USER MOD reduce.3.24.130724 H: found=0, std=0, add=1053, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1051 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 84 THR OG1 : rot 15:sc= -1.16! USER MOD Set 1.2: A 89 HIS : no HE2:sc= 0.0451 K(o=0.55,f=-0.57) USER MOD Set 1.3: A 106 SER OG : rot -84:sc= 1.26 USER MOD Set 1.4: A 108 ASN : amide:sc= -0.299 K(o=0.55,f=-5!) USER MOD Set 1.5: A 110 THR OG1 : rot -76:sc= 0.705 USER MOD Set 2.1: A 4 ASN : amide:sc= 0.759 K(o=1.6,f=0.039) USER MOD Set 2.2: A 7 THR OG1 : rot -35:sc= 0.869 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 5 ASN : amide:sc= -0.0628 K(o=-0.063,f=-1.1) USER MOD Single : A 11 GLN : amide:sc= -0.979 K(o=-0.98,f=-0.0023) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ -136:sc= -0.545 (180deg=-2.56!) USER MOD Single : A 26 MET CE :methyl -160:sc= -0.17 (180deg=-1.11) USER MOD Single : A 28 SER OG : rot 180:sc= 0.07 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 91:sc= 1.21 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 ASN : amide:sc= -0.0372 K(o=-0.037,f=-1.8!) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 141:sc= 1.04 (180deg=0.0595) USER MOD Single : A 56 ASN : amide:sc= -3.02! C(o=-3!,f=-5.6!) USER MOD Single : A 65 GLN : amide:sc= 1.62 K(o=1.6,f=-0.17) USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot 38:sc= 0.143 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 HIS : no HE2:sc= -0.447 K(o=-0.45,f=-2.3!) USER MOD Single : A 76 SER OG : rot 130:sc= 1.22 USER MOD Single : A 86 SER OG : rot -177:sc= 1.26 USER MOD Single : A 95 ASN : amide:sc= 0.637 K(o=0.64,f=-8.8!) USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 ASN : amide:sc= -0.164 K(o=-0.16,f=-2.5) USER MOD Single : A 118 ASN : amide:sc= -0.851 K(o=-0.85,f=0) USER MOD Single : A 120 GLN : amide:sc= 1 K(o=1,f=-3!) USER MOD Single : A 122 MET CE :methyl 134:sc= -0.0113 (180deg=-1.59!) USER MOD Single : A 123 GLN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : A 124 THR OG1 : rot 33:sc= 0.199 USER MOD Single : A 129 GLN : amide:sc= 0.607 K(o=0.61,f=-0.5) USER MOD Single : A 132 LYS NZ :NH3+ -162:sc= -0.102 (180deg=-0.503) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 10.475 -4.933 55.953 1.00 11.00 N ATOM 2 CA MET A 1 9.781 -3.768 56.499 1.00 43.05 C ATOM 3 C MET A 1 8.301 -4.075 56.705 1.00 52.20 C ATOM 4 O MET A 1 7.486 -4.036 55.775 1.00 43.13 O ATOM 5 CB MET A 1 10.013 -2.492 55.634 1.00 71.14 C ATOM 6 CG MET A 1 9.626 -2.609 54.165 1.00 15.10 C ATOM 7 SD MET A 1 9.926 -1.082 53.251 1.00 2.14 S ATOM 8 CE MET A 1 9.348 -1.569 51.620 1.00 51.31 C ATOM 0 H1 MET A 1 11.481 -4.706 55.819 1.00 11.00 H new ATOM 0 H2 MET A 1 10.385 -5.732 56.613 1.00 11.00 H new ATOM 0 H3 MET A 1 10.053 -5.191 55.038 1.00 11.00 H new ATOM 0 HA MET A 1 10.208 -3.547 57.477 1.00 43.05 H new ATOM 0 HB2 MET A 1 9.449 -1.670 56.075 1.00 71.14 H new ATOM 0 HB3 MET A 1 11.068 -2.223 55.692 1.00 71.14 H new ATOM 0 HG2 MET A 1 10.191 -3.421 53.707 1.00 15.10 H new ATOM 0 HG3 MET A 1 8.571 -2.873 54.090 1.00 15.10 H new ATOM 0 HE1 MET A 1 9.464 -0.734 50.929 1.00 51.31 H new ATOM 0 HE2 MET A 1 9.933 -2.418 51.265 1.00 51.31 H new ATOM 