USER MOD reduce.3.24.130724 H: found=0, std=0, add=658, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 656 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 28 MET CE :methyl -141:sc= -1.7 (180deg=-1.04) USER MOD Set 1.2: A 33 SER OG : rot -130:sc= -1.45 USER MOD Single : A 1 GLY N :NH3+ -139:sc= 0.0102 (180deg=0) USER MOD Single : A 2 SER OG : rot -43:sc= 1.08 USER MOD Single : A 3 SER OG : rot 43:sc= 1.15 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 TYR OH : rot 148:sc= 0.509 USER MOD Single : A 16 ASN : amide:sc= 0.0283 X(o=0.028,f=0) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 GLN : amide:sc= 0.0126 K(o=0.013,f=-1.8!) USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 ASN : amide:sc= -0.0636 X(o=-0.064,f=0) USER MOD Single : A 45 GLN : amide:sc= -6.77! C(o=-6.8!,f=-11!) USER MOD Single : A 47 CYS SG : rot -63:sc= -0.587 USER MOD Single : A 48 CYS SG : rot 15:sc= -7.14! USER MOD Single : A 51 TYR OH : rot -140:sc= -1.02 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot -151:sc= -0.986 USER MOD Single : A 65 THR OG1 : rot -71:sc= -4.68! USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 41:sc= 0.407 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 14.457 -20.319 -8.455 1.00 0.00 N ATOM 2 CA GLY A 1 14.916 -21.108 -7.324 1.00 0.00 C ATOM 3 C GLY A 1 15.964 -20.344 -6.512 1.00 0.00 C ATOM 4 O GLY A 1 15.823 -19.143 -6.284 1.00 0.00 O ATOM 0 H1 GLY A 1 13.428 -20.429 -8.560 1.00 0.00 H new ATOM 0 H2 GLY A 1 14.684 -19.317 -8.294 1.00 0.00 H new ATOM 0 H3 GLY A 1 14.930 -20.646 -9.321 1.00 0.00 H new ATOM 0 HA2 GLY A 1 14.070 -21.361 -6.685 1.00 0.00 H new ATOM 0 HA3 GLY A 1 15.340 -22.047 -7.679 1.00 0.00 H new ATOM 8 N SER A 2 16.991 -21.071 -6.099 1.00 0.00 N ATOM 9 CA SER A 2 18.062 -20.477 -5.317 1.00 0.00 C ATOM 10 C SER A 2 17.485 -19.781 -4.083 1.00 0.00 C ATOM 11 O SER A 2 16.271 -19.621 -3.966 1.00 0.00 O ATOM 12 CB SER A 2 18.871 -19.485 -6.156 1.00 0.00 C ATOM 13 OG SER A 2 18.220 -18.223 -6.265 1.00 0.00 O ATOM 0 H SER A 2 17.105 -22.066 -6.291 1.00 0.00 H new ATOM 0 HA SER A 2 18.734 -21.273 -4.996 1.00 0.00 H new ATOM 0 HB2 SER A 2 19.855 -19.348 -5.707 1.00 0.00 H new ATOM 0 HB3 SER A 2 19.030 -19.898 -7.152 1.00 0.00 H new ATOM 0 HG SER A 2 17.265 -18.361 -6.434 1.00 0.00 H new ATOM 19 N SER A 3 18.383 -19.387 -3.191 1.00 0.00 N ATOM 20 CA SER A 3 17.978 -18.712 -1.970 1.00 0.00 C ATOM 21 C SER A 3 19.125 -17.845 -1.447 1.00 0.00 C ATOM 22 O SER A 3 19.983 -18.324 -0.707 1.00 0.00 O ATOM 23 CB SER A 3 17.545 -19.719 -0.902 1.00 0.00 C ATOM 24 OG SER A 3 18.637 -20.505 -0.435 1.00 0.00 O ATOM 0 H SER A 3 19.389 -19.523 -3.290 1.00 0.00 H new ATOM 0 HA SER A 3 17.124 -18.075 -2.198 1.00 0.00 H new ATOM 0 HB2 SER A 3 17.096 -19.187 -0.063 1.00 0.00 H new ATOM 0 HB3 SER A 3 16.776 -20.374 -1.312 1.00 0.00 H new ATOM 0 HG SER A 3 19.421 -19.931 -0.305 1.00 0.00 H new ATOM 30 N GLY A 4 19.103 -16.583 -1.851 1.00 0.00 N ATOM 31 CA GLY A 4 20.130 -15.645 -1.433 1.00 0.00 C ATOM 32 C GLY A 4 19.507 -14.350 -0.906 1.00 0.00 C ATOM 33 O GLY A 4 19.667 -14.012 0.266 1.00 0.00 O ATOM 0 H GLY A 4 18.389 -16.189 -2.464 1.00 0.00 H new ATOM 0 HA2 GLY A 4 20.747 -16.098 -0.657 1.00 0.00 H new ATOM 0 HA3 GLY A 4 20.787 -15.421 -2.273 1.00 0.00 H new ATOM 37 N SER A 5 18.811 -13.660 -1.797 1.00 0.00 N ATOM 38 CA SER A 5 18.164 -12.410 -1.437 1.00 0.00 C ATOM 39 C SER A 5 16.657 -12.513 -1.676 1.00 0.00 C ATOM 40 O SER A 5 16.177 -12.221 -2.771 1.00 0.00 O ATOM 41 CB SER A 5 18.749 -11.239 -2.229 1.00 0.00 C ATOM 42 OG SER A 5 18.683 -10.016 -1.501 1.00 0.00 O ATOM 0 H SER A 5 18.681 -13.943 -2.768 1.00 0.00 H new ATOM 0 HA SER A 5 18.345 -12.224 -0.378 1.00 0.00 H new ATOM 0 HB2 SER A 5 19.787 -11.455 -2.482 1.00 0.00 H new ATOM 0 HB3 SER A 5 18.208 -11.131 -3.169 1.00 0.00 H new ATOM 0 HG SER A 5 19.068 -9.293 -2.040 1.00 0.00 H new ATOM 48 N SER A 6 15.951 -12.929 -0.635 1.00 0.00 N ATOM 49 CA SER A 6 14.508 -13.074 -0.718 1.00 0.00 C ATOM 50 C SER A 6 13.835 -12.258 0.387 1.00 0.00 C ATOM 51 O SER A 6 13.650 -12.748 1.500 1.00 0.00 O ATOM 52 CB SER A 6 14.096 -14.544 -0.618 1.00 0.00 C ATOM 53 OG SER A 6 14.531 -15.299 -1.746 1.00 0.00 O ATOM 0 H SER A 6 16.352 -13.170 0.271 1.00 0.00 H new ATOM 0 HA SER A 6 14.182 -12.698 -1.688 1.00 0.00 H new ATOM 0 HB2 SER A 6 14.514 -14.977 0.291 1.00 0.00 H new ATOM 0 HB3 SER A 6 13.011 -14.611 -0.533 1.00 0.00 H new ATOM 0 HG SER A 6 14.250 -16.232 -1.643 1.00 0.00 H new ATOM 59 N GLY A 7 13.488 -11.027 0.042 1.00 0.00 N ATOM 60 CA GLY A 7 12.840 -10.138 0.991 1.00 0.00 C ATOM 61 C GLY A 7 13.791 -9.027 1.440 1.00 0.00 C ATOM 62 O GLY A 7 14.958 -9.285 1.734 1.00 0.00 O ATOM 0 H GLY A 7 13.643 -10.624 -0.882 1.00 0.00 H new ATOM 0 HA2 GLY A 7 11.952 -9.699 0.536 1.00 0.00 H new ATOM 0 HA3 GLY A 7 12.505 -10.708 1.858 1.00 0.00 H new ATOM 66 N GLY A 8 13.258 -7.815 1.478 1.00 0.00 N ATOM 67 CA GLY A 8 14.045 -6.663 1.886 1.00 0.00 C ATOM 68 C GLY A 8 13.252 -5.367 1.709 1.00 0.00 C ATOM 69 O GLY A 8 13.410 -4.428 2.488 1.00 0.00 O ATOM 0 H GLY A 8 12.290 -7.605 1.233 1.00 0.00 H new ATOM 0 HA2 GLY A 8 14.342 -6.772 2.929 1.00 0.00 H new ATOM 0 HA3 GLY A 8 14.961 -6.617 1.297 1.00 0.00 H new ATOM 73 N THR A 9 12.418 -5.357 0.681 1.00 0.00 N ATOM 74 CA THR A 9 11.600 -4.191 0.392 1.00 0.00 C ATOM 75 C THR A 9 10.335 -4.601 -0.366 1.00 0.00 C ATOM 76 O THR A 9 10.242 -5.721 -0.865 1.00 0.00 O ATOM 77 CB THR A 9 12.464 -3.184 -0.369 1.00 0.00 C ATOM 78 OG1 THR A 9 13.217 -3.987 -1.275 1.00 0.00 O ATOM 79 CG2 THR A 9 13.525 -2.532 0.520 1.00 0.00 C ATOM 0 H THR A 9 12.290 -6.138 0.037 1.00 0.00 H new ATOM 0 HA THR A 9 11.252 -3.715 1.309 1.00 0.00 H new ATOM 0 HB THR A 9 11.826 -2.412 -0.799 1.00 0.00 H new ATOM 0 HG1 THR A 9 13.804 -3.413 -1.810 1.00 0.00 H new ATOM 0 HG21 THR A 9 14.110 -1.826 -0.070 1.00 0.00 H new ATOM 0 HG22 THR A 9 13.038 -2.004 1.340 1.00 0.00 H new ATOM 0 HG23 THR A 9 14.184 -3.301 0.924 1.00 0.00 H new ATOM 87 N VAL A 10 9.394 -3.671 -0.427 1.00 0.00 N ATOM 88 CA VAL A 10 8.139 -3.921 -1.116 1.00 0.00 C ATOM 89 C VAL A 10 7.750 -2.683 -1.926 1.00 0.00 C ATOM 90 O VAL A 10 8.050 -1.558 -1.529 1.00 0.00 O ATOM 91 CB VAL A 10 7.064 -4.339 -0.109 1.00 0.00 C ATOM 92 CG1 VAL A 10 5.676 -4.327 -0.753 1.00 0.00 C ATOM 93 CG2 VAL A 10 7.379 -5.710 0.492 1.00 0.00 C ATOM 0 H VAL A 10 9.475 -2.743 -0.011 1.00 0.00 H new ATOM 0 HA VAL A 10 8.247 -4.747 -1.819 1.00 0.00 H new ATOM 0 HB VAL A 10 7.063 -3.611 0.702 1.00 0.00 H new ATOM 0 HG11 VAL A 10 4.931 -4.628 -0.017 1.00 0.00 H new ATOM 0 HG12 VAL A 10 5.449 -3.322 -1.110 1.00 0.00 H new ATOM 0 HG13 VAL A 10 5.658 -5.023 -1.592 1.00 0.00 H new ATOM 0 HG21 VAL A 10 6.600 -5.983 1.204 1.00 0.00 H new ATOM 0 HG22 VAL A 10 7.421 -6.455 -0.303 1.00 0.00 H new ATOM 0 HG23 VAL A 10 8.341 -5.671 1.004 1.00 0.00 H new ATOM 103 N LYS A 11 7.088 -2.932 -3.046 1.00 0.00 N ATOM 104 CA LYS A 11 6.656 -1.851 -3.916 1.00 0.00 C ATOM 105 C LYS A 11 5.248 -1.408 -3.510 1.00 0.00 C ATOM 106 O LYS A 11 4.352 -2.237 -3.360 1.00 0.00 O ATOM 107 CB LYS A 11 6.771 -2.266 -5.384 1.00 0.00 C ATOM 108 CG LYS A 11 8.227 -2.541 -5.764 1.00 0.00 C ATOM 109 CD LYS A 11 8.334 -3.762 -6.679 1.00 0.00 C ATOM 110 CE LYS A 11 9.648 -3.747 -7.462 1.00 0.00 C ATOM 111 NZ LYS A 11 9.767 -4.962 -8.299 1.00 0.00 N ATOM 0 H LYS A 11 6.840 -3.866 -3.371 1.00 0.00 H new ATOM 0 HA LYS A 11 7.309 -0.986 -3.802 1.00 0.00 H new ATOM 0 HB2 LYS A 11 6.170 -3.158 -5.561 1.00 0.00 H new ATOM 0 HB3 LYS A 11 6.368 -1.479 -6.021 1.00 0.00 H new ATOM 0 HG2 LYS A 11 8.647 -1.669 -6.265 1.00 0.00 H new ATOM 0 HG3 LYS A 11 8.817 -2.705 -4.862 1.00 0.00 H new ATOM 0 HD2 LYS A 11 8.271 -4.673 -6.084 1.00 0.00 H new ATOM 0 HD3 LYS A 11 7.493 -3.776 -7.373 1.00 0.00 H new ATOM 0 HE2 LYS A 11 9.693 -2.859 -8.092 1.00 0.00 H new ATOM 0 HE3 LYS A 11 10.489 -3.690 -6.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 10.665 -4.936 -8.824 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 9.746 -5.806 -7.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 8.974 -5.000 -8.971 1.00 0.00 H new ATOM 125 N VAL A 12 5.098 -0.102 -3.345 1.00 0.00 N ATOM 126 CA VAL A 12 3.815 0.461 -2.960 1.00 0.00 C ATOM 127 C VAL A 12 3.336 1.420 -4.051 1.00 0.00 C ATOM 128 O VAL A 12 3.938 2.471 -4.266 1.00 0.00 O ATOM 129 CB VAL A 12 3.927 1.125 -1.586 1.00 0.00 C ATOM 130 CG1 VAL A 12 2.588 1.731 -1.160 1.00 0.00 C ATOM 131 CG2 VAL A 12 4.438 0.135 -0.538 1.00 0.00 C ATOM 0 H VAL A 12 5.844 0.582 -3.471 1.00 0.00 H new ATOM 0 HA VAL A 12 3.065 -0.324 -2.866 1.00 0.00 H new ATOM 0 HB VAL A 12 4.653 1.935 -1.664 1.00 0.00 H new ATOM 0 HG11 VAL A 12 2.695 2.197 -0.180 1.00 0.00 H new ATOM 0 HG12 VAL A 12 2.281 2.482 -1.887 1.00 0.00 H new ATOM 0 HG13 VAL A 12 1.833 0.946 -1.108 1.00 0.00 H new ATOM 0 HG21 VAL A 12 4.508 0.633 0.429 1.00 0.00 H new ATOM 0 HG22 VAL A 12 3.748 -0.705 -0.464 1.00 0.00 H new ATOM 0 HG23 VAL A 12 5.423 -0.229 -0.831 1.00 0.00 H new ATOM 141 N TYR A 13 2.257 1.024 -4.710 1.00 0.00 N ATOM 142 CA TYR A 13 1.690 1.836 -5.774 1.00 0.00 C ATOM 143 C TYR A 13 0.799 2.942 -5.204 1.00 0.00 C ATOM 144 O TYR A 13 -0.198 2.660 -4.542 1.00 0.00 O ATOM 145 CB TYR A 13 0.833 0.889 -6.616 1.00 0.00 C ATOM 146 CG TYR A 13 1.642 -0.052 -7.511 1.00 0.00 C ATOM 147 CD1 TYR A 13 2.442 0.465 -8.510 1.00 0.00 C ATOM 148 CD2 TYR A 13 1.570 -1.417 -7.321 1.00 0.00 C ATOM 149 CE1 TYR A 13 3.203 -0.421 -9.352 1.00 