884 17.871 1.00 0.00 C ATOM 0 H ALA A 3 17.579 15.448 18.463 1.00 0.00 H new ATOM 0 HA ALA A 3 19.010 17.190 16.632 1.00 0.00 H new ATOM 0 HB1 ALA A 3 17.708 18.931 17.718 1.00 0.00 H new ATOM 0 HB2 ALA A 3 16.671 17.596 17.162 1.00 0.00 H new ATOM 0 HB3 ALA A 3 17.078 17.747 18.887 1.00 0.00 H new ATOM 38 N LYS A 4 20.931 17.740 18.120 1.00 0.00 N ATOM 39 CA LYS A 4 22.092 17.993 18.962 1.00 0.00 C ATOM 40 C LYS A 4 21.994 19.360 19.652 1.00 0.00 C ATOM 41 O LYS A 4 22.814 19.695 20.516 1.00 0.00 O ATOM 42 CB LYS A 4 23.387 17.868 18.134 1.00 0.00 C ATOM 43 CG LYS A 4 24.676 17.850 18.953 1.00 0.00 C ATOM 44 CD LYS A 4 24.700 16.659 19.900 1.00 0.00 C ATOM 45 CE LYS A 4 25.969 16.614 20.720 1.00 0.00 C ATOM 46 NZ LYS A 4 25.973 15.467 21.650 1.00 0.00 N ATOM 0 H LYS A 4 21.097 17.865 17.121 1.00 0.00 H new ATOM 0 HA LYS A 4 22.117 17.240 19.750 1.00 0.00 H new ATOM 0 HB2 LYS A 4 23.336 16.953 17.544 1.00 0.00 H new ATOM 0 HB3 LYS A 4 23.433 18.699 17.430 1.00 0.00 H new ATOM 0 HG2 LYS A 4 25.536 17.806 18.285 1.00 0.00 H new ATOM 0 HG3 LYS A 4 24.763 18.775 19.523 1.00 0.00 H new ATOM 0 HD2 LYS A 4 23.839 16.708 20.567 1.00 0.00 H new ATOM 0 HD3 LYS A 4 24.606 15.737 19.326 1.00 0.00 H new ATOM 0 HE2 LYS A 4 26.830 16.548 20.055 1.00 0.00 H new ATOM 0 HE3 LYS A 4 26.072 17.541 21.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 26.858 15.466 22.197 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 25.165 15.544 22.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 25.900 14.582 21.109 1.00 0.00 H new ATOM 60 N ASN A 5 20.995 20.146 19.248 1.00 0.00 N ATOM 61 CA ASN A 5 20.685 21.482 19.818 1.00 0.00 C ATOM 62 C ASN A 5 21.694 22.539 19.427 1.00 0.00 C ATOM 63 O ASN A 5 21.322 23.579 18.886 1.00 0.00 O ATOM 64 CB ASN A 5 20.513 21.466 21.363 1.00 0.00 C ATOM 65 CG ASN A 5 19.252 20.779 21.835 1.00 0.00 C ATOM 66 OD1 ASN A 5 18.219 21.408 21.972 1.00 0.00 O ATOM 67 ND2 ASN A 5 19.321 19.508 22.109 1.00 0.00 N ATOM 0 H ASN A 5 20.357 19.876 18.499 1.00 0.00 H new ATOM 0 HA ASN A 5 19.724 21.747 19.377 1.00 0.00 H new ATOM 0 HB2 ASN A 5 21.374 20.968 21.809 1.00 0.00 H new ATOM 0 HB3 ASN A 5 20.514 22.493 21.729 1.00 0.00 H new ATOM 0 HD21 ASN A 5 18.496 19.014 22.448 1.00 0.00 H new ATOM 0 HD22 ASN A 5 20.200 19.006 21.985 1.00 0.00 H new ATOM 74 N TYR A 6 22.976 22.251 19.694 1.00 0.00 N ATOM 75 CA TYR A 6 24.123 23.154 19.494 1.00 0.00 C ATOM 76 C TYR A 6 24.040 24.267 20.525 1.00 0.00 C ATOM 77 O TYR A 6 24.864 24.347 21.438 1.00 0.00 O ATOM 78 CB TYR A 6 24.217 23.698 18.044 1.00 0.00 C ATOM 79 CG TYR A 6 24.178 22.604 16.995 1.00 0.00 C ATOM 80 CD1 TYR A 6 25.252 21.744 16.807 1.00 0.00 C ATOM 81 CD2 TYR A 6 23.047 22.417 16.215 1.00 0.00 C ATOM 82 CE1 TYR A 6 25.194 20.726 15.872 1.00 0.00 C ATOM 83 CE2 TYR A 6 22.984 21.413 15.279 1.00 0.00 C ATOM 84 CZ TYR A 6 24.054 20.568 15.112 1.00 0.00 C ATOM 85 OH TYR A 6 23.975 19.546 14.186 1.00 0.00 O ATOM 0 H TYR A 6 23.256 21.345 20.071 1.00 0.00 H new ATOM 0 HA TYR A 6 25.046 22.592 19.638 1.00 0.00 H new ATOM 0 HB2 TYR A 6 23.394 24.391 17.868 1.00 0.00 H new ATOM 0 HB3 TYR A 6 25.141 24.266 17.934 1.00 0.00 H new ATOM 0 HD1 TYR A 6 26.146 21.872 17.400 1.00 0.00 H new ATOM 0 HD2 TYR A 6 22.199 23.073 16.346 1.00 0.00 H new ATOM 0 HE1 TYR A 6 26.034 20.061 15.738 1.00 0.00 H new ATOM 0 HE2 TYR A 6 22.096 21.289 14.677 1.00 0.00 H new ATOM 0 HH TYR A 6 23.104 19.577 13.738 1.00 0.00 H new ATOM 95 N MET A 7 23.020 25.062 20.412 1.00 0.00 N ATOM 96 CA MET A 7 22.708 26.063 21.382 1.00 0.00 C ATOM 97 C MET A 7 21.591 25.506 22.262 1.00 0.00 C ATOM 98 O MET A 7 20.433 25.400 21.844 1.00 0.00 O ATOM 99 CB MET A 7 22.321 27.409 20.709 1.00 0.00 C ATOM 100 CG MET A 7 21.173 27.338 19.696 1.00 0.00 C ATOM 101 SD MET A 7 20.780 28.942 18.958 1.00 0.00 S ATOM 102 CE MET A 7 19.442 28.482 17.854 1.00 0.00 C ATOM 0 H MET A 7 22.369 25.031 19.627 1.00 0.00 H new ATOM 0 HA MET A 7 23.580 26.291 21.995 1.00 0.00 H new ATOM 0 HB2 MET A 7 22.049 28.120 21.489 1.00 0.00 H new ATOM 0 HB3 MET A 7 23.201 27.809 20.206 1.00 0.00 H new ATOM 0 HG2 MET A 7 21.437 26.635 18.905 1.00 0.00 H new ATOM 0 HG3 MET A 7 20.285 26.944 20.189 1.00 0.00 H new ATOM 0 HE1 MET A 7 19.088 29.366 17.323 1.00 0.00 H new ATOM 0 HE2 MET A 7 19.801 27.746 17.135 1.00 0.00 H new ATOM 0 HE3 MET A 7 18.623 28.055 18.433 1.00 0.00 H new ATOM 112 N ASP A 8 21.952 25.062 23.435 1.00 0.00 N ATOM 113 CA ASP A 8 20.994 24.442 24.338 1.00 0.00 C ATOM 114 C ASP A 8 20.305 25.526 25.138 1.00 0.00 C ATOM 115 O ASP A 8 20.960 26.253 25.898 1.00 0.00 O ATOM 116 CB ASP A 8 21.700 23.440 25.264 1.00 0.00 C ATOM 117 CG ASP A 8 20.743 22.642 26.118 1.00 0.00 C ATOM 118 OD1 ASP A 8 20.218 21.614 25.632 1.00 0.00 O ATOM 119 OD2 ASP A 8 20.518 23.006 27.298 1.00 0.00 O ATOM 0 H ASP A 8 22.904 25.114 23.798 1.00 0.00 H new ATOM 0 HA ASP A 8 20.249 23.891 23.764 1.00 0.00 H new ATOM 0 HB2 ASP A 8 22.296 22.755 24.661 1.00 0.00 H new ATOM 0 HB3 ASP A 8 22.392 23.979 25.911 1.00 0.00 H new ATOM 124 N LYS A 9 19.016 25.677 24.939 1.00 0.00 N ATOM 125 CA LYS A 9 18.272 26.745 25.587 1.00 0.00 C ATOM 126 C LYS A 9 16.824 26.348 25.887 1.00 0.00 C ATOM 127 O LYS A 9 16.089 27.111 26.500 1.00 0.00 O ATOM 128 CB LYS A 9 18.304 28.019 24.711 1.00 0.00 C ATOM 129 CG LYS A 9 17.714 27.828 23.309 1.00 0.00 C ATOM 130 CD LYS A 9 17.851 29.074 22.431 1.00 0.00 C ATOM 131 CE LYS A 9 17.086 30.276 22.984 1.00 0.00 C ATOM 132 NZ LYS A 9 15.626 30.037 23.061 1.00 0.00 N ATOM 0 H LYS A 9 18.456 25.076 24.334 1.00 0.00 H new ATOM 0 HA LYS A 9 18.756 26.944 26.543 1.00 0.00 H new ATOM 0 HB2 LYS A 9 17.755 28.811 25.220 1.00 0.00 H new ATOM 0 HB3 LYS A 9 19.336 28.357 24.617 1.00 0.00 H new ATOM 0 HG2 LYS A 9 18.212 26.990 22.822 1.00 0.00 H new ATOM 0 HG3 LYS A 9 16.660 27.565 23.397 1.00 0.00 H new ATOM 0 HD2 LYS A 9 18.906 29.332 22.337 1.00 0.00 H new ATOM 0 HD3 LYS A 9 17.488 28.848 21.428 1.00 0.00 H new ATOM 0 HE2 LYS A 9 17.464 30.516 23.978 1.00 0.00 H new ATOM 0 HE3 LYS A 9 17.275 31.144 22.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 15.144 30.919 23.329 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 15.277 29.719 22.134 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 15.431 29.306 23.774 1.00 0.00 H new ATOM 146 N GLY A 10 16.410 25.178 25.459 1.00 0.00 N ATOM 147 CA GLY A 10 15.048 24.767 25.676 1.00 0.00 C ATOM 148 C GLY A 10 14.532 23.973 24.517 1.00 0.00 C ATOM 149 O GLY A 10 15.197 23.065 24.043 1.00 0.00 O ATOM 0 H GLY A 10 16.992 24.502 24.964 1.00 0.00 H new ATOM 0 HA2 GLY A 10 14.986 24.170 26.586 1.00 0.00 H new ATOM 0 HA3 GLY A 10 14.420 25.645 25.827 1.00 0.00 H new ATOM 153 N THR A 11 13.384 24.309 24.030 1.00 0.00 N ATOM 154 CA THR A 11 12.827 23.589 22.938 1.00 0.00 C ATOM 155 C THR A 11 13.052 24.332 21.611 1.00 0.00 C ATOM 156 O THR A 11 12.223 25.115 21.160 1.00 0.00 O ATOM 157 CB THR A 11 11.334 23.253 23.177 1.00 0.00 C ATOM 158 OG1 THR A 11 11.215 22.566 24.446 1.00 0.00 O ATOM 159 CG2 THR A 11 10.795 22.341 22.074 1.00 0.00 C ATOM 0 H THR A 11 12.813 25.081 24.374 1.00 0.00 H new ATOM 0 HA THR A 11 13.352 22.636 22.865 1.00 0.00 H new ATOM 0 HB THR A 11 10.760 24.179 23.176 1.00 0.00 H new ATOM 0 HG1 THR A 11 10.274 22.348 24.613 1.00 0.00 H new ATOM 0 HG21 THR A 11 9.745 22.120 22.265 1.00 0.00 H new ATOM 0 HG22 THR A 11 10.891 22.840 21.110 1.00 0.00 H new ATOM 0 HG23 THR A 11 11.364 21.412 22.060 1.00 0.00 H new ATOM 167 N SER A 12 14.224 24.141 21.057 1.00 0.00 N ATOM 168 CA SER A 12 14.575 24.670 19.762 1.00 0.00 C ATOM 169 C SER A 12 14.313 23.589 18.704 1.00 0.00 C ATOM 170 O SER A 12 14.360 23.846 17.492 1.00 0.00 O ATOM 171 CB SER A 12 16.049 25.061 19.766 1.00 0.00 C ATOM 172 OG SER A 12 16.337 25.892 20.885 1.00 0.00 O ATOM 0 H SER A 12 14.971 23.606 21.499 1.00 0.00 H new ATOM 0 HA SER A 12 13.977 25.552 19.533 1.00 0.00 H new ATOM 0 HB2 SER A 12 16.670 24.166 19.800 1.00 0.00 H new ATOM 0 HB3 SER A 12 16.296 25.585 18.842 1.00 0.00 H new ATOM 0 HG SER A 12 17.287 26.134 20.877 1.00 0.00 H new ATOM 178 N SER A 13 14.050 22.375 19.185 1.00 0.00 N ATOM 179 CA SER A 13 13.707 21.266 18.335 1.00 0.00 C ATOM 180 C SER A 13 12.315 21.497 17.756 1.00 0.00 C ATOM 181 O SER A 13 11.448 22.078 18.423 1.00 0.00 O ATOM 182 CB SER A 13 13.720 19.980 19.155 1.00 0.00 C ATOM 183 OG SER A 13 14.964 19.822 19.822 1.00 0.00 O ATOM 0 H SER A 13 14.072 22.146 20.179 1.00 0.00 H new ATOM 0 HA SER A 13 14.429 21.180 17.523 1.00 0.00 H new ATOM 0 HB2 SER A 13 12.911 20.000 19.885 1.00 0.00 H new ATOM 0 HB3 SER A 13 13.540 19.125 18.503 1.00 0.00 H new ATOM 0 HG SER A 13 14.952 18.993 20.344 1.00 0.00 H new ATOM 189 N SER A 14 12.108 21.067 16.548 1.00 0.00 N ATOM 190 CA SER A 14 10.860 21.239 15.884 1.00 0.00 C ATOM 191 C SER A 14 10.811 20.217 14.779 1.00 0.00 C ATOM 192 O SER A 14 11.825 19.537 14.523 1.00 0.00 O ATOM 193 CB SER A 14 10.747 22.668 15.317 1.00 0.00 C ATOM 194 OG SER A 14 9.451 22.911 14.791 1.00 0.00 O ATOM 0 H SER A 14 12.812 20.581 15.993 1.00 0.00 H new ATOM 0 HA SER A 14 10.026 21.101 16.572 1.00 0.00 H new ATOM 0 HB2 SER A 14 10.965 23.392 16.102 1.00 0.00 H new ATOM 0 HB3 SER A 14 11.493 22.812 14.535 1.00 0.00 H new ATOM 0 HG SER A 14 9.407 23.825 14.440 1.00 0.00 H new ATOM 200 N THR A 15 9.690 20.102 14.126 1.00 0.00 N ATOM 201 CA THR A 15 9.527 19.144 13.080 1.00 0.00 C ATOM 202 C THR A 15 10.196 19.667 11.806 1.00 0.00 C ATOM 203 O THR A 15 9.565 20.279 10.945 1.00 0.00 O ATOM 204 CB THR A 15 8.039 18.868 12.840 1.00 0.00 C ATOM 205 OG1 THR A 15 7.399 18.727 14.118 1.00 0.00 O ATOM 206 CG2 THR A 15 7.852 17.575 12.053 1.00 0.00 C ATOM 0 H THR A 15 8.864 20.673 14.307 1.00 0.00 H new ATOM 0 HA THR A 15 10.000 18.206 13.369 1.00 0.00 H new ATOM 0 HB THR A 15 7.606 19.690 12.270 1.00 0.00 H new ATOM 0 HG1 THR A 15 6.444 18.551 13.988 1.00 0.00 H new ATOM 0 HG21 THR A 15 6.789 17.397 11.893 1.00 0.00 H new ATOM 0 HG22 THR A 15 8.355 17.660 11.090 1.00 0.00 H new ATOM 0 HG23 THR A 15 8.279 16.743 12.613 1.00 0.00 H new ATOM 214 N VAL A 16 11.491 19.516 11.756 1.00 0.00 N ATOM 215 CA VAL A 16 12.270 19.965 10.643 1.00 0.00 C ATOM 216 C VAL A 16 12.329 18.866 9.612 1.00 0.00 C ATOM 217 O VAL A 16 13.038 17.873 9.785 1.00 0.00 O ATOM 218 CB VAL A 16 13.712 20.375 11.072 1.00 0.00 C ATOM 219 CG1 VAL A 16 14.509 20.906 9.888 1.00 0.00 C ATOM 220 CG2 VAL A 16 13.670 21.411 12.192 1.00 0.00 C ATOM 0 H VAL A 16 12.037 19.073 12.495 1.00 0.00 H new ATOM 0 HA VAL A 16 11.793 20.851 10.223 1.00 0.00 H new ATOM 0 HB VAL A 16 14.213 19.482 11.445 1.00 0.00 H new ATOM 0 HG11 VAL A 16 15.510 21.184 10.218 1.00 0.00 H new ATOM 0 HG12 VAL A 16 14.581 20.134 9.122 1.00 0.00 H new ATOM 0 HG13 VAL A 16 14.007 21.781 9.475 1.00 0.00 H new ATOM 0 HG21 VAL A 16 14.687 21.682 12.475 1.00 0.00 H new ATOM 0 HG22 VAL A 16 13.141 22.299 11.847 1.00 0.00 H new ATOM 0 HG23 VAL A 16 13.152 20.993 13.055 1.00 0.00 H new ATOM 230 N VAL A 17 11.540 19.003 8.584 1.00 0.00 N ATOM 231 CA VAL A 17 11.554 18.038 7.529 1.00 0.00 C ATOM 232 C VAL A 17 12.756 18.307 6.639 1.00 0.00 C ATOM 233 O VAL A 17 13.166 19.474 6.483 1.00 0.00 O ATOM 234 CB VAL A 17 10.228 18.010 6.702 1.00 0.00 C ATOM 235 CG1 VAL A 17 9.043 17.693 7.604 1.00 0.00 C ATOM 236 CG2 VAL A 17 9.987 19.319 5.961 1.00 0.00 C ATOM 0 H VAL A 17 10.882 19.772 8.457 1.00 0.00 H new ATOM 0 HA VAL A 17 11.634 17.047 7.977 1.00 0.00 H new ATOM 0 HB VAL A 17 10.332 17.223 5.955 1.00 0.00 H new ATOM 0 HG11 VAL A 17 8.128 17.678 7.011 1.00 0.00 H new ATOM 0 HG12 VAL A 17 9.190 16.718 8.069 1.00 0.00 H new ATOM 0 HG13 VAL A 17 8.961 18.456 8.378 1.00 0.00 H new ATOM 0 HG21 VAL A 17 9.055 19.253 5.400 1.00 0.00 H new ATOM 0 HG22 VAL A 17 9.922 20.137 6.679 1.00 0.00 H new ATOM 0 HG23 VAL A 17 10.812 19.505 5.273 1.00 0.00 H new ATOM 246 N LYS A 18 13.354 17.233 6.129 1.00 0.00 N ATOM 247 CA LYS A 18 14.542 17.280 5.264 1.00 0.00 C ATOM 248 C LYS A 18 15.765 17.803 6.028 1.00 0.00 C ATOM 249 O LYS A 18 16.709 18.308 5.422 1.00 0.00 O ATOM 250 CB LYS A 18 14.299 18.125 3.994 1.00 0.00 C ATOM 251 CG LYS A 18 13.146 17.646 3.126 1.00 0.00 C ATOM 252 CD LYS A 18 13.041 18.477 1.859 1.00 0.00 C ATOM 253 CE LYS A 18 11.819 18.100 1.034 1.00 0.00 C ATOM 254 NZ LYS A 18 10.556 18.366 1.761 1.00 0.00 N ATOM 0 H LYS A 18 13.024 16.284 6.306 1.00 0.00 H new ATOM 0 HA LYS A 18 14.743 16.256 4.948 1.00 0.00 H new ATOM 0 HB2 LYS A 18 14.109 19.157 4.291 1.00 0.00 H new ATOM 0 HB3 LYS A 18 15.210 18.128 3.396 1.00 0.00 H new ATOM 0 HG2 LYS A 18 13.292 16.597 2.867 1.00 0.00 H new ATOM 0 HG3 LYS A 18 12.213 17.710 3.686 1.00 0.00 H new ATOM 0 HD2 LYS A 18 12.990 19.534 2.121 1.00 0.00 H new ATOM 0 HD3 LYS A 18 13.941 18.340 1.259 1.00 0.00 H new ATOM 0 HE2 LYS A 18 11.825 18.661 0.100 1.00 0.00 H new ATOM 0 HE3 LYS A 18 11.871 17.043 0.