0 HE3 MET A 1 8.296 -1.851 51.676 1.00 51.31 H new ATOM 20 N SER A 2 7.966 -4.411 57.919 1.00 34.42 N ATOM 21 CA SER A 2 6.646 -4.847 58.254 1.00 13.13 C ATOM 22 C SER A 2 5.691 -3.669 58.471 1.00 62.42 C ATOM 23 O SER A 2 4.597 -3.640 57.892 1.00 25.42 O ATOM 24 CB SER A 2 6.707 -5.749 59.495 1.00 63.23 C ATOM 25 OG SER A 2 5.436 -6.264 59.833 1.00 74.35 O ATOM 0 H SER A 2 8.610 -4.389 58.709 1.00 34.42 H new ATOM 0 HA SER A 2 6.248 -5.417 57.415 1.00 13.13 H new ATOM 0 HB2 SER A 2 7.396 -6.573 59.311 1.00 63.23 H new ATOM 0 HB3 SER A 2 7.105 -5.182 60.337 1.00 63.23 H new ATOM 0 HG SER A 2 5.514 -6.834 60.626 1.00 74.35 H new ATOM 31 N ASP A 3 6.093 -2.702 59.263 1.00 42.35 N ATOM 32 CA ASP A 3 5.214 -1.583 59.575 1.00 35.45 C ATOM 33 C ASP A 3 5.689 -0.336 58.853 1.00 4.15 C ATOM 34 O ASP A 3 6.903 -0.090 58.769 1.00 75.13 O ATOM 35 CB ASP A 3 5.157 -1.347 61.085 1.00 73.20 C ATOM 36 CG ASP A 3 4.092 -0.353 61.475 1.00 1.22 C ATOM 37 OD1 ASP A 3 2.899 -0.729 61.499 1.00 52.31 O ATOM 38 OD2 ASP A 3 4.405 0.804 61.748 1.00 52.31 O ATOM 0 H ASP A 3 7.013 -2.661 59.703 1.00 42.35 H new ATOM 0 HA ASP A 3 4.206 -1.821 59.234 1.00 35.45 H new ATOM 0 HB2 ASP A 3 4.968 -2.294 61.590 1.00 73.20 H new ATOM 0 HB3 ASP A 3 6.127 -0.989 61.430 1.00 73.20 H new ATOM 43 N ASN A 4 4.765 0.438 58.319 1.00 25.33 N ATOM 44 CA ASN A 4 5.129 1.619 57.542 1.00 15.02 C ATOM 45 C ASN A 4 5.113 2.875 58.383 1.00 13.11 C ATOM 46 O ASN A 4 4.091 3.246 58.958 1.00 50.04 O ATOM 47 CB ASN A 4 4.225 1.798 56.301 1.00 15.11 C ATOM 48 CG ASN A 4 4.576 3.053 55.479 1.00 1.11 C ATOM 49 OD1 ASN A 4 4.025 4.136 55.693 1.00 25.14 O ATOM 50 ND2 ASN A 4 5.493 2.919 54.554 1.00 14.22 N ATOM 0 H ASN A 4 3.761 0.277 58.405 1.00 25.33 H new ATOM 0 HA ASN A 4 6.149 1.453 57.197 1.00 15.02 H new ATOM 0 HB2 ASN A 4 4.312 0.917 55.665 1.00 15.11 H new ATOM 0 HB3 ASN A 4 3.185 1.859 56.621 1.00 15.11 H new ATOM 0 HD21 ASN A 4 5.768 3.722 53.989 1.00 14.22 H new ATOM 0 HD22 ASN A 4 5.932 2.011 54.399 1.00 14.22 H new ATOM 57 N ASN A 5 6.245 3.506 58.459 1.00 64.12 N ATOM 58 CA ASN A 5 6.393 4.773 59.130 1.00 74.00 C ATOM 59 C ASN A 5 6.828 5.769 58.106 1.00 32.11 C ATOM 60 O ASN A 5 7.557 5.411 57.172 1.00 4.13 O ATOM 61 CB ASN A 5 7.411 4.700 60.274 1.00 44.13 C ATOM 62 CG ASN A 5 6.882 3.993 61.507 1.00 53.42 C ATOM 63 OD1 ASN A 5 5.694 4.067 61.818 1.00 72.54 O ATOM 64 ND2 ASN A 5 7.741 3.313 62.215 1.00 13.44 N ATOM 0 H ASN A 5 7.111 3.153 58.051 1.00 64.12 H new ATOM 0 HA ASN A 5 5.444 5.062 59.581 1.00 74.00 H new ATOM 0 HB2 ASN A 5 8.304 4.183 59.923 1.00 44.13 H new ATOM 0 HB3 ASN A 5 7.714 5.711 60.546 1.00 44.13 H new ATOM 0 HD21 ASN A 5 7.435 2.822 63.055 1.00 13.44 H new ATOM 0 HD22 ASN A 5 8.719 3.272 61.929 1.00 13.44 H new ATOM 71 N GLY A 6 6.391 6.984 58.238 1.00 13.42 N ATOM 72 CA GLY A 6 6.692 7.962 57.238 1.00 53.44 C ATOM 73 C GLY A 6 5.583 8.011 56.232 1.00 33.45 C ATOM 74 O GLY A 6 5.805 7.973 55.020 1.00 73.05 O ATOM 0 H GLY A 6 5.830 7.320 59.021 1.00 13.42 H new ATOM 0 HA2 GLY A 6 6.821 8.941 57.700 1.00 53.44 H new ATOM 0 HA3 GLY A 6 7.633 7.715 56.745 1.00 53.44 H new ATOM 78 N THR A 7 4.386 8.030 56.737 1.00 