0.00 C ATOM 150 CE2 TYR A 13 2.331 -2.302 -8.163 1.00 0.00 C ATOM 151 CZ TYR A 13 3.110 -1.761 -9.138 1.00 0.00 C ATOM 152 OH TYR A 13 3.828 -2.597 -9.934 1.00 0.00 O ATOM 0 H TYR A 13 1.760 0.152 -4.528 1.00 0.00 H new ATOM 0 HA TYR A 13 2.479 2.313 -6.355 1.00 0.00 H new ATOM 0 HB2 TYR A 13 0.208 0.293 -5.951 1.00 0.00 H new ATOM 0 HB3 TYR A 13 0.162 1.480 -7.240 1.00 0.00 H new ATOM 0 HD1 TYR A 13 2.497 1.533 -8.660 1.00 0.00 H new ATOM 0 HD2 TYR A 13 0.943 -1.821 -6.540 1.00 0.00 H new ATOM 0 HE1 TYR A 13 3.834 -0.030 -10.136 1.00 0.00 H new ATOM 0 HE2 TYR A 13 2.285 -3.372 -8.024 1.00 0.00 H new ATOM 0 HH TYR A 13 4.091 -3.390 -9.422 1.00 0.00 H new ATOM 162 N LEU A 14 1.191 4.176 -5.482 1.00 0.00 N ATOM 163 CA LEU A 14 0.440 5.325 -5.006 1.00 0.00 C ATOM 164 C LEU A 14 -0.622 5.700 -6.042 1.00 0.00 C ATOM 165 O LEU A 14 -0.521 5.318 -7.206 1.00 0.00 O ATOM 166 CB LEU A 14 1.386 6.474 -4.651 1.00 0.00 C ATOM 167 CG LEU A 14 1.942 6.469 -3.225 1.00 0.00 C ATOM 168 CD1 LEU A 14 3.192 7.344 -3.121 1.00 0.00 C ATOM 169 CD2 LEU A 14 0.868 6.882 -2.217 1.00 0.00 C ATOM 0 H LEU A 14 2.019 4.406 -6.031 1.00 0.00 H new ATOM 0 HA LEU A 14 -0.087 5.080 -4.084 1.00 0.00 H new ATOM 0 HB2 LEU A 14 2.225 6.456 -5.347 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.859 7.415 -4.811 1.00 0.00 H new ATOM 0 HG LEU A 14 2.241 5.450 -2.978 1.00 0.00 H new ATOM 0 HD11 LEU A 14 3.567 7.323 -2.098 1.00 0.00 H new ATOM 0 HD12 LEU A 14 3.959 6.965 -3.796 1.00 0.00 H new ATOM 0 HD13 LEU A 14 2.942 8.369 -3.395 1.00 0.00 H new ATOM 0 HD21 LEU A 14 1.289 6.870 -1.212 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.516 7.887 -2.451 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.033 6.184 -2.269 1.00 0.00 H new ATOM 181 N PRO A 15 -1.642 6.465 -5.568 1.00 0.00 N ATOM 182 CA PRO A 15 -2.721 6.896 -6.440 1.00 0.00 C ATOM 183 C PRO A 15 -2.261 8.024 -7.366 1.00 0.00 C ATOM 184 O PRO A 15 -2.638 9.179 -7.178 1.00 0.00 O ATOM 185 CB PRO A 15 -3.841 7.318 -5.502 1.00 0.00 C ATOM 186 CG PRO A 15 -3.186 7.547 -4.149 1.00 0.00 C ATOM 187 CD PRO A 15 -1.795 6.937 -4.195 1.00 0.00 C ATOM 0 HA PRO A 15 -3.058 6.107 -7.112 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -4.328 8.225 -5.859 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -4.609 6.547 -5.439 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -3.128 8.613 -3.928 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -3.778 7.089 -3.356 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -1.032 7.673 -3.942 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -1.698 6.118 -3.482 1.00 0.00 H new ATOM 195 N ASN A 16 -1.452 7.648 -8.346 1.00 0.00 N ATOM 196 CA ASN A 16 -0.936 8.613 -9.302 1.00 0.00 C ATOM 197 C ASN A 16 0.080 7.925 -10.217 1.00 0.00 C ATOM 198 O ASN A 16 1.121 8.497 -10.534 1.00 0.00 O ATOM 199 CB ASN A 16 -0.226 9.767 -8.591 1.00 0.00 C ATOM 200 CG ASN A 16 -0.578 11.109 -9.237 1.00 0.00 C ATOM 201 OD1 ASN A 16 -1.490 11.806 -8.823 1.00 0.00 O ATOM 202 ND2 ASN A 16 0.194 11.430 -10.271 1.00 0.00 N ATOM 0 H ASN A 16 -1.141 6.688 -8.498 1.00 0.00 H new ATOM 0 HA ASN A 16 -1.778 9.004 -9.874 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -0.510 9.780 -7.539 1.00 0.00 H new ATOM 0 HB3 ASN A 16 0.852 9.613 -8.628 1.00 0.00 H new ATOM 0 HD21 ASN A 16 0.040 12.306 -10.770 1.00 0.00 H new ATOM 0 HD22 ASN A 16 0.940 10.800 -10.565 1.00 0.00 H new ATOM 209 N LYS A 17 -0.260 6.708 -10.615 1.00 0.00 N ATOM 210 CA LYS A 17 0.609 5.936 -11.487 1.00 0.00 C ATOM 211 C LYS A 17 2.037 5.971 -10.937 1.00 0.00 C ATOM 212 O LYS A 17 2.998 5.786 -11.683 1.00 0.00 O ATOM 213 CB LYS A 17 0.494 6.430 -12.931 1.00 0.00 C ATOM 214 CG LYS A 17 -0.714 5.803 -13.629 1.00 0.00 C ATOM 215 CD LYS A 17 -0.339 4.472 -14.285 1.00 0.00 C ATOM 216 CE LYS A 17 -0.499 4.546 -15.805 1.00 0.00 C ATOM 217 NZ LYS A 17 0.701 4.004 -16.480 1.00 0.00 N ATOM 0 H LYS A 17 -1.125 6.237 -10.350 1.00 0.00 H new ATOM 0 HA LYS A 17 0.299 4.891 -11.506 1.00 0.00 H new ATOM 0 HB2 LYS A 17 0.402 7.516 -12.942 1.00 0.00 H new ATOM 0 HB3 LYS A 17 1.404 6.182 -13.478 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -1.514 5.643 -12.906 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -1.099 6.489 -14.384 1.00 0.00 H new ATOM 0 HD2 LYS A 17 0.691 4.217 -14.036 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -0.969 3.676 -13.888 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -1.381 3.984 -16.111 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -0.659 5.580 -16.110 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 0.575 4.062 -17.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 1.536 4.558 -16.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 0.836 3.011 -16.203 1.00 0.00 H new ATOM 231 N GLN A 18 2.131 6.209 -9.637 1.00 0.00 N ATOM 232 CA GLN A 18 3.425 6.270 -8.979 1.00 0.00 C ATOM 233 C GLN A 18 3.607 5.065 -8.054 1.00 0.00 C ATOM 234 O GLN A 18 2.641 4.378 -7.725 1.00 0.00 O ATOM 235 CB GLN A 18 3.587 7.582 -8.209 1.00 0.00 C ATOM 236 CG GLN A 18 4.060 8.705 -9.134 1.00 0.00 C ATOM 237 CD GLN A 18 5.080 9.603 -8.430 1.00 0.00 C ATOM 238 OE1 GLN A 18 4.755 10.642 -7.880 1.00 0.00 O ATOM 239 NE2 GLN A 18 6.327 9.144 -8.478 1.00 0.00 N ATOM 0 H GLN A 18 1.332 6.362 -9.022 1.00 0.00 H new ATOM 0 HA GLN A 18 4.202 6.237 -9.743 1.00 0.00 H new ATOM 0 HB2 GLN A 18 2.637 7.859 -7.751 1.00 0.00 H new ATOM 0 HB3 GLN A 18 4.304 7.447 -7.399 1.00 0.00 H new ATOM 0 HG2 GLN A 18 4.505 8.278 -10.032 1.00 0.00 H new ATOM 0 HG3 GLN A 18 3.206 9.301 -9.455 1.00 0.00 H new ATOM 0 HE21 GLN A 18 6.529 8.266 -8.956 1.00 0.00 H new ATOM 0 HE22 GLN A 18 7.081 9.670 -8.037 1.00 0.00 H new ATOM 248 N ARG A 19 4.853 4.845 -7.660 1.00 0.00 N ATOM 249 CA ARG A 19 5.174 3.735 -6.779 1.00 0.00 C ATOM 250 C ARG A 19 6.366 4.092 -5.888 1.00 0.00 C ATOM 251 O ARG A 19 7.216 4.892 -6.274 1.00 0.00 O ATOM 252 CB ARG A 19 5.504 2.474 -7.580 1.00 0.00 C ATOM 253 CG ARG A 19 6.615 2.745 -8.597 1.00 0.00 C ATOM 254 CD ARG A 19 6.039 3.303 -9.900 1.00 0.00 C ATOM 255 NE ARG A 19 6.788 4.514 -10.306 1.00 0.00 N ATOM 256 CZ ARG A 19 8.023 4.495 -10.825 1.00 0.00 C ATOM 257 NH1 ARG A 19 8.657 3.328 -11.003 1.00 0.00 N ATOM 258 NH2 ARG A 19 8.625 5.643 -11.165 1.00 0.00 N ATOM 0 H ARG A 19 5.652 5.417 -7.935 1.00 0.00 H new ATOM 0 HA ARG A 19 4.299 3.539 -6.159 1.00 0.00 H new ATOM 0 HB2 ARG A 19 5.813 1.679 -6.902 1.00 0.00 H new ATOM 0 HB3 ARG A 19 4.611 2.123 -8.097 1.00 0.00 H new ATOM 0 HG2 ARG A 19 7.331 3.452 -8.179 1.00 0.00 H new ATOM 0 HG3 ARG A 19 7.160 1.823 -8.801 1.00 0.00 H new ATOM 0 HD2 ARG A 19 6.097 2.549 -10.685 1.00 0.00 H new ATOM 0 HD3 ARG A 19 4.984 3.545 -9.767 1.00 0.00 H new ATOM 0 HE ARG A 19 6.335 5.420 -10.183 1.00 0.00 H new ATOM 0 HH11 ARG A 19 8.199 2.454 -10.743 1.00 0.00 H new ATOM 0 HH12 ARG A 19 9.597 3.313 -11.398 1.00 0.00 H new ATOM 0 HH21 ARG A 19 8.143 6.532 -11.029 1.00 0.00 H new ATOM 0 HH22 ARG A 19 9.565 5.628 -11.560 1.00 0.00 H new ATOM 272 N THR A 20 6.389 3.481 -4.713 1.00 0.00 N ATOM 273 CA THR A 20 7.462 3.725 -3.764 1.00 0.00 C ATOM 274 C THR A 20 7.853 2.426 -3.056 1.00 0.00 C ATOM 275 O THR A 20 6.988 1.667 -2.621 1.00 0.00 O ATOM 276 CB THR A 20 7.005 4.825 -2.805 1.00 0.00 C ATOM 277 OG1 THR A 20 8.216 5.317 -2.237 1.00 0.00 O ATOM 278 CG2 THR A 20 6.229 4.273 -1.607 1.00 0.00 C ATOM 0 H THR A 20 5.682 2.817 -4.396 1.00 0.00 H new ATOM 0 HA THR A 20 8.365 4.069 -4.268 1.00 0.00 H new ATOM 0 HB THR A 20 6.382 5.539 -3.343 1.00 0.00 H new ATOM 0 HG1 THR A 20 8.012 6.036 -1.603 1.00 0.00 H new ATOM 0 HG21 THR A 20 5.928 5.096 -0.958 1.00 0.00 H new ATOM 0 HG22 THR A 20 5.342 3.746 -1.959 1.00 0.00 H new ATOM 0 HG23 THR A 20 6.863 3.584 -1.049 1.00 0.00 H new ATOM 286 N VAL A 21 9.157 2.209 -2.963 1.00 0.00 N ATOM 287 CA VAL A 21 9.673 1.015 -2.316 1.00 0.00 C ATOM 288 C VAL A 21 9.825 1.279 -0.816 1.00 0.00 C ATOM 289 O VAL A 21 10.395 2.292 -0.415 1.00 0.00 O ATOM 290 CB VAL A 21 10.981 0.583 -2.982 1.00 0.00 C ATOM 291 CG1 VAL A 21 11.302 -0.879 -2.662 1.00 0.00 C ATOM 292 CG2 VAL A 21 10.929 0.814 -4.493 1.00 0.00 C ATOM 0 H VAL A 21 9.872 2.840 -3.325 1.00 0.00 H new ATOM 0 HA VAL A 21 8.975 0.186 -2.432 1.00 0.00 H new ATOM 0 HB VAL A 21 11.783 1.199 -2.576 1.00 0.00 H new ATOM 0 HG11 VAL A 21 12.236 -1.161 -3.147 1.00 0.00 H new ATOM 0 HG12 VAL A 21 11.402 -1.002 -1.584 1.00 0.00 H new ATOM 0 HG13 VAL A 21 10.497 -1.517 -3.027 1.00 0.00 H new ATOM 0 HG21 VAL A 21 11.871 0.499 -4.942 1.00 0.00 H new ATOM 0 HG22 VAL A 21 10.111 0.235 -4.922 1.00 0.00 H new ATOM 0 HG23 VAL A 21 10.768 1.873 -4.694 1.00 0.00 H new ATOM 302 N VAL A 22 9.304 0.349 -0.029 1.00 0.00 N ATOM 303 CA VAL A 22 9.374 0.468 1.418 1.00 0.00 C ATOM 304 C VAL A 22 10.107 -0.747 1.990 1.00 0.00 C ATOM 305 O VAL A 22 10.143 -1.806 1.365 1.00 0.00 O ATOM 306 CB VAL A 22 7.969 0.646 1.997 1.00 0.00 C ATOM 307 CG1 VAL A 22 8.029 0.944 3.496 1.00 0.00 C ATOM 308 CG2 VAL A 22 7.203 1.739 1.250 1.00 0.00 C ATOM 0 H VAL A 22 8.832 -0.490 -0.366 1.00 0.00 H new ATOM 0 HA VAL A 22 9.942 1.354 1.702 1.00 0.00 H new ATOM 0 HB VAL A 22 7.429 -0.291 1.863 1.00 0.00 H new ATOM 0 HG11 VAL A 22 7.018 1.066 3.883 1.00 0.00 H new ATOM 0 HG12 VAL A 22 8.518 0.118 4.012 1.00 0.00 H new ATOM 0 HG13 VAL A 22 8.595 1.861 3.662 1.00 0.00 H new ATOM 0 HG21 VAL A 22 6.208 1.845 1.681 1.00 0.00 H new ATOM 0 HG22 VAL A 22 7.739 2.684 1.338 1.00 0.00 H new ATOM 0 HG23 VAL A 22 