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 9.761 18.358 1.090 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 10.409 17.631 2.482 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 10.610 19.297 2.222 1.00 0.00 H new ATOM 268 N ASP A 19 15.743 17.641 7.356 1.00 0.00 N ATOM 269 CA ASP A 19 16.833 18.083 8.249 1.00 0.00 C ATOM 270 C ASP A 19 18.157 17.435 7.872 1.00 0.00 C ATOM 271 O ASP A 19 18.280 16.200 7.886 1.00 0.00 O ATOM 272 CB ASP A 19 16.510 17.757 9.712 1.00 0.00 C ATOM 273 CG ASP A 19 17.603 18.214 10.657 1.00 0.00 C ATOM 274 OD1 ASP A 19 17.663 19.420 10.970 1.00 0.00 O ATOM 275 OD2 ASP A 19 18.417 17.373 11.115 1.00 0.00 O ATOM 0 H ASP A 19 14.967 17.198 7.849 1.00 0.00 H new ATOM 0 HA ASP A 19 16.923 19.163 8.132 1.00 0.00 H new ATOM 0 HB2 ASP A 19 15.570 18.234 9.989 1.00 0.00 H new ATOM 0 HB3 ASP A 19 16.366 16.682 9.819 1.00 0.00 H new ATOM 280 N GLY A 20 19.119 18.257 7.521 1.00 0.00 N ATOM 281 CA GLY A 20 20.409 17.778 7.100 1.00 0.00 C ATOM 282 C GLY A 20 20.498 17.820 5.610 1.00 0.00 C ATOM 283 O GLY A 20 19.476 17.978 4.951 1.00 0.00 O ATOM 0 H GLY A 20 19.027 19.273 7.520 1.00 0.00 H new ATOM 0 HA2 GLY A 20 21.196 18.391 7.539 1.00 0.00 H new ATOM 0 HA3 GLY A 20 20.563 16.759 7.455 1.00 0.00 H new ATOM 287 N LYS A 21 21.680 17.687 5.058 1.00 0.00 N ATOM 288 CA LYS A 21 21.813 17.710 3.611 1.00 0.00 C ATOM 289 C LYS A 21 21.360 16.385 3.039 1.00 0.00 C ATOM 290 O LYS A 21 22.142 15.439 2.902 1.00 0.00 O ATOM 291 CB LYS A 21 23.235 18.053 3.162 1.00 0.00 C ATOM 292 CG LYS A 21 23.706 19.425 3.622 1.00 0.00 C ATOM 293 CD LYS A 21 25.111 19.750 3.125 1.00 0.00 C ATOM 294 CE LYS A 21 25.175 19.894 1.608 1.00 0.00 C ATOM 295 NZ LYS A 21 24.302 20.976 1.103 1.00 0.00 N ATOM 0 H LYS A 21 22.552 17.564 5.572 1.00 0.00 H new ATOM 0 HA LYS A 21 21.173 18.504 3.226 1.00 0.00 H new ATOM 0 HB2 LYS A 21 23.920 17.296 3.544 1.00 0.00 H new ATOM 0 HB3 LYS A 21 23.284 18.007 2.074 1.00 0.00 H new ATOM 0 HG2 LYS A 21 23.011 20.185 3.263 1.00 0.00 H new ATOM 0 HG3 LYS A 21 23.689 19.466 4.711 1.00 0.00 H new ATOM 0 HD2 LYS A 21 25.452 20.675 3.589 1.00 0.00 H new ATOM 0 HD3 LYS A 21 25.796 18.963 3.441 1.00 0.00 H new ATOM 0 HE2 LYS A 21 26.204 20.093 1.309 1.00 0.00 H new ATOM 0 HE3 LYS A 21 24.884 18.951 1.144 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 24.541 21.181 0.112 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 23.308 20.677 1.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 24.443 21.832 1.677 1.00 0.00 H new ATOM 309 N THR A 22 20.087 16.297 2.799 1.00 0.00 N ATOM 310 CA THR A 22 19.478 15.104 2.320 1.00 0.00 C ATOM 311 C THR A 22 19.218 15.228 0.824 1.00 0.00 C ATOM 312 O THR A 22 19.732 14.442 0.024 1.00 0.00 O ATOM 313 CB THR A 22 18.150 14.854 3.074 1.00 0.00 C ATOM 314 OG1 THR A 22 18.385 14.976 4.495 1.00 0.00 O ATOM 315 CG2 THR A 22 17.607 13.458 2.778 1.00 0.00 C ATOM 0 H THR A 22 19.435 17.069 2.935 1.00 0.00 H new ATOM 0 HA THR A 22 20.146 14.261 2.496 1.00 0.00 H new ATOM 0 HB THR A 22 17.418 15.590 2.742 1.00 0.00 H new ATOM 0 HG1 THR A 22 17.547 14.821 4.980 1.00 0.00 H new ATOM 0 HG21 THR A 22 16.673 13.308 3.320 1.00 0.00 H new ATOM 0 HG22 THR A 22 17.425 13.358 1.708 1.00 0.00 H new ATOM 0 HG23 THR A 22 18.334 12.710 3.094 1.00 0.00 H new ATOM 323 N SER A 23 18.483 16.233 0.452 1.00 0.00 N ATOM 324 CA SER A 23 18.122 16.436 -0.915 1.00 0.00 C ATOM 325 C SER A 23 19.236 17.147 -1.683 1.00 0.00 C ATOM 326 O SER A 23 19.800 18.147 -1.213 1.00 0.00 O ATOM 327 CB SER A 23 16.819 17.225 -0.967 1.00 0.00 C ATOM 328 OG SER A 23 15.815 16.567 -0.199 1.00 0.00 O ATOM 0 H SER A 23 18.116 16.937 1.093 1.00 0.00 H new ATOM 0 HA SER A 23 17.976 15.470 -1.398 1.00 0.00 H new ATOM 0 HB2 SER A 23 16.980 18.232 -0.583 1.00 0.00 H new ATOM 0 HB3 SER A 23 16.488 17.327 -2.001 1.00 0.00 H new ATOM 0 HG SER A 23 14.983 17.083 -0.238 1.00 0.00 H new ATOM 334 N SER A 24 19.572 16.610 -2.837 1.00 0.00 N ATOM 335 CA SER A 24 20.557 17.207 -3.710 1.00 0.00 C ATOM 336 C SER A 24 19.900 18.323 -4.530 1.00 0.00 C ATOM 337 O SER A 24 20.567 19.152 -5.163 1.00 0.00 O ATOM 338 CB SER A 24 21.148 16.122 -4.605 1.00 0.00 C ATOM 339 OG SER A 24 20.112 15.358 -5.230 1.00 0.00 O ATOM 0 H SER A 24 19.168 15.745 -3.196 1.00 0.00 H new ATOM 0 HA SER A 24 21.366 17.651 -3.130 1.00 0.00 H new ATOM 0 HB2 SER A 24 21.780 16.578 -5.367 1.00 0.00 H new ATOM 0 HB3 SER A 24 21.785 15.464 -4.014 1.00 0.00 H new ATOM 0 HG SER A 24 20.512 14.669 -5.801 1.00 0.00 H new ATOM 345 N ALA A 25 18.590 18.305 -4.523 1.00 0.00 N ATOM 346 CA ALA A 25 17.767 19.292 -5.147 1.00 0.00 C ATOM 347 C ALA A 25 16.493 19.356 -4.349 1.00 0.00 C ATOM 348 O ALA A 25 16.025 18.320 -3.877 1.00 0.00 O ATOM 349 CB ALA A 25 17.474 18.919 -6.595 1.00 0.00 C ATOM 0 H ALA A 25 18.054 17.570 -4.062 1.00 0.00 H new ATOM 0 HA ALA A 25 18.268 20.260 -5.165 1.00 0.00 H new ATOM 0 HB1 ALA A 25 16.846 19.686 -7.048 1.00 0.00 H new ATOM 0 HB2 ALA A 25 18.410 18.843 -7.148 1.00 0.00 H new ATOM 0 HB3 ALA A 25 16.956 17.961 -6.626 1.00 0.00 H new ATOM 355 N SER A 26 15.960 20.546 -4.159 1.00 0.00 N ATOM 356 CA SER A 26 14.734 20.733 -3.400 1.00 0.00 C ATOM 357 C SER A 26 13.560 20.094 -4.130 1.00 0.00 C ATOM 358 O SER A 26 12.596 19.639 -3.510 1.00 0.00 O ATOM 359 CB SER A 26 14.501 22.218 -3.172 1.00 0.00 C ATOM 360 OG SER A 26 15.654 22.802 -2.573 1.00 0.00 O ATOM 0 H SER A 26 16.361 21.410 -4.524 1.00 0.00 H new ATOM 0 HA SER A 26 14.826 20.245 -2.430 1.00 0.00 H new ATOM 0 HB2 SER A 26 14.283 22.711 -4.120 1.00 0.00 H new ATOM 0 HB3 SER A 26 13.633 22.365 -2.530 1.00 0.00 H new ATOM 0 HG SER A 26 15.499 23.759 -2.430 1.00 0.00 H new ATOM 366 N THR A 27 13.648 20.078 -5.437 1.00 0.00 N ATOM 367 CA THR A 27 12.700 19.396 -6.250 1.00 0.00 C ATOM 368 C THR A 27 13.338 18.078 -6.722 1.00 0.00 C ATOM 369 O THR A 27 14.178 18.076 -7.652 1.00 0.00 O ATOM 370 CB THR A 27 12.307 20.258 -7.462 1.00 0.00 C ATOM 371 OG1 THR A 27 11.899 21.548 -6.991 1.00 0.00 O ATOM 372 CG2 THR A 27 11.155 19.619 -8.233 1.00 0.00 C ATOM 0 H THR A 27 14.389 20.544 -5.960 1.00 0.00 H new ATOM 0 HA THR A 27 11.795 19.195 -5.676 1.00 0.00 H new ATOM 0 HB THR A 27 13.164 20.344 -8.130 1.00 0.00 H new ATOM 0 HG1 THR A 27 11.647 22.110 -7.753 1.00 0.00 H new ATOM 0 HG21 THR A 27 10.895 20.247 -9.085 1.00 0.00 H new ATOM 0 HG22 THR A 27 11.457 18.633 -8.587 1.00 0.00 H new ATOM 0 HG23 THR A 27 10.289 19.520 -7.578 1.00 0.00 H new ATOM 380 N PRO A 28 13.008 16.945 -6.068 1.00 0.00 N ATOM 381 CA PRO A 28 13.568 15.643 -6.400 1.00 0.00 C ATOM 382 C PRO A 28 12.941 15.071 -7.675 1.00 0.00 C ATOM 383 O PRO A 28 12.185 14.085 -7.662 1.00 0.00 O ATOM 384 CB PRO A 28 13.253 14.771 -5.172 1.00 0.00 C ATOM 385 CG PRO A 28 12.626 15.694 -4.168 1.00 0.00 C ATOM 386 CD PRO A 28 12.065 16.838 -4.948 1.00 0.00 C ATOM 0 HA PRO A 28 14.637 15.692 -6.607 1.00 0.00 H new ATOM 0 HB2 PRO A 28 12.576 13.958 -5.433 1.00 0.00 H new ATOM 0 HB3 PRO A 28 14.159 14.315 -4.773 1.00 0.00 H new ATOM 0 HG2 PRO A 28 11.843 15.184 -3.606 1.00 0.00 H new ATOM 0 HG3 PRO A 28 13.363 16.041 -3.444 1.00 0.00 H new ATOM 0 HD2 PRO A 28 11.049 16.638 -5.289 1.00 0.00 H new ATOM 0 HD3 PRO A 28 12.029 17.754 -4.358 1.00 0.00 H new ATOM 394 N ALA A 29 13.220 15.745 -8.756 1.00 0.00 N ATOM 395 CA ALA A 29 12.782 15.359 -10.066 1.00 0.00 C ATOM 396 C ALA A 29 13.991 14.960 -10.883 1.00 0.00 C ATOM 397 O ALA A 29 13.893 14.644 -12.052 1.00 0.00 O ATOM 398 CB ALA A 29 12.050 16.519 -10.732 1.00 0.00 C ATOM 0 H ALA A 29 13.774 16.602 -8.748 1.00 0.00 H new ATOM 0 HA ALA A 29 12.095 14.516 -9.996 1.00 0.00 H new ATOM 0 HB1 ALA A 29 11.720 16.218 -11.727 1.00 0.00 H new ATOM 0 HB2 ALA A 29 11.184 16.796 -10.131 1.00 0.00 H new ATOM 0 HB3 ALA A 29 12.722 17.373 -10.815 1.00 0.00 H new ATOM 404 N THR A 30 15.127 14.976 -10.241 1.00 0.00 N ATOM 405 CA THR A 30 16.370 14.666 -10.871 1.00 0.00 C ATOM 406 C THR A 30 16.701 13.174 -10.760 1.00 0.00 C ATOM 407 O THR A 30 16.492 12.400 -11.702 1.00 0.00 O ATOM 408 CB THR A 30 17.470 15.504 -10.218 1.00 0.00 C ATOM 409 OG1 THR A 30 17.267 15.477 -8.780 1.00 0.00 O ATOM 410 CG2 THR A 30 17.428 16.940 -10.708 1.00 0.00 C ATOM 0 H THR A 30 15.211 15.209 -9.251 1.00 0.00 H new ATOM 0 HA THR A 30 16.297 14.901 -11.933 1.00 0.00 H new ATOM 0 HB THR A 30 18.442 15.088 -10.481 1.00 0.00 H new ATOM 0 HG1 THR A 30 17.964 16.008 -8.341 1.00 0.00 H new ATOM 0 HG21 THR A 30 18.221 17.512 -10.227 1.00 0.00 H new ATOM 0 HG22 THR A 30 17.570 16.960 -11.788 1.00 0.00 H new ATOM 0 HG23 THR A 30 16.462 17.381 -10.461 1.00 0.00 H new ATOM 418 N ARG A 31 17.174 12.783 -9.604 1.00 0.00 N ATOM 419 CA ARG A 31 17.579 11.423 -9.349 1.00 0.00 C ATOM 420 C ARG A 31 16.371 10.598 -8.852 1.00 0.00 C ATOM 421 O ARG A 31 15.946 9.680 -9.549 1.00 0.00 O ATOM 422 CB ARG A 31 18.836 11.431 -8.409 1.00 0.00 C ATOM 423 CG ARG A 31 19.602 10.105 -8.130 1.00 0.00 C ATOM 424 CD ARG A 31 18.903 9.116 -7.181 1.00 0.00 C ATOM 425 NE ARG A 31 17.959 8.214 -7.856 1.00 0.00 N ATOM 426 CZ ARG A 31 17.067 7.426 -7.233 1.00 0.00 C ATOM 427 NH1 ARG A 31 16.952 7.466 -5.904 1.00 0.00 N ATOM 428 NH2 ARG A 31 16.288 6.618 -7.947 1.00 0.00 N ATOM 0 H ARG A 31 17.290 13.406 -8.805 1.00 0.00 H new ATOM 0 HA ARG A 31 17.900 10.916 -10.259 1.00 0.00 H new ATOM 0 HB2 ARG A 31 19.552 12.138 -8.829 1.00 0.00 H new ATOM 0 HB3 ARG A 31 18.519 11.832 -7.446 1.00 0.00 H new ATOM 0 HG2 ARG A 31 19.780 9.603 -9.081 1.00 0.00 H new ATOM 0 HG3 ARG A 31 20.578 10.352 -7.713 1.00 0.00 H new ATOM 0 HD2 ARG A 31 19.660 8.520 -6.671 1.00 0.00 H new ATOM 0 HD3 ARG A 31 18.370 9.678 -6.414 1.00 0.00 H new ATOM 0 HE ARG A 31 17.983 8.184 -8.875 1.00 0.00 H new ATOM 0 HH11 ARG A 31 17.542 8.096 -5.360 1.00 0.00 H new ATOM 0 HH12 ARG A 31 16.274 6.867 -5.432 1.00 0.00 H new ATOM 0 HH21 ARG A 31 16.369 6.598 -8.964 1.00 0.00 H new ATOM 0 HH22 ARG A 31 15.609 6.018 -7.478 1.00 0.00 H new ATOM 442 N PRO A 32 15.728 10.918 -7.688 1.00 0.00 N ATOM 443 CA PRO A 32 14.577 10.155 -7.221 1.00 0.00 C ATOM 444 C PRO A 32 13.285 10.750 -7.788 1.00 0.00 C ATOM 445 O PRO A 32 12.296 10.919 -7.064 1.00 0.00 O ATOM 446 CB PRO A 32 14.657 10.350 -5.708 1.00 0.00 C ATOM 447 CG PRO A 32 15.177 11.736 -5.535 1.00 0.00 C ATOM 448 CD PRO A 32 16.031 12.034 -6.742 1.00 0.00 C ATOM 0 HA PRO A 32 14.579 9.108 -7.523 1.00 0.00 H new ATOM 0 HB2 PRO A 32 13.679 10.232 -5.241 1.00 0.00 H new ATOM 0 HB3 PRO A 32 15.320 9.617 -5.248 1.00 0.00 H new ATOM 0 HG2 PRO A 32 14.357 12.450 -5.456 1.00 0.00 H new ATOM 0 HG3 PRO A 32 15.761 11.818 -4.618 1.00 0.00 H new ATOM 0 HD2 PRO A 32 15.783 13.003 -7.176 1.00 0.00 H new ATOM 0 HD3 PRO A 32 17.090 12.062 -6.484 1.00 0.00 H new ATOM 456 N VAL A 33 13.311 11.022 -9.110 1.00 0.00 N ATOM 457 CA VAL A 33 12.221 11.663 -9.850 1.00 0.00 C ATOM 458 C VAL A 33 10.838 11.092 -9.511 1.00 0.00 C ATOM 459 O VAL A 33 10.484 9.997 -9.922 1.00 0.00 O ATOM 460 CB VAL A 33 12.486 11.707 -11.398 1.00 0.00 C ATOM 461 CG1 VAL A 33 12.776 10.328 -11.971 1.00 0.00 C ATOM 462 CG2 VAL A 33 11.328 12.374 -12.144 1.00 0.00 C ATOM 0 H VAL A 33 14.112 10.794 -9.699 1.00 0.00 H new ATOM 0 HA VAL A 33 12.206 12.697 -9.507 1.00 0.00 H new ATOM 0 HB VAL A 33 13.380 12.314 -11.545 1.00 0.00 H new ATOM 0 HG11 VAL A 33 12.953 10.409 -13.044 1.00 0.00 H new ATOM 0 HG12 VAL A 33 13.660 9.912 -11.488 1.00 0.00 H new ATOM 0 HG13 VAL A 33 11.923 9.673 -11.792 1.00 0.00 H new ATOM 0 HG21 VAL A 33 11.543 12.388 -13.212 1.00 0.00 H new ATOM 0 HG22 VAL A 33 10.410 11.814 -11.966 1.00 0.00 H new ATOM 0 HG23 VAL A 33 11.205 13.396 -11.785 1.00 0.00 H new ATOM 472 N THR A 34 10.177 11.831 -8.619 1.00 0.00 N ATOM 473 CA THR A 34 8.826 11.638 -8.049 1.00 0.00 C ATOM 474 C THR A 34 8.818 12.362 -6.719 1.00 0.00 C ATOM 475 O THR A 34 7.834 12.973 -6.319 1.00 0.00 O ATOM 476 CB THR A 34 8.409 10.149 -7.768 1.00 0.00 C ATOM 477 OG1 THR A 34 9.529 9.362 -7.315 1.00 0.00 O ATOM 478 CG2 THR A 34 7.702 9.487 -8.955 1.00 0.00 C ATOM 0 H THR A 34 10.613 12.668 -8.233 1.00 0.00 H new ATOM 0 HA THR A 34 8.118 12.011 -8.789 1.00 0.00 H new ATOM 0 HB THR A 34 7.677 10.187 -6.962 1.00 0.00 H new ATOM 0 HG1 THR A 34 9.236 8.442 -7.148 1.00 0.00 H new ATOM 0 HG21 THR A 34 7.440 8.461 -8.697 1.00 0.00 H new ATOM 0 HG22 THR A 34 6.796 10.043 -9.195 1.00 0.00 H new ATOM 0 HG23 THR A 34 8.366 9.485 -9.819 1.00 0.00 H new ATOM 486 N GLY A 35 9.958 12.301 -6.063 1.00 0.00 N ATOM 487 CA GLY A 35 10.136 12.880 -4.775 1.00 0.00 C ATOM 488 C GLY A 35 10.887 11.908 -3.918 1.00 0.00 C ATOM 489 O GLY A 35 12.103 11.938 -3.842 1.00 0.00 O ATOM 0 H GLY A 35 10.791 11.838 -6.427 1.00 0.00 H new ATOM 0 HA2 GLY A 35 10.685 13.818 -4.854 1.00 0.00 H new ATOM 0 HA3 GLY A 35 9.170 13.112 -4.327 1.00 0.00 H new ATOM 493 N SER A 36 10.158 11.047 -3.277 1.00 0.00 N ATOM 494 CA SER A 36 10.706 9.955 -2.492 1.00 0.00 C ATOM 495 C SER A 36 9.621 8.896 -2.385 1.00 0.00 C ATOM 496 O SER A 36 9.586 8.098 -1.447 1.00 0.00 O ATOM 497 CB SER A 36 11.125 10.447 -1.089 1.00 0.00 C ATOM 498 OG SER A 36 12.111 11.487 -1.171 1.00 0.00 O ATOM 0 H SER A 36 9.138 11.075 -3.278 1.00 0.00 H new ATOM 0 HA SER A 36 11.598 9.548 -2.969 1.00 0.00 H new ATOM 0 HB2 SER A 36 10.249 10.815 -0.554 1.00 0.00 H new ATOM 0 HB3 SER A 36 11.522 9.612 -0.513 1.00 0.00 H new ATOM 0 HG SER A 36 12.326 11.660 -2.111 1.00 0.00 H new ATOM 504 N TRP A 37 8.771 8.870 -3.401 1.00 0.00 N ATOM 505 CA TRP A 37 7.607 8.018 -3.415 1.00 0.00 C ATOM 506 C TRP A 37 7.945 6.677 -4.032 1.00 0.00 C ATOM 507 O TRP A 37 8.787 6.587 -4.929 1.00 0.00 O ATOM 508 CB TRP A 37 6.475 8.662 -4.231 1.00 0.00 C ATOM 509 CG TRP A 37 6.042 10.024 -3.770 1.00 0.00 C ATOM 510 CD1 TRP A 37 6.597 11.211 -4.119 1.00 0.00 C ATOM 511 CD2 TRP A 37 4.946 10.338 -2.901 1.00 0.00 C ATOM 512 NE1 TRP A 37 5.932 12.243 -3.521 1.00 0.00 N ATOM 513 CE2 TRP A 37 4.909 11.738 -2.769 1.00 0.00 C ATOM 514 CE3 TRP A 37 3.993 9.576 -2.224 1.00 0.00 C ATOM 515 CZ2 TRP A 37 3.964 12.390 -1.986 1.00 0.00 C ATOM 516 CZ3 TRP A 37 3.056 10.223 -1.446 1.00 0.00 C ATOM 517 CH2 TRP A 37 3.046 11.618 -1.335 1.00 0.00 C ATOM 0 H TRP A 37 8.876 9.444 -4.238 1.00 0.00 H new ATOM 0 HA TRP A 37 7.281 7.880 -2.384 1.00 0.00 H new ATOM 0 HB2 TRP A 37 6.795 8.734 -5.270 1.00 0.00 H new ATOM 0 HB3 TRP A 37 5.611 7.998 -4.209 1.00 0.00 H new ATOM 0 HD1 TRP A 37 7.446 11.324 -4.777 1.00 0.00 H new ATOM 0 HE1 TRP A 37 6.162 13.232 -3.620 1.00 0.00 H new ATOM 0 HE3 TRP A 37 3.989 8.499 -2.308 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 3.956 13.466 -1.896 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 2.317 9.643 -0.913 1.00 0.00 H new ATOM 0 HH2 TRP A 37 2.296 12.094 -0.721 1.00 0.00 H new ATOM 528 N LYS A 38 7.327 5.651 -3.535 1.00 0.00 N ATOM 529 CA LYS A 38 7.441 4.312 -4.065 1.00 0.00 C ATOM 530 C LYS A 38 6.040 3.757 -4.202 1.00 0.00 C ATOM 531 O LYS A 38 5.168 4.119 -3.422 1.00 0.00 O ATOM 532 CB LYS A 38 8.291 3.426 -3.134 1.00 0.00 C ATOM 533 CG LYS A 38 9.793 3.782 -3.053 1.00 0.00 C ATOM 534 CD LYS A 38 10.661 3.087 -4.135 1.00 0.00 C ATOM 535 CE LYS A 38 10.376 3.521 -5.579 1.00 0.00 C ATOM 536 NZ LYS A 38 10.698 4.941 -5.834 1.00 0.00 N ATOM 0 H LYS A 38 6.709 5.715 -2.726 1.00 0.00 H new ATOM 0 HA LYS A 38 7.940 4.328 -5.034 1.00 0.00 H new ATOM 0 HB2 LYS A 38 7.870 3.478 -2.130 1.00 0.00 H new ATOM 0 HB3 LYS A 38 8.199 2.391 -3.465 1.00 0.00 H new ATOM 0 HG2 LYS A 38 9.906 4.862 -3.148 1.00 0.00 H new ATOM 0 HG3 LYS A 38 10.169 3.508 -2.067 1.00 0.00 H new ATOM 0 HD2 LYS A 38 11.711 3.280 -3.915 1.00 0.00 H new ATOM 0 HD3 LYS A 38 10.513 2.010 -4.060 1.00 0.00 H new ATOM 0 HE2 LYS A 38 10.954 2.896 -6.260 1.00 0.00 H new ATOM 0 HE3 LYS A 38 9.323 3.348 -5.