25.35 N ATOM 79 CA THR A 7 3.223 8.111 55.933 1.00 32.04 C ATOM 80 C THR A 7 2.856 9.597 55.784 1.00 5.11 C ATOM 81 O THR A 7 2.700 10.305 56.787 1.00 73.51 O ATOM 82 CB THR A 7 2.080 7.362 56.653 1.00 31.33 C ATOM 83 OG1 THR A 7 2.495 6.002 56.939 1.00 72.14 O ATOM 84 CG2 THR A 7 0.808 7.337 55.825 1.00 64.13 C ATOM 0 H THR A 7 4.196 7.989 57.738 1.00 25.35 H new ATOM 0 HA THR A 7 3.388 7.667 54.951 1.00 32.04 H new ATOM 0 HB THR A 7 1.866 7.896 57.579 1.00 31.33 H new ATOM 0 HG1 THR A 7 3.061 5.673 56.210 1.00 72.14 H new ATOM 0 HG21 THR A 7 0.030 6.801 56.369 1.00 64.13 H new ATOM 0 HG22 THR A 7 0.478 8.358 55.634 1.00 64.13 H new ATOM 0 HG23 THR A 7 1.001 6.834 54.877 1.00 64.13 H new ATOM 92 N PRO A 8 2.767 10.103 54.550 1.00 41.14 N ATOM 93 CA PRO A 8 2.376 11.475 54.305 1.00 55.25 C ATOM 94 C PRO A 8 0.924 11.710 54.683 1.00 50.24 C ATOM 95 O PRO A 8 0.046 10.927 54.287 1.00 2.03 O ATOM 96 CB PRO A 8 2.582 11.661 52.795 1.00 33.11 C ATOM 97 CG PRO A 8 2.520 10.286 52.230 1.00 71.03 C ATOM 98 CD PRO A 8 3.047 9.376 53.298 1.00 40.12 C ATOM 0 HA PRO A 8 2.956 12.181 54.899 1.00 55.25 H new ATOM 0 HB2 PRO A 8 1.810 12.300 52.366 1.00 33.11 H new ATOM 0 HB3 PRO A 8 3.541 12.133 52.582 1.00 33.11 H new ATOM 0 HG2 PRO A 8 1.498 10.021 51.961 1.00 71.03 H new ATOM 0 HG3 PRO A 8 3.119 10.210 51.322 1.00 71.03 H new ATOM 0 HD2 PRO A 8 2.549 8.406 53.279 1.00 40.12 H new ATOM 0 HD3 PRO A 8 4.114 9.189 53.174 1.00 40.12 H new ATOM 106 N GLU A 9 0.673 12.732 55.472 1.00 11.05 N ATOM 107 CA GLU A 9 -0.681 13.127 55.777 1.00 2.11 C ATOM 108 C GLU A 9 -1.243 13.798 54.535 1.00 71.02 C ATOM 109 O GLU A 9 -0.801 14.886 54.163 1.00 55.05 O ATOM 110 CB GLU A 9 -0.721 14.064 56.987 1.00 11.40 C ATOM 111 CG GLU A 9 -0.305 13.392 58.285 1.00 15.53 C ATOM 112 CD GLU A 9 -0.333 14.324 59.470 1.00 14.34 C ATOM 113 OE1 GLU A 9 -1.399 14.948 59.734 1.00 42.11 O ATOM 114 OE2 GLU A 9 0.687 14.414 60.195 1.00 65.33 O ATOM 0 H GLU A 9 1.392 13.305 55.914 1.00 11.05 H new ATOM 0 HA GLU A 9 -1.285 12.259 56.042 1.00 2.11 H new ATOM 0 HB2 GLU A 9 -0.065 14.914 56.800 1.00 11.40 H new ATOM 0 HB3 GLU A 9 -1.731 14.459 57.098 1.00 11.40 H new ATOM 0 HG2 GLU A 9 -0.967 12.548 58.479 1.00 15.53 H new ATOM 0 HG3 GLU A 9 0.701 12.988 58.172 1.00 15.53 H new ATOM 121 N PRO A 10 -2.184 13.148 53.857 1.00 73.21 N ATOM 122 CA PRO A 10 -2.655 13.600 52.570 1.00 71.23 C ATOM 123 C PRO A 10 -3.527 14.820 52.659 1.00 14.11 C ATOM 124 O PRO A 10 -4.427 14.902 53.498 1.00 2.13 O ATOM 125 CB PRO A 10 -3.449 12.414 52.033 1.00 25.43 C ATOM 126 CG PRO A 10 -3.937 11.705 53.245 1.00 73.44 C ATOM 127 CD PRO A 10 -2.905 11.942 54.317 1.00 53.45 C ATOM 0 HA PRO A 10 -1.826 13.898 51.929 1.00 71.23 H new ATOM 0 HB2 PRO A 10 -4.278 12.744 51.407 1.00 25.43 H new ATOM 0 HB3 PRO A 10 -2.824 11.765 51.419 1.00 25.43 H new ATOM 0 HG2 PRO A 10 -4.911 12.085 53.552 1.00 73.44 H new ATOM 0 HG3 PRO A 10 -4.058 10.639 53.050 1.00 73.44 H new ATOM 0 HD2 PRO A 10 -3.369 12.101 55.290 1.00 53.45 H new ATOM 0 HD3 PRO A 10 -2.233 11.090 54.420 1.00 53.45 H new ATOM 135 N GLN A 11 -3.246 15.770 51.825 1.00 42.31 N ATOM 136 CA GLN A 11 -4.046 16.943 51.742 