7.115 1.468 0.198 1.00 0.00 H new ATOM 318 N THR A 23 10.674 -0.554 3.172 1.00 0.00 N ATOM 319 CA THR A 23 11.404 -1.621 3.835 1.00 0.00 C ATOM 320 C THR A 23 10.441 -2.533 4.597 1.00 0.00 C ATOM 321 O THR A 23 9.413 -2.077 5.096 1.00 0.00 O ATOM 322 CB THR A 23 12.469 -0.981 4.728 1.00 0.00 C ATOM 323 OG1 THR A 23 13.289 -0.249 3.820 1.00 0.00 O ATOM 324 CG2 THR A 23 13.419 -2.013 5.339 1.00 0.00 C ATOM 0 H THR A 23 10.643 0.326 3.688 1.00 0.00 H new ATOM 0 HA THR A 23 11.907 -2.264 3.113 1.00 0.00 H new ATOM 0 HB THR A 23 11.983 -0.418 5.525 1.00 0.00 H new ATOM 0 HG1 THR A 23 14.006 0.200 4.315 1.00 0.00 H new ATOM 0 HG21 THR A 23 14.155 -1.506 5.963 1.00 0.00 H new ATOM 0 HG22 THR A 23 12.850 -2.716 5.947 1.00 0.00 H new ATOM 0 HG23 THR A 23 13.930 -2.553 4.542 1.00 0.00 H new ATOM 332 N VAL A 24 10.807 -3.804 4.662 1.00 0.00 N ATOM 333 CA VAL A 24 9.988 -4.785 5.354 1.00 0.00 C ATOM 334 C VAL A 24 10.509 -4.961 6.782 1.00 0.00 C ATOM 335 O VAL A 24 11.587 -5.516 6.989 1.00 0.00 O ATOM 336 CB VAL A 24 9.957 -6.094 4.563 1.00 0.00 C ATOM 337 CG1 VAL A 24 8.646 -6.847 4.801 1.00 0.00 C ATOM 338 CG2 VAL A 24 10.179 -5.838 3.071 1.00 0.00 C ATOM 0 H VAL A 24 11.660 -4.178 4.247 1.00 0.00 H new ATOM 0 HA VAL A 24 8.956 -4.440 5.424 1.00 0.00 H new ATOM 0 HB VAL A 24 10.774 -6.721 4.920 1.00 0.00 H new ATOM 0 HG11 VAL A 24 8.649 -7.774 4.227 1.00 0.00 H new ATOM 0 HG12 VAL A 24 8.546 -7.077 5.862 1.00 0.00 H new ATOM 0 HG13 VAL A 24 7.808 -6.227 4.484 1.00 0.00 H new ATOM 0 HG21 VAL A 24 10.152 -6.785 2.531 1.00 0.00 H new ATOM 0 HG22 VAL A 24 9.394 -5.183 2.693 1.00 0.00 H new ATOM 0 HG23 VAL A 24 11.149 -5.364 2.924 1.00 0.00 H new ATOM 348 N ARG A 25 9.719 -4.478 7.730 1.00 0.00 N ATOM 349 CA ARG A 25 10.087 -4.576 9.132 1.00 0.00 C ATOM 350 C ARG A 25 9.100 -5.474 9.879 1.00 0.00 C ATOM 351 O ARG A 25 7.985 -5.056 10.187 1.00 0.00 O ATOM 352 CB ARG A 25 10.111 -3.196 9.793 1.00 0.00 C ATOM 353 CG ARG A 25 10.763 -2.160 8.875 1.00 0.00 C ATOM 354 CD ARG A 25 11.527 -1.112 9.687 1.00 0.00 C ATOM 355 NE ARG A 25 12.823 -0.814 9.037 1.00 0.00 N ATOM 356 CZ ARG A 25 13.724 0.052 9.519 1.00 0.00 C ATOM 357 NH1 ARG A 25 13.475 0.713 10.658 1.00 0.00 N ATOM 358 NH2 ARG A 25 14.873 0.259 8.862 1.00 0.00 N ATOM 0 H ARG A 25 8.826 -4.018 7.555 1.00 0.00 H new ATOM 0 HA ARG A 25 11.086 -5.008 9.182 1.00 0.00 H new ATOM 0 HB2 ARG A 25 9.094 -2.886 10.033 1.00 0.00 H new ATOM 0 HB3 ARG A 25 10.658 -3.249 10.734 1.00 0.00 H new ATOM 0 HG2 ARG A 25 11.444 -2.658 8.185 1.00 0.00 H new ATOM 0 HG3 ARG A 25 9.998 -1.671 8.271 1.00 0.00 H new ATOM 0 HD2 ARG A 25 10.934 -0.201 9.770 1.00 0.00 H new ATOM 0 HD3 ARG A 25 11.694 -1.476 10.701 1.00 0.00 H new ATOM 0 HE ARG A 25 13.044 -1.299 8.167 1.00 0.00 H new ATOM 0 HH11 ARG A 25 12.600 0.556 11.158 1.00 0.00 H new ATOM 0 HH12 ARG A 25 14.161 1.373 11.025 1.00 0.00 H new ATOM 0 HH21 ARG A 25 15.062 -0.243 7.994 1.00 0.00 H new ATOM 0 HH22 ARG A 25 15.559 0.919 9.229 1.00 0.00 H new ATOM 372 N ASP A 26 9.545 -6.693 10.149 1.00 0.00 N ATOM 373 CA ASP A 26 8.714 -7.654 10.854 1.00 0.00 C ATOM 374 C ASP A 26 8.461 -7.154 12.278 1.00 0.00 C ATOM 375 O ASP A 26 9.097 -7.616 13.224 1.00 0.00 O ATOM 376 CB ASP A 26 9.405 -9.016 10.947 1.00 0.00 C ATOM 377 CG ASP A 26 9.206 -9.925 9.733 1.00 0.00 C ATOM 378 OD1 ASP A 26 9.279 -9.391 8.605 1.00 0.00 O ATOM 379 OD2 ASP A 26 8.986 -11.135 9.960 1.00 0.00 O ATOM 0 H ASP A 26 10.470 -7.037 9.892 1.00 0.00 H new ATOM 0 HA ASP A 26 7.780 -7.761 10.303 1.00 0.00 H new ATOM 0 HB2 ASP A 26 10.473 -8.856 11.091 1.00 0.00 H new ATOM 0 HB3 ASP A 26 9.038 -9.533 11.834 1.00 0.00 H new ATOM 384 N GLY A 27 7.529 -6.218 12.386 1.00 0.00 N ATOM 385 CA GLY A 27 7.183 -5.652 13.678 1.00 0.00 C ATOM 386 C GLY A 27 6.157 -4.527 13.527 1.00 0.00 C ATOM 387 O GLY A 27 5.043 -4.625 14.040 1.00 0.00 O ATOM 0 H GLY A 27 7.003 -5.838 11.599 1.00 0.00 H new ATOM 0 HA2 GLY A 27 6.780 -6.432 14.325 1.00 0.00 H new ATOM 0 HA3 GLY A 27 8.080 -5.268 14.163 1.00 0.00 H new ATOM 391 N MET A 28 6.569 -3.484 12.821 1.00 0.00 N ATOM 392 CA MET A 28 5.700 -2.342 12.596 1.00 0.00 C ATOM 393 C MET A 28 4.408 -2.766 11.895 1.00 0.00 C ATOM 394 O MET A 28 4.303 -3.890 11.405 1.00 0.00 O ATOM 395 CB MET A 28 6.430 -1.306 11.739 1.00 0.00 C ATOM 396 CG MET A 28 6.513 -1.761 10.281 1.00 0.00 C ATOM 397 SD MET A 28 7.743 -0.803 9.411 1.00 0.00 S ATOM 398 CE MET A 28 6.898 0.766 9.309 1.00 0.00 C ATOM 0 H MET A 28 7.494 -3.406 12.397 1.00 0.00 H new ATOM 0 HA MET A 28 5.442 -1.910 13.563 1.00 0.00 H new ATOM 0 HB2 MET A 28 5.910 -0.350 11.796 1.00 0.00 H new ATOM 0 HB3 MET A 28 7.434 -1.147 12.132 1.00 0.00 H new ATOM 0 HG2 MET A 28 6.766 -2.820 10.236 1.00 0.00 H new ATOM 0 HG3 MET A 28 5.542 -1.645 9.799 1.00 0.00 H new ATOM 0 HE1 MET A 28 7.090 1.220 8.337 1.00 0.00 H new ATOM 0 HE2 MET A 28 5.826 0.611 9.432 1.00 0.00 H new ATOM 0 HE3 MET A 28 7.261 1.427 10.096 1.00 0.00 H new ATOM 408 N SER A 29 3.456 -1.845 11.869 1.00 0.00 N ATOM 409 CA SER A 29 2.175 -2.109 11.236 1.00 0.00 C ATOM 410 C SER A 29 2.173 -1.557 9.809 1.00 0.00 C ATOM 411 O SER A 29 3.198 -1.082 9.322 1.00 0.00 O ATOM 412 CB SER A 29 1.026 -1.501 12.043 1.00 0.00 C ATOM 413 OG SER A 29 1.163 -0.090 12.186 1.00 0.00 O ATOM 0 H SER A 29 3.546 -0.914 12.276 1.00 0.00 H new ATOM 0 HA SER A 29 2.026 -3.188 11.201 1.00 0.00 H new ATOM 0 HB2 SER A 29 0.079 -1.725 11.552 1.00 0.00 H new ATOM 0 HB3 SER A 29 0.991 -1.964 13.029 1.00 0.00 H new ATOM 0 HG SER A 29 0.410 0.261 12.705 1.00 0.00 H new ATOM 419 N VAL A 30 1.010 -1.637 9.180 1.00 0.00 N ATOM 420 CA VAL A 30 0.861 -1.151 7.819 1.00 0.00 C ATOM 421 C VAL A 30 0.678 0.367 7.841 1.00 0.00 C ATOM 422 O VAL A 30 1.263 1.079 7.026 1.00 0.00 O ATOM 423 CB VAL A 30 -0.291 -1.882 7.125 1.00 0.00 C ATOM 424 CG1 VAL A 30 -0.552 -1.300 5.735 1.00 0.00 C ATOM 425 CG2 VAL A 30 -0.019 -3.386 7.048 1.00 0.00 C ATOM 0 H VAL A 30 0.162 -2.031 9.588 1.00 0.00 H new ATOM 0 HA VAL A 30 1.759 -1.362 7.238 1.00 0.00 H new ATOM 0 HB VAL A 30 -1.190 -1.734 7.724 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -1.375 -1.838 5.264 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -0.812 -0.245 5.825 1.00 0.00 H new ATOM 0 HG13 VAL A 30 0.345 -1.402 5.124 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -0.853 -3.882 6.551 1.00 0.00 H new ATOM 0 HG22 VAL A 30 0.897 -3.562 6.483 1.00 0.00 H new ATOM 0 HG23 VAL A 30 0.093 -3.788 8.055 1.00 0.00 H new ATOM 435 N TYR A 31 -0.137 0.820 8.783 1.00 0.00 N ATOM 436 CA TYR A 31 -0.404 2.241 8.922 1.00 0.00 C ATOM 437 C TYR A 31 0.897 3.029 9.091 1.00 0.00 C ATOM 438 O TYR A 31 1.210 3.898 8.278 1.00 0.00 O ATOM 439 CB TYR A 31 -1.244 2.390 10.192 1.00 0.00 C ATOM 440 CG TYR A 31 -1.351 3.828 10.703 1.00 0.00 C ATOM 441 CD1 TYR A 31 -2.323 4.668 10.201 1.00 0.00 C ATOM 442 CD2 TYR A 31 -0.474 4.285 11.666 1.00 0.00 C ATOM 443 CE1 TYR A 31 -2.424 6.022 10.682 1.00 0.00 C ATOM 444 CE2 TYR A 31 -0.574 5.638 12.147 1.00 0.00 C ATOM 445 CZ TYR A 31 -1.544 6.440 11.632 1.00 0.00 C ATOM 446 OH TYR A 31 -1.639 7.718 12.086 1.00 0.00 O ATOM 0 H TYR A 31 -0.621 0.227 9.457 1.00 0.00 H new ATOM 0 HA TYR A 31 -0.912 2.624 8.037 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -2.247 2.009 9.999 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -0.812 1.768 10.976 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -3.009 4.310 9.447 1.00 0.00 H new ATOM 0 HD2 TYR A 31 0.287 3.627 12.059 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -3.181 6.690 10.298 1.00 0.00 H new ATOM 0 HE2 TYR A 31 0.106 6.008 12.900 1.00 0.00 H new ATOM 0 HH TYR A 31 -0.948 7.877 12.762 1.00 0.00 H new ATOM 456 N ASP A 32 1.619 2.699 10.151 1.00 0.00 N ATOM 457 CA ASP A 32 2.878 3.365 10.436 1.00 0.00 C ATOM 458 C ASP A 32 3.800 3.245 9.221 1.00 0.00 C ATOM 459 O ASP A 32 4.698 4.065 9.036 1.00 0.00 O ATOM 460 CB ASP A 32 3.584 2.721 11.631 1.00 0.00 C ATOM 461 CG ASP A 32 3.540 3.537 12.925 1.00 0.00 C ATOM 462 OD1 ASP A 32 3.684 4.774 12.820 1.00 0.00 O ATOM 463 OD2 ASP A 32 3.364 2.904 13.989 1.00 0.00 O ATOM 0 H ASP A 32 1.356 1.979 10.823 1.00 0.00 H new ATOM 0 HA ASP A 32 2.663 4.409 10.664 1.00 0.00 H new ATOM 0 HB2 ASP A 32 3.133 1.746 11.818 1.00 0.00 H new ATOM 0 HB3 ASP A 32 4.626 2.544 11.366 1.00 0.00 H new ATOM 468 N SER A 33 3.547 2.216 8.425 1.00 0.00 N ATOM 469 CA SER A 33 4.343 1.978 7.234 1.00 0.00 C ATOM 470 C SER A 33 3.869 2.887 6.098 1.00 0.00 C ATOM 471 O SER A 33 4.669 3.603 5.496 1.00 0.00 O ATOM 472 CB SER A 33 4.269 0.511 6.806 1.00 0.00 C ATOM 473 OG SER A 33 5.424 -0.221 7.206 1.00 0.00 O ATOM 0 H SER A 33 2.802 1.538 8.582 1.00 0.00 H new ATOM 0 HA SER A 33 5.383 2.209 7.466 1.00 0.00 H new ATOM 0 HB2 SER A 33 3.381 0.051 7.239 1.00 0.00 H new ATOM 0 HB3 SER A 33 4.161 0.454 5.723 1.00 0.00 H new ATOM 0 HG SER A 33 5.778 -0.718 6.439 1.00 0.00 H new ATOM 479 N LEU A 34 2.571 2.830 5.838 1.00 0.00 N ATOM 480 CA LEU A 34 1.982 3.639 4.785 1.00 0.00 C ATOM 481 C LEU A 34 1.612 5.012 5.350 1.00 0.00 C ATOM 482 O LEU A 34 0.829 5.745 4.747 1.00 0.00 O ATOM 483 CB LEU A 34 0.806 2.903 4.139 1.00 0.00 C ATOM 484 CG LEU A 34 1.151 1.991 2.960 1.00 0.00 C ATOM 485 CD1 LEU A 34 1.791 2.787 1.821 1.00 0.00 C ATOM 486 CD2 LEU A 34 2.033 0.824 3.409 1.00 0.00 C ATOM 0 H LEU A 34 1.911 2.236 6.339 1.00 0.00 H new ATOM 0 HA LEU A 34 2.703 3.806 3.984 1.00 0.00 H new ATOM 0 HB2 LEU A 34 0.314 2.303 4.905 1.00 0.00 H new ATOM 