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 10.581 5.147 -6.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 10.058 5.547 -5.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 11.682 5.130 -5.554 1.00 0.00 H new ATOM 550 N LYS A 39 5.810 2.937 -5.195 1.00 0.00 N ATOM 551 CA LYS A 39 4.487 2.387 -5.428 1.00 0.00 C ATOM 552 C LYS A 39 4.355 1.034 -4.744 1.00 0.00 C ATOM 553 O LYS A 39 5.255 0.195 -4.833 1.00 0.00 O ATOM 554 CB LYS A 39 4.222 2.229 -6.939 1.00 0.00 C ATOM 555 CG LYS A 39 2.818 1.719 -7.277 1.00 0.00 C ATOM 556 CD LYS A 39 2.654 1.374 -8.759 1.00 0.00 C ATOM 557 CE LYS A 39 2.822 2.584 -9.667 1.00 0.00 C ATOM 558 NZ LYS A 39 2.629 2.243 -11.094 1.00 0.00 N ATOM 0 H LYS A 39 6.520 2.631 -5.860 1.00 0.00 H new ATOM 0 HA LYS A 39 3.752 3.076 -5.012 1.00 0.00 H new ATOM 0 HB2 LYS A 39 4.374 3.192 -7.426 1.00 0.00 H new ATOM 0 HB3 LYS A 39 4.957 1.541 -7.356 1.00 0.00 H new ATOM 0 HG2 LYS A 39 2.603 0.835 -6.677 1.00 0.00 H new ATOM 0 HG3 LYS A 39 2.085 2.477 -7.002 1.00 0.00 H new ATOM 0 HD2 LYS A 39 3.386 0.614 -9.034 1.00 0.00 H new ATOM 0 HD3 LYS A 39 1.668 0.939 -8.919 1.00 0.00 H new ATOM 0 HE2 LYS A 39 2.106 3.354 -9.379 1.00 0.00 H new ATOM 0 HE3 LYS A 39 3.817 3.006 -9.527 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 2.753 3.097 -11.675 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 3.328 1.527 -11.377 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 1.670 1.865 -11.234 1.00 0.00 H new ATOM 572 N ASN A 40 3.269 0.838 -4.055 1.00 0.00 N ATOM 573 CA ASN A 40 2.980 -0.444 -3.440 1.00 0.00 C ATOM 574 C ASN A 40 2.051 -1.241 -4.360 1.00 0.00 C ATOM 575 O ASN A 40 1.582 -0.715 -5.378 1.00 0.00 O ATOM 576 CB ASN A 40 2.387 -0.284 -2.006 1.00 0.00 C ATOM 577 CG ASN A 40 1.086 0.519 -1.922 1.00 0.00 C ATOM 578 OD1 ASN A 40 0.270 0.527 -2.841 1.00 0.00 O ATOM 579 ND2 ASN A 40 0.891 1.207 -0.817 1.00 0.00 N ATOM 0 H ASN A 40 2.557 1.551 -3.899 1.00 0.00 H new ATOM 0 HA ASN A 40 3.912 -0.995 -3.315 1.00 0.00 H new ATOM 0 HB2 ASN A 40 2.210 -1.276 -1.591 1.00 0.00 H new ATOM 0 HB3 ASN A 40 3.133 0.197 -1.374 1.00 0.00 H new ATOM 0 HD21 ASN A 40 0.045 1.766 -0.707 1.00 0.00 H new ATOM 0 HD22 ASN A 40 1.586 1.181 -0.071 1.00 0.00 H new ATOM 586 N GLN A 41 1.727 -2.472 -3.993 1.00 0.00 N ATOM 587 CA GLN A 41 0.914 -3.342 -4.862 1.00 0.00 C ATOM 588 C GLN A 41 -0.562 -2.977 -4.822 1.00 0.00 C ATOM 589 O GLN A 41 -1.396 -3.600 -5.476 1.00 0.00 O ATOM 590 CB GLN A 41 1.108 -4.811 -4.505 1.00 0.00 C ATOM 591 CG GLN A 41 2.537 -5.296 -4.671 1.00 0.00 C ATOM 592 CD GLN A 41 3.078 -5.048 -6.068 1.00 0.00 C ATOM 593 OE1 GLN A 41 3.690 -4.010 -6.350 1.00 0.00 O ATOM 594 NE2 GLN A 41 2.828 -5.967 -6.950 1.00 0.00 N ATOM 0 H GLN A 41 2.007 -2.898 -3.109 1.00 0.00 H new ATOM 0 HA GLN A 41 1.264 -3.182 -5.882 1.00 0.00 H new ATOM 0 HB2 GLN A 41 0.798 -4.969 -3.472 1.00 0.00 H new ATOM 0 HB3 GLN A 41 0.453 -5.417 -5.131 1.00 0.00 H new ATOM 0 HG2 GLN A 41 3.174 -4.793 -3.944 1.00 0.00 H new ATOM 0 HG3 GLN A 41 2.583 -6.363 -4.451 1.00 0.00 H new ATOM 0 HE21 GLN A 41 2.321 -6.809 -6.679 1.00 0.00 H new ATOM 0 HE22 GLN A 41 3.139 -5.847 -7.914 1.00 0.00 H new ATOM 603 N TYR A 42 -0.863 -1.958 -4.075 1.00 0.00 N ATOM 604 CA TYR A 42 -2.209 -1.458 -3.945 1.00 0.00 C ATOM 605 C TYR A 42 -2.388 -0.251 -4.871 1.00 0.00 C ATOM 606 O TYR A 42 -3.395 0.470 -4.813 1.00 0.00 O ATOM 607 CB TYR A 42 -2.485 -1.077 -2.483 1.00 0.00 C ATOM 608 CG TYR A 42 -2.253 -2.213 -1.500 1.00 0.00 C ATOM 609 CD1 TYR A 42 -2.932 -3.421 -1.630 1.00 0.00 C ATOM 610 CD2 TYR A 42 -1.362 -2.075 -0.441 1.00 0.00 C ATOM 611 CE1 TYR A 42 -2.733 -4.454 -0.739 1.00 0.00 C ATOM 612 CE2 TYR A 42 -1.155 -3.109 0.456 1.00 0.00 C ATOM 613 CZ TYR A 42 -1.844 -4.296 0.299 1.00 0.00 C ATOM 614 OH TYR A 42 -1.652 -5.328 1.194 1.00 0.00 O ATOM 0 H TYR A 42 -0.175 -1.440 -3.529 1.00 0.00 H new ATOM 0 HA TYR A 42 -2.923 -2.230 -4.233 1.00 0.00 H new ATOM 0 HB2 TYR A 42 -1.848 -0.236 -2.210 1.00 0.00 H new ATOM 0 HB3 TYR A 42 -3.517 -0.737 -2.394 1.00 0.00 H new ATOM 0 HD1 TYR A 42 -3.629 -3.552 -2.445 1.00 0.00 H new ATOM 0 HD2 TYR A 42 -0.823 -1.147 -0.317 1.00 0.00 H new ATOM 0 HE1 TYR A 42 -3.272 -5.383 -0.855 1.00 0.00 H new ATOM 0 HE2 TYR A 42 -0.459 -2.988 1.273 1.00 0.00 H new ATOM 0 HH TYR A 42 -0.992 -5.059 1.867 1.00 0.00 H new ATOM 624 N GLY A 43 -1.367 -0.017 -5.703 1.00 0.00 N ATOM 625 CA GLY A 43 -1.399 1.048 -6.687 1.00 0.00 C ATOM 626 C GLY A 43 -1.272 2.411 -6.059 1.00 0.00 C ATOM 627 O GLY A 43 -1.593 3.435 -6.681 1.00 0.00 O ATOM 0 H GLY A 43 -0.505 -0.562 -5.706 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -0.589 0.903 -7.402 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -2.333 0.994 -7.247 1.00 0.00 H new ATOM 631 N THR A 44 -0.809 2.431 -4.846 1.00 0.00 N ATOM 632 CA THR A 44 -0.686 3.637 -4.106 1.00 0.00 C ATOM 633 C THR A 44 0.782 4.045 -4.049 1.00 0.00 C ATOM 634 O THR A 44 1.665 3.184 -3.961 1.00 0.00 O ATOM 635 CB THR A 44 -1.186 3.400 -2.674 1.00 0.00 C ATOM 636 OG1 THR A 44 -2.399 2.640 -2.714 1.00 0.00 O ATOM 637 CG2 THR A 44 -1.458 4.713 -1.985 1.00 0.00 C ATOM 0 H THR A 44 -0.504 1.598 -4.342 1.00 0.00 H new ATOM 0 HA THR A 44 -1.273 4.421 -4.585 1.00 0.00 H new ATOM 0 HB THR A 44 -0.418 2.858 -2.122 1.00 0.00 H new ATOM 0 HG1 THR A 44 -2.719 2.486 -1.801 1.00 0.00 H new ATOM 0 HG21 THR A 44 -1.812 4.525 -0.971 1.00 0.00 H new ATOM 0 HG22 THR A 44 -0.541 5.301 -1.947 1.00 0.00 H new ATOM 0 HG23 THR A 44 -2.219 5.264 -2.538 1.00 0.00 H new ATOM 645 N TRP A 45 1.039 5.319 -4.138 1.00 0.00 N ATOM 646 CA TRP A 45 2.382 5.827 -3.978 1.00 0.00 C ATOM 647 C TRP A 45 2.556 6.284 -2.566 1.00 0.00 C ATOM 648 O TRP A 45 1.722 7.020 -2.059 1.00 0.00 O ATOM 649 CB TRP A 45 2.661 6.978 -4.931 1.00 0.00 C ATOM 650 CG TRP A 45 2.807 6.563 -6.351 1.00 0.00 C ATOM 651 CD1 TRP A 45 1.823 6.441 -7.279 1.00 0.00 C ATOM 652 CD2 TRP A 45 4.027 6.222 -7.008 1.00 0.00 C ATOM 653 NE1 TRP A 45 2.356 6.040 -8.476 1.00 0.00 N ATOM 654 CE2 TRP A 45 3.713 5.899 -8.331 1.00 0.00 C ATOM 655 CE3 TRP A 45 5.357 6.160 -6.598 1.00 0.00 C ATOM 656 CZ2 TRP A 45 4.685 5.516 -9.250 1.00 0.00 C ATOM 657 CZ3 TRP A 45 6.318 5.780 -7.507 1.00 0.00 C ATOM 658 CH2 TRP A 45 5.979 5.464 -8.817 1.00 0.00 C ATOM 0 H TRP A 45 0.334 6.033 -4.322 1.00 0.00 H new ATOM 0 HA TRP A 45 3.088 5.030 -4.210 1.00 0.00 H new ATOM 0 HB2 TRP A 45 1.851 7.703 -4.856 1.00 0.00 H new ATOM 0 HB3 TRP A 45 3.573 7.485 -4.615 1.00 0.00 H new ATOM 0 HD1 TRP A 45 0.775 6.632 -7.100 1.00 0.00 H new ATOM 0 HE1 TRP A 45 1.830 5.874 -9.334 1.00 0.00 H new ATOM 0 HE3 TRP A 45 5.630 6.406 -5.582 1.00 0.00 H new ATOM 0 HZ2 TRP A 45 4.425 5.269 -10.269 1.00 0.00 H new ATOM 0 HZ3 TRP A 45 7.351 5.727 -7.197 1.00 0.00 H new ATOM 0 HH2 TRP A 45 6.756 5.171 -9.508 1.00 0.00 H new ATOM 669 N TYR A 46 3.595 5.841 -1.927 1.00 0.00 N ATOM 670 CA TYR A 46 3.840 6.204 -0.557 1.00 0.00 C ATOM 671 C TYR A 46 5.227 6.790 -0.407 1.00 0.00 C ATOM 672 O TYR A 46 6.132 6.457 -1.177 1.00 0.00 O ATOM 673 CB TYR A 46 3.663 4.988 0.383 1.00 0.00 C ATOM 674 CG TYR A 46 4.667 3.860 0.191 1.00 0.00 C ATOM 675 CD1 TYR A 46 5.864 3.850 0.897 1.00 0.00 C ATOM 676 CD2 TYR A 46 4.413 2.805 -0.681 1.00 0.00 C ATOM 677 CE1 TYR A 46 6.776 2.840 0.741 1.00 0.00 C ATOM 678 CE2 TYR A 46 5.330 1.778 -0.839 1.00 0.00 C ATOM 679 CZ TYR A 46 6.509 1.805 -0.126 1.00 0.00 C ATOM 680 OH TYR A 46 7.430 0.778 -0.265 1.00 0.00 O ATOM 0 H TYR A 46 4.296 5.221 -2.334 1.00 0.00 H new ATOM 0 HA TYR A 46 3.107 6.959 -0.272 1.00 0.00 H new ATOM 0 HB2 TYR A 46 3.726 5.336 1.414 1.00 0.00 H new ATOM 0 HB3 TYR A 46 2.660 4.586 0.243 1.00 0.00 H new ATOM 0 HD1 TYR A 46 6.080 4.656 1.583 1.00 0.00 H new ATOM 0 HD2 TYR A 46 3.490 2.787 -1.241 1.00 0.00 H new ATOM 0 HE1 TYR A 46 7.702 2.856 1.297 1.00 0.00 H new ATOM 0 HE2 TYR A 46 5.122 0.963 -1.516 1.00 0.00 H new ATOM 0 HH TYR A 46 7.095 0.123 -0.913 1.00 0.00 H new ATOM 690 N LYS A 47 5.385 7.670 0.541 1.00 0.00 N ATOM 691 CA LYS A 47 6.677 8.226 0.847 1.00 0.00 C ATOM 692 C LYS A 47 6.843 8.240 2.354 1.00 0.00 C ATOM 693 O LYS A 47 5.843 8.354 3.091 1.00 0.00 O ATOM 694 CB LYS A 47 6.835 9.685 0.319 1.00 0.00 C ATOM 695 CG LYS A 47 6.061 10.748 1.125 1.00 0.00 C ATOM 696 CD LYS A 47 6.290 12.175 0.615 1.00 0.00 C ATOM 697 CE LYS A 47 7.758 12.611 0.662 1.00 0.00 C ATOM 698 NZ LYS A 47 8.326 12.679 2.037 1.00 0.00 N ATOM 0 H LYS A 47 4.625 8.023 1.123 1.00 0.00 H new ATOM 0 HA LYS A 47 7.433 7.611 0.359 1.00 0.00 H new ATOM 0 HB2 LYS A 47 7.893 9.946 0.322 1.00 0.00 H new ATOM 0 HB3 LYS A 47 6.501 9.720 -0.718 1.00 0.00 H new ATOM 0 HG2 LYS A 47 4.996 10.521 1.085 1.00 0.00 H new ATOM 0 HG3 LYS A 47 6.360 10.690 2.172 1.00 0.00 H new ATOM 0 HD2 LYS A 47 5.930 12.248 -0.411 1.00 0.00 H new ATOM 0 HD3 LYS A 47 5.694 12.866 1.212 1.00 0.00 H new ATOM 0 HE2 LYS A 47 8.352 11.916 0.069 1.00 0.00 H new ATOM 0 HE3 LYS A 47 7.851 13.590 0.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 9.338 12.914 1.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 7.829 13.412 2.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 8.209 11.759 2.507 1.00 0.00 H new ATOM 712 N PRO A 48 8.064 8.080 2.848 1.00 0.00 N ATOM 713 CA PRO A 48 8.336 8.276 4.253 1.00 0.00 C ATOM 714 C PRO A 48 8.251 9.772 4.574 1.00 0.00 C ATOM 715 O PRO A 48 8.826 10.615 3.847 1.00 0.00 O ATOM 716 CB PRO A 48 9.772 7.758 4.432 1.00 0.00 C ATOM 717 CG PRO A 48 10.384 7.819 3.072 1.00 0.00 C ATOM 718 CD PRO A 48 9.259 7.650 2.092 1.00 0.00 C ATOM 0 HA PRO A 48 7.634 7.764 4.911 1.00 0.00 H new ATOM 0 HB2 PRO A 48 10.327 8.373 5.141 1.00 0.00 H new ATOM 0 HB3 PRO A 48 9.777 6.740 4.821 1.00 0.00 H new ATOM 0 HG2 PRO A 48 10.893 8.770 2.918 1.00 0.00 H new ATOM 0 HG3 PRO A 48 11.130 7.034 2.946 1.00 0.00 H new ATOM 0 HD2 PRO A 48 9.410 8.260 1.201 1.00 0.00 H new ATOM 0 HD3 PRO A 48 9.171 6.616 1.759 1.00 0.00 H new ATOM 726 N GLU A 49 7.492 10.110 5.582 1.00 0.00 N ATOM 727 CA GLU A 49 7.332 11.487 5.998 1.00 0.00 C ATOM 728 C GLU A 49 6.769 11.479 7.399 1.00 0.00 C ATOM 729 O GLU A 49 5.684 10.973 7.616 1.00 0.00 O ATOM 730 CB GLU A 49 6.331 12.189 5.067 1.00 0.00 C ATOM 731 CG GLU A 49 6.230 13.689 5.257 1.00 0.00 C ATOM 732 CD GLU A 49 7.492 14.385 4.852 1.00 0.00 C ATOM 733 OE1 GLU A 49 7.648 14.684 3.645 1.00 0.00 O ATOM 734 OE2 GLU A 49 8.358 14.622 5.704 1.00 0.00 O ATOM 0 H GLU A 49 6.964 9.441 6.142 1.00 0.00 H new ATOM 0 HA GLU A 49 8.288 12.010 5.962 1.00 0.00 H new ATOM 0 HB2 GLU A 49 6.613 11.986 4.034 1.00 0.00 H new ATOM 0 HB3 GLU A 49 5.345 11.750 5.220 1.00 0.00 H new ATOM 0 HG2 GLU A 49 5.397 14.075 4.669 1.00 0.00 H new ATOM 0 HG3 GLU A 49 6.012 13.910 6.302 1.00 0.00 H new ATOM 741 N ASN A 50 7.476 12.052 8.326 1.00 0.00 N ATOM 742 CA ASN A 50 7.021 12.063 9.699 1.00 0.00 C ATOM 743 C ASN A 50 6.525 13.441 10.052 1.00 0.00 C ATOM 744 O ASN A 50 7.303 14.411 10.074 1.00 0.00 O ATOM 745 CB ASN A 50 8.136 11.629 10.660 1.00 0.00 C ATOM 746 CG ASN A 50 7.654 11.434 12.099 1.00 0.00 C ATOM 747 OD1 ASN A 50 7.243 10.339 12.488 1.00 0.00 O ATOM 748 ND2 ASN A 50 7.726 12.466 12.903 1.00 0.00 N ATOM 0 H ASN A 50 8.369 12.519 8.166 1.00 0.00 H new ATOM 0 HA ASN A 50 6.205 11.347 9.801 1.00 0.00 H new ATOM 0 HB2 ASN A 50 8.573 10.697 10.301 1.00 0.00 H new ATOM 0 HB3 ASN A 50 8.928 12.378 10.648 1.00 0.00 H new ATOM 0 HD21 ASN A 50 7.438 12.375 13.877 1.00 0.00 H new ATOM 0 HD22 ASN A 50 8.070 13.361 12.555 1.00 0.00 H new ATOM 755 N ALA A 51 5.248 13.528 10.289 1.00 0.00 N ATOM 756 CA ALA A 51 4.580 14.760 10.632 1.00 0.00 C ATOM 757 C ALA A 51 3.361 14.415 11.465 1.00 0.00 C ATOM 758 O ALA A 51 3.067 13.224 11.653 1.00 0.00 O ATOM 759 CB ALA A 51 4.186 15.517 9.373 1.00 0.00 C ATOM 0 H ALA A 51 4.621 12.724 10.249 1.00 0.00 H new ATOM 0 HA ALA A 51 5.245 15.407 11.204 1.00 0.00 H new ATOM 0 HB1 ALA A 51 3.683 16.444 9.648 1.00 0.00 H new ATOM 0 HB2 ALA A 51 5.079 15.747 8.792 1.00 0.00 H new ATOM 0 HB3 ALA A 51 3.513 14.903 8.775 1.00 0.00 H new ATOM 765 N THR A 52 2.656 15.397 11.958 1.00 0.00 N ATOM 766 CA THR A 52 1.527 15.123 12.817 1.00 0.00 C ATOM 767 C THR A 52 0.210 15.648 12.233 1.00 0.00 C ATOM 768 O THR A 52 0.135 16.759 11.758 1.00 0.00 O ATOM 769 CB THR A 52 1.775 15.720 14.221 1.00 0.00 C ATOM 770 OG1 THR A 52 2.990 15.159 14.762 1.00 0.00 O ATOM 771 CG2 THR A 52 0.629 15.412 15.167 1.00 0.00 C ATOM 0 H THR A 52 2.837 16.386 11.785 1.00 0.00 H new ATOM 0 HA THR A 52 1.429 14.040 12.896 1.00 0.00 H new ATOM 0 HB THR A 52 1.857 16.802 14.122 1.00 0.00 H new ATOM 0 HG1 THR A 52 3.155 15.534 15.652 1.00 0.00 H new ATOM 0 HG21 THR A 52 0.837 15.847 16.145 1.00 0.00 H new ATOM 0 HG22 THR A 52 -0.294 15.835 14.771 1.00 0.00 H new ATOM 0 HG23 THR A 52 0.519 14.332 15.266 1.00 0.00 H new ATOM 779 N PHE A 53 -0.802 14.823 12.256 1.00 0.00 N ATOM 780 CA PHE A 53 -2.110 15.209 11.817 1.00 0.00 C ATOM 781 C PHE A 53 -3.013 15.347 13.023 1.00 0.00 C ATOM 782 O PHE A 53 -3.063 14.458 13.876 1.00 0.00 O ATOM 783 CB PHE A 53 -2.688 14.176 10.835 1.00 0.00 C ATOM 784 CG PHE A 53 -4.113 14.453 10.417 1.00 0.00 C ATOM 785 CD1 PHE A 53 -4.403 15.463 9.520 1.00 0.00 C ATOM 786 CD2 PHE A 53 -5.160 13.706 10.938 1.00 0.00 C ATOM 787 CE1 PHE A 53 -5.704 15.723 9.144 1.00 0.00 C ATOM 788 CE2 PHE A 53 -6.464 13.964 