1.00 50.35 C ATOM 137 C GLN A 11 -4.798 16.944 50.430 1.00 24.31 C ATOM 138 O GLN A 11 -4.198 16.925 49.343 1.00 64.34 O ATOM 139 CB GLN A 11 -3.211 18.226 51.927 1.00 54.34 C ATOM 140 CG GLN A 11 -2.007 18.354 51.002 1.00 41.22 C ATOM 141 CD GLN A 11 -1.265 19.669 51.152 1.00 31.21 C ATOM 142 OE1 GLN A 11 -0.054 19.725 50.963 1.00 35.02 O ATOM 143 NE2 GLN A 11 -1.974 20.732 51.459 1.00 4.33 N ATOM 0 H GLN A 11 -2.454 15.751 51.183 1.00 42.31 H new ATOM 0 HA GLN A 11 -4.766 16.934 52.560 1.00 50.35 H new ATOM 0 HB2 GLN A 11 -3.860 19.088 51.774 1.00 54.34 H new ATOM 0 HB3 GLN A 11 -2.863 18.268 52.959 1.00 54.34 H new ATOM 0 HG2 GLN A 11 -1.318 17.533 51.200 1.00 41.22 H new ATOM 0 HG3 GLN A 11 -2.340 18.249 49.969 1.00 41.22 H new ATOM 0 HE21 GLN A 11 -2.979 20.648 51.609 1.00 4.33 H new ATOM 0 HE22 GLN A 11 -1.519 21.641 51.547 1.00 4.33 H new ATOM 152 N VAL A 12 -6.096 16.896 50.508 1.00 3.51 N ATOM 153 CA VAL A 12 -6.884 16.935 49.317 1.00 4.11 C ATOM 154 C VAL A 12 -7.139 18.390 48.902 1.00 72.44 C ATOM 155 O VAL A 12 -8.063 19.059 49.366 1.00 22.42 O ATOM 156 CB VAL A 12 -8.195 16.075 49.407 1.00 1.21 C ATOM 157 CG1 VAL A 12 -9.122 16.513 50.533 1.00 72.13 C ATOM 158 CG2 VAL A 12 -8.926 16.049 48.070 1.00 34.50 C ATOM 0 H VAL A 12 -6.625 16.830 51.377 1.00 3.51 H new ATOM 0 HA VAL A 12 -6.309 16.457 48.523 1.00 4.11 H new ATOM 0 HB VAL A 12 -7.880 15.060 49.649 1.00 1.21 H new ATOM 0 HG11 VAL A 12 -10.009 15.879 50.541 1.00 72.13 H new ATOM 0 HG12 VAL A 12 -8.603 16.423 51.487 1.00 72.13 H new ATOM 0 HG13 VAL A 12 -9.419 17.550 50.377 1.00 72.13 H new ATOM 0 HG21 VAL A 12 -9.830 15.447 48.161 1.00 34.50 H new ATOM 0 HG22 VAL A 12 -9.195 17.065 47.782 1.00 34.50 H new ATOM 0 HG23 VAL A 12 -8.277 15.616 47.309 1.00 34.50 H new ATOM 168 N GLU A 13 -6.239 18.903 48.125 1.00 21.31 N ATOM 169 CA GLU A 13 -6.339 20.237 47.632 1.00 23.44 C ATOM 170 C GLU A 13 -6.233 20.152 46.128 1.00 55.41 C ATOM 171 O GLU A 13 -5.233 19.658 45.597 1.00 42.34 O ATOM 172 CB GLU A 13 -5.201 21.078 48.208 1.00 14.51 C ATOM 173 CG GLU A 13 -5.301 22.557 47.905 1.00 32.22 C ATOM 174 CD GLU A 13 -4.092 23.316 48.375 1.00 21.24 C ATOM 175 OE1 GLU A 13 -4.055 23.750 49.554 1.00 50.53 O ATOM 176 OE2 GLU A 13 -3.148 23.483 47.574 1.00 22.40 O ATOM 0 H GLU A 13 -5.407 18.402 47.813 1.00 21.31 H new ATOM 0 HA GLU A 13 -7.279 20.706 47.922 1.00 23.44 H new ATOM 0 HB2 GLU A 13 -5.176 20.942 49.289 1.00 14.51 H new ATOM 0 HB3 GLU A 13 -4.255 20.703 47.818 1.00 14.51 H new ATOM 0 HG2 GLU A 13 -5.422 22.699 46.831 1.00 32.22 H new ATOM 0 HG3 GLU A 13 -6.192 22.965 48.383 1.00 32.22 H new ATOM 183 N THR A 14 -7.239 20.602 45.442 1.00 13.32 N ATOM 184 CA THR A 14 -7.267 20.477 44.018 1.00 12.21 C ATOM 185 C THR A 14 -7.186 21.843 43.340 1.00 30.02 C ATOM 186 O THR A 14 -8.166 22.591 43.285 1.00 45.03 O ATOM 187 CB THR A 14 -8.534 19.714 43.570 1.00 24.03 C ATOM 188 OG1 THR A 14 -8.639 18.497 44.349 1.00 5.40 O ATOM 189 CG2 THR A 14 -8.457 19.345 42.091 1.00 60.45 C ATOM 0 H THR A 14 -8.054 21.061 45.848 1.00 13.32 H new ATOM 0 HA THR A 14 -6.391 19.905 43.711 1.00 12.21 H new ATOM 0 HB THR A 14 -9.403 20.354 43.724 1.00 24.03 H