0 HB3 LEU A 34 0.082 3.644 3.800 1.00 0.00 H new ATOM 0 HG LEU A 34 0.224 1.565 2.575 1.00 0.00 H new ATOM 0 HD11 LEU A 34 2.027 2.115 0.995 1.00 0.00 H new ATOM 0 HD12 LEU A 34 1.097 3.554 1.478 1.00 0.00 H new ATOM 0 HD13 LEU A 34 2.707 3.259 2.177 1.00 0.00 H new ATOM 0 HD21 LEU A 34 2.263 0.191 2.552 1.00 0.00 H new ATOM 0 HD22 LEU A 34 2.959 1.211 3.834 1.00 0.00 H new ATOM 0 HD23 LEU A 34 1.505 0.238 4.161 1.00 0.00 H new ATOM 498 N ASP A 35 2.194 5.320 6.500 1.00 0.00 N ATOM 499 CA ASP A 35 1.936 6.592 7.152 1.00 0.00 C ATOM 500 C ASP A 35 2.647 7.708 6.383 1.00 0.00 C ATOM 501 O ASP A 35 2.034 8.717 6.037 1.00 0.00 O ATOM 502 CB ASP A 35 2.468 6.594 8.586 1.00 0.00 C ATOM 503 CG ASP A 35 2.499 7.966 9.263 1.00 0.00 C ATOM 504 OD1 ASP A 35 3.475 8.703 9.006 1.00 0.00 O ATOM 505 OD2 ASP A 35 1.546 8.246 10.022 1.00 0.00 O ATOM 0 H ASP A 35 2.843 4.710 6.997 1.00 0.00 H new ATOM 0 HA ASP A 35 0.858 6.750 7.167 1.00 0.00 H new ATOM 0 HB2 ASP A 35 1.853 5.923 9.186 1.00 0.00 H new ATOM 0 HB3 ASP A 35 3.478 6.184 8.583 1.00 0.00 H new ATOM 510 N LYS A 36 3.931 7.490 6.139 1.00 0.00 N ATOM 511 CA LYS A 36 4.732 8.464 5.417 1.00 0.00 C ATOM 512 C LYS A 36 4.405 8.381 3.925 1.00 0.00 C ATOM 513 O LYS A 36 4.140 9.398 3.286 1.00 0.00 O ATOM 514 CB LYS A 36 6.217 8.276 5.733 1.00 0.00 C ATOM 515 CG LYS A 36 7.092 8.955 4.678 1.00 0.00 C ATOM 516 CD LYS A 36 8.178 9.810 5.333 1.00 0.00 C ATOM 517 CE LYS A 36 7.965 11.294 5.029 1.00 0.00 C ATOM 518 NZ LYS A 36 9.265 11.999 4.951 1.00 0.00 N ATOM 0 H LYS A 36 4.437 6.653 6.429 1.00 0.00 H new ATOM 0 HA LYS A 36 4.487 9.475 5.742 1.00 0.00 H new ATOM 0 HB2 LYS A 36 6.439 8.691 6.716 1.00 0.00 H new ATOM 0 HB3 LYS A 36 6.452 7.212 5.776 1.00 0.00 H new ATOM 0 HG2 LYS A 36 7.553 8.199 4.042 1.00 0.00 H new ATOM 0 HG3 LYS A 36 6.473 9.579 4.034 1.00 0.00 H new ATOM 0 HD2 LYS A 36 8.170 9.651 6.411 1.00 0.00 H new ATOM 0 HD3 LYS A 36 9.158 9.498 4.972 1.00 0.00 H new ATOM 0 HE2 LYS A 36 7.427 11.405 4.087 1.00 0.00 H new ATOM 0 HE3 LYS A 36 7.346 11.745 5.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 9.102 13.005 4.744 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 9.764 11.909 5.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 9.843 11.579 4.195 1.00 0.00 H new ATOM 532 N ALA A 37 4.436 7.160 3.412 1.00 0.00 N ATOM 533 CA ALA A 37 4.147 6.931 2.006 1.00 0.00 C ATOM 534 C ALA A 37 2.994 7.838 1.573 1.00 0.00 C ATOM 535 O ALA A 37 2.933 8.264 0.420 1.00 0.00 O ATOM 536 CB ALA A 37 3.839 5.449 1.783 1.00 0.00 C ATOM 0 H ALA A 37 4.657 6.319 3.945 1.00 0.00 H new ATOM 0 HA ALA A 37 5.011 7.180 1.391 1.00 0.00 H new ATOM 0 HB1 ALA A 37 3.622 5.277 0.729 1.00 0.00 H new ATOM 0 HB2 ALA A 37 4.700 4.850 2.079 1.00 0.00 H new ATOM 0 HB3 ALA A 37 2.975 5.163 2.382 1.00 0.00 H new ATOM 542 N LEU A 38 2.107 8.107 2.520 1.00 0.00 N ATOM 543 CA LEU A 38 0.959 8.956 2.250 1.00 0.00 C ATOM 544 C LEU A 38 1.335 10.415 2.517 1.00 0.00 C ATOM 545 O LEU A 38 1.250 11.255 1.623 1.00 0.00 O ATOM 546 CB LEU A 38 -0.258 8.479 3.045 1.00 0.00 C ATOM 547 CG LEU A 38 -0.837 7.122 2.637 1.00 0.00 C ATOM 548 CD1 LEU A 38 -2.141 6.835 3.383 1.00 0.00 C ATOM 549 CD2 LEU A 38 -1.013 7.036 1.120 1.00 0.00 C ATOM 0 H LEU A 38 2.160 7.752 3.475 1.00 0.00 H new ATOM 0 HA LEU A 38 0.672 8.887 1.201 1.00 0.00 H new ATOM 0 HB2 LEU A 38 0.017 8.432 4.099 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -1.044 9.229 2.953 1.00 0.00 H new ATOM 0 HG LEU A 38 -0.126 6.347 2.923 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -2.531 5.865 3.074 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -1.952 6.825 4.456 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -2.871 7.610 3.151 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -1.426 6.062 0.856 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -1.693 7.820 0.788 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -0.046 7.164 0.634 1.00 0.00 H new ATOM 561 N LYS A 39 1.741 10.671 3.752 1.00 0.00 N ATOM 562 CA LYS A 39 2.130 12.014 4.148 1.00 0.00 C ATOM 563 C LYS A 39 3.008 12.629 3.057 1.00 0.00 C ATOM 564 O LYS A 39 2.768 13.755 2.623 1.00 0.00 O ATOM 565 CB LYS A 39 2.788 11.996 5.529 1.00 0.00 C ATOM 566 CG LYS A 39 1.769 11.654 6.618 1.00 0.00 C ATOM 567 CD LYS A 39 1.792 12.697 7.737 1.00 0.00 C ATOM 568 CE LYS A 39 0.883 12.279 8.895 1.00 0.00 C ATOM 569 NZ LYS A 39 0.338 13.471 9.582 1.00 0.00 N ATOM 0 H LYS A 39 1.809 9.972 4.491 1.00 0.00 H new ATOM 0 HA LYS A 39 1.251 12.651 4.247 1.00 0.00 H new ATOM 0 HB2 LYS A 39 3.597 11.266 5.541 1.00 0.00 H new ATOM 0 HB3 LYS A 39 3.234 12.969 5.736 1.00 0.00 H new ATOM 0 HG2 LYS A 39 0.771 11.603 6.184 1.00 0.00 H new ATOM 0 HG3 LYS A 39 1.988 10.669 7.030 1.00 0.00 H new ATOM 0 HD2 LYS A 39 2.812 12.825 8.099 1.00 0.00 H new ATOM 0 HD3 LYS A 39 1.469 13.662 7.346 1.00 0.00 H new ATOM 0 HE2 LYS A 39 0.066 11.663 8.520 1.00 0.00 H new ATOM 0 HE3 LYS A 39 1.443 11.668 9.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -0.277 13.170 10.365 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 1.121 14.044 9.957 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -0.214 14.038 8.907 1.00 0.00 H new ATOM 583 N VAL A 40 4.007 11.863 2.644 1.00 0.00 N ATOM 584 CA VAL A 40 4.922 12.318 1.611 1.00 0.00 C ATOM 585 C VAL A 40 4.135 13.063 0.531 1.00 0.00 C ATOM 586 O VAL A 40 4.658 13.977 -0.104 1.00 0.00 O ATOM 587 CB VAL A 40 5.720 11.135 1.060 1.00 0.00 C ATOM 588 CG1 VAL A 40 4.793 10.093 0.431 1.00 0.00 C ATOM 589 CG2 VAL A 40 6.776 11.605 0.058 1.00 0.00 C ATOM 0 H VAL A 40 4.203 10.930 3.006 1.00 0.00 H new ATOM 0 HA VAL A 40 5.648 13.017 2.025 1.00 0.00 H new ATOM 0 HB VAL A 40 6.237 10.662 1.895 1.00 0.00 H new ATOM 0 HG11 VAL A 40 5.386 9.263 0.047 1.00 0.00 H new ATOM 0 HG12 VAL A 40 4.097 9.724 1.184 1.00 0.00 H new ATOM 0 HG13 VAL A 40 4.235 10.549 -0.387 1.00 0.00 H new ATOM 0 HG21 VAL A 40 7.329 10.744 -0.318 1.00 0.00 H new ATOM 0 HG22 VAL A 40 6.288 12.114 -0.773 1.00 0.00 H new ATOM 0 HG23 VAL A 40 7.465 12.292 0.550 1.00 0.00 H new ATOM 599 N ARG A 41 2.890 12.644 0.356 1.00 0.00 N ATOM 600 CA ARG A 41 2.026 13.260 -0.636 1.00 0.00 C ATOM 601 C ARG A 41 0.977 14.141 0.046 1.00 0.00 C ATOM 602 O ARG A 41 0.546 15.148 -0.514 1.00 0.00 O ATOM 603 CB ARG A 41 1.319 12.201 -1.485 1.00 0.00 C ATOM 604 CG ARG A 41 2.328 11.377 -2.286 1.00 0.00 C ATOM 605 CD ARG A 41 1.619 10.334 -3.152 1.00 0.00 C ATOM 606 NE ARG A 41 2.005 10.508 -4.571 1.00 0.00 N ATOM 607 CZ ARG A 41 1.438 11.396 -5.400 1.00 0.00 C ATOM 608 NH1 ARG A 41 0.457 12.194 -4.957 1.00 0.00 N ATOM 609 NH2 ARG A 41 1.851 11.484 -6.671 1.00 0.00 N ATOM 0 H ARG A 41 2.459 11.885 0.885 1.00 0.00 H new ATOM 0 HA ARG A 41 2.652 13.872 -1.286 1.00 0.00 H new ATOM 0 HB2 ARG A 41 0.737 11.543 -0.841 1.00 0.00 H new ATOM 0 HB3 ARG A 41 0.617 12.684 -2.165 1.00 0.00 H new ATOM 0 HG2 ARG A 41 2.922 12.037 -2.918 1.00 0.00 H new ATOM 0 HG3 ARG A 41 3.020 10.881 -1.605 1.00 0.00 H new ATOM 0 HD2 ARG A 41 1.881 9.331 -2.816 1.00 0.00 H new ATOM 0 HD3 ARG A 41 0.539 10.434 -3.045 1.00 0.00 H new ATOM 0 HE ARG A 41 2.748 9.915 -4.941 1.00 0.00 H new ATOM 0 HH11 ARG A 41 0.142 12.126 -3.989 1.00 0.00 H new ATOM 0 HH12 ARG A 41 0.025 12.870 -5.587 1.00 0.00 H new ATOM 0 HH21 ARG A 41 2.597 10.875 -7.008 1.00 0.00 H new ATOM 0 HH22 ARG A 41 1.420 12.160 -7.302 1.00 0.00 H new ATOM 623 N GLY A 42 0.596 13.729 1.247 1.00 0.00 N ATOM 624 CA GLY A 42 -0.394 14.468 2.012 1.00 0.00 C ATOM 625 C GLY A 42 -1.649 13.624 2.244 1.00 0.00 C ATOM 626 O GLY A 42 -2.624 14.101 2.822 1.00 0.00 O ATOM 0 H GLY A 42 0.955 12.893 1.709 1.00 0.00 H new ATOM 0 HA2 GLY A 42 0.030 14.766 2.971 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -0.659 15.383 1.482 1.00 0.00 H new ATOM 630 N LEU A 43 -1.583 12.384 1.781 1.00 0.00 N ATOM 631 CA LEU A 43 -2.702 11.469 1.931 1.00 0.00 C ATOM 632 C LEU A 43 -2.876 11.121 3.411 1.00 0.00 C ATOM 633 O LEU A 43 -2.007 11.420 4.228 1.00 0.00 O ATOM 634 CB LEU A 43 -2.519 10.247 1.029 1.00 0.00 C ATOM 635 CG LEU A 43 -2.803 10.463 -0.459 1.00 0.00 C ATOM 636 CD1 LEU A 43 -2.111 9.396 -1.309 1.00 0.00 C ATOM 637 CD2 LEU A 43 -4.308 10.522 -0.727 1.00 0.00 C ATOM 0 H LEU A 43 -0.772 11.992 1.302 1.00 0.00 H new ATOM 0 HA LEU A 43 -3.628 11.942 1.604 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -1.494 9.892 1.135 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -3.171 9.452 1.391 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.386 11.427 -0.750 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -2.329 9.572 -2.362 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -1.034 9.445 -1.148 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -2.476 8.410 -1.023 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -4.482 10.676 -1.792 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -4.770 9.585 -0.416 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -4.746 11.347 -0.165 1.00 0.00 H new ATOM 649 N ASN A 44 -4.005 10.495 3.710 1.00 0.00 N ATOM 650 CA ASN A 44 -4.304 10.103 5.076 1.00 0.00 C ATOM 651 C ASN A 44 -4.923 8.704 5.077 1.00 0.00 C ATOM 652 O ASN A 44 -5.475 8.264 4.070 1.00 0.00 O ATOM 653 CB ASN A 44 -5.307 11.064 5.718 1.00 0.00 C ATOM 654 CG ASN A 44 -5.103 11.139 7.232 1.00 0.00 C ATOM 655 OD1 ASN A 44 -4.216 11.810 7.733 1.00 0.00 O ATOM 656 ND2 ASN A 44 -5.972 10.414 7.932 1.00 0.00 N ATOM 0 H ASN A 44 -4.724 10.250 3.029 1.00 0.00 H new ATOM 