10.568 1.00 0.00 C ATOM 789 CZ PHE A 53 -6.737 14.973 9.671 1.00 0.00 C ATOM 0 H PHE A 53 -0.739 13.859 12.582 1.00 0.00 H new ATOM 0 HA PHE A 53 -2.043 16.163 11.295 1.00 0.00 H new ATOM 0 HB2 PHE A 53 -2.059 14.145 9.945 1.00 0.00 H new ATOM 0 HB3 PHE A 53 -2.641 13.188 11.294 1.00 0.00 H new ATOM 0 HD1 PHE A 53 -3.600 16.057 9.108 1.00 0.00 H new ATOM 0 HD2 PHE A 53 -4.952 12.913 11.641 1.00 0.00 H new ATOM 0 HE1 PHE A 53 -5.915 16.513 8.438 1.00 0.00 H new ATOM 0 HE2 PHE A 53 -7.270 13.375 10.981 1.00 0.00 H new ATOM 0 HZ PHE A 53 -7.757 15.177 9.380 1.00 0.00 H new ATOM 799 N VAL A 54 -3.680 16.447 13.119 1.00 0.00 N ATOM 800 CA VAL A 54 -4.629 16.663 14.175 1.00 0.00 C ATOM 801 C VAL A 54 -6.005 16.662 13.559 1.00 0.00 C ATOM 802 O VAL A 54 -6.306 17.515 12.722 1.00 0.00 O ATOM 803 CB VAL A 54 -4.385 18.010 14.911 1.00 0.00 C ATOM 804 CG1 VAL A 54 -5.364 18.189 16.066 1.00 0.00 C ATOM 805 CG2 VAL A 54 -2.955 18.092 15.414 1.00 0.00 C ATOM 0 H VAL A 54 -3.587 17.228 12.469 1.00 0.00 H new ATOM 0 HA VAL A 54 -4.524 15.871 14.917 1.00 0.00 H new ATOM 0 HB VAL A 54 -4.551 18.817 14.197 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -5.170 19.140 16.563 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -6.384 18.181 15.683 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -5.238 17.374 16.779 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -2.803 19.042 15.926 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -2.765 17.272 16.106 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -2.268 18.021 14.571 1.00 0.00 H new ATOM 815 N ASN A 55 -6.807 15.693 13.921 1.00 0.00 N ATOM 816 CA ASN A 55 -8.154 15.572 13.375 1.00 0.00 C ATOM 817 C ASN A 55 -9.041 16.705 13.886 1.00 0.00 C ATOM 818 O ASN A 55 -8.852 17.195 15.012 1.00 0.00 O ATOM 819 CB ASN A 55 -8.773 14.194 13.701 1.00 0.00 C ATOM 820 CG ASN A 55 -10.152 14.009 13.074 1.00 0.00 C ATOM 821 OD1 ASN A 55 -10.454 14.566 12.022 1.00 0.00 O ATOM 822 ND2 ASN A 55 -10.982 13.221 13.688 1.00 0.00 N ATOM 0 H ASN A 55 -6.558 14.968 14.594 1.00 0.00 H new ATOM 0 HA ASN A 55 -8.086 15.651 12.290 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -8.108 13.407 13.346 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -8.851 14.081 14.782 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -11.909 13.053 13.298 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -10.707 12.770 14.561 1.00 0.00 H new ATOM 829 N GLY A 56 -9.989 17.110 13.067 1.00 0.00 N ATOM 830 CA GLY A 56 -10.855 18.201 13.389 1.00 0.00 C ATOM 831 C GLY A 56 -12.013 17.819 14.294 1.00 0.00 C ATOM 832 O GLY A 56 -11.901 16.922 15.128 1.00 0.00 O ATOM 0 H GLY A 56 -10.173 16.684 12.159 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -10.272 18.985 13.872 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -11.252 18.622 12.465 1.00 0.00 H new ATOM 836 N ASN A 57 -13.140 18.452 14.063 1.00 0.00 N ATOM 837 CA ASN A 57 -14.324 18.360 14.931 1.00 0.00 C ATOM 838 C ASN A 57 -15.225 17.166 14.615 1.00 0.00 C ATOM 839 O ASN A 57 -16.356 17.081 15.122 1.00 0.00 O ATOM 840 CB ASN A 57 -15.150 19.654 14.826 1.00 0.00 C ATOM 841 CG ASN A 57 -15.829 19.855 13.460 1.00 0.00 C ATOM 842 OD1 ASN A 57 -15.343 19.390 12.417 1.00 0.00 O ATOM 843 ND2 ASN A 57 -16.942 20.553 13.454 1.00 0.00 N ATOM 0 H ASN A 57 -13.277 19.060 13.256 1.00 0.00 H new ATOM 0 HA ASN A 57 -13.948 18.217 15.944 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -15.915 19.649 15.603 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -14.499 20.505 15.025 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -17.431 20.726 12.576 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -17.317 20.922 14.328 1.00 0.00 H new ATOM 850 N GLN A 58 -14.754 16.250 13.820 1.00 0.00 N ATOM 851 CA GLN A 58 -15.545 15.098 13.481 1.00 0.00 C ATOM 852 C GLN A 58 -14.704 13.836 13.386 1.00 0.00 C ATOM 853 O GLN A 58 -13.546 13.901 13.005 1.00 0.00 O ATOM 854 CB GLN A 58 -16.452 15.341 12.234 1.00 0.00 C ATOM 855 CG GLN A 58 -15.806 15.918 10.956 1.00 0.00 C ATOM 856 CD GLN A 58 -14.800 15.008 10.271 1.00 0.00 C ATOM 857 OE1 GLN A 58 -15.176 14.163 9.461 1.00 0.00 O ATOM 858 NE2 GLN A 58 -13.534 15.239 10.493 1.00 0.00 N ATOM 0 H GLN A 58 -13.828 16.276 13.394 1.00 0.00 H new ATOM 0 HA GLN A 58 -16.235 14.931 14.308 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -16.916 14.390 11.971 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -17.254 16.015 12.534 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -16.597 16.159 10.245 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -15.310 16.855 11.210 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -13.256 15.948 11.172 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -12.823 14.711 9.987 1.00 0.00 H new ATOM 867 N PRO A 59 -15.237 12.683 13.811 1.00 0.00 N ATOM 868 CA PRO A 59 -14.528 11.419 13.707 1.00 0.00 C ATOM 869 C PRO A 59 -14.453 10.937 12.255 1.00 0.00 C ATOM 870 O PRO A 59 -15.469 10.887 11.546 1.00 0.00 O ATOM 871 CB PRO A 59 -15.367 10.446 14.547 1.00 0.00 C ATOM 872 CG PRO A 59 -16.331 11.301 15.295 1.00 0.00 C ATOM 873 CD PRO A 59 -16.551 12.507 14.446 1.00 0.00 C ATOM 0 HA PRO A 59 -13.497 11.501 14.051 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -15.888 9.728 13.913 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -14.739 9.873 15.229 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -17.267 10.772 15.472 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -15.932 11.578 16.271 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -17.341 12.349 13.711 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -16.836 13.376 15.039 1.00 0.00 H new ATOM 881 N ILE A 60 -13.282 10.555 11.835 1.00 0.00 N ATOM 882 CA ILE A 60 -13.070 10.119 10.476 1.00 0.00 C ATOM 883 C ILE A 60 -12.869 8.623 10.483 1.00 0.00 C ATOM 884 O ILE A 60 -12.133 8.102 11.319 1.00 0.00 O ATOM 885 CB ILE A 60 -11.807 10.796 9.839 1.00 0.00 C ATOM 886 CG1 ILE A 60 -11.952 12.323 9.834 1.00 0.00 C ATOM 887 CG2 ILE A 60 -11.560 10.283 8.418 1.00 0.00 C ATOM 888 CD1 ILE A 60 -10.769 13.056 9.221 1.00 0.00 C ATOM 0 H ILE A 60 -12.446 10.535 12.419 1.00 0.00 H new ATOM 0 HA ILE A 60 -13.940 10.402 9.883 1.00 0.00 H new ATOM 0 HB ILE A 60 -10.946 10.529 10.452 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -12.855 12.590 9.285 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -12.088 12.668 10.859 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -10.678 10.771 8.003 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -11.400 9.205 8.443 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -12.426 10.507 7.795 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -10.949 14.130 9.256 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -9.865 12.821 9.783 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -10.644 12.742 8.185 1.00 0.00 H new ATOM 900 N VAL A 61 -13.543 7.925 9.608 1.00 0.00 N ATOM 901 CA VAL A 61 -13.346 6.512 9.521 1.00 0.00 C ATOM 902 C VAL A 61 -12.076 6.253 8.719 1.00 0.00 C ATOM 903 O VAL A 61 -11.808 6.923 7.710 1.00 0.00 O ATOM 904 CB VAL A 61 -14.584 5.744 8.944 1.00 0.00 C ATOM 905 CG1 VAL A 61 -14.911 6.130 7.510 1.00 0.00 C ATOM 906 CG2 VAL A 61 -14.405 4.243 9.077 1.00 0.00 C ATOM 0 H VAL A 61 -14.225 8.311 8.954 1.00 0.00 H new ATOM 0 HA VAL A 61 -13.231 6.115 10.529 1.00 0.00 H new ATOM 0 HB VAL A 61 -15.441 6.047 9.546 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -15.778 5.563 7.169 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -15.133 7.196 7.462 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -14.057 5.908 6.870 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -15.279 3.735 8.669 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -13.516 3.933 8.529 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -14.292 3.982 10.129 1.00 0.00 H new ATOM 916 N THR A 62 -11.286 5.353 9.190 1.00 0.00 N ATOM 917 CA THR A 62 -10.023 5.067 8.600 1.00 0.00 C ATOM 918 C THR A 62 -10.051 3.683 7.981 1.00 0.00 C ATOM 919 O THR A 62 -10.981 2.896 8.234 1.00 0.00 O ATOM 920 CB THR A 62 -8.892 5.172 9.655 1.00 0.00 C ATOM 921 OG1 THR A 62 -9.168 4.307 10.763 1.00 0.00 O ATOM 922 CG2 THR A 62 -8.766 6.596 10.170 1.00 0.00 C ATOM 0 H THR A 62 -11.501 4.785 10.009 1.00 0.00 H new ATOM 0 HA THR A 62 -9.822 5.800 7.818 1.00 0.00 H new ATOM 0 HB THR A 62 -7.959 4.877 9.175 1.00 0.00 H new ATOM 0 HG1 THR A 62 -8.447 4.380 11.423 1.00 0.00 H new ATOM 0 HG21 THR A 62 -7.966 6.646 10.909 1.00 0.00 H new ATOM 0 HG22 THR A 62 -8.535 7.264 9.340 1.00 0.00 H new ATOM 0 HG23 THR A 62 -9.706 6.901 10.631 1.00 0.00 H new ATOM 930 N ARG A 63 -9.071 3.382 7.186 1.00 0.00 N ATOM 931 CA ARG A 63 -9.010 2.115 6.535 1.00 0.00 C ATOM 932 C ARG A 63 -7.814 1.348 7.047 1.00 0.00 C ATOM 933 O ARG A 63 -6.724 1.905 7.236 1.00 0.00 O ATOM 934 CB ARG A 63 -8.986 2.281 5.024 1.00 0.00 C ATOM 935 CG ARG A 63 -10.215 3.009 4.460 1.00 0.00 C ATOM 936 CD ARG A 63 -11.521 2.262 4.713 1.00 0.00 C ATOM 937 NE ARG A 63 -12.687 3.046 4.270 1.00 0.00 N ATOM 938 CZ ARG A 63 -13.869 2.545 3.885 1.00 0.00 C ATOM 939 NH1 ARG A 63 -14.029 1.236 3.702 1.00 0.00 N ATOM 940 NH2 ARG A 63 -14.877 3.363 3.647 1.00 0.00 N ATOM 0 H ARG A 63 -8.294 4.007 6.972 1.00 0.00 H new ATOM 0 HA ARG A 63 -9.907 1.541 6.767 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -8.088 2.832 4.743 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -8.914 1.297 4.561 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -10.279 4.001 4.906 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -10.086 3.150 3.387 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -11.503 1.307 4.188 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -11.614 2.039 5.776 1.00 0.00 H new ATOM 0 HE ARG A 63 -12.586 4.061 4.255 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -13.246 0.600 3.855 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -14.934 0.869 3.409 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -14.754 4.370 3.756 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -15.779 2.989 3.354 1.00 0.00 H new ATOM 954 N ILE A 64 -8.022 0.097 7.293 1.00 0.00 N ATOM 955 CA ILE A 64 -7.036 -0.728 7.933 1.00 0.00 C ATOM 956 C ILE A 64 -6.140 -1.473 6.942 1.00 0.00 C ATOM 957 O ILE A 64 -6.620 -2.182 6.048 1.00 0.00 O ATOM 958 CB ILE A 64 -7.723 -1.723 8.903 1.00 0.00 C ATOM 959 CG1 ILE A 64 -8.489 -0.939 9.986 1.00 0.00 C ATOM 960 CG2 ILE A 64 -6.705 -2.675 9.530 1.00 0.00 C ATOM 961 CD1 ILE A 64 -9.296 -1.800 10.927 1.00 0.00 C ATOM 0 H ILE A 64 -8.886 -0.391 7.056 1.00 0.00 H new ATOM 0 HA ILE A 64 -6.382 -0.061 8.495 1.00 0.00 H new ATOM 0 HB ILE A 64 -8.430 -2.333 8.340 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -7.775 -0.356 10.568 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -9.158 -0.229 9.499 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -7.216 -3.361 10.205 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -6.206 -3.243 8.745 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -5.965 -2.101 10.088 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -9.802 -1.167 11.656 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -10.037 -2.364 10.360 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -8.633 -2.492 11.446 1.00 0.00 H new ATOM 973 N GLY A 65 -4.843 -1.259 7.091 1.00 0.00 N ATOM 974 CA GLY A 65 -3.820 -1.987 6.361 1.00 0.00 C ATOM 975 C GLY A 65 -3.565 -1.525 4.940 1.00 0.00 C ATOM 976 O GLY A 65 -2.471 -1.745 4.407 1.00 0.00 O ATOM 0 H GLY A 65 -4.466 -0.563 7.734 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -2.886 -1.919 6.918 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -4.099 -3.040 6.335 1.00 0.00 H new ATOM 980 N SER A 66 -4.513 -0.880 4.314 1.00 0.00 N ATOM 981 CA SER A 66 -4.339 -0.476 2.934 1.00 0.00 C ATOM 982 C SER A 66 -5.150 0.777 2.610 1.00 0.00 C ATOM 983 O SER A 66 -6.226 0.974 3.172 1.00 0.00 O ATOM 984 CB SER A 66 -4.770 -1.620 2.003 1.00 0.00 C ATOM 985 OG SER A 66 -4.014 -2.795 2.264 1.00 0.00 O ATOM 0 H SER A 66 -5.409 -0.622 4.729 1.00 0.00 H new ATOM 0 HA SER A 66 -3.284 -0.246 2.781 1.00 0.00 H new ATOM 0 HB2 SER A 66 -5.831 -1.827 2.141 1.00 0.00 H new ATOM 0 HB3 SER A 66 -4.636 -1.319 0.964 1.00 0.00 H new ATOM 0 HG SER A 66 -3.340 -2.913 1.562 1.00 0.00 H new ATOM 991 N PRO A 67 -4.623 1.663 1.751 1.00 0.00 N ATOM 992 CA PRO A 67 -5.363 2.809 1.265 1.00 0.00 C ATOM 993 C PRO A 67 -6.140 2.449 -0.016 1.00 0.00 C ATOM 994 O PRO A 67 -5.553 2.057 -1.017 1.00 0.00 O ATOM 995 CB PRO A 67 -4.250 3.836 0.943 1.00 0.00 C ATOM 996 CG PRO A 67 -2.948 3.130 1.212 1.00 0.00 C ATOM 997 CD PRO A 67 -3.258 1.669 1.222 1.00 0.00 C ATOM 0 HA PRO A 67 -6.100 3.176 1.979 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -4.309 4.164 -0.095 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -4.348 4.726 1.565 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -2.212 3.366 0.444 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -2.525 3.444 2.166 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -3.203 1.231 0.225 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -2.570 1.108 1.855 1.00 0.00 H new ATOM 1005 N PHE A 68 -7.437 2.606 0.044 1.00 0.00 N ATOM 1006 CA PHE A 68 -8.396 2.336 -1.032 1.00 0.00 C ATOM 1007 C PHE A 68 -9.701 2.929 -0.592 1.00 0.00 C ATOM 1008 O PHE A 68 -9.838 3.302 0.573 1.00 0.00 O ATOM 1009 CB PHE A 68 -8.696 0.824 -1.260 1.00 0.00 C ATOM 1010 CG PHE A 68 -7.659 -0.026 -1.918 1.00 0.00 C ATOM 1011 CD1 PHE A 68 -7.421 0.087 -3.274 1.00 0.00 C ATOM 1012 CD2 PHE A 68 -6.961 -0.973 -1.193 1.00 0.00 C ATOM 1013 CE1 PHE A 68 -6.498 -0.719 -3.896 1.00 0.00 C ATOM 1014 CE2 PHE A 68 -6.044 -1.788 -1.811 1.00 0.00 C ATOM 1015 CZ PHE A 68 -5.812 -1.661 -3.166 1.00 0.00 C ATOM 0 H PHE A 68 -7.894 2.946 0.890 1.00 0.00 H new ATOM 0 HA PHE A 68 -7.970 2.743 -1.949 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -8.917 0.382 -0.289 