new ATOM 0 HG1 THR A 14 -9.440 18.002 44.077 1.00 5.40 H new ATOM 0 HG21 THR A 14 -9.361 18.809 41.802 1.00 60.45 H new ATOM 0 HG22 THR A 14 -8.367 20.252 41.494 1.00 60.45 H new ATOM 0 HG23 THR A 14 -7.588 18.710 41.919 1.00 60.45 H new ATOM 197 N THR A 15 -6.001 22.184 42.911 1.00 13.12 N ATOM 198 CA THR A 15 -5.760 23.392 42.154 1.00 53.33 C ATOM 199 C THR A 15 -5.522 23.007 40.687 1.00 72.51 C ATOM 200 O THR A 15 -5.534 23.838 39.770 1.00 62.23 O ATOM 201 CB THR A 15 -4.552 24.151 42.745 1.00 74.15 C ATOM 202 OG1 THR A 15 -4.751 24.290 44.166 1.00 34.35 O ATOM 203 CG2 THR A 15 -4.396 25.540 42.129 1.00 31.24 C ATOM 0 H THR A 15 -5.163 21.627 43.077 1.00 13.12 H new ATOM 0 HA THR A 15 -6.622 24.057 42.209 1.00 53.33 H new ATOM 0 HB THR A 15 -3.648 23.583 42.524 1.00 74.15 H new ATOM 0 HG1 THR A 15 -3.991 24.769 44.557 1.00 34.35 H new ATOM 0 HG21 THR A 15 -3.535 26.040 42.572 1.00 31.24 H new ATOM 0 HG22 THR A 15 -4.247 25.446 41.053 1.00 31.24 H new ATOM 0 HG23 THR A 15 -5.295 26.126 42.321 1.00 31.24 H new ATOM 211 N SER A 16 -5.350 21.733 40.491 1.00 14.24 N ATOM 212 CA SER A 16 -5.182 21.161 39.190 1.00 5.22 C ATOM 213 C SER A 16 -6.563 20.949 38.580 1.00 72.20 C ATOM 214 O SER A 16 -7.224 19.943 38.843 1.00 4.13 O ATOM 215 CB SER A 16 -4.403 19.830 39.294 1.00 4.24 C ATOM 216 OG SER A 16 -4.214 19.212 38.021 1.00 74.52 O ATOM 0 H SER A 16 -5.322 21.049 41.247 1.00 14.24 H new ATOM 0 HA SER A 16 -4.605 21.828 38.550 1.00 5.22 H new ATOM 0 HB2 SER A 16 -3.432 20.015 39.753 1.00 4.24 H new ATOM 0 HB3 SER A 16 -4.941 19.147 39.951 1.00 4.24 H new ATOM 0 HG SER A 16 -3.716 18.375 38.134 1.00 74.52 H new ATOM 222 N VAL A 17 -7.030 21.932 37.849 1.00 24.30 N ATOM 223 CA VAL A 17 -8.337 21.890 37.232 1.00 2.24 C ATOM 224 C VAL A 17 -8.187 22.362 35.804 1.00 0.50 C ATOM 225 O VAL A 17 -7.558 23.398 35.557 1.00 45.11 O ATOM 226 CB VAL A 17 -9.367 22.822 37.971 1.00 65.43 C ATOM 227 CG1 VAL A 17 -10.743 22.761 37.311 1.00 61.32 C ATOM 228 CG2 VAL A 17 -9.480 22.469 39.455 1.00 50.24 C ATOM 0 H VAL A 17 -6.511 22.790 37.663 1.00 24.30 H new ATOM 0 HA VAL A 17 -8.718 20.870 37.285 1.00 2.24 H new ATOM 0 HB VAL A 17 -8.989 23.841 37.890 1.00 65.43 H new ATOM 0 HG11 VAL A 17 -11.432 23.416 37.845 1.00 61.32 H new ATOM 0 HG12 VAL A 17 -10.664 23.086 36.274 1.00 61.32 H new ATOM 0 HG13 VAL A 17 -11.117 21.738 37.343 1.00 61.32 H new ATOM 0 HG21 VAL A 17 -10.200 23.133 39.933 1.00 50.24 H new ATOM 0 HG22 VAL A 17 -9.814 21.437 39.559 1.00 50.24 H new ATOM 0 HG23 VAL A 17 -8.507 22.585 39.932 1.00 50.24 H new ATOM 238 N PHE A 18 -8.719 21.619 34.869 1.00 53.14 N ATOM 239 CA PHE A 18 -8.624 22.020 33.506 1.00 21.04 C ATOM 240 C PHE A 18 -9.977 22.029 32.838 1.00 22.11 C ATOM 241 O PHE A 18 -10.834 21.190 33.112 1.00 55.35 O ATOM 242 CB PHE A 18 -7.566 21.225 32.709 1.00 52.31 C ATOM 243 CG PHE A 18 -7.835 19.761 32.500 1.00 31.31 C ATOM 244 CD1 PHE A 18 -7.677 18.853 33.527 1.00 71.03 C ATOM 245 CD2 PHE A 18 -8.206 19.293 31.251 1.00 51.40 C ATOM 246 CE1 PHE A 18 -7.886 17.512 33.312 1.00 4.35 C ATOM 247 CE2 PHE A 18 -8.422 17.952 31.035 1.00 63.33 C ATOM 248 CZ PHE A 18 -8.260 17.061 32.065 1.00 24.04 