0 HA ASN A 44 -3.373 10.121 5.643 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -5.194 12.057 5.283 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -6.323 10.734 5.500 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -5.919 10.398 8.951 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -6.691 9.874 7.450 1.00 0.00 H new ATOM 663 N GLN A 45 -4.810 8.043 6.220 1.00 0.00 N ATOM 664 CA GLN A 45 -5.351 6.702 6.366 1.00 0.00 C ATOM 665 C GLN A 45 -6.822 6.766 6.782 1.00 0.00 C ATOM 666 O GLN A 45 -7.250 6.036 7.674 1.00 0.00 O ATOM 667 CB GLN A 45 -4.532 5.886 7.368 1.00 0.00 C ATOM 668 CG GLN A 45 -3.065 5.809 6.943 1.00 0.00 C ATOM 669 CD GLN A 45 -2.225 6.854 7.680 1.00 0.00 C ATOM 670 OE1 GLN A 45 -2.533 8.035 7.697 1.00 0.00 O ATOM 671 NE2 GLN A 45 -1.150 6.357 8.284 1.00 0.00 N ATOM 0 H GLN A 45 -4.352 8.411 7.054 1.00 0.00 H new ATOM 0 HA GLN A 45 -5.288 6.199 5.401 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -4.605 6.339 8.357 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -4.945 4.880 7.447 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -2.675 4.812 7.149 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -2.986 5.966 5.867 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -0.951 5.358 8.230 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -0.524 6.975 8.801 1.00 0.00 H new ATOM 680 N ASP A 46 -7.555 7.646 6.116 1.00 0.00 N ATOM 681 CA ASP A 46 -8.968 7.815 6.406 1.00 0.00 C ATOM 682 C ASP A 46 -9.773 7.643 5.116 1.00 0.00 C ATOM 683 O ASP A 46 -10.742 6.885 5.081 1.00 0.00 O ATOM 684 CB ASP A 46 -9.255 9.213 6.958 1.00 0.00 C ATOM 685 CG ASP A 46 -10.723 9.492 7.283 1.00 0.00 C ATOM 686 OD1 ASP A 46 -11.564 9.205 6.403 1.00 0.00 O ATOM 687 OD2 ASP A 46 -10.973 9.986 8.404 1.00 0.00 O ATOM 0 H ASP A 46 -7.196 8.250 5.376 1.00 0.00 H new ATOM 0 HA ASP A 46 -9.250 7.069 7.149 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -8.665 9.358 7.863 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -8.913 9.951 6.232 1.00 0.00 H new ATOM 692 N CYS A 47 -9.342 8.358 4.087 1.00 0.00 N ATOM 693 CA CYS A 47 -10.010 8.293 2.799 1.00 0.00 C ATOM 694 C CYS A 47 -9.061 7.632 1.798 1.00 0.00 C ATOM 695 O CYS A 47 -9.001 8.032 0.636 1.00 0.00 O ATOM 696 CB CYS A 47 -10.464 9.676 2.327 1.00 0.00 C ATOM 697 SG CYS A 47 -11.880 9.512 1.180 1.00 0.00 S ATOM 0 H CYS A 47 -8.538 8.985 4.120 1.00 0.00 H new ATOM 0 HA CYS A 47 -10.917 7.695 2.887 1.00 0.00 H new ATOM 0 HB2 CYS A 47 -10.748 10.287 3.184 1.00 0.00 H new ATOM 0 HB3 CYS A 47 -9.640 10.188 1.830 1.00 0.00 H new ATOM 0 HG CYS A 47 -11.505 8.863 0.118 1.00 0.00 H new ATOM 703 N CYS A 48 -8.342 6.631 2.285 1.00 0.00 N ATOM 704 CA CYS A 48 -7.398 5.910 1.447 1.00 0.00 C ATOM 705 C CYS A 48 -7.471 4.426 1.809 1.00 0.00 C ATOM 706 O CYS A 48 -7.733 4.075 2.959 1.00 0.00 O ATOM 707 CB CYS A 48 -5.979 6.464 1.589 1.00 0.00 C ATOM 708 SG CYS A 48 -5.823 8.033 0.660 1.00 0.00 S ATOM 0 H CYS A 48 -8.394 6.302 3.249 1.00 0.00 H new ATOM 0 HA CYS A 48 -7.665 6.040 0.398 1.00 0.00 H new ATOM 0 HB2 CYS A 48 -5.749 6.631 2.641 1.00 0.00 H new ATOM 0 HB3 CYS A 48 -5.257 5.738 1.216 1.00 0.00 H new ATOM 0 HG CYS A 48 -7.007 8.479 0.359 1.00 0.00 H new ATOM 714 N VAL A 49 -7.234 3.593 0.807 1.00 0.00 N ATOM 715 CA VAL A 49 -7.270 2.154 1.005 1.00 0.00 C ATOM 716 C VAL A 49 -6.041 1.522 0.347 1.00 0.00 C ATOM 717 O VAL A 49 -5.478 2.083 -0.592 1.00 0.00 O ATOM 718 CB VAL A 49 -8.589 1.585 0.478 1.00 0.00 C ATOM 719 CG1 VAL A 49 -8.816 1.988 -0.980 1.00 0.00 C ATOM 720 CG2 VAL A 49 -8.634 0.064 0.640 1.00 0.00 C ATOM 0 H VAL A 49 -7.016 3.887 -0.145 1.00 0.00 H new ATOM 0 HA VAL A 49 -7.230 1.914 2.068 1.00 0.00 H new ATOM 0 HB VAL A 49 -9.398 2.009 1.073 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -9.760 1.571 -1.330 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -8.849 3.075 -1.056 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -8.001 1.606 -1.594 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -9.582 -0.315 0.258 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -7.812 -0.386 0.083 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -8.540 -0.192 1.695 1.00 0.00 H new ATOM 730 N VAL A 50 -5.662 0.363 0.865 1.00 0.00 N ATOM 731 CA VAL A 50 -4.511 -0.351 0.340 1.00 0.00 C ATOM 732 C VAL A 50 -4.944 -1.747 -0.112 1.00 0.00 C ATOM 733 O VAL A 50 -5.469 -2.525 0.683 1.00 0.00 O ATOM 734 CB VAL A 50 -3.392 -0.380 1.384 1.00 0.00 C ATOM 735 CG1 VAL A 50 -2.142 -1.065 0.828 1.00 0.00 C ATOM 736 CG2 VAL A 50 -3.070 1.030 1.882 1.00 0.00 C ATOM 0 H VAL A 50 -6.132 -0.099 1.643 1.00 0.00 H new ATOM 0 HA VAL A 50 -4.109 0.163 -0.533 1.00 0.00 H new ATOM 0 HB VAL A 50 -3.743 -0.963 2.236 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -1.362 -1.072 1.589 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -2.384 -2.090 0.546 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -1.789 -0.521 -0.048 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -2.272 0.981 2.623 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -2.749 1.648 1.043 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -3.959 1.468 2.335 1.00 0.00 H new ATOM 746 N TYR A 51 -4.708 -2.021 -1.386 1.00 0.00 N ATOM 747 CA TYR A 51 -5.068 -3.310 -1.953 1.00 0.00 C ATOM 748 C TYR A 51 -3.847 -4.228 -2.046 1.00 0.00 C ATOM 749 O TYR A 51 -2.755 -3.781 -2.392 1.00 0.00 O ATOM 750 CB TYR A 51 -5.581 -3.021 -3.365 1.00 0.00 C ATOM 751 CG TYR A 51 -6.476 -1.783 -3.460 1.00 0.00 C ATOM 752 CD1 TYR A 51 -7.538 -1.631 -2.592 1.00 0.00 C ATOM 753 CD2 TYR A 51 -6.221 -0.819 -4.415 1.00 0.00 C ATOM 754 CE1 TYR A 51 -8.380 -0.466 -2.682 1.00 0.00 C ATOM 755 CE2 TYR A 51 -7.063 0.345 -4.504 1.00 0.00 C ATOM 756 CZ TYR A 51 -8.101 0.465 -3.634 1.00 0.00 C ATOM 757 OH TYR A 51 -8.896 1.565 -3.718 1.00 0.00 O ATOM 0 H TYR A 51 -4.272 -1.373 -2.042 1.00 0.00 H new ATOM 0 HA TYR A 51 -5.812 -3.808 -1.331 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -4.728 -2.892 -4.031 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -6.137 -3.887 -3.723 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -7.738 -2.385 -1.845 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -5.390 -0.938 -5.095 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -9.214 -0.334 -2.009 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -6.874 1.107 -5.246 1.00 0.00 H new ATOM 0 HH TYR A 51 -9.051 1.786 -4.660 1.00 0.00 H new ATOM 767 N ARG A 52 -4.074 -5.494 -1.730 1.00 0.00 N ATOM 768 CA ARG A 52 -3.006 -6.479 -1.773 1.00 0.00 C ATOM 769 C ARG A 52 -3.285 -7.517 -2.862 1.00 0.00 C ATOM 770 O ARG A 52 -4.422 -7.959 -3.027 1.00 0.00 O ATOM 771 CB ARG A 52 -2.858 -7.190 -0.426 1.00 0.00 C ATOM 772 CG ARG A 52 -3.065 -6.215 0.734 1.00 0.00 C ATOM 773 CD ARG A 52 -2.767 -6.888 2.076 1.00 0.00 C ATOM 774 NE ARG A 52 -3.887 -7.778 2.455 1.00 0.00 N ATOM 775 CZ ARG A 52 -3.776 -8.799 3.315 1.00 0.00 C ATOM 776 NH1 ARG A 52 -2.596 -9.065 3.891 1.00 0.00 N ATOM 777 NH2 ARG A 52 -4.846 -9.555 3.600 1.00 0.00 N ATOM 0 H ARG A 52 -4.981 -5.861 -1.443 1.00 0.00 H new ATOM 0 HA ARG A 52 -2.078 -5.953 -1.997 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -3.583 -8.001 -0.357 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -1.868 -7.640 -0.355 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -2.416 -5.349 0.606 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -4.091 -5.848 0.727 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -1.843 -7.462 2.007 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -2.616 -6.132 2.846 1.00 0.00 H new ATOM 0 HE ARG A 52 -4.800 -7.603 2.035 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -1.782 -8.490 3.675 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -2.512 -9.843 4.546 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -5.745 -9.353 3.162 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -4.761 -10.332 4.255 1.00 0.00 H new ATOM 791 N LEU A 53 -2.230 -7.877 -3.577 1.00 0.00 N ATOM 792 CA LEU A 53 -2.347 -8.854 -4.645 1.00 0.00 C ATOM 793 C LEU A 53 -2.131 -10.257 -4.073 1.00 0.00 C ATOM 794 O LEU A 53 -0.997 -10.719 -3.965 1.00 0.00 O ATOM 795 CB LEU A 53 -1.399 -8.507 -5.795 1.00 0.00 C ATOM 796 CG LEU A 53 -1.971 -7.597 -6.884 1.00 0.00 C ATOM 797 CD1 LEU A 53 -2.559 -8.418 -8.033 1.00 0.00 C ATOM 798 CD2 LEU A 53 -2.991 -6.617 -6.300 1.00 0.00 C ATOM 0 H LEU A 53 -1.289 -7.509 -3.437 1.00 0.00 H new ATOM 0 HA LEU A 53 -3.350 -8.834 -5.071 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -0.513 -8.028 -5.378 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -1.070 -9.436 -6.261 1.00 0.00 H new ATOM 0 HG LEU A 53 -1.154 -7.005 -7.297 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -2.958 -7.746 -8.793 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -1.779 -9.040 -8.472 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -3.359 -9.054 -7.654 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -3.382 -5.982 -7.095 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -3.810 -7.173 -5.844 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -2.509 -5.997 -5.545 1.00 0.00 H new ATOM 810 N ILE A 54 -3.238 -10.895 -3.722 1.00 0.00 N ATOM 811 CA ILE A 54 -3.185 -12.235 -3.163 1.00 0.00 C ATOM 812 C ILE A 54 -3.403 -13.257 -4.280 1.00 0.00 C ATOM 813 O ILE A 54 -2.514 -14.051 -4.583 1.00 0.00 O ATOM 814 CB ILE A 54 -4.172 -12.372 -2.003 1.00 0.00 C ATOM 815 CG1 ILE A 54 -3.615 -11.730 -0.730 1.00 0.00 C ATOM 816 CG2 ILE A 54 -4.562 -13.835 -1.784 1.00 0.00 C ATOM 817 CD1 ILE A 54 -4.193 -10.329 -0.524 1.00 0.00 C ATOM 0 H ILE A 54 -4.177 -10.508 -3.814 1.00 0.00 H new ATOM 0 HA ILE A 54 -2.201 -12.431 -2.738 1.00 0.00 H new ATOM 0 HB ILE A 54 -5.082 -11.832 -2.264 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -3.852 -12.355 0.131 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -2.528 -11.673 -0.793 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -5.265 -13.904 -0.953 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -5.029 -14.226 -2.688 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -3.671 -14.419 -1.555 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -3.781 -9.896 0.387 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -3.933 -9.699 -1.375 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -5.278 -10.392 -0.437 1.00 0.00 H new ATOM 829 N LYS A 55 -4.592 -13.205 -4.863 1.00 0.00 N ATOM 830 CA LYS A 55 -4.939 -14.116 -5.940 1.00 0.00 C ATOM 831 C LYS A 55 -5.201 -13.314 -7.216 1.00 0.00 C ATOM 832 O LYS A 55 -6.186 -13.555 -7.913 1.00 0.00 O ATOM 833 CB LYS A 55 -6.106 -15.014 -5.527 1.00 0.00 C ATOM 834 CG LYS A 55 -5.762 -16.491 -5.733 1.00 0.00 C ATOM 835 CD LYS A 55 -6.779 -17.394 -5.031 1.00 0.00 C ATOM 836 CE LYS A 55 -6.151 -18.090 -3.822 1.00 0.00 C ATOM 837 NZ LYS A 55 -6.675 -19.467 -3.687 1.00 0.00 N ATOM 0 H LYS A 55 -5.327 -12.545 -4.609 1.00 0.00 H new ATOM 0 HA LYS A 55 -4.109 -14.790 -6.152 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -6.353 -14.837 -4.480 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -6.990 -14.758 -6.111 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -5.743 -16.718 -6.799 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -4.763 -16.693 -5.346 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -7.636 -16.802 -4.710 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -7.152 -18.141 -5.732 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -5.067 -18.116 -3.933 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -6.365 -17.523 -2.916 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -6.239 -19.925 -2.862 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -7.707 -19.435 -3.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -6.449 -20.010 -4.544 1.00 0.00 H new ATOM 851 N GLY A 56 -4.303 -12.378 -7.484 1.00 0.00 N ATOM 852 CA GLY A 56 -4.425 -11.540 -8.664 1.00 0.00 C ATOM 853 C GLY A 56 -5.628 -10.601 -8.548 1.00 0.00 C ATOM 854 O GLY A 56 -6.149 -10.126 -9.556 1.00 0.00 O ATOM 0 H GLY A 56 -3.487 -12.181 -6.904 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -3.514 -10.956 -8.795 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -4.532 -12.166 -9.550 1.00 0.00 H new ATOM 858 N ARG A 57 -6.034 -10.362 -7.310 1.00 0.00 N ATOM 859 CA ARG A 57 -7.165 -9.489 -7.048 1.00 0.00 C ATOM 860 C ARG A 57 -6.828 -8.503 -5.928 1.00 0.00 C ATOM 861 O ARG A 57 -6.146 -8.859 -4.967 1.00 0.00 O ATOM 862 CB ARG A 57 -8.404 -10.295 -6.652 1.00 0.00 C ATOM 863 CG ARG A 57 -8.155 -11.085 -5.366 1.00 0.00 C ATOM 864 CD ARG A 57 -8.517 -12.560 -5.549 1.00 0.00 C ATOM 865 NE ARG A 57 -9.914 -12.796 -5.122 1.00 0.00 N ATOM 866 CZ ARG A 57 -10.415 -14.002 -4.822 1.00 0.00 C ATOM 867 NH1 ARG A 57 -9.636 -15.090 -4.902 1.00 0.00 N ATOM 868 NH2 ARG A 57 -11.695 -14.121 -4.443 1.00 0.00 N ATOM 0 H ARG A 57 -5.599 -10.758 -6.477 1.00 0.00 H new ATOM 0 HA ARG A 57 -7.379 -8.942 -7.966 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -9.250 -9.623 -6.512 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -8.670 -10.979 -7.458 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -7.107 -10.997 -5.078 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -8.745 -10.660 -4.554 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -8.394 -12.846 -6.594 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -7.840 -13.184 -4.966 1.00 0.00 H new ATOM 0 HE ARG A 57 -10.535 -11.990 -5.052 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -8.662 -15.000 -5.191 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -10.017 -16.008 -4.674 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -12.288 -13.293 -4.383 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -12.076 -15.039 -4.215 1.00 0.00 H new ATOM 882 N LYS A 58 -7.319 -7.283 -6.088 1.00 0.00 N ATOM 883 CA LYS A 58 -7.078 -6.244 -5.102 1.00 0.00 C ATOM 884 C LYS A 58 -7.771 -6.619 -3.791 1.00 0.00 C ATOM 885 O LYS A 58 -8.995 -6.556 -3.691 1.00 0.00 O ATOM 886 CB LYS A 58 -7.497 -4.878 -5.650 1.00 0.00 C ATOM 887 CG LYS A 58 -6.371 -4.247 -6.472 1.00 0.00 C ATOM 888 CD LYS A 58 -6.819 -3.995 -7.913 1.00 0.00 C ATOM 889 CE LYS A 58 -6.058 -2.818 -8.525 1.00 0.00 C ATOM 890 NZ LYS A 58 -6.331 -2.723 -9.977 1.00 0.00 N ATOM 0 H LYS A 58 -7.883 -6.991 -6.886 1.00 0.00 H new ATOM 0 HA LYS A 58 -6.012 -6.163 -4.887 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -8.387 -4.988 -6.270 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -7.764 -4.218 -4.825 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -6.064 -3.307 -6.013 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -5.501 -4.903 -6.467 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -6.653 -4.891 -8.511 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -7.890 -3.791 -7.935 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -6.352 -1.891 -8.032 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -4.988 -2.942 -8.357 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -5.807 -1.919 -10.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -6.028 -3.601 -10.445 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -7.350 -2.582 -10.130 1.00 0.00 H new ATOM 904 N THR A 59 -6.958 -7.003 -2.818 1.00 0.00 N ATOM 905 CA THR A 59 -7.477 -7.390 -1.517 1.00 0.00 C ATOM 906 C THR A 59 -7.250 -6.271 -0.499 1.00 0.00 C ATOM 907 O THR A 59 -6.121 -6.034 -0.073 1.00 0.00 O ATOM 908 CB THR A 59 -6.822 -8.714 -1.121 1.00 0.00 C ATOM 909 OG1 THR A 59 -7.461 -9.680 -1.951 1.00 0.00 O ATOM 910 CG2 THR A 59 -7.188 -9.146 0.301 1.00 0.00 C ATOM 0 H THR A 59 -5.943 -7.054 -2.905 1.00 0.00 H new ATOM 0 HA THR A 59 -8.556 -7.543 -1.551 1.00 0.00 H new ATOM 0 HB THR A 59 -5.739 -8.622 -1.206 1.00 0.00 H new ATOM 0 HG1 THR A 59 -7.094 -10.569 -1.761 1.00 0.00 H new ATOM 0 HG21 THR A 59 -6.697 -10.091 0.532 1.00 0.00 H new ATOM 0 HG22 THR A 59 -6.860 -8.384 1.008 1.00 0.00 H new ATOM 0 HG23 THR A 59 -8.268 -9.270 0.377 1.00 0.00 H new ATOM 918 N VAL A 60 -8.342 -5.613 -0.137 1.00 0.00 N ATOM 919 CA VAL A 60 -8.276 -4.524 0.823 1.00 0.00 C ATOM 920 C VAL A 60 -7.562 -5.008 2.087 1.00 0.00 C ATOM 921 O VAL A 60 -7.716 -6.160 2.489 1.00 0.00 O ATOM 922 CB VAL A 60 -9.681 -3.985 1.100 1.00 0.00 C ATOM 923 CG1 VAL A 60 -9.661 -2.958 2.234 1.00 0.00 C ATOM 924 CG2 VAL A 60 -10.299 -3.390 -0.167 1.00 0.00 C ATOM 0 H VAL A 60 -9.277 -5.813 -0.491 1.00 0.00 H new ATOM 0 HA VAL A 60 -7.697 -3.693 0.420 1.00 0.00 H new ATOM 0 HB VAL A 60 -10.304 -4.821 1.417 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -10.672 -2.591 2.410 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -9.281 -3.426 3.142 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -9.015 -2.124 1.958 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -11.297 -3.014 0.057 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -9.675 -2.572 -0.526 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -10.365 -4.160 -0.936 1.00 0.00 H new ATOM 934 N THR A 61 -6.797 -4.103 2.679 1.00 0.00 N ATOM 935 CA THR A 61 -6.058 -4.422 3.889 1.00 0.00 C ATOM 936 C THR A 61 -6.433 -3.455 5.013 1.00 0.00 C ATOM 937 O THR A 61 -6.989 -2.387 4.759 1.00 0.00 O ATOM 938 CB THR A 61 -4.567 -4.412 3.549 1.00 0.00 C ATOM 939 OG1 THR A 61 -4.005 -5.389 4.421 1.00 0.00 O ATOM 940 CG2 THR A 61 -3.882 -3.107 3.961 1.00 0.00 C ATOM 0 H THR A 61 -6.673 -3.148 2.343 1.00 0.00 H new ATOM 0 HA THR A 61 -6.314 -5.415 4.259 1.00 0.00 H new ATOM 0 HB THR A 61 -4.438 -4.568 2.478 1.00 0.00 H new ATOM 0 HG1 THR A 61 -3.075 -5.153 4.620 1.00 0.00 H new ATOM 0 HG21 THR A 61 -2.825 -3.152 3.697 1.00 0.00 H new ATOM 0 HG22 THR A 61 -4.350 -2.271 3.442 1.00 0.00 H new ATOM 0 HG23 THR A 61 -3.982 -2.968 5.037 1.00 0.00 H new ATOM 948 N ALA A 62 -6.112 -3.863 6.233 1.00 0.00 N ATOM 949 CA ALA A 62 -6.408 -3.045 7.397 1.00 0.00 C ATOM 950 C ALA A 62 -5.202 -2.158 7.711 1.00 0.00 C ATOM 951 O ALA A 62 -4.094 -2.421 7.245 1.00 0.00 O ATOM 952 CB ALA A 62 -6.789 -3.948 8.572 1.00 0.00 C ATOM 0 H ALA A 62 -5.650 -4.749 6.440 1.00 0.00 H new ATOM 0 HA ALA A 62 -7.257 -2.390 7.200 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -7.011 -3.335 9.445 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -7.668 -4.536 8.309 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -5.960 -4.617 8.800 1.00 0.00 H new ATOM 958 N TRP A 63 -5.457 -1.124 8.499 1.00 0.00 N ATOM 959 CA TRP A 63 -4.406 -0.196 8.881 1.00 0.00 C ATOM 960 C TRP A 63 -3.776 -0.704 10.179 1.00 0.00 C ATOM 961 O TRP A 63 -2.661 -0.317 10.525 1.00 0.00 O ATOM 962 CB TRP A 63 -4.950 1.229 8.998 1.00 0.00 C ATOM 963 CG TRP A 63 -5.407 1.832 7.669 1.00 0.00 C ATOM 964 CD1 TRP A 63 -6.651 2.170 7.301 1.00 0.00 C ATOM 965 CD2 TRP A 63 -4.571 2.157 6.538 1.00 0.00 C ATOM 966 NE1 TRP A 63 -6.677 2.687 6.021 1.00 0.00 N ATOM 967 CE2 TRP A 63 -5.372 2.678 5.543 1.00 0.00 C ATOM 968 CE3 TRP A 63 -3.183 2.015 6.363 1.00 