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -9.606 0.755 -1.856 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -7.967 0.818 -3.852 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -7.138 -1.073 -0.132 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -6.312 -0.613 -4.955 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -5.505 -2.527 -1.237 1.00 0.00 H new ATOM 0 HZ PHE A 68 -5.092 -2.302 -3.653 1.00 0.00 H new ATOM 1025 N LEU A 69 -10.657 2.976 -1.482 1.00 0.00 N ATOM 1026 CA LEU A 69 -12.005 3.376 -1.124 1.00 0.00 C ATOM 1027 C LEU A 69 -12.729 2.165 -0.543 1.00 0.00 C ATOM 1028 O LEU A 69 -13.565 2.282 0.337 1.00 0.00 O ATOM 1029 CB LEU A 69 -12.765 3.905 -2.351 1.00 0.00 C ATOM 1030 CG LEU A 69 -12.228 5.194 -2.986 1.00 0.00 C ATOM 1031 CD1 LEU A 69 -13.009 5.529 -4.248 1.00 0.00 C ATOM 1032 CD2 LEU A 69 -12.309 6.351 -1.995 1.00 0.00 C ATOM 0 H LEU A 69 -10.532 2.742 -2.467 1.00 0.00 H new ATOM 0 HA LEU A 69 -11.961 4.179 -0.388 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -12.768 3.125 -3.113 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -13.803 4.073 -2.063 1.00 0.00 H new ATOM 0 HG LEU A 69 -11.183 5.036 -3.253 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -12.616 6.446 -4.687 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -12.911 4.713 -4.964 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -14.061 5.668 -3.999 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -11.924 7.258 -2.462 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -13.347 6.507 -1.702 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -11.714 6.117 -1.112 1.00 0.00 H new ATOM 1044 N ASN A 70 -12.350 0.998 -1.027 1.00 0.00 N ATOM 1045 CA ASN A 70 -12.940 -0.272 -0.600 1.00 0.00 C ATOM 1046 C ASN A 70 -12.031 -1.020 0.358 1.00 0.00 C ATOM 1047 O ASN A 70 -12.084 -2.246 0.456 1.00 0.00 O ATOM 1048 CB ASN A 70 -13.268 -1.166 -1.806 1.00 0.00 C ATOM 1049 CG ASN A 70 -14.433 -0.658 -2.626 1.00 0.00 C ATOM 1050 OD1 ASN A 70 -14.257 0.106 -3.571 1.00 0.00 O ATOM 1051 ND2 ASN A 70 -15.626 -1.085 -2.283 1.00 0.00 N ATOM 0 H ASN A 70 -11.620 0.896 -1.732 1.00 0.00 H new ATOM 0 HA ASN A 70 -13.865 -0.029 -0.077 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -12.388 -1.241 -2.445 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -13.492 -2.173 -1.453 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -16.446 -0.782 -2.808 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -15.733 -1.720 -1.492 1.00 0.00 H new ATOM 1058 N ALA A 71 -11.199 -0.296 1.062 1.00 0.00 N ATOM 1059 CA ALA A 71 -10.275 -0.902 2.013 1.00 0.00 C ATOM 1060 C ALA A 71 -11.026 -1.339 3.289 1.00 0.00 C ATOM 1061 O ALA A 71 -12.122 -0.824 3.567 1.00 0.00 O ATOM 1062 CB ALA A 71 -9.182 0.086 2.358 1.00 0.00 C ATOM 0 H ALA A 71 -11.135 0.720 1.001 1.00 0.00 H new ATOM 0 HA ALA A 71 -9.827 -1.786 1.560 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -8.492 -0.368 3.069 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -8.641 0.361 1.453 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -9.625 0.978 2.801 1.00 0.00 H new ATOM 1068 N PRO A 72 -10.473 -2.317 4.054 1.00 0.00 N ATOM 1069 CA PRO A 72 -11.077 -2.816 5.311 1.00 0.00 C ATOM 1070 C PRO A 72 -11.454 -1.697 6.296 1.00 0.00 C ATOM 1071 O PRO A 72 -10.645 -0.799 6.589 1.00 0.00 O ATOM 1072 CB PRO A 72 -9.981 -3.697 5.898 1.00 0.00 C ATOM 1073 CG PRO A 72 -9.253 -4.198 4.707 1.00 0.00 C ATOM 1074 CD PRO A 72 -9.224 -3.054 3.741 1.00 0.00 C ATOM 0 HA PRO A 72 -12.017 -3.335 5.122 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -9.325 -3.131 6.559 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -10.397 -4.515 6.486 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -8.244 -4.515 4.969 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -9.757 -5.063 4.275 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -8.342 -2.430 3.882 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -9.208 -3.400 2.707 1.00 0.00 H new ATOM 1082 N VAL A 73 -12.669 -1.777 6.795 1.00 0.00 N ATOM 1083 CA VAL A 73 -13.252 -0.783 7.683 1.00 0.00 C ATOM 1084 C VAL A 73 -13.182 -1.308 9.141 1.00 0.00 C ATOM 1085 O VAL A 73 -12.761 -2.456 9.367 1.00 0.00 O ATOM 1086 CB VAL A 73 -14.738 -0.494 7.261 1.00 0.00 C ATOM 1087 CG1 VAL A 73 -15.686 -1.627 7.646 1.00 0.00 C ATOM 1088 CG2 VAL A 73 -15.241 0.860 7.750 1.00 0.00 C ATOM 0 H VAL A 73 -13.298 -2.554 6.592 1.00 0.00 H new ATOM 0 HA VAL A 73 -12.695 0.151 7.615 1.00 0.00 H new ATOM 0 HB VAL A 73 -14.731 -0.445 6.172 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -16.699 -1.376 7.332 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -15.371 -2.548 7.155 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -15.666 -1.767 8.727 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -16.273 1.003 7.428 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -15.192 0.895 8.838 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -14.618 1.652 7.334 1.00 0.00 H new ATOM 1098 N GLY A 74 -13.559 -0.489 10.108 1.00 0.00 N ATOM 1099 CA GLY A 74 -13.533 -0.908 11.489 1.00 0.00 C ATOM 1100 C GLY A 74 -12.619 -0.053 12.320 1.00 0.00 C ATOM 1101 O GLY A 74 -12.551 -0.205 13.543 1.00 0.00 O ATOM 0 H GLY A 74 -13.885 0.466 9.958 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -14.542 -0.866 11.900 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -13.209 -1.947 11.546 1.00 0.00 H new ATOM 1105 N GLY A 75 -11.928 0.852 11.675 1.00 0.00 N ATOM 1106 CA GLY A 75 -11.061 1.759 12.380 1.00 0.00 C ATOM 1107 C GLY A 75 -11.613 3.161 12.333 1.00 0.00 C ATOM 1108 O GLY A 75 -11.851 3.693 11.253 1.00 0.00 O ATOM 0 H GLY A 75 -11.949 0.980 10.663 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -10.955 1.438 13.416 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -10.066 1.739 11.936 1.00 0.00 H new ATOM 1112 N ASN A 76 -11.817 3.758 13.463 1.00 0.00 N ATOM 1113 CA ASN A 76 -12.370 5.099 13.531 1.00 0.00 C ATOM 1114 C ASN A 76 -11.419 6.018 14.266 1.00 0.00 C ATOM 1115 O ASN A 76 -10.870 5.651 15.304 1.00 0.00 O ATOM 1116 CB ASN A 76 -13.756 5.078 14.212 1.00 0.00 C ATOM 1117 CG ASN A 76 -14.371 6.462 14.417 1.00 0.00 C ATOM 1118 OD1 ASN A 76 -15.060 7.002 13.529 1.00 0.00 O ATOM 1119 ND2 ASN A 76 -14.167 7.028 15.586 1.00 0.00 N ATOM 0 H ASN A 76 -11.610 3.342 14.371 1.00 0.00 H new ATOM 0 HA ASN A 76 -12.499 5.479 12.517 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -14.436 4.476 13.610 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -13.666 4.585 15.180 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -14.578 7.939 15.790 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -13.597 6.556 16.289 1.00 0.00 H new ATOM 1126 N LEU A 77 -11.206 7.185 13.715 1.00 0.00 N ATOM 1127 CA LEU A 77 -10.344 8.171 14.307 1.00 0.00 C ATOM 1128 C LEU A 77 -11.207 9.216 15.016 1.00 0.00 C ATOM 1129 O LEU A 77 -12.030 9.876 14.368 1.00 0.00 O ATOM 1130 CB LEU A 77 -9.505 8.849 13.214 1.00 0.00 C ATOM 1131 CG LEU A 77 -8.452 9.838 13.696 1.00 0.00 C ATOM 1132 CD1 LEU A 77 -7.394 9.120 14.510 1.00 0.00 C ATOM 1133 CD2 LEU A 77 -7.821 10.566 12.521 1.00 0.00 C ATOM 0 H LEU A 77 -11.630 7.479 12.835 1.00 0.00 H new ATOM 0 HA LEU A 77 -9.674 7.695 15.023 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -9.007 8.073 12.633 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -10.181 9.370 12.536 1.00 0.00 H new ATOM 0 HG LEU A 77 -8.937 10.579 14.332 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -6.647 9.837 14.849 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -7.859 8.645 15.374 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -6.914 8.360 13.893 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -7.072 11.268 12.888 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -7.347 9.843 11.857 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -8.591 11.110 11.974 1.00 0.00 H new ATOM 1145 N PRO A 78 -11.052 9.371 16.342 1.00 0.00 N ATOM 1146 CA PRO A 78 -11.840 10.324 17.117 1.00 0.00 C ATOM 1147 C PRO A 78 -11.532 11.781 16.753 1.00 0.00 C ATOM 1148 O PRO A 78 -10.480 12.094 16.169 1.00 0.00 O ATOM 1149 CB PRO A 78 -11.458 10.065 18.578 1.00 0.00 C ATOM 1150 CG PRO A 78 -10.471 8.943 18.587 1.00 0.00 C ATOM 1151 CD PRO A 78 -10.099 8.625 17.171 1.00 0.00 C ATOM 0 HA PRO A 78 -12.903 10.186 16.918 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -11.027 10.960 19.027 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -12.339 9.807 19.166 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -9.585 9.222 19.158 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -10.899 8.066 19.072 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -9.073 8.925 16.957 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -10.165 7.554 16.978 1.00 0.00 H new ATOM 1159 N ALA A 79 -12.445 12.657 17.084 1.00 0.00 N ATOM 1160 CA ALA A 79 -12.302 14.071 16.826 1.00 0.00 C ATOM 1161 C ALA A 79 -11.252 14.658 17.758 1.00 0.00 C ATOM 1162 O ALA A 79 -11.203 14.306 18.940 1.00 0.00 O ATOM 1163 CB ALA A 79 -13.639 14.766 17.019 1.00 0.00 C ATOM 0 H ALA A 79 -13.320 12.408 17.546 1.00 0.00 H new ATOM 0 HA ALA A 79 -11.978 14.223 15.797 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -13.526 15.832 16.823 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -14.371 14.346 16.329 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -13.981 14.619 18.044 1.00 0.00 H new ATOM 1169 N GLY A 80 -10.393 15.499 17.223 1.00 0.00 N ATOM 1170 CA GLY A 80 -9.347 16.116 18.014 1.00 0.00 C ATOM 1171 C GLY A 80 -8.120 15.229 18.191 1.00 0.00 C ATOM 1172 O GLY A 80 -7.150 15.619 18.860 1.00 0.00 O ATOM 0 H GLY A 80 -10.398 15.773 16.240 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -9.046 17.050 17.540 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -9.746 16.371 18.996 1.00 0.00 H new ATOM 1176 N ALA A 81 -8.145 14.051 17.593 1.00 0.00 N ATOM 1177 CA ALA A 81 -7.054 13.100 17.726 1.00 0.00 C ATOM 1178 C ALA A 81 -5.775 13.607 17.067 1.00 0.00 C ATOM 1179 O ALA A 81 -5.774 14.011 15.902 1.00 0.00 O ATOM 1180 CB ALA A 81 -7.445 11.749 17.160 1.00 0.00 C ATOM 0 H ALA A 81 -8.914 13.728 17.006 1.00 0.00 H new ATOM 0 HA ALA A 81 -6.852 12.987 18.791 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -6.613 11.054 17.271 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -8.312 11.366 17.698 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -7.692 11.855 16.104 1.00 0.00 H new ATOM 1186 N THR A 82 -4.714 13.603 17.828 1.00 0.00 N ATOM 1187 CA THR A 82 -3.412 14.000 17.370 1.00 0.00 C ATOM 1188 C THR A 82 -2.635 12.731 16.984 1.00 0.00 C ATOM 1189 O THR A 82 -2.280 11.912 17.848 1.00 0.00 O ATOM 1190 CB THR A 82 -2.700 14.763 18.506 1.00 0.00 C ATOM 1191 OG1 THR A 82 -3.551 15.852 18.923 1.00 0.00 O ATOM 1192 CG2 THR A 82 -1.361 15.319 18.057 1.00 0.00 C ATOM 0 H THR A 82 -4.732 13.317 18.807 1.00 0.00 H new ATOM 0 HA THR A 82 -3.477 14.656 16.502 1.00 0.00 H new ATOM 0 HB THR A 82 -2.513 14.071 19.327 1.00 0.00 H new ATOM 0 HG1 THR A 82 -3.116 16.349 19.647 1.00 0.00 H new ATOM 0 HG21 THR A 82 -0.891 15.849 18.885 1.00 0.00 H new ATOM 0 HG22 THR A 82 -0.716 14.501 17.737 1.00 0.00 H new ATOM 0 HG23 THR A 82 -1.513 16.007 17.225 1.00 0.00 H new ATOM 1200 N ILE A 83 -2.429 12.544 15.706 1.00 0.00 N ATOM 1201 CA ILE A 83 -1.812 11.343 15.185 1.00 0.00 C ATOM 1202 C ILE A 83 -0.517 11.665 14.456 1.00 0.00 C ATOM 1203 O ILE A 83 -0.513 12.431 13.499 1.00 0.00 O ATOM 1204 CB ILE A 83 -2.777 10.623 14.199 1.00 0.00 C ATOM 1205 CG1 ILE A 83 -4.077 10.196 14.898 1.00 0.00 C ATOM 1206 CG2 ILE A 83 -2.109 9.432 13.532 1.00 0.00 C ATOM 1207 CD1 ILE A 83 -3.894 9.215 16.046 1.00 0.00 C ATOM 0 H ILE A 83 -2.685 13.223 14.989 1.00 0.00 H new ATOM 0 HA ILE A 83 -1.593 10.692 16.032 1.00 0.00 H new ATOM 0 HB ILE A 83 -3.033 11.341 13.420 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -4.578 11.087 15.277 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -4.740 9.747 14.158 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -2.813 8.954 12.851 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -1.236 9.770 12.973 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -1.798 8.716 14.293 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -4.866 8.973 16.476 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -3.424 8.304 15.675 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -3.260 9.664 16.811 1.00 0.00 H new ATOM 1219 N VAL A 84 0.569 11.099 14.911 1.00 0.00 N ATOM 1220 CA VAL A 84 1.827 11.258 14.227 1.00 0.00 C ATOM 1221 C VAL A 84 1.963 10.144 13.182 1.00 0.00 C ATOM 1222 O VAL A 84 1.765 8.958 13.489 1.00 0.00 O ATOM 1223 CB VAL A 84 3.049 11.283 15.212 1.00 0.00 C ATOM 1224 CG1 VAL A 84 3.177 9.992 16.019 1.00 0.00 C ATOM 1225 CG2 VAL A 84 4.348 11.599 14.475 1.00 0.00 C ATOM 0 H VAL A 84 0.609 10.524 15.752 1.00 0.00 H new ATOM 0 HA VAL A 84 1.834 12.228 13.730 1.00 0.00 H new ATOM 0 HB VAL A 84 2.857 12.085 15.925 1.00 0.00 H new ATOM 0 HG11 VAL A 84 4.038 10.062 16.684 1.00 0.00 H new ATOM 0 HG12 VAL A 84 2.273 9.841 16.610 1.00 0.00 H new ATOM 0 HG13 VAL A 84 3.311 9.150 15.340 1.00 0.00 H new ATOM 0 HG21 VAL A 84 5.176 11.609 15.184 1.00 0.00 H new ATOM 0 HG22 VAL A 84 4.530 10.838 13.716 1.00 0.00 H new ATOM 0 HG23 VAL A 84 4.267 12.576 13.998 1.00 0.00 H new ATOM 1235 N TYR A 85 2.235 10.514 11.970 1.00 0.00 N ATOM 1236 CA TYR A 85 2.354 9.553 10.899 1.00 0.00 C ATOM 1237 C TYR A 85 3.759 9.562 10.356 1.00 0.00 C ATOM 1238 O TYR A 85 4.459 10.566 10.478 1.00 0.00 O ATOM 1239 CB TYR A 85 1.317 9.819 9.790 1.00 0.00 C ATOM 1240 CG TYR A 85 1.364 11.210 9.175 1.00 0.00 C ATOM 1241 CD1 TYR A 85 2.177 11.486 8.085 1.00 0.00 C ATOM 1242 CD2 TYR A 85 0.579 12.241 9.681 1.00 0.00 C ATOM 1243 CE1 TYR A 85 2.207 12.744 7.521 1.00 0.00 C ATOM 1244 CE2 TYR A 85 0.607 13.501 9.119 1.00 0.00 C ATOM 1245 CZ TYR A 85 1.421 13.746 8.042 1.00 0.00 C ATOM 1246 OH TYR A 85 1.447 