C ATOM 0 H PHE A 18 -9.216 20.743 35.032 1.00 53.14 H new ATOM 0 HA PHE A 18 -8.262 23.048 33.508 1.00 21.04 H new ATOM 0 HB2 PHE A 18 -7.455 21.693 31.731 1.00 52.31 H new ATOM 0 HB3 PHE A 18 -6.609 21.325 33.221 1.00 52.31 H new ATOM 0 HD1 PHE A 18 -7.387 19.199 34.508 1.00 71.03 H new ATOM 0 HD2 PHE A 18 -8.327 19.990 30.435 1.00 51.40 H new ATOM 0 HE1 PHE A 18 -7.757 16.810 34.122 1.00 4.35 H new ATOM 0 HE2 PHE A 18 -8.718 17.602 30.057 1.00 63.33 H new ATOM 0 HZ PHE A 18 -8.425 16.007 31.899 1.00 24.04 H new ATOM 258 N ARG A 19 -10.142 22.971 31.963 1.00 70.21 N ATOM 259 CA ARG A 19 -11.373 23.222 31.237 1.00 13.42 C ATOM 260 C ARG A 19 -11.219 22.608 29.857 1.00 51.35 C ATOM 261 O ARG A 19 -11.632 23.189 28.845 1.00 20.23 O ATOM 262 CB ARG A 19 -11.534 24.734 31.095 1.00 42.30 C ATOM 263 CG ARG A 19 -11.369 25.505 32.398 1.00 15.43 C ATOM 264 CD ARG A 19 -11.448 26.991 32.155 1.00 74.14 C ATOM 265 NE ARG A 19 -11.054 27.770 33.330 1.00 41.32 N ATOM 266 CZ ARG A 19 -10.753 29.072 33.306 1.00 4.14 C ATOM 267 NH1 ARG A 19 -10.916 29.777 32.187 1.00 44.12 N ATOM 268 NH2 ARG A 19 -10.296 29.668 34.394 1.00 71.13 N ATOM 0 H ARG A 19 -9.396 23.621 31.716 1.00 70.21 H new ATOM 0 HA ARG A 19 -12.237 22.800 31.750 1.00 13.42 H new ATOM 0 HB2 ARG A 19 -10.802 25.100 30.374 1.00 42.30 H new ATOM 0 HB3 ARG A 19 -12.521 24.946 30.683 1.00 42.30 H new ATOM 0 HG2 ARG A 19 -12.144 25.206 33.103 1.00 15.43 H new ATOM 0 HG3 ARG A 19 -10.410 25.257 32.854 1.00 15.43 H new ATOM 0 HD2 ARG A 19 -10.804 27.254 31.316 1.00 74.14 H new ATOM 0 HD3 ARG A 19 -12.466 27.256 31.871 1.00 74.14 H new ATOM 0 HE ARG A 19 -11.006 27.287 34.227 1.00 41.32 H new ATOM 0 HH11 ARG A 19 -11.271 29.323 31.346 1.00 44.12 H new ATOM 0 HH12 ARG A 19 -10.685 30.770 32.172 1.00 44.12 H new ATOM 0 HH21 ARG A 19 -10.172 29.134 35.254 1.00 71.13 H new ATOM 0 HH22 ARG A 19 -10.067 30.662 34.373 1.00 71.13 H new ATOM 282 N ALA A 20 -10.629 21.405 29.842 1.00 14.12 N ATOM 283 CA ALA A 20 -10.260 20.666 28.624 1.00 43.20 C ATOM 284 C ALA A 20 -9.105 21.365 27.912 1.00 73.15 C ATOM 285 O ALA A 20 -8.814 21.086 26.753 1.00 11.45 O ATOM 286 CB ALA A 20 -11.458 20.446 27.687 1.00 3.50 C ATOM 0 H ALA A 20 -10.388 20.905 30.698 1.00 14.12 H new ATOM 0 HA ALA A 20 -9.927 19.673 28.926 1.00 43.20 H new ATOM 0 HB1 ALA A 20 -11.133 19.897 26.804 1.00 3.50 H new ATOM 0 HB2 ALA A 20 -12.227 19.875 28.207 1.00 3.50 H new ATOM 0 HB3 ALA A 20 -11.865 21.411 27.385 1.00 3.50 H new ATOM 292 N ASP A 21 -8.405 22.224 28.671 1.00 74.35 N ATOM 293 CA ASP A 21 -7.268 23.042 28.189 1.00 31.34 C ATOM 294 C ASP A 21 -6.248 22.209 27.444 1.00 10.32 C ATOM 295 O ASP A 21 -5.835 22.550 26.338 1.00 23.53 O ATOM 296 CB ASP A 21 -6.540 23.726 29.365 1.00 53.40 C ATOM 297 CG ASP A 21 -7.388 24.683 30.167 1.00 32.34 C ATOM 298 OD1 ASP A 21 -7.453 25.877 29.823 1.00 54.30 O ATOM 299 OD2 ASP A 21 -7.985 24.254 31.171 1.00 4.31 O ATOM 0 H ASP A 21 -8.614 22.376 29.658 1.00 74.35 H new ATOM 0 HA ASP A 21 -7.695 23.786 27.517 1.00 31.34 H new ATOM 0 HB2 ASP A 21 -6.157 22.955 30.034 1.00 53.40 H new ATOM 0 HB3 ASP A 21 -5.678 24.267 28.975 1.00 53.40 H new ATOM 304 N LEU A 22 -5.854 21.109 28.045 1.00 45.41 N ATOM 305 CA LEU A 22 -4.833 20.246 27.469 1.00 45.41 C ATOM 306 C LEU A 22 -5.430 18.921 27.015 1.00 61.13 C ATOM 307 O LEU A 22 -4.742 17.896 26.942 1.00 21.22 O ATOM 308 CB LEU A 22 -3.631 20.018 28.442 1.00 55.52 C ATOM 309 CG LEU A 22 -3.898 19.368 29.824 1.00 15.43 C ATOM 310 CD1 LEU A 22 -2.588 18.875 30.419 1.00 62.05 C ATOM 311 CD2 LEU A 22 -4.523 20.360 30.795 1.00 41.42 C ATOM 0 H LEU A 22 -6.224 20.785 28.938 1.00 45.41 H new ATOM 0 HA LEU A 22 -4.438 20.761 26.593 1.00 45.41 H new ATOM 0 HB2 LEU A 22 -2.900 19.399 27.923 1.00 55.52 H new ATOM 0 HB3 LEU A 22 -3.162 20.986 28.618 1.00 55.52 H new ATOM 0 HG LEU A 22 -4.589 18.539 29.671 1.00 15.43 H new ATOM 0 HD11 LEU A 22 -2.779 18.419 31.390 1.00 62.05 H new ATOM 0 HD12 LEU A 22 -2.141 18.137 29.753 1.00 62.05 H new ATOM 0 HD13 LEU A 22 -1.905 19.715 30.541 1.00 62.05 H new ATOM 0 HD21 LEU A 22 -4.697 19.871 31.753 1.00 41.42 H new ATOM 0 HD22 LEU A 22 -3.849 21.205 30.936 1.00 41.42 H new ATOM 0 HD23 LEU A 22 -5.471 20.715 30.392 1.00 41.42 H new ATOM 323 N LEU A 23 -6.694 18.949 26.679 1.00 23.10 N ATOM 324 CA LEU A 23 -7.383 17.766 26.208 1.00 75.42 C ATOM 325 C LEU A 23 -7.677 17.968 24.725 1.00 25.40 C ATOM 326 O LEU A 23 -8.635 18.658 24.356 1.00 54.11 O ATOM 327 CB LEU A 23 -8.675 17.535 27.042 1.00 74.15 C ATOM 328 CG LEU A 23 -9.388 16.153 26.949 1.00 13.33 C ATOM 329 CD1 LEU A 23 -10.470 16.056 28.010 1.00 53.51 C ATOM 330 CD2 LEU A 23 -10.013 15.910 25.579 1.00 61.14 C ATOM 0 H LEU A 23 -7.276 19.786 26.722 1.00 23.10 H new ATOM 0 HA LEU A 23 -6.772 16.872 26.331 1.00 75.42 H new ATOM 0 HB2 LEU A 23 -8.428 17.710 28.089 1.00 74.15 H new ATOM 0 HB3 LEU A 23 -9.396 18.299 26.753 1.00 74.15 H new ATOM 0 HG LEU A 23 -8.625 15.391 27.109 1.00 13.33 H new ATOM 0 HD11 LEU A 23 -10.964 15.087 27.938 1.00 53.51 H new ATOM 0 HD12 LEU A 23 -10.022 16.163 28.998 1.00 53.51 H new ATOM 0 HD13 LEU A 23 -11.202 16.849 27.856 1.00 53.51 H new ATOM 0 HD21 LEU A 23 -10.497 14.933 25.568 1.00 61.14 H new ATOM 0 HD22 LEU A 23 -10.753 16.684 25.374 1.00 61.14 H new ATOM 0 HD23 LEU A 23 -9.237 15.939 24.815 1.00 61.14 H new ATOM 342 N LYS A 24 -6.824 17.423 23.895 1.00 74.10 N ATOM 343 CA LYS A 24 -6.940 17.573 22.462 1.00 33.14 C ATOM 344 C LYS A 24 -6.882 16.229 21.729 1.00 45.44 C ATOM 345 O LYS A 24 -7.900 15.741 21.244 1.00 24.31 O ATOM 346 CB LYS A 24 -5.899 18.588 21.913 1.00 51.30 C ATOM 347 CG LYS A 24 -4.485 18.461 22.502 1.00 4.01 C ATOM 348 CD LYS A 24 -3.422 19.335 21.799 1.00 64.13 C ATOM 349 CE LYS A 24 -3.613 20.859 21.954 1.00 53.11 C ATOM 350 NZ LYS A 24 -4.776 21.411 21.214 1.00 64.25 N ATOM 0 H LYS A 24 -6.027 16.861 24.192 1.00 74.10 H new ATOM 0 HA LYS A 24 -7.929 17.985 22.262 1.00 33.14 H new ATOM 0 HB2 LYS A 24 -5.836 18.470 20.831 1.00 51.30 H new ATOM 0 HB3 LYS A 24 -6.265 19.597 22.103 1.00 51.30 H new ATOM 0 HG2 LYS A 24 -4.519 18.729 23.558 1.00 4.01 H new ATOM 0 HG3 LYS A 24 -4.174 17.418 22.448 1.00 4.01 H new ATOM 0 HD2 LYS A 24 -2.440 19.067 22.189 1.00 64.13 H new ATOM 0 HD3 LYS A 24 -3.421 19.092 20.736 1.00 64.13 H new ATOM 0 HE2 LYS A 24 -3.728 21.092 23.013 1.00 53.11 H new ATOM 0 HE3 LYS A 24 -2.709 21.363 21.613 1.00 53.11 H new ATOM 0 HZ1 LYS A 24 -4.497 22.291 20.734 1.00 64.25 H new ATOM 0 HZ2 LYS A 24 -5.098 20.719 20.508 1.00 64.25 H new ATOM 0 HZ3 LYS A 24 -5.549 21.611 21.881 1.00 64.25 H new ATOM 364 N GLU A 25 -5.717 15.618 21.683 1.00 71.15 N ATOM 365 CA GLU A 25 -5.534 14.371 20.974 1.00 53.04 C ATOM 366 C GLU A 25 -4.908 13.358 21.914 1.00 42.22 C ATOM 367 O GLU A 25 -3.680 13.285 22.052 1.00 33.30 O ATOM 368 CB GLU A 25 -4.651 14.579 19.729 1.00 2.34 C ATOM 369 CG GLU A 25 -5.213 15.574 18.711 1.00 32.54 C ATOM 370 CD GLU A 25 -4.251 15.867 17.585 1.00 43.34 C ATOM 371 OE1 GLU A 25 -4.258 15.137 16.553 1.00 51.41 O ATOM 372 OE2 GLU A 25 -3.470 16.834 17.697 1.00 0.31 O ATOM 0 H GLU A 25 -4.873 15.971 22.135 1.00 71.15 H new ATOM 0 HA GLU A 25 -6.501 14.000 20.634 1.00 53.04 H new ATOM 0 HB2 GLU A 25 -3.668 14.923 20.050 1.00 2.34 H new ATOM 0 HB3 GLU A 25 -4.507 13.617 19.237 1.00 2.34 H new ATOM 0 HG2 GLU A 25 -6.140 15.178 18.297 1.00 32.54 H new ATOM 0 HG3 GLU A 25 -5.463 16.505 19.220 1.00 32.54 H new ATOM 379 N MET A 26 -5.735 12.621 22.602 1.00 52.31 N ATOM 380 CA MET A 26 -5.246 11.673 23.570 1.00 24.22 C ATOM 381 C MET A 26 -5.081 10.315 22.957 1.00 14.52 C ATOM 382 O MET A 26 -5.967 9.826 22.247 1.00 2.54 O ATOM 383 CB MET A 26 -6.147 11.599 24.800 1.00 72.45 C ATOM 384 CG MET A 26 -6.169 12.873 25.626 1.00 34.14 C ATOM 385 SD MET A 26 -7.247 12.757 27.070 1.00 1.11 S ATOM 386 CE MET A 26 -8.824 12.473 26.278 1.00 22.32 C ATOM 0 H MET A 26 -6.750 12.657 22.512 1.00 52.31 H new ATOM 0 HA MET A 26 -4.268 12.026 23.898 1.00 24.22 H new ATOM 0 HB2 MET A 26 -7.163 11.368 24.480 1.00 72.45 H new ATOM 0 HB3 MET A 26 -5.816 10.774 25.431 1.00 72.45 H new ATOM 0 HG2 MET A 26 -5.156 13.105 25.953 1.00 34.14 H new ATOM 0 HG3 MET A 26 -6.499 13.701 24.998 1.00 34.14 H new ATOM 0 HE1 MET A 26 -9.629 12.727 26.968 1.00 22.32 H new ATOM 0 HE2 MET A 26 -8.900 13.095 25.386 1.00 22.32 H new ATOM 0 HE3 MET A 26 -8.906 11.423 25.996 1.00 22.32 H new ATOM 396 N GLU A 27 -3.955 9.719 23.216 1.00 24.03 N ATOM 397 CA GLU A 27 -3.652 8.406 22.714 1.00 4.41 C ATOM 398 C GLU A 27 -4.358 7.362 23.558 1.00 10.11 C ATOM 399 O GLU A 27 -3.962 7.095 24.707 1.00 54.24 O ATOM 400 CB GLU A 27 -2.144 8.171 22.726 1.00 65.20 C ATOM 401 CG GLU A 27 -1.358 9.157 21.878 1.00 45.03 C ATOM 402 CD GLU A 27 -1.679 9.054 20.405 1.00 62.05 C ATOM 403 OE1 GLU A 27 -2.698 9.604 19.958 1.00 43.51 O ATOM 404 OE2 GLU A 27 -0.889 8.445 19.657 1.00 32.23 O ATOM 0 H GLU A 27 -3.215 10.130 23.785 1.00 24.03 H new ATOM 0 HA GLU A 27 -4.003 8.326 21.685 1.00 4.41 H new ATOM 0 HB2 GLU A 27 -1.786 8.226 23.754 1.00 65.20 H new ATOM 0 HB3 GLU A 27 -1.941 7.160 22.372 1.00 65.20 H new ATOM 0 HG2 GLU A 27 -1.568 10.170 22.220 1.00 45.03 H new ATOM 0 HG3 GLU A 27 -0.292 8.985 22.025 1.00 45.03 H new ATOM 411 N SER A 28 -5.415 6.823 23.021 1.00 10.34 N ATOM 412 CA SER A 28 -6.177 5.815 23.675 1.00 71.10 C ATOM 413 C SER A 28 -5.501 4.451 23.534 1.00 22.30 C ATOM 414 O SER A 28 -5.721 3.732 22.550 1.00 11.51 O ATOM 415 CB SER A 28 -7.599 5.832 23.117 1.00 41.55 C ATOM 416 OG SER A 28 -7.567 