0.00 C ATOM 969 CZ2 TRP A 63 -4.877 3.100 4.303 1.00 0.00 C ATOM 970 CZ3 TRP A 63 -2.705 2.440 5.118 1.00 0.00 C ATOM 971 CH2 TRP A 63 -3.498 2.967 4.105 1.00 0.00 C ATOM 0 H TRP A 63 -6.377 -0.908 8.884 1.00 0.00 H new ATOM 0 HA TRP A 63 -3.633 -0.151 8.114 1.00 0.00 H new ATOM 0 HB2 TRP A 63 -5.789 1.230 9.693 1.00 0.00 H new ATOM 0 HB3 TRP A 63 -4.178 1.867 9.428 1.00 0.00 H new ATOM 0 HD1 TRP A 63 -7.523 2.053 7.927 1.00 0.00 H new ATOM 0 HE1 TRP A 63 -7.502 3.015 5.519 1.00 0.00 H new ATOM 0 HE3 TRP A 63 -2.537 1.610 7.128 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 -5.525 3.506 3.540 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 -1.645 2.352 4.931 1.00 0.00 H new ATOM 0 HH2 TRP A 63 -3.052 3.272 3.170 1.00 0.00 H new ATOM 982 N ASP A 64 -4.517 -1.564 10.863 1.00 0.00 N ATOM 983 CA ASP A 64 -4.044 -2.129 12.115 1.00 0.00 C ATOM 984 C ASP A 64 -3.414 -3.497 11.847 1.00 0.00 C ATOM 985 O ASP A 64 -3.366 -4.347 12.734 1.00 0.00 O ATOM 986 CB ASP A 64 -5.198 -2.325 13.101 1.00 0.00 C ATOM 987 CG ASP A 64 -4.843 -2.079 14.569 1.00 0.00 C ATOM 988 OD1 ASP A 64 -4.218 -2.985 15.161 1.00 0.00 O ATOM 989 OD2 ASP A 64 -5.205 -0.990 15.065 1.00 0.00 O ATOM 0 H ASP A 64 -5.442 -1.883 10.573 1.00 0.00 H new ATOM 0 HA ASP A 64 -3.317 -1.439 12.543 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -6.012 -1.655 12.822 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -5.574 -3.343 12.999 1.00 0.00 H new ATOM 994 N THR A 65 -2.946 -3.666 10.619 1.00 0.00 N ATOM 995 CA THR A 65 -2.320 -4.916 10.222 1.00 0.00 C ATOM 996 C THR A 65 -0.797 -4.797 10.295 1.00 0.00 C ATOM 997 O THR A 65 -0.259 -3.692 10.351 1.00 0.00 O ATOM 998 CB THR A 65 -2.835 -5.282 8.829 1.00 0.00 C ATOM 999 OG1 THR A 65 -4.235 -5.023 8.897 1.00 0.00 O ATOM 1000 CG2 THR A 65 -2.747 -6.783 8.547 1.00 0.00 C ATOM 0 H THR A 65 -2.988 -2.958 9.886 1.00 0.00 H new ATOM 0 HA THR A 65 -2.584 -5.724 10.904 1.00 0.00 H new ATOM 0 HB THR A 65 -2.264 -4.738 8.077 1.00 0.00 H new ATOM 0 HG1 THR A 65 -4.665 -5.697 9.464 1.00 0.00 H new ATOM 0 HG21 THR A 65 -3.125 -6.988 7.545 1.00 0.00 H new ATOM 0 HG22 THR A 65 -1.708 -7.106 8.616 1.00 0.00 H new ATOM 0 HG23 THR A 65 -3.345 -7.326 9.279 1.00 0.00 H new ATOM 1008 N ALA A 66 -0.144 -5.950 10.291 1.00 0.00 N ATOM 1009 CA ALA A 66 1.308 -5.988 10.356 1.00 0.00 C ATOM 1010 C ALA A 66 1.878 -5.943 8.937 1.00 0.00 C ATOM 1011 O ALA A 66 1.209 -6.335 7.982 1.00 0.00 O ATOM 1012 CB ALA A 66 1.752 -7.235 11.124 1.00 0.00 C ATOM 0 H ALA A 66 -0.593 -6.865 10.244 1.00 0.00 H new ATOM 0 HA ALA A 66 1.692 -5.121 10.893 1.00 0.00 H new ATOM 0 HB1 ALA A 66 2.841 -7.264 11.173 1.00 0.00 H new ATOM 0 HB2 ALA A 66 1.344 -7.205 12.134 1.00 0.00 H new ATOM 0 HB3 ALA A 66 1.388 -8.126 10.613 1.00 0.00 H new ATOM 1018 N ILE A 67 3.109 -5.462 8.844 1.00 0.00 N ATOM 1019 CA ILE A 67 3.778 -5.361 7.558 1.00 0.00 C ATOM 1020 C ILE A 67 4.759 -6.525 7.405 1.00 0.00 C ATOM 1021 O ILE A 67 5.647 -6.486 6.554 1.00 0.00 O ATOM 1022 CB ILE A 67 4.426 -3.985 7.398 1.00 0.00 C ATOM 1023 CG1 ILE A 67 4.912 -3.771 5.963 1.00 0.00 C ATOM 1024 CG2 ILE A 67 5.548 -3.785 8.419 1.00 0.00 C ATOM 1025 CD1 ILE A 67 3.998 -2.801 5.212 1.00 0.00 C ATOM 0 H ILE A 67 3.661 -5.138 9.638 1.00 0.00 H new ATOM 0 HA ILE A 67 3.056 -5.444 6.746 1.00 0.00 H new ATOM 0 HB ILE A 67 3.670 -3.226 7.598 1.00 0.00 H new ATOM 0 HG12 ILE A 67 5.930 -3.382 5.975 1.00 0.00 H new ATOM 0 HG13 ILE A 67 4.942 -4.727 5.439 1.00 0.00 H new ATOM 0 HG21 ILE A 67 5.992 -2.799 8.283 1.00 0.00 H new ATOM 0 HG22 ILE A 67 5.141 -3.864 9.427 1.00 0.00 H new ATOM 0 HG23 ILE A 67 6.312 -4.549 8.275 1.00 0.00 H new ATOM 0 HD11 ILE A 67 4.367 -2.667 4.195 1.00 0.00 H new ATOM 0 HD12 ILE A 67 2.986 -3.205 5.181 1.00 0.00 H new ATOM 0 HD13 ILE A 67 3.989 -1.839 5.724 1.00 0.00 H new ATOM 1037 N ALA A 68 4.567 -7.533 8.243 1.00 0.00 N ATOM 1038 CA ALA A 68 5.424 -8.706 8.212 1.00 0.00 C ATOM 1039 C ALA A 68 5.011 -9.604 7.044 1.00 0.00 C ATOM 1040 O ALA A 68 5.830 -9.932 6.188 1.00 0.00 O ATOM 1041 CB ALA A 68 5.350 -9.429 9.558 1.00 0.00 C ATOM 0 H ALA A 68 3.830 -7.562 8.948 1.00 0.00 H new ATOM 0 HA ALA A 68 6.463 -8.417 8.054 1.00 0.00 H new ATOM 0 HB1 ALA A 68 5.993 -10.309 9.534 1.00 0.00 H new ATOM 0 HB2 ALA A 68 5.682 -8.758 10.350 1.00 0.00 H new ATOM 0 HB3 ALA A 68 4.322 -9.736 9.750 1.00 0.00 H new ATOM 1047 N PRO A 69 3.705 -9.986 7.047 1.00 0.00 N ATOM 1048 CA PRO A 69 3.173 -10.840 5.999 1.00 0.00 C ATOM 1049 C PRO A 69 2.976 -10.055 4.700 1.00 0.00 C ATOM 1050 O PRO A 69 1.882 -10.043 4.138 1.00 0.00 O ATOM 1051 CB PRO A 69 1.873 -11.391 6.563 1.00 0.00 C ATOM 1052 CG PRO A 69 1.493 -10.469 7.711 1.00 0.00 C ATOM 1053 CD PRO A 69 2.706 -9.617 8.045 1.00 0.00 C ATOM 0 HA PRO A 69 3.851 -11.651 5.732 1.00 0.00 H new ATOM 0 HB2 PRO A 69 1.093 -11.409 5.802 1.00 0.00 H new ATOM 0 HB3 PRO A 69 2.002 -12.416 6.911 1.00 0.00 H new ATOM 0 HG2 PRO A 69 0.649 -9.839 7.431 1.00 0.00 H new ATOM 0 HG3 PRO A 69 1.183 -11.049 8.580 1.00 0.00 H new ATOM 0 HD2 PRO A 69 2.469 -8.554 7.994 1.00 0.00 H new ATOM 0 HD3 PRO A 69 3.063 -9.816 9.055 1.00 0.00 H new ATOM 1061 N LEU A 70 4.053 -9.420 4.261 1.00 0.00 N ATOM 1062 CA LEU A 70 4.012 -8.635 3.039 1.00 0.00 C ATOM 1063 C LEU A 70 5.220 -8.991 2.170 1.00 0.00 C ATOM 1064 O LEU A 70 5.094 -9.132 0.954 1.00 0.00 O ATOM 1065 CB LEU A 70 3.905 -7.144 3.363 1.00 0.00 C ATOM 1066 CG LEU A 70 2.531 -6.654 3.823 1.00 0.00 C ATOM 1067 CD1 LEU A 70 1.443 -7.055 2.824 1.00 0.00 C ATOM 1068 CD2 LEU A 70 2.219 -7.145 5.238 1.00 0.00 C ATOM 0 H LEU A 70 4.959 -9.433 4.730 1.00 0.00 H new ATOM 0 HA LEU A 70 3.120 -8.876 2.461 1.00 0.00 H new ATOM 0 HB2 LEU A 70 4.632 -6.909 4.141 1.00 0.00 H new ATOM 0 HB3 LEU A 70 4.192 -6.578 2.477 1.00 0.00 H new ATOM 0 HG LEU A 70 2.551 -5.565 3.857 1.00 0.00 H new ATOM 0 HD11 LEU A 70 0.476 -6.694 3.175 1.00 0.00 H new ATOM 0 HD12 LEU A 70 1.663 -6.616 1.851 1.00 0.00 H new ATOM 0 HD13 LEU A 70 1.414 -8.141 2.734 1.00 0.00 H new ATOM 0 HD21 LEU A 70 1.237 -6.783 5.541 1.00 0.00 H new ATOM 0 HD22 LEU A 70 2.225 -8.235 5.254 1.00 0.00 H new ATOM 0 HD23 LEU A 70 2.973 -6.768 5.929 1.00 0.00 H new ATOM 1080 N ASP A 71 6.362 -9.125 2.826 1.00 0.00 N ATOM 1081 CA ASP A 71 7.592 -9.461 2.128 1.00 0.00 C ATOM 1082 C ASP A 71 7.271 -10.398 0.962 1.00 0.00 C ATOM 1083 O ASP A 71 6.998 -11.580 1.168 1.00 0.00 O ATOM 1084 CB ASP A 71 8.573 -10.180 3.056 1.00 0.00 C ATOM 1085 CG ASP A 71 9.859 -10.667 2.385 1.00 0.00 C ATOM 1086 OD1 ASP A 71 9.966 -10.473 1.155 1.00 0.00 O ATOM 1087 OD2 ASP A 71 10.706 -11.222 3.118 1.00 0.00 O ATOM 0 H ASP A 71 6.462 -9.007 3.834 1.00 0.00 H new ATOM 0 HA ASP A 71 8.044 -8.534 1.775 1.00 0.00 H new ATOM 0 HB2 ASP A 71 8.839 -9.507 3.871 1.00 0.00 H new ATOM 0 HB3 ASP A 71 8.067 -11.036 3.502 1.00 0.00 H new ATOM 1092 N GLY A 72 7.314 -9.836 -0.236 1.00 0.00 N ATOM 1093 CA GLY A 72 7.032 -10.607 -1.435 1.00 0.00 C ATOM 1094 C GLY A 72 5.586 -10.400 -1.892 1.00 0.00 C ATOM 1095 O GLY A 72 4.842 -11.364 -2.064 1.00 0.00 O ATOM 0 H GLY A 72 7.540 -8.855 -0.403 1.00 0.00 H new ATOM 0 HA2 GLY A 72 7.715 -10.311 -2.231 1.00 0.00 H new ATOM 0 HA3 GLY A 72 7.208 -11.665 -1.241 1.00 0.00 H new ATOM 1099 N GLU A 73 5.232 -9.137 -2.076 1.00 0.00 N ATOM 1100 CA GLU A 73 3.889 -8.791 -2.509 1.00 0.00 C ATOM 1101 C GLU A 73 3.866 -7.376 -3.089 1.00 0.00 C ATOM 1102 O GLU A 73 4.917 -6.780 -3.325 1.00 0.00 O ATOM 1103 CB GLU A 73 2.890 -8.929 -1.359 1.00 0.00 C ATOM 1104 CG GLU A 73 3.079 -7.812 -0.331 1.00 0.00 C ATOM 1105 CD GLU A 73 2.205 -6.602 -0.668 1.00 0.00 C ATOM 1106 OE1 GLU A 73 0.996 -6.821 -0.894 1.00 0.00 O ATOM 1107 OE2 GLU A 73 2.767 -5.486 -0.693 1.00 0.00 O ATOM 0 H GLU A 73 5.852 -8.340 -1.933 1.00 0.00 H new ATOM 0 HA GLU A 73 3.590 -9.488 -3.292 1.00 0.00 H new ATOM 0 HB2 GLU A 73 1.873 -8.899 -1.750 1.00 0.00 H new ATOM 0 HB3 GLU A 73 3.018 -9.898 -0.876 1.00 0.00 H new ATOM 0 HG2 GLU A 73 2.827 -8.181 0.663 1.00 0.00 H new ATOM 0 HG3 GLU A 73 4.127 -7.512 -0.303 1.00 0.00 H new ATOM 1114 N GLU A 74 2.657 -6.877 -3.303 1.00 0.00 N ATOM 1115 CA GLU A 74 2.484 -5.543 -3.851 1.00 0.00 C ATOM 1116 C GLU A 74 1.210 -4.903 -3.295 1.00 0.00 C ATOM 1117 O GLU A 74 0.122 -5.462 -3.426 1.00 0.00 O ATOM 1118 CB GLU A 74 2.458 -5.577 -5.380 1.00 0.00 C ATOM 1119 CG GLU A 74 3.839 -5.260 -5.959 1.00 0.00 C ATOM 1120 CD GLU A 74 3.932 -5.693 -7.423 1.00 0.00 C ATOM 1121 OE1 GLU A 74 3.403 -6.784 -7.727 1.00 0.00 O ATOM 1122 OE2 GLU A 74 4.530 -4.923 -8.206 1.00 0.00 O ATOM 0 H GLU A 74 1.788 -7.373 -3.107 1.00 0.00 H new ATOM 0 HA GLU A 74 3.336 -4.934 -3.549 1.00 0.00 H new ATOM 0 HB2 GLU A 74 2.134 -6.561 -5.720 1.00 0.00 H new ATOM 0 HB3 GLU A 74 1.730 -4.856 -5.751 1.00 0.00 H new ATOM 0 HG2 GLU A 74 4.034 -4.191 -5.879 1.00 0.00 H new ATOM 0 HG3 GLU A 74 4.607 -5.768 -5.376 1.00 0.00 H new ATOM 1129 N LEU A 75 1.387 -3.739 -2.688 1.00 0.00 N ATOM 1130 CA LEU A 75 0.266 -3.017 -2.112 1.00 0.00 C ATOM 1131 C LEU A 75 -0.070 -1.814 -2.997 1.00 0.00 C ATOM 1132 O LEU A 75 0.828 -1.136 -3.494 1.00 0.00 O ATOM 1133 CB LEU A 75 0.557 -2.646 -0.656 1.00 0.00 C ATOM 1134 CG LEU A 75 0.715 -3.818 0.315 1.00 0.00 C ATOM 1135 CD1 LEU A 75 2.033 -3.718 1.085 1.00 0.00 C ATOM 1136 CD2 LEU A 75 -0.490 -3.919 1.252 1.00 0.00 C ATOM 0 H LEU A 75 2.291 -3.278 -2.583 1.00 0.00 H new ATOM 0 HA LEU A 75 -0.620 -3.651 -2.084 1.00 0.00 H new ATOM 0 HB2 LEU A 75 1.470 -2.051 -0.629 