14.998 7.477 1.00 0.00 O ATOM 0 H TYR A 85 2.382 11.483 11.688 1.00 0.00 H new ATOM 0 HA TYR A 85 2.145 8.560 11.297 1.00 0.00 H new ATOM 0 HB2 TYR A 85 1.461 9.084 8.998 1.00 0.00 H new ATOM 0 HB3 TYR A 85 0.321 9.655 10.200 1.00 0.00 H new ATOM 0 HD1 TYR A 85 2.796 10.703 7.672 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -0.063 12.052 10.528 1.00 0.00 H new ATOM 0 HE1 TYR A 85 2.846 12.942 6.673 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -0.009 14.290 9.525 1.00 0.00 H new ATOM 0 HH TYR A 85 1.647 14.921 6.521 1.00 0.00 H new ATOM 1256 N ASP A 86 4.171 8.459 9.781 1.00 0.00 N ATOM 1257 CA ASP A 86 5.522 8.339 9.235 1.00 0.00 C ATOM 1258 C ASP A 86 5.471 8.036 7.740 1.00 0.00 C ATOM 1259 O ASP A 86 6.513 7.846 7.077 1.00 0.00 O ATOM 1260 CB ASP A 86 6.323 7.232 9.957 1.00 0.00 C ATOM 1261 CG ASP A 86 5.755 5.835 9.765 1.00 0.00 C ATOM 1262 OD1 ASP A 86 6.085 5.165 8.762 1.00 0.00 O ATOM 1263 OD2 ASP A 86 4.979 5.367 10.623 1.00 0.00 O ATOM 0 H ASP A 86 3.596 7.623 9.673 1.00 0.00 H new ATOM 0 HA ASP A 86 6.025 9.293 9.394 1.00 0.00 H new ATOM 0 HB2 ASP A 86 7.352 7.248 9.597 1.00 0.00 H new ATOM 0 HB3 ASP A 86 6.355 7.457 11.023 1.00 0.00 H new ATOM 1268 N GLU A 87 4.280 8.037 7.196 1.00 0.00 N ATOM 1269 CA GLU A 87 4.069 7.682 5.817 1.00 0.00 C ATOM 1270 C GLU A 87 2.912 8.464 5.234 1.00 0.00 C ATOM 1271 O GLU A 87 1.912 8.713 5.912 1.00 0.00 O ATOM 1272 CB GLU A 87 3.801 6.189 5.750 1.00 0.00 C ATOM 1273 CG GLU A 87 3.454 5.612 4.397 1.00 0.00 C ATOM 1274 CD GLU A 87 3.326 4.112 4.466 1.00 0.00 C ATOM 1275 OE1 GLU A 87 2.567 3.599 5.325 1.00 0.00 O ATOM 1276 OE2 GLU A 87 4.035 3.420 3.730 1.00 0.00 O ATOM 0 H GLU A 87 3.428 8.285 7.699 1.00 0.00 H new ATOM 0 HA GLU A 87 4.953 7.927 5.229 1.00 0.00 H new ATOM 0 HB2 GLU A 87 4.684 5.670 6.123 1.00 0.00 H new ATOM 0 HB3 GLU A 87 2.984 5.961 6.435 1.00 0.00 H new ATOM 0 HG2 GLU A 87 2.518 6.044 4.042 1.00 0.00 H new ATOM 0 HG3 GLU A 87 4.224 5.882 3.674 1.00 0.00 H new ATOM 1283 N VAL A 88 3.076 8.874 4.006 1.00 0.00 N ATOM 1284 CA VAL A 88 2.058 9.573 3.254 1.00 0.00 C ATOM 1285 C VAL A 88 1.826 8.781 1.976 1.00 0.00 C ATOM 1286 O VAL A 88 2.791 8.355 1.344 1.00 0.00 O ATOM 1287 CB VAL A 88 2.511 11.021 2.908 1.00 0.00 C ATOM 1288 CG1 VAL A 88 1.473 11.732 2.075 1.00 0.00 C ATOM 1289 CG2 VAL A 88 2.776 11.817 4.167 1.00 0.00 C ATOM 0 H VAL A 88 3.940 8.730 3.484 1.00 0.00 H new ATOM 0 HA VAL A 88 1.144 9.653 3.842 1.00 0.00 H new ATOM 0 HB VAL A 88 3.433 10.944 2.332 1.00 0.00 H new ATOM 0 HG11 VAL A 88 1.817 12.741 1.849 1.00 0.00 H new ATOM 0 HG12 VAL A 88 1.316 11.185 1.145 1.00 0.00 H new ATOM 0 HG13 VAL A 88 0.535 11.784 2.628 1.00 0.00 H new ATOM 0 HG21 VAL A 88 3.091 12.826 3.900 1.00 0.00 H new ATOM 0 HG22 VAL A 88 1.865 11.867 4.764 1.00 0.00 H new ATOM 0 HG23 VAL A 88 3.563 11.332 4.745 1.00 0.00 H new ATOM 1299 N CYS A 89 0.587 8.542 1.631 1.00 0.00 N ATOM 1300 CA CYS A 89 0.247 7.743 0.475 1.00 0.00 C ATOM 1301 C CYS A 89 -0.778 8.451 -0.409 1.00 0.00 C ATOM 1302 O CYS A 89 -1.748 8.986 0.081 1.00 0.00 O ATOM 1303 CB CYS A 89 -0.335 6.414 0.941 1.00 0.00 C ATOM 1304 SG CYS A 89 0.734 5.476 2.041 1.00 0.00 S ATOM 0 H CYS A 89 -0.220 8.896 2.144 1.00 0.00 H new ATOM 0 HA CYS A 89 1.154 7.583 -0.109 1.00 0.00 H new ATOM 0 HB2 CYS A 89 -1.281 6.604 1.449 1.00 0.00 H new ATOM 0 HB3 CYS A 89 -0.560 5.804 0.066 1.00 0.00 H new ATOM 0 HG CYS A 89 0.038 4.559 2.644 1.00 0.00 H new ATOM 1310 N ILE A 90 -0.561 8.440 -1.697 1.00 0.00 N ATOM 1311 CA ILE A 90 -1.516 9.013 -2.626 1.00 0.00 C ATOM 1312 C ILE A 90 -2.307 7.902 -3.300 1.00 0.00 C ATOM 1313 O ILE A 90 -1.749 7.095 -4.065 1.00 0.00 O ATOM 1314 CB ILE A 90 -0.851 9.908 -3.721 1.00 0.00 C ATOM 1315 CG1 ILE A 90 -0.090 11.076 -3.077 1.00 0.00 C ATOM 1316 CG2 ILE A 90 -1.918 10.441 -4.691 1.00 0.00 C ATOM 1317 CD1 ILE A 90 0.629 11.973 -4.072 1.00 0.00 C ATOM 0 H ILE A 90 0.270 8.041 -2.134 1.00 0.00 H new ATOM 0 HA ILE A 90 -2.173 9.656 -2.040 1.00 0.00 H new ATOM 0 HB ILE A 90 -0.140 9.299 -4.279 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -0.792 11.679 -2.502 1.00 0.00 H new ATOM 0 HG13 ILE A 90 0.639 10.676 -2.372 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -1.442 11.063 -5.449 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -2.422 9.604 -5.173 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -2.647 11.035 -4.140 1.00 0.00 H new ATOM 0 HD11 ILE A 90 1.141 12.773 -3.537 1.00 0.00 H new ATOM 0 HD12 ILE A 90 1.357 11.386 -4.631 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -0.096 12.405 -4.762 1.00 0.00 H new ATOM 1329 N GLN A 91 -3.570 7.839 -2.980 1.00 0.00 N ATOM 1330 CA GLN A 91 -4.497 6.909 -3.577 1.00 0.00 C ATOM 1331 C GLN A 91 -5.504 7.764 -4.321 1.00 0.00 C ATOM 1332 O GLN A 91 -5.788 8.863 -3.875 1.00 0.00 O ATOM 1333 CB GLN A 91 -5.171 6.022 -2.490 1.00 0.00 C ATOM 1334 CG GLN A 91 -6.214 5.018 -3.007 1.00 0.00 C ATOM 1335 CD GLN A 91 -5.652 4.046 -4.043 1.00 0.00 C ATOM 1336 OE1 GLN A 91 -5.656 4.333 -5.244 1.00 0.00 O ATOM 1337 NE2 GLN A 91 -5.204 2.900 -3.607 1.00 0.00 N ATOM 0 H GLN A 91 -3.997 8.446 -2.280 1.00 0.00 H new ATOM 0 HA GLN A 91 -4.002 6.213 -4.254 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -4.393 5.471 -1.962 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -5.651 6.674 -1.760 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -6.612 4.451 -2.165 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -7.048 5.565 -3.446 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -5.215 2.695 -2.608 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -4.843 2.210 -4.265 1.00 0.00 H new ATOM 1346 N ALA A 92 -5.997 7.298 -5.452 1.00 0.00 N ATOM 1347 CA ALA A 92 -6.884 8.090 -6.312 1.00 0.00 C ATOM 1348 C ALA A 92 -8.058 8.712 -5.536 1.00 0.00 C ATOM 1349 O ALA A 92 -8.987 8.010 -5.102 1.00 0.00 O ATOM 1350 CB ALA A 92 -7.397 7.238 -7.466 1.00 0.00 C ATOM 0 H ALA A 92 -5.800 6.363 -5.809 1.00 0.00 H new ATOM 0 HA ALA A 92 -6.294 8.917 -6.708 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -8.054 7.837 -8.097 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -6.554 6.880 -8.057 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -7.951 6.386 -7.071 1.00 0.00 H new ATOM 1356 N GLY A 93 -7.961 10.014 -5.295 1.00 0.00 N ATOM 1357 CA GLY A 93 -9.012 10.730 -4.632 1.00 0.00 C ATOM 1358 C GLY A 93 -8.611 11.295 -3.273 1.00 0.00 C ATOM 1359 O GLY A 93 -9.112 12.344 -2.870 1.00 0.00 O ATOM 0 H GLY A 93 -7.157 10.585 -5.555 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -9.341 11.548 -5.272 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -9.865 10.065 -4.501 1.00 0.00 H new ATOM 1363 N HIS A 94 -7.706 10.636 -2.563 1.00 0.00 N ATOM 1364 CA HIS A 94 -7.359 11.071 -1.200 1.00 0.00 C ATOM 1365 C HIS A 94 -5.903 10.825 -0.917 1.00 0.00 C ATOM 1366 O HIS A 94 -5.309 9.886 -1.439 1.00 0.00 O ATOM 1367 CB HIS A 94 -8.189 10.322 -0.126 1.00 0.00 C ATOM 1368 CG HIS A 94 -9.671 10.475 -0.244 1.00 0.00 C ATOM 1369 ND1 HIS A 94 -10.474 9.514 -0.809 1.00 0.00 N ATOM 1370 CD2 HIS A 94 -10.497 11.482 0.122 1.00 0.00 C ATOM 1371 CE1 HIS A 94 -11.724 9.921 -0.789 1.00 0.00 C ATOM 1372 NE2 HIS A 94 -11.764 11.109 -0.232 1.00 0.00 N ATOM 0 H HIS A 94 -7.202 9.812 -2.892 1.00 0.00 H new ATOM 0 HA HIS A 94 -7.582 12.137 -1.149 1.00 0.00 H new ATOM 0 HB2 HIS A 94 -7.945 9.261 -0.176 1.00 0.00 H new ATOM 0 HB3 HIS A 94 -7.881 10.674 0.859 1.00 0.00 H new ATOM 0 HD2 HIS A 94 -10.210 12.406 0.603 1.00 0.00 H new ATOM 0 HE1 HIS A 94 -12.574 9.371 -1.167 1.00 0.00 H new ATOM 0 HE2 HIS A 94 -12.606 11.665 -0.086 1.00 0.00 H new ATOM 1381 N ILE A 95 -5.340 11.626 -0.074 1.00 0.00 N ATOM 1382 CA ILE A 95 -3.976 11.433 0.315 1.00 0.00 C ATOM 1383 C ILE A 95 -3.988 10.884 1.739 1.00 0.00 C ATOM 1384 O ILE A 95 -4.375 11.552 2.673 1.00 0.00 O ATOM 1385 CB ILE A 95 -3.128 12.737 0.143 1.00 0.00 C ATOM 1386 CG1 ILE A 95 -1.655 12.508 0.477 1.00 0.00 C ATOM 1387 CG2 ILE A 95 -3.692 13.896 0.946 1.00 0.00 C ATOM 1388 CD1 ILE A 95 -0.771 13.711 0.181 1.00 0.00 C ATOM 0 H ILE A 95 -5.802 12.424 0.362 1.00 0.00 H new ATOM 0 HA ILE A 95 -3.481 10.714 -0.337 1.00 0.00 H new ATOM 0 HB ILE A 95 -3.191 13.007 -0.911 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -1.566 12.252 1.533 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -1.291 11.651 -0.090 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -3.071 14.779 0.796 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -4.709 14.107 0.615 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -3.701 13.635 2.004 1.00 0.00 H new ATOM 0 HD11 ILE A 95 0.261 13.477 0.442 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -0.831 13.954 -0.880 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -1.109 14.565 0.768 1.00 0.00 H new ATOM 1400 N TRP A 96 -3.594 9.668 1.867 1.00 0.00 N ATOM 1401 CA TRP A 96 -3.740 8.931 3.090 1.00 0.00 C ATOM 1402 C TRP A 96 -2.472 8.999 3.899 1.00 0.00 C ATOM 1403 O TRP A 96 -1.379 9.119 3.349 1.00 0.00 O ATOM 1404 CB TRP A 96 -4.067 7.455 2.771 1.00 0.00 C ATOM 1405 CG TRP A 96 -5.327 7.255 1.959 1.00 0.00 C ATOM 1406 CD1 TRP A 96 -5.501 7.527 0.636 1.00 0.00 C ATOM 1407 CD2 TRP A 96 -6.568 6.711 2.413 1.00 0.00 C ATOM 1408 NE1 TRP A 96 -6.782 7.221 0.251 1.00 0.00 N ATOM 1409 CE2 TRP A 96 -7.454 6.716 1.316 1.00 0.00 C ATOM 1410 CE3 TRP A 96 -7.020 6.233 3.635 1.00 0.00 C ATOM 1411 CZ2 TRP A 96 -8.759 6.262 1.414 1.00 0.00 C ATOM 1412 CZ3 TRP A 96 -8.314 5.781 3.730 1.00 0.00 C ATOM 1413 CH2 TRP A 96 -9.172 5.799 2.625 1.00 0.00 C ATOM 0 H TRP A 96 -3.151 9.139 1.116 1.00 0.00 H new ATOM 0 HA TRP A 96 -4.552 9.371 3.668 1.00 0.00 H new ATOM 0 HB2 TRP A 96 -3.228 7.019 2.230 1.00 0.00 H new ATOM 0 HB3 TRP A 96 -4.162 6.906 3.708 1.00 0.00 H new ATOM 0 HD1 TRP A 96 -4.739 7.927 -0.017 1.00 0.00 H new ATOM 0 HE1 TRP A 96 -7.167 7.352 -0.685 1.00 0.00 H new ATOM 0 HE3 TRP A 96 -6.367 6.217 4.495 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 -9.423 6.275 0.562 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 -8.676 5.405 4.676 1.00 0.00 H new ATOM 0 HH2 TRP A 96 -10.184 5.438 2.736 1.00 0.00 H new ATOM 1424 N ILE A 97 -2.612 8.967 5.186 1.00 0.00 N ATOM 1425 CA ILE A 97 -1.467 8.927 6.059 1.00 0.00 C ATOM 1426 C ILE A 97 -1.350 7.542 6.664 1.00 0.00 C ATOM 1427 O ILE A 97 -2.365 6.923 7.019 1.00 0.00 O ATOM 1428 CB ILE A 97 -1.512 9.995 7.190 1.00 0.00 C ATOM 1429 CG1 ILE A 97 -2.734 9.792 8.104 1.00 0.00 C ATOM 1430 CG2 ILE A 97 -1.513 11.398 6.588 1.00 0.00 C ATOM 1431 CD1 ILE A 97 -2.737 10.658 9.350 1.00 0.00 C ATOM 0 H ILE A 97 -3.512 8.968 5.665 1.00 0.00 H new ATOM 0 HA ILE A 97 -0.593 9.161 5.451 1.00 0.00 H new ATOM 0 HB ILE A 97 -0.620 9.877 7.805 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -3.638 9.998 7.532 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -2.778 8.745 8.404 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -1.545 12.137 7.388 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -0.608 11.541 5.997 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -2.387 11.519 5.948 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -3.633 10.450 9.935 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -1.853 10.437 9.949 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -2.727 11.709 9.062 1.00 0.00 H new ATOM 1443 N GLY A 98 -0.148 7.055 6.753 1.00 0.00 N ATOM 1444 CA GLY A 98 0.091 5.761 7.315 1.00 0.00 C ATOM 1445 C GLY A 98 0.702 5.884 8.673 1.00 0.00 C ATOM 1446 O GLY A 98 1.764 6.516 8.831 1.00 0.00 O ATOM 0 H GLY A 98 0.691 7.542 6.439 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -0.846 5.208 7.380 1.00 0.00 H new ATOM 0 HA3 GLY A 98 0.753 5.191 6.662 1.00 0.00 H new ATOM 1450 N TYR A 99 0.046 5.333 9.661 1.00 0.00 N ATOM 1451 CA TYR A 99 0.545 5.411 11.007 1.00 0.00 C ATOM 1452 C TYR A 99 0.432 4.065 11.699 1.00 0.00 C ATOM 1453 O TYR A 99 -0.230 3.143 11.190 1.00 0.00 O ATOM 1454 CB TYR A 99 -0.183 6.513 11.810 1.00 0.00 C ATOM 1455 CG TYR A 99 -1.661 6.277 12.087 1.00 0.00 C ATOM 1456 CD1 TYR A 99 -2.644 6.688 11.190 1.00 0.00 C ATOM 1457 CD2 TYR A 99 -2.067 5.679 13.272 1.00 0.00 C ATOM 1458 CE1 TYR A 99 -3.985 6.495 11.470 1.00 0.00 C ATOM 1459 CE2 TYR A 99 -3.395 5.491 13.559 1.00 0.00 C ATOM 1460 CZ TYR A 99 -4.352 5.897 12.662 1.00 0.00 C ATOM 1461 OH TYR A 99 -5.686 5.714 12.965 1.00 0.00 O ATOM 0 H TYR A 99 -0.833 4.826 9.558 1.00 0.00 H new ATOM 0 HA TYR A 99 1.600 5.681 10.961 1.00 0.00 H new ATOM 0 HB2 TYR A 99 0.329 6.636 12.764 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -0.082 7.454 11.270 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -2.356 7.163 10.264 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -1.321 5.355 13.983 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -4.739 6.809 10.764 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -3.687 5.025 14.488 1.00 0.00 H new ATOM 0 HH TYR A 99 -5.766 5.279 13.839 1.00 0.00 H new ATOM 1471 N ASN A 100 1.073 3.948 12.835 1.00 0.00 N ATOM 1472 CA ASN A 100 1.043 2.732 13.619 1.00 0.00 C ATOM 1473 C ASN A 100 0.103 2.894 14.776 1.00 0.00 C ATOM 1474 O ASN A 100 0.145 3.910 15.484 1.00 0.00 O ATOM 1475 CB ASN A 100 2.429 2.357 14.182 1.00 0.00 C ATOM 1476 CG ASN A 100 3.436 1.914 13.144 1.00 0.00 C ATOM 1477 OD1 ASN A 100 3.488 0.746 12.786 1.00 0.00 O ATOM 1478 ND2 ASN A 100 4.282 2.815 12.699 1.00 0.00 N ATOM 0 H ASN A 100 1.633 4.695 13.246 1.00 0.00 H new ATOM 0 HA ASN A 100 0.714 1.938 12.949 1.00 0.00 H new ATOM 0 HB2 ASN A 100 2.833 3.217 14.716 1.00 0.00 H new ATOM 0 HB3 ASN A 100 2.305 1.557 14.912 1.00 0.00 H new ATOM 0 HD21 ASN A 100 5.009 2.548 12.035 1.00 0.00 H new ATOM 0 HD22 ASN A 100 4.212 3.782 13.017 1.00 0.00 H new ATOM 1485 N ALA A 101 -0.763 1.938 14.953 1.00 0.00 N ATOM 1486 CA ALA A 101 -1.625 1.907 16.106 1.00 0.00 C ATOM 1487 C ALA A 101 -0.855 1.273 17.263 1.00 0.00 C ATOM 1488 O ALA A 101 0.258 0.788 17.066 1.00 0.00 O ATOM 