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -0.250 -2.008 -0.296 1.00 0.00 H new ATOM 0 HG LEU A 75 0.750 -4.740 -0.265 1.00 0.00 H new ATOM 0 HD11 LEU A 75 2.120 -4.563 1.768 1.00 0.00 H new ATOM 0 HD12 LEU A 75 2.867 -3.731 0.383 1.00 0.00 H new ATOM 0 HD13 LEU A 75 2.053 -2.788 1.654 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -0.353 -4.760 1.932 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -0.581 -2.998 1.828 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -1.396 -4.071 0.665 1.00 0.00 H new ATOM 1148 N ILE A 76 -1.364 -1.587 -3.166 1.00 0.00 N ATOM 1149 CA ILE A 76 -1.829 -0.479 -3.983 1.00 0.00 C ATOM 1150 C ILE A 76 -2.611 0.501 -3.106 1.00 0.00 C ATOM 1151 O ILE A 76 -3.706 0.187 -2.642 1.00 0.00 O ATOM 1152 CB ILE A 76 -2.620 -0.994 -5.186 1.00 0.00 C ATOM 1153 CG1 ILE A 76 -1.706 -1.730 -6.169 1.00 0.00 C ATOM 1154 CG2 ILE A 76 -3.392 0.140 -5.862 1.00 0.00 C ATOM 1155 CD1 ILE A 76 -2.523 -2.567 -7.155 1.00 0.00 C ATOM 0 H ILE A 76 -2.105 -2.152 -2.751 1.00 0.00 H new ATOM 0 HA ILE A 76 -0.983 0.069 -4.399 1.00 0.00 H new ATOM 0 HB ILE A 76 -3.355 -1.715 -4.827 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -1.098 -1.009 -6.715 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -1.020 -2.375 -5.620 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -3.946 -0.254 -6.714 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -4.089 0.581 -5.149 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -2.693 0.902 -6.205 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -1.850 -3.080 -7.842 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -3.112 -3.303 -6.607 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -3.191 -1.916 -7.719 1.00 0.00 H new ATOM 1167 N VAL A 77 -2.019 1.670 -2.906 1.00 0.00 N ATOM 1168 CA VAL A 77 -2.647 2.698 -2.094 1.00 0.00 C ATOM 1169 C VAL A 77 -3.482 3.612 -2.992 1.00 0.00 C ATOM 1170 O VAL A 77 -2.979 4.144 -3.981 1.00 0.00 O ATOM 1171 CB VAL A 77 -1.585 3.454 -1.293 1.00 0.00 C ATOM 1172 CG1 VAL A 77 -2.215 4.581 -0.473 1.00 0.00 C ATOM 1173 CG2 VAL A 77 -0.792 2.500 -0.397 1.00 0.00 C ATOM 0 H VAL A 77 -1.111 1.928 -3.293 1.00 0.00 H new ATOM 0 HA VAL A 77 -3.324 2.250 -1.367 1.00 0.00 H new ATOM 0 HB VAL A 77 -0.889 3.905 -2.001 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -1.438 5.102 0.087 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -2.713 5.283 -1.142 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -2.943 4.162 0.221 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -0.044 3.063 0.161 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -1.470 2.007 0.300 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -0.296 1.750 -1.013 1.00 0.00 H new ATOM 1183 N GLU A 78 -4.743 3.768 -2.616 1.00 0.00 N ATOM 1184 CA GLU A 78 -5.652 4.609 -3.375 1.00 0.00 C ATOM 1185 C GLU A 78 -6.532 5.428 -2.429 1.00 0.00 C ATOM 1186 O GLU A 78 -6.515 5.214 -1.218 1.00 0.00 O ATOM 1187 CB GLU A 78 -6.505 3.772 -4.331 1.00 0.00 C ATOM 1188 CG GLU A 78 -5.941 3.818 -5.752 1.00 0.00 C ATOM 1189 CD GLU A 78 -6.835 4.654 -6.670 1.00 0.00 C ATOM 1190 OE1 GLU A 78 -8.058 4.396 -6.660 1.00 0.00 O ATOM 1191 OE2 GLU A 78 -6.275 5.532 -7.362 1.00 0.00 O ATOM 0 H GLU A 78 -5.156 3.326 -1.795 1.00 0.00 H new ATOM 0 HA GLU A 78 -5.060 5.298 -3.978 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -6.540 2.740 -3.983 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -7.530 4.144 -4.330 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -4.936 4.240 -5.735 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -5.855 2.805 -6.146 1.00 0.00 H new ATOM 1198 N VAL A 79 -7.281 6.349 -3.018 1.00 0.00 N ATOM 1199 CA VAL A 79 -8.167 7.201 -2.243 1.00 0.00 C ATOM 1200 C VAL A 79 -9.591 6.646 -2.311 1.00 0.00 C ATOM 1201 O VAL A 79 -10.069 6.283 -3.384 1.00 0.00 O ATOM 1202 CB VAL A 79 -8.065 8.647 -2.734 1.00 0.00 C ATOM 1203 CG1 VAL A 79 -9.139 9.523 -2.088 1.00 0.00 C ATOM 1204 CG2 VAL A 79 -6.667 9.215 -2.480 1.00 0.00 C ATOM 0 H VAL A 79 -7.292 6.524 -4.023 1.00 0.00 H new ATOM 0 HA VAL A 79 -7.870 7.206 -1.194 1.00 0.00 H new ATOM 0 HB VAL A 79 -8.236 8.648 -3.810 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -9.044 10.545 -2.454 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -10.126 9.137 -2.343 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -9.014 9.513 -1.005 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -6.622 10.243 -2.838 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -6.454 9.193 -1.411 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -5.928 8.613 -3.009 1.00 0.00 H new ATOM 1214 N LEU A 80 -10.229 6.597 -1.151 1.00 0.00 N ATOM 1215 CA LEU A 80 -11.588 6.092 -1.065 1.00 0.00 C ATOM 1216 C LEU A 80 -12.515 6.992 -1.885 1.00 0.00 C ATOM 1217 O LEU A 80 -12.388 8.215 -1.850 1.00 0.00 O ATOM 1218 CB LEU A 80 -12.013 5.942 0.397 1.00 0.00 C ATOM 1219 CG LEU A 80 -11.510 4.689 1.117 1.00 0.00 C ATOM 1220 CD1 LEU A 80 -11.841 4.743 2.609 1.00 0.00 C ATOM 1221 CD2 LEU A 80 -12.054 3.421 0.455 1.00 0.00 C ATOM 0 H LEU A 80 -9.829 6.899 -0.262 1.00 0.00 H new ATOM 0 HA LEU A 80 -11.650 5.092 -1.495 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -11.666 6.817 0.947 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -13.102 5.949 0.441 1.00 0.00 H new ATOM 0 HG LEU A 80 -10.424 4.658 1.030 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -11.472 3.840 3.096 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -11.366 5.616 3.056 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -12.921 4.811 2.740 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -11.681 2.545 0.986 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -13.143 3.431 0.490 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -11.725 3.383 -0.583 1.00 0.00 H new ATOM 1233 N SER A 81 -13.426 6.352 -2.603 1.00 0.00 N ATOM 1234 CA SER A 81 -14.373 7.080 -3.431 1.00 0.00 C ATOM 1235 C SER A 81 -13.635 7.798 -4.562 1.00 0.00 C ATOM 1236 O SER A 81 -12.520 8.282 -4.373 1.00 0.00 O ATOM 1237 CB SER A 81 -15.174 8.083 -2.599 1.00 0.00 C ATOM 1238 OG SER A 81 -16.128 8.789 -3.387 1.00 0.00 O ATOM 0 H SER A 81 -13.529 5.338 -2.629 1.00 0.00 H new ATOM 0 HA SER A 81 -15.073 6.364 -3.860 1.00 0.00 H new ATOM 0 HB2 SER A 81 -15.687 7.558 -1.793 1.00 0.00 H new ATOM 0 HB3 SER A 81 -14.492 8.794 -2.133 1.00 0.00 H new ATOM 0 HG SER A 81 -16.620 9.418 -2.819 1.00 0.00 H new ATOM 1244 N GLY A 82 -14.288 7.846 -5.714 1.00 0.00 N ATOM 1245 CA GLY A 82 -13.708 8.498 -6.877 1.00 0.00 C ATOM 1246 C GLY A 82 -14.686 9.504 -7.486 1.00 0.00 C ATOM 1247 O GLY A 82 -15.558 9.131 -8.269 1.00 0.00 O ATOM 0 H GLY A 82 -15.213 7.444 -5.867 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -12.788 9.007 -6.592 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -13.440 7.749 -7.622 1.00 0.00 H new ATOM 1251 N PRO A 83 -14.503 10.793 -7.094 1.00 0.00 N ATOM 1252 CA PRO A 83 -15.359 11.856 -7.593 1.00 0.00 C ATOM 1253 C PRO A 83 -15.007 12.210 -9.039 1.00 0.00 C ATOM 1254 O PRO A 83 -15.893 12.465 -9.853 1.00 0.00 O ATOM 1255 CB PRO A 83 -15.150 13.014 -6.630 1.00 0.00 C ATOM 1256 CG PRO A 83 -13.846 12.723 -5.905 1.00 0.00 C ATOM 1257 CD PRO A 83 -13.480 11.272 -6.168 1.00 0.00 C ATOM 0 HA PRO A 83 -16.410 11.569 -7.628 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -15.096 13.962 -7.165 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -15.979 13.092 -5.927 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -13.056 13.386 -6.259 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -13.956 12.901 -4.835 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -12.483 11.187 -6.601 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -13.477 10.691 -5.246 1.00 0.00 H new ATOM 1265 N SER A 84 -13.711 12.214 -9.315 1.00 0.00 N ATOM 1266 CA SER A 84 -13.231 12.532 -10.649 1.00 0.00 C ATOM 1267 C SER A 84 -12.193 11.499 -11.092 1.00 0.00 C ATOM 1268 O SER A 84 -11.124 11.392 -10.493 1.00 0.00 O ATOM 1269 CB SER A 84 -12.633 13.940 -10.698 1.00 0.00 C ATOM 1270 OG SER A 84 -11.576 14.104 -9.757 1.00 0.00 O ATOM 0 H SER A 84 -12.979 12.002 -8.637 1.00 0.00 H new ATOM 0 HA SER A 84 -14.079 12.502 -11.334 1.00 0.00 H new ATOM 0 HB2 SER A 84 -12.259 14.140 -11.702 1.00 0.00 H new ATOM 0 HB3 SER A 84 -13.414 14.673 -10.497 1.00 0.00 H new ATOM 0 HG SER A 84 -11.015 13.300 -9.751 1.00 0.00 H new ATOM 1276 N SER A 85 -12.545 10.765 -12.138 1.00 0.00 N ATOM 1277 CA SER A 85 -11.657 9.744 -12.668 1.00 0.00 C ATOM 1278 C SER A 85 -11.000 8.975 -11.520 1.00 0.00 C ATOM 1279 O SER A 85 -9.866 9.265 -11.142 1.00 0.00 O ATOM 1280 CB SER A 85 -10.589 10.360 -13.574 1.00 0.00 C ATOM 1281 OG SER A 85 -10.122 9.435 -14.553 1.00 0.00 O ATOM 0 H SER A 85 -13.432 10.857 -12.632 1.00 0.00 H new ATOM 0 HA SER A 85 -12.249 9.053 -13.268 1.00 0.00 H new ATOM 0 HB2 SER A 85 -10.999 11.239 -14.072 1.00 0.00 H new ATOM 0 HB3 SER A 85 -9.750 10.700 -12.967 1.00 0.00 H new ATOM 0 HG SER A 85 -9.443 9.866 -15.113 1.00 0.00 H new ATOM 1287 N GLY A 86 -11.740 8.008 -10.998 1.00 0.00 N ATOM 1288 CA GLY A 86 -11.244 7.194 -9.901 1.00 0.00 C ATOM 1289 C GLY A 86 -10.677 8.070 -8.782 1.00 0.00 C ATOM 1290 O GLY A 86 -9.486 8.378 -8.772 1.00 0.00 O ATOM 0 H GLY A 86 -12.680 7.770 -11.315 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -12.051 6.574 -9.509 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -10.471 6.518 -10.266 1.00 0.00 H new TER 1294 GLY A 86