1489 CB ALA A 101 -2.888 1.115 15.804 1.00 0.00 C ATOM 0 H ALA A 101 -0.894 1.160 14.307 1.00 0.00 H new ATOM 0 HA ALA A 101 -1.927 2.920 16.374 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -3.528 1.101 16.686 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -3.421 1.582 14.976 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -2.621 0.093 15.534 1.00 0.00 H new ATOM 1495 N TYR A 102 -1.457 1.242 18.435 1.00 0.00 N ATOM 1496 CA TYR A 102 -0.834 0.693 19.656 1.00 0.00 C ATOM 1497 C TYR A 102 -0.304 -0.743 19.472 1.00 0.00 C ATOM 1498 O TYR A 102 0.754 -1.092 19.972 1.00 0.00 O ATOM 1499 CB TYR A 102 -1.817 0.781 20.846 1.00 0.00 C ATOM 1500 CG TYR A 102 -3.189 0.156 20.594 1.00 0.00 C ATOM 1501 CD1 TYR A 102 -4.186 0.870 19.936 1.00 0.00 C ATOM 1502 CD2 TYR A 102 -3.483 -1.135 21.015 1.00 0.00 C ATOM 1503 CE1 TYR A 102 -5.425 0.321 19.703 1.00 0.00 C ATOM 1504 CE2 TYR A 102 -4.727 -1.692 20.785 1.00 0.00 C ATOM 1505 CZ TYR A 102 -5.693 -0.957 20.128 1.00 0.00 C ATOM 1506 OH TYR A 102 -6.937 -1.508 19.890 1.00 0.00 O ATOM 0 H TYR A 102 -2.402 1.597 18.584 1.00 0.00 H new ATOM 0 HA TYR A 102 0.040 1.308 19.872 1.00 0.00 H new ATOM 0 HB2 TYR A 102 -1.364 0.293 21.709 1.00 0.00 H new ATOM 0 HB3 TYR A 102 -1.954 1.830 21.108 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -3.982 1.876 19.601 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -2.729 -1.712 21.529 1.00 0.00 H new ATOM 0 HE1 TYR A 102 -6.184 0.892 19.188 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -4.942 -2.697 21.118 1.00 0.00 H new ATOM 0 HH TYR A 102 -6.966 -2.418 20.252 1.00 0.00 H new ATOM 1516 N ASN A 103 -1.011 -1.537 18.703 1.00 0.00 N ATOM 1517 CA ASN A 103 -0.632 -2.932 18.461 1.00 0.00 C ATOM 1518 C ASN A 103 0.307 -3.052 17.266 1.00 0.00 C ATOM 1519 O ASN A 103 0.705 -4.159 16.885 1.00 0.00 O ATOM 1520 CB ASN A 103 -1.871 -3.815 18.231 1.00 0.00 C ATOM 1521 CG ASN A 103 -2.689 -3.401 17.020 1.00 0.00 C ATOM 1522 OD1 ASN A 103 -2.760 -2.218 16.674 1.00 0.00 O ATOM 1523 ND2 ASN A 103 -3.275 -4.356 16.352 1.00 0.00 N ATOM 0 H ASN A 103 -1.864 -1.247 18.224 1.00 0.00 H new ATOM 0 HA ASN A 103 -0.112 -3.280 19.353 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -1.553 -4.850 18.109 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -2.504 -3.779 19.118 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -3.814 -4.136 15.514 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -3.195 -5.323 16.668 1.00 0.00 H new ATOM 1530 N GLY A 104 0.654 -1.924 16.680 1.00 0.00 N ATOM 1531 CA GLY A 104 1.534 -1.913 15.535 1.00 0.00 C ATOM 1532 C GLY A 104 0.775 -2.032 14.238 1.00 0.00 C ATOM 1533 O GLY A 104 1.374 -2.145 13.173 1.00 0.00 O ATOM 0 H GLY A 104 0.338 -1.002 16.981 1.00 0.00 H new ATOM 0 HA2 GLY A 104 2.114 -0.990 15.532 1.00 0.00 H new ATOM 0 HA3 GLY A 104 2.245 -2.736 15.616 1.00 0.00 H new ATOM 1537 N ASN A 105 -0.547 -2.006 14.330 1.00 0.00 N ATOM 1538 CA ASN A 105 -1.405 -2.124 13.158 1.00 0.00 C ATOM 1539 C ASN A 105 -1.257 -0.892 12.291 1.00 0.00 C ATOM 1540 O ASN A 105 -1.318 0.242 12.790 1.00 0.00 O ATOM 1541 CB ASN A 105 -2.869 -2.299 13.572 1.00 0.00 C ATOM 1542 CG ASN A 105 -3.806 -2.589 12.412 1.00 0.00 C ATOM 1543 OD1 ASN A 105 -5.043 -2.197 12.551 1.00 0.00 O flip ATOM 1544 ND2 ASN A 105 -3.421 -3.196 11.409 1.00 0.00 N flip ATOM 0 H ASN A 105 -1.052 -1.904 15.210 1.00 0.00 H new ATOM 0 HA ASN A 105 -1.101 -3.005 12.592 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -2.937 -3.113 14.294 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -3.204 -1.394 14.079 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -2.447 -3.488 11.332 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -4.077 -3.406 10.657 1.00 0.00 H new ATOM 1551 N ARG A 106 -1.025 -1.106 11.031 1.00 0.00 N ATOM 1552 CA ARG A 106 -0.841 -0.038 10.100 1.00 0.00 C ATOM 1553 C ARG A 106 -2.205 0.469 9.651 1.00 0.00 C ATOM 1554 O ARG A 106 -2.930 -0.216 8.925 1.00 0.00 O ATOM 1555 CB ARG A 106 -0.030 -0.539 8.903 1.00 0.00 C ATOM 1556 CG ARG A 106 0.582 0.557 8.056 1.00 0.00 C ATOM 1557 CD ARG A 106 1.566 1.368 8.878 1.00 0.00 C ATOM 1558 NE ARG A 106 2.300 2.337 8.081 1.00 0.00 N ATOM 1559 CZ ARG A 106 3.208 3.178 8.562 1.00 0.00 C ATOM 1560 NH1 ARG A 106 3.421 3.293 9.864 1.00 0.00 N ATOM 1561 NH2 ARG A 106 3.882 3.905 7.743 1.00 0.00 N ATOM 0 H ARG A 106 -0.958 -2.036 10.618 1.00 0.00 H new ATOM 0 HA ARG A 106 -0.295 0.781 10.569 1.00 0.00 H new ATOM 0 HB2 ARG A 106 0.767 -1.188 9.266 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -0.676 -1.150 8.273 1.00 0.00 H new ATOM 0 HG2 ARG A 106 1.089 0.121 7.195 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -0.202 1.208 7.668 1.00 0.00 H new ATOM 0 HD2 ARG A 106 1.028 1.889 9.671 1.00 0.00 H new ATOM 0 HD3 ARG A 106 2.272 0.693 9.362 1.00 0.00 H new ATOM 0 HE ARG A 106 2.104 2.374 7.081 1.00 0.00 H new ATOM 0 HH11 ARG A 106 2.882 2.729 10.521 1.00 0.00 H new ATOM 0 HH12 ARG A 106 4.124 3.946 10.210 1.00 0.00 H new ATOM 0 HH21 ARG A 106 3.716 3.831 6.739 1.00 0.00 H new ATOM 0 HH22 ARG A 106 4.583 4.556 8.097 1.00 0.00 H new ATOM 1575 N VAL A 107 -2.571 1.629 10.107 1.00 0.00 N ATOM 1576 CA VAL A 107 -3.859 2.190 9.779 1.00 0.00 C ATOM 1577 C VAL A 107 -3.654 3.402 8.881 1.00 0.00 C ATOM 1578 O VAL A 107 -2.669 4.140 9.045 1.00 0.00 O ATOM 1579 CB VAL A 107 -4.647 2.597 11.064 1.00 0.00 C ATOM 1580 CG1 VAL A 107 -6.062 3.042 10.729 1.00 0.00 C ATOM 1581 CG2 VAL A 107 -4.677 1.453 12.071 1.00 0.00 C ATOM 0 H VAL A 107 -1.995 2.214 10.712 1.00 0.00 H new ATOM 0 HA VAL A 107 -4.449 1.436 9.259 1.00 0.00 H new ATOM 0 HB VAL A 107 -4.124 3.441 11.514 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -6.583 3.318 11.646 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -6.024 3.902 10.060 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -6.594 2.225 10.241 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -5.232 1.762 12.957 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -5.163 0.586 11.623 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -3.658 1.191 12.354 1.00 0.00 H new ATOM 1591 N TYR A 108 -4.541 3.581 7.924 1.00 0.00 N ATOM 1592 CA TYR A 108 -4.470 4.684 6.997 1.00 0.00 C ATOM 1593 C TYR A 108 -5.688 5.576 7.134 1.00 0.00 C ATOM 1594 O TYR A 108 -6.825 5.097 7.171 1.00 0.00 O ATOM 1595 CB TYR A 108 -4.325 4.180 5.552 1.00 0.00 C ATOM 1596 CG TYR A 108 -2.987 3.533 5.267 1.00 0.00 C ATOM 1597 CD1 TYR A 108 -2.754 2.195 5.556 1.00 0.00 C ATOM 1598 CD2 TYR A 108 -1.951 4.272 4.721 1.00 0.00 C ATOM 1599 CE1 TYR A 108 -1.526 1.619 5.308 1.00 0.00 C ATOM 1600 CE2 TYR A 108 -0.721 3.703 4.471 1.00 0.00 C ATOM 1601 CZ TYR A 108 -0.510 2.379 4.763 1.00 0.00 C ATOM 1602 OH TYR A 108 0.727 1.807 4.518 1.00 0.00 O ATOM 0 H TYR A 108 -5.335 2.960 7.769 1.00 0.00 H new ATOM 0 HA TYR A 108 -3.585 5.272 7.239 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -5.118 3.461 5.346 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -4.467 5.017 4.868 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -3.546 1.597 5.981 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -2.110 5.314 4.487 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -1.359 0.577 5.539 1.00 0.00 H new ATOM 0 HE2 TYR A 108 0.075 4.297 4.046 1.00 0.00 H new ATOM 0 HH TYR A 108 1.434 2.419 4.811 1.00 0.00 H new ATOM 1612 N CYS A 109 -5.449 6.852 7.232 1.00 0.00 N ATOM 1613 CA CYS A 109 -6.510 7.827 7.352 1.00 0.00 C ATOM 1614 C CYS A 109 -6.530 8.675 6.087 1.00 0.00 C ATOM 1615 O CYS A 109 -5.469 9.085 5.621 1.00 0.00 O ATOM 1616 CB CYS A 109 -6.291 8.704 8.598 1.00 0.00 C ATOM 1617 SG CYS A 109 -7.601 9.918 8.915 1.00 0.00 S ATOM 0 H CYS A 109 -4.511 7.253 7.232 1.00 0.00 H new ATOM 0 HA CYS A 109 -7.470 7.324 7.468 1.00 0.00 H new ATOM 0 HB2 CYS A 109 -6.198 8.056 9.469 1.00 0.00 H new ATOM 0 HB3 CYS A 109 -5.344 9.232 8.491 1.00 0.00 H new ATOM 0 HG CYS A 109 -7.219 10.734 9.852 1.00 0.00 H new ATOM 1623 N PRO A 110 -7.727 8.925 5.497 1.00 0.00 N ATOM 1624 CA PRO A 110 -7.850 9.684 4.241 1.00 0.00 C ATOM 1625 C PRO A 110 -7.487 11.155 4.387 1.00 0.00 C ATOM 1626 O PRO A 110 -7.094 11.771 3.421 1.00 0.00 O ATOM 1627 CB PRO A 110 -9.322 9.530 3.851 1.00 0.00 C ATOM 1628 CG PRO A 110 -10.029 9.193 5.117 1.00 0.00 C ATOM 1629 CD PRO A 110 -9.044 8.469 5.994 1.00 0.00 C ATOM 0 HA PRO A 110 -7.157 9.305 3.490 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -9.712 10.450 3.415 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -9.452 8.745 3.107 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -10.391 10.096 5.608 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -10.899 8.568 4.918 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -9.184 8.721 7.045 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -9.151 7.388 5.908 1.00 0.00 H new ATOM 1637 N VAL A 111 -7.664 11.687 5.615 1.00 0.00 N ATOM 1638 CA VAL A 111 -7.324 13.081 6.068 1.00 0.00 C ATOM 1639 C VAL A 111 -7.873 14.277 5.230 1.00 0.00 C ATOM 1640 O VAL A 111 -8.400 15.248 5.802 1.00 0.00 O ATOM 1641 CB VAL A 111 -5.812 13.286 6.430 1.00 0.00 C ATOM 1642 CG1 VAL A 111 -5.393 12.312 7.496 1.00 0.00 C ATOM 1643 CG2 VAL A 111 -4.893 13.168 5.233 1.00 0.00 C ATOM 0 H VAL A 111 -8.070 11.136 6.371 1.00 0.00 H new ATOM 0 HA VAL A 111 -7.909 13.125 6.987 1.00 0.00 H new ATOM 0 HB VAL A 111 -5.719 14.306 6.802 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -4.341 12.466 7.737 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -5.997 12.469 8.390 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -5.537 11.294 7.135 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -3.861 13.320 5.550 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -4.995 12.176 4.792 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -5.160 13.923 4.493 1.00 0.00 H new ATOM 1653 N ARG A 112 -7.745 14.218 3.922 1.00 0.00 N ATOM 1654 CA ARG A 112 -8.190 15.268 3.037 1.00 0.00 C ATOM 1655 C ARG A 112 -8.324 14.734 1.620 1.00 0.00 C ATOM 1656 O ARG A 112 -7.794 13.662 1.287 1.00 0.00 O ATOM 1657 CB ARG A 112 -7.199 16.441 3.038 1.00 0.00 C ATOM 1658 CG ARG A 112 -5.816 16.107 2.542 1.00 0.00 C ATOM 1659 CD ARG A 112 -4.935 17.333 2.512 1.00 0.00 C ATOM 1660 NE ARG A 112 -3.536 16.987 2.247 1.00 0.00 N ATOM 1661 CZ ARG A 112 -2.519 17.862 2.219 1.00 0.00 C ATOM 1662 NH1 ARG A 112 -2.752 19.165 2.318 1.00 0.00 N ATOM 1663 NH2 ARG A 112 -1.274 17.423 2.075 1.00 0.00 N ATOM 0 H ARG A 112 -7.322 13.426 3.438 1.00 0.00 H new ATOM 0 HA ARG A 112 -9.158 15.620 3.393 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -7.606 17.242 2.421 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -7.120 16.830 4.053 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -5.369 15.350 3.187 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -5.879 15.677 1.542 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -5.292 18.019 1.744 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -5.006 17.856 3.466 1.00 0.00 H new ATOM 0 HE ARG A 112 -3.319 16.006 2.070 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -3.708 19.506 2.416 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -1.975 19.825 2.296 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -1.093 16.423 1.986 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -0.499 18.086 2.053 1.00 0.00 H new ATOM 1677 N THR A 113 -9.021 15.464 0.800 1.00 0.00 N ATOM 1678 CA THR A 113 -9.130 15.118 -0.585 1.00 0.00 C ATOM 1679 C THR A 113 -7.874 15.625 -1.308 1.00 0.00 C ATOM 1680 O THR A 113 -7.325 16.694 -0.957 1.00 0.00 O ATOM 1681 CB THR A 113 -10.444 15.686 -1.238 1.00 0.00 C ATOM 1682 OG1 THR A 113 -10.505 15.360 -2.633 1.00 0.00 O ATOM 1683 CG2 THR A 113 -10.555 17.196 -1.067 1.00 0.00 C ATOM 0 H THR A 113 -9.526 16.308 1.070 1.00 0.00 H new ATOM 0 HA THR A 113 -9.199 14.034 -0.680 1.00 0.00 H new ATOM 0 HB THR A 113 -11.281 15.218 -0.720 1.00 0.00 H new ATOM 0 HG1 THR A 113 -10.888 16.114 -3.129 1.00 0.00 H new ATOM 0 HG21 THR A 113 -11.476 17.548 -1.532 1.00 0.00 H new ATOM 0 HG22 THR A 113 -10.567 17.442 -0.005 1.00 0.00 H new ATOM 0 HG23 THR A 113 -9.701 17.680 -1.542 1.00 0.00 H new ATOM 1691 N CYS A 114 -7.386 14.848 -2.242 1.00 0.00 N ATOM 1692 CA CYS A 114 -6.214 15.206 -2.980 1.00 0.00 C ATOM 1693 C CYS A 114 -6.234 14.481 -4.300 1.00 0.00 C ATOM 1694 O CYS A 114 -6.461 13.271 -4.351 1.00 0.00 O ATOM 1695 CB CYS A 114 -4.944 14.847 -2.195 1.00 0.00 C ATOM 1696 SG CYS A 114 -3.403 15.478 -2.907 1.00 0.00 S ATOM 0 H CYS A 114 -7.794 13.952 -2.508 1.00 0.00 H new ATOM 0 HA CYS A 114 -6.208 16.283 -3.148 1.00 0.00 H new ATOM 0 HB2 CYS A 114 -5.042 15.231 -1.179 1.00 0.00 H new ATOM 0 HB3 CYS A 114 -4.875 13.762 -2.121 1.00 0.00 H new ATOM 0 HG CYS A 114 -3.677 16.352 -3.829 1.00 0.00 H new ATOM 1702 N GLN A 115 -6.076 15.217 -5.350 1.00 0.00 N ATOM 1703 CA GLN A 115 -6.033 14.652 -6.668 1.00 0.00 C ATOM 1704 C GLN A 115 -4.618 14.759 -7.173 1.00 0.00 C ATOM 1705 O GLN A 115 -3.947 15.761 -6.918 1.00 0.00 O ATOM 1706 CB GLN A 115 -6.979 15.387 -7.655 1.00 0.00 C ATOM 1707 CG GLN A 115 -8.499 15.205 -7.456 1.00 0.00 C ATOM 1708 CD GLN A 115 -9.073 15.820 -6.188 1.00 0.00 C ATOM 1709 OE1 GLN A 115 -9.458 17.000 -6.168 1.00 0.00 O ATOM 1710 NE2 GLN A 115 -9.201 15.026 -5.155 1.00 0.00 N ATOM 0 H GLN A 115 -5.972 16.231 -5.323 1.00 0.00 H new ATOM 0 HA GLN A 115 -6.364 13.615 -6.610 1.00 0.00 H new ATOM 0 HB2 GLN A 115 -6.758 16.453 -7.601 1.00 0.00 H new ATOM 0 HB3 GLN A 115 -6.731 15.060 -8.665 1.00 0.00 H new ATOM 0 HG2 GLN A 115 -9.014 15.637 -8.314 1.00 0.00 H new ATOM 0 HG3 GLN A 115 -8.722 14.138 -7.455 1.00 0.00 H new ATOM 0 HE21 GLN A 115 -8.873 14.062 -5.209 1.00 0.00 H new ATOM 0 HE22 GLN A 115 -9.629 15.372 -4.296 1.00 0.00 H new ATOM 1719 N GLY A 116 -4.138 13.751 -7.822 1.00 0.00 N ATOM 1720 CA GLY A 116 -2.846 13.856 -8.402 1.00 0.00 C ATOM 1721 C GLY A 116 -2.053 12.603 -8.322 1.00 0.00 C ATOM 1722 O GLY A 116 -2.497 11.597 -7.764 1.00 0.00 O ATOM 0 H GLY A 116 -4.614 12.860 -7.962 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -2.949 14.144 -9.448 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -2.297 14.655 -7.904 1.00 0.00 H new ATOM 1726 N VAL A 117 -0.885 12.673 -8.887 1.00 0.00 N ATOM 1727 CA VAL A 117 0.070 11.606 -8.917 1.00 0.00 C ATOM 1728 C VAL A 117 1.434 12.240 -8.733 1.00 0.00 C ATOM 1729 O VAL A 117 1.632 13.380 -9.165 1.00 0.00 O ATOM 1730 CB VAL A 117 0.036 10.787 -10.263 1.00 0.00 C ATOM 1731 CG1 VAL A 117 -1.241 9.966 -10.390 1.00 0.00 C ATOM 1732 CG2 VAL A 117 0.179 11.706 -11.473 1.00 0.00 C ATOM 0 H VAL A 117 -0.557 13.514 -9.361 1.00 0.00 H new ATOM 0 HA VAL A 117 -0.165 10.892 -8.128 1.00 0.00 H new ATOM 0 HB VAL A 117 0.884 10.103 -10.237 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -1.228 9.415 -11.331 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -1.306 9.263 -9.559 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -2.104 10.631 -10.371 1.00 0.00 H new ATOM 0 HG21 VAL A 117 0.152 11.112 -12.386 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -0.641 12.424 -11.483 1.00 0.00 H new ATOM 0 HG23 VAL A 117 1.128 12.239 -11.415 1.00 0.00 H new ATOM 1742 N PRO A 118 2.365 11.562 -8.049 1.00 0.00 N ATOM 1743 CA PRO A 118 3.717 12.083 -7.811 1.00 0.00 C ATOM 1744 C PRO A 118 4.392 12.611 -9.094 1.00 0.00 C ATOM 1745 O PRO A 118 4.277 11.998 -10.168 1.00 0.00 O ATOM 1746 CB PRO A 118 4.468 10.870 -7.277 1.00 0.00 C ATOM 1747 CG PRO A 118 3.421 10.078 -6.594 1.00 0.00 C ATOM 1748 CD PRO A 118 2.181 10.236 -7.428 1.00 0.00 C ATOM 0 HA PRO A 118 3.707 12.936 -7.133 1.00 0.00 H new ATOM 0 HB2 PRO A 118 4.937 10.304 -8.082 1.00 0.00 H new ATOM 0 HB3 PRO A 118 5.261 11.162 -6.589 1.00 0.00 H new ATOM 0 HG2 PRO A 118 3.710 9.030 -6.518 1.00 0.00 H new ATOM 0 HG3 PRO A 118 3.258 10.438 -5.578 1.00 0.00 H new ATOM 0 HD2 PRO A 118 2.095 9.448 -8.176 1.00 0.00 H new ATOM 0 HD3 PRO A 118 1.278 10.197 -6.819 1.00 0.00 H new ATOM 1756 N PRO A 119 5.090 13.756 -9.008 1.00 0.00 N ATOM 1757 CA PRO A 119 5.242 14.518 -7.761 1.00 0.00 C ATOM 1758 C PRO A 119 4.077 15.493 -7.486 1.00 0.00 C ATOM 1759 O PRO A 119 3.871 15.928 -6.332 1.00 0.00 O ATOM 1760 CB PRO A 119 6.533 15.310 -8.003 1.00 0.00 C ATOM 1761 CG PRO A 119 6.634 15.479 -9.491 1.00 0.00 C ATOM 1762 CD PRO A 119 5.818 14.377 -10.130 1.00 0.00 C ATOM 0 HA PRO A 119 5.259 13.859 -6.893 1.00 0.00 H new ATOM 0 HB2 PRO A 119 6.499 16.277 -7.501 1.00 0.00 H new ATOM 0 HB3 PRO A 119 7.399 14.777 -7.610 1.00 0.00 H new ATOM 0 HG2 PRO A 119 6.259 16.457 -9.792 1.00 0.00 H new ATOM 0 HG3 PRO A 119 7.674 15.423 -9.814 1.00 0.00 H new ATOM 0 HD2 PRO A 119 5.131 14.775 -10.877 1.00 0.00 H new ATOM 0 HD3 PRO A 119 6.457 13.654 -10.637 1.00 0.00 H new ATOM 1770 N ASN A 120 3.287 15.770 -8.511 1.00 0.00 N ATOM 1771 CA ASN A 120 2.271 16.810 -8.435 1.00 0.00 C ATOM 1772 C ASN A 120 0.997 16.376 -7.738 1.00 0.00 C ATOM 1773 O ASN A 120 0.139 15.693 -8.304 1.00 0.00 O ATOM 1774 CB ASN A 120 1.963 17.392 -9.812 1.00 0.00 C ATOM 1775 CG ASN A 120 3.093 18.237 -10.351 1.00 0.00 C ATOM 1776 OD1 ASN A 120 4.005 17.743 -11.024 1.00 0.00 O ATOM 1777 ND2 ASN A 120 3.047 19.514 -10.065 1.00 0.00 N ATOM 0 H ASN A 120 3.329 15.288 -9.409 1.00 0.00 H new ATOM 0 HA ASN A 120 2.706 17.591 -7.811 1.00 0.00 H new ATOM 0 HB2 ASN A 120 1.758 16.579 -10.508 1.00 0.00 H new ATOM 0 HB3 ASN A 120 1.058 17.997 -9.753 1.00 0.00 H new ATOM 0 HD21 ASN A 120 3.780 20.139 -10.401 1.00 0.00 H new ATOM 0 HD22 ASN A 120 2.278 19.884 -9.507 1.00 0.00 H new ATOM 1784 N HIS A 121 0.896 16.779 -6.510 1.00 0.00 N ATOM 1785 CA HIS A 121 -0.253 16.513 -5.670 1.00 0.00 C ATOM 1786 C HIS A 121 -1.104 17.776 -5.473 1.00 0.00 C ATOM 1787 O HIS A 121 -0.588 18.796 -5.031 1.00 0.00 O ATOM 1788 CB HIS A 121 0.182 15.865 -4.331 1.00 0.00 C ATOM 1789 CG HIS A 121 1.226 16.625 -3.543 1.00 0.00 C ATOM 1790 ND1 HIS A 121 2.579 16.592 -3.842 1.00 0.00 N ATOM 1791 CD2 HIS A 121 1.108 17.413 -2.457 1.00 0.00 C ATOM 1792 CE1 HIS A 121 3.236 17.322 -2.963 1.00 0.00 C ATOM 1793 NE2 HIS A 121 2.368 17.830 -2.116 1.00 0.00 N ATOM 0 H HIS A 121 1.625 17.318 -6.042 1.00 0.00 H new ATOM 0 HA HIS A 121 -0.892 15.790 -6.177 1.00 0.00 H new ATOM 0 HB2 HIS A 121 -0.701 15.742 -3.704 1.00 0.00 H new ATOM 0 HB3 HIS A 121 0.566 14.867 -4.540 1.00 0.00 H new ATOM 0 HD1 HIS A 121 3.000 16.083 -4.619 1.00 0.00 H new ATOM 0 HD2 HIS A 121 0.190 17.669 -1.949 1.00 0.00 H new ATOM 0 HE1 HIS A 121 4.305 17.477 -2.942 1.00 0.00 H new ATOM 1802 N ILE A 122 -2.378 17.705 -5.808 1.00 0.00 N ATOM 1803 CA ILE A 122 -3.302 18.831 -5.646 1.00 0.00 C ATOM 1804 C ILE A 122 -4.043 18.678 -4.310 1.00 0.00 C ATOM 1805 O ILE A 122 -4.868 17.768 -4.164 1.00 0.00 O ATOM 1806 CB ILE A 122 -4.365 18.857 -6.794 1.00 0.00 C ATOM 1807 CG1 ILE A 122 -3.685 18.924 -8.166 1.00 0.00 C ATOM 1808 CG2 ILE A 122 -5.334 20.025 -6.615 1.00 0.00 C ATOM 1809 CD1 ILE A 122 -4.647 18.831 -9.339 1.00 0.00 C ATOM 0 H ILE A 122 -2.810 16.869 -6.201 1.00 0.00 H new ATOM 0 HA ILE A 122 -2.725 19.755 -5.674 1.00 0.00 H new ATOM 0 HB ILE A 122 -4.937 17.931 -6.742 1.00 0.00 H new ATOM 0 HG12 ILE A 122 -3.129 19.859 -8.239 1.00 0.00 H new ATOM 0 HG13 ILE A 122 -2.959 18.114 -8.240 1.00 0.00 H new ATOM 0 HG21 ILE A 122 -6.063 20.021 -7.426 1.00 0.00 H new ATOM 0 HG22 ILE A 122 -5.852 19.925 -5.661 1.00 0.00 H new ATOM 0 HG23 ILE A 122 -4.780 20.963 -6.630 1.00 0.00 H new ATOM 0 HD11 ILE A 122 -4.088 18.886 -10.273 1.00 0.00 H new ATOM 0 HD12 ILE A 122 -5.186 17.885 -9.294 1.00 0.00 H new ATOM 0 HD13 ILE A 122 -5.358 19.656 -9.293 1.00 0.00 H new ATOM 1821 N PRO A 123 -3.731 19.511 -3.310 1.00 0.00 N ATOM 1822 CA PRO A 123 -4.366 19.430 -1.999 1.00 0.00 C ATOM 1823 C PRO A 123 -5.710 20.181 -1.938 1.00 0.00 C ATOM 1824 O PRO A 123 -5.817 21.350 -2.364 1.00 0.00 O ATOM 1825 CB PRO A 123 -3.337 20.087 -1.082 1.00 0.00 C ATOM 1826 CG PRO A 123 -2.643 21.098 -1.942 1.00 0.00 C ATOM 1827 CD PRO A 123 -2.728 20.600 -3.369 1.00 0.00 C ATOM 0 HA PRO A 123 -4.616 18.405 -1.727 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -3.817 20.560 -0.225 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -2.633 19.353 -0.689 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -3.116 22.075 -1.846 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -1.603 21.216 -1.636 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -3.039 21.392 -4.050 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -1.764 20.236 -3.723 1.00 0.00 H new ATOM 1835 N GLY A 124 -6.723 19.514 -1.431 1.00 0.00 N ATOM 1836 CA GLY A 124 -8.012 20.132 -1.301 1.00 0.00 C ATOM 1837 C GLY A 124 -8.429 20.277 0.149 1.00 0.00 C ATOM 1838 O GLY A 124 -7.577 20.457 1.028 1.00 0.00 O ATOM 0 H GLY A 124 -6.674 18.549 -1.105 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -7.992 21.115 -1.772 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -8.754 19.538 -1.834 1.00 0.00 H new ATOM 1842 N VAL A 125 -9.729 20.193 0.388 1.00 0.00 N ATOM 1843 CA VAL A 125 -10.324 20.314 1.726 1.00 0.00 C ATOM 1844 C VAL A 125 -9.763 19.282 2.697 1.00 0.00 C ATOM 1845 O VAL A 125 -9.899 18.064 2.480 1.00 0.00 O ATOM 1846 CB VAL A 125 -11.875 20.154 1.682 1.00 0.00 C ATOM 1847 CG1 VAL A 125 -12.489 20.233 3.075 1.00 0.00 C ATOM 1848 CG2 VAL A 125 -12.493 21.201 0.789 1.00 0.00 C ATOM 0 H VAL A 125 -10.417 20.037 -0.348 1.00 0.00 H new ATOM 0 HA VAL A 125 -10.067 21.314 2.076 1.00 0.00 H new ATOM 0 HB VAL A 125 -12.087 19.166 1.274 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -13.570 20.117 3.003 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -12.080 19.438 3.699 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -12.256 21.200 3.521 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -13.575 21.072 0.772 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -12.252 22.193 1.171 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -12.099 21.096 -0.222 1.00 0.00 H new ATOM 1858 N ALA A 126 -9.094 19.771 3.713 1.00 0.00 N ATOM 1859 CA ALA A 126 -8.613 18.946 4.786 1.00 0.00 C ATOM 1860 C ALA A 126 -9.618 18.946 5.907 1.00 0.00 C ATOM 1861 O ALA A 126 -10.258 19.972 6.167 1.00 0.00 O ATOM 1862 CB ALA A 126 -7.267 19.429 5.277 1.00 0.00 C ATOM 0 H ALA A 126 -8.868 20.760 3.816 1.00 0.00 H new ATOM 0 HA ALA A 126 -8.485 17.928 4.419 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -6.925 18.788 6.089 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -6.547 19.394 4.459 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -7.357 20.454 5.637 1.00 0.00 H new ATOM 1868 N TRP A 127 -9.764 17.824 6.563 1.00 0.00 N ATOM 1869 CA TRP A 127 -10.700 17.714 7.666 1.00 0.00 C ATOM 1870 C TRP A 127 -9.936 17.719 8.988 1.00 0.00 C ATOM 1871 O TRP A 127 -10.451 17.311 10.037 1.00 0.00 O ATOM 1872 CB TRP A 127 -11.546 16.444 7.510 1.00 0.00 C ATOM 1873 CG TRP A 127 -12.257 16.370 6.184 1.00 0.00 C ATOM 1874 CD1 TRP A 127 -13.173 17.258 5.690 1.00 0.00 C ATOM 1875 CD2 TRP A 127 -12.115 15.345 5.187 1.00 0.00 C ATOM 1876 NE1 TRP A 127 -13.604 16.847 4.449 1.00 0.00 N ATOM 1877 CE2 TRP A 127 -12.965 15.681 4.117 1.00 0.00 C ATOM 1878 CE3 TRP A 127 -11.349 14.180 5.095 1.00 0.00 C ATOM 1879 CZ2 TRP A 127 -13.069 14.894 2.973 1.00 0.00 C ATOM 1880 CZ3 TRP A 127 -11.452 13.401 3.960 1.00 0.00 C ATOM 1881 CH2 TRP A 127 -12.305 13.763 2.913 1.00 0.00 C ATOM 0 H TRP A 127 -9.248 16.969 6.357 1.00 0.00 H new ATOM 0 HA TRP A 127 -11.377 18.568 7.662 1.00 0.00 H new ATOM 0 HB2 TRP A 127 -10.904 15.570 7.621 1.00 0.00 H new ATOM 0 HB3 TRP A 127 -12.282 16.403 8.313 1.00 0.00 H new ATOM 0 HD1 TRP A 127 -13.508 18.150 6.199 1.00 0.00 H new ATOM 0 HE1 TRP A 127 -14.289 17.332 3.870 1.00 0.00 H new ATOM 0 HE3 TRP A 127 -10.687 13.894 5.899 1.00 0.00 H new ATOM 0 HZ2 TRP A 127 -13.729 15.168 2.163 1.00 0.00 H new ATOM 0 HZ3 TRP A 127 -10.865 12.498 3.880 1.00 0.00 H new ATOM 0 HH2 TRP A 127 -12.361 13.134 2.037 1.00 0.00 H new ATOM 1892 N GLY A 128 -8.720 18.214 8.922 1.00 0.00 N ATOM 1893 CA GLY A 128 -7.868 18.306 10.064 1.00 0.00 C ATOM 1894 C GLY A 128 -6.704 19.212 9.764 1.00 0.00 C ATOM 1895 O GLY A 128 -6.634 19.782 8.668 1.00 0.00 O ATOM 0 H GLY A 128 -8.300 18.565 8.061 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -8.428 18.690 10.916 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -7.507 17.315 10.340 1.00 0.00 H new ATOM 1899 N VAL A 129 -5.790 19.327 10.688 1.00 0.00 N ATOM 1900 CA VAL A 129 -4.636 20.206 10.549 1.00 0.00 C ATOM 1901 C VAL A 129 -3.357 19.370 10.449 1.00 0.00 C ATOM 1902 O VAL A 129 -3.233 18.341 11.121 1.00 0.00 O ATOM 1903 CB VAL A 129 -4.533 21.186 11.761 1.00 0.00 C ATOM 1904 CG1 VAL A 129 -3.347 22.137 11.621 1.00 0.00 C ATOM 1905 CG2 VAL A 129 -5.825 21.979 11.927 1.00 0.00 C ATOM 0 H VAL A 129 -5.815 18.814 11.569 1.00 0.00 H new ATOM 0 HA VAL A 129 -4.759 20.795 9.640 1.00 0.00 H new ATOM 0 HB VAL A 129 -4.373 20.580 12.653 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -3.310 22.802 12.484 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -2.423 21.561 11.567 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -3.460 22.728 10.712 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -5.730 22.655 12.777 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -6.016 22.557 11.023 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -6.654 21.292 12.100 1.00 0.00 H new ATOM 1915 N PHE A 130 -2.434 19.801 9.608 1.00 0.00 N ATOM 1916 CA PHE A 130 -1.175 19.101 9.407 1.00 0.00 C ATOM 1917 C PHE A 130 -0.033 19.865 10.049 1.00 0.00 C ATOM 1918 O PHE A 130 0.200 21.038 9.734 1.00 0.00 O ATOM 1919 CB PHE A 130 -0.885 18.911 7.915 1.00 0.00 C ATOM 1920 CG PHE A 130 -1.880 18.047 7.203 1.00 0.00 C ATOM 1921 CD1 PHE A 130 -3.042 18.588 6.677 1.00 0.00 C ATOM 1922 CD2 PHE A 130 -1.656 16.689 7.063 1.00 0.00 C ATOM 1923 CE1 PHE A 130 -3.955 17.794 6.027 1.00 0.00 C ATOM 1924 CE2 PHE A 130 -2.567 15.889 6.411 1.00 0.00 C ATOM 1925 CZ PHE A 130 -3.719 16.444 5.893 1.00 0.00 C ATOM 0 H PHE A 130 -2.535 20.645 9.045 1.00 0.00 H new ATOM 0 HA PHE A 130 -1.262 18.121 9.876 1.00 0.00 H new ATOM 0 HB2 PHE A 130 -0.859 19.889 7.434 1.00 0.00 H new ATOM 0 HB3 PHE A 130 0.107 18.473 7.802 1.00 0.00 H new ATOM 0 HD1 PHE A 130 -3.232 19.646 6.779 1.00 0.00 H new ATOM 0 HD2 PHE A 130 -0.756 16.252 7.470 1.00 0.00 H new ATOM 0 HE1 PHE A 130 -4.857 18.228 5.621 1.00 0.00 H new ATOM 0 HE2 PHE A 130 -2.381 14.830 6.305 1.00 0.00 H new ATOM 0 HZ PHE A 130 -4.436 15.819 5.382 1.00 0.00 H new ATOM 1935 N LYS A 131 0.650 19.216 10.941 1.00 0.00 N ATOM 1936 CA LYS A 131 1.791 19.755 11.627 1.00 0.00 C ATOM 1937 C LYS A 131 2.917 18.727 11.566 1.00 0.00 C ATOM 1938 O LYS A 131 3.438 18.490 10.475 1.00 0.00 O ATOM 1939 CB LYS A 131 1.435 20.072 13.096 1.00 0.00 C ATOM 1940 CG LYS A 131 0.450 21.219 13.288 1.00 0.00 C ATOM 1941 CD LYS A 131 1.052 22.540 12.833 1.00 0.00 C ATOM 1942 CE LYS A 131 0.091 23.690 13.047 1.00 0.00 C ATOM 1943 NZ LYS A 131 0.694 24.989 12.660 1.00 0.00 N ATOM 1944 OXT LYS A 131 3.294 18.159 12.609 1.00 0.00 O ATOM 0 H LYS A 131 0.423 18.263 11.224 1.00 0.00 H new ATOM 0 HA LYS A 131 2.107 20.683 11.150 1.00 0.00 H new ATOM 0 HB2 LYS A 131 1.019 19.175 13.555 1.00 0.00 H new ATOM 0 HB3 LYS A 131 2.353 20.308 13.634 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -0.461 21.018 12.725 1.00 0.00 H new ATOM 0 HG3 LYS A 131 0.167 21.287 14.338 1.00 0.00 H new ATOM 0 HD2 LYS A 131 1.975 22.729 13.381 1.00 0.00 H new ATOM 0 HD3 LYS A 131 1.316 22.476 11.777 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -0.814 23.521 12.464 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -0.207 23.725 14.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 0.006 25.753 12.821 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 1.544 25.162 13.234 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 0.955 24.964 11.654 1.00 0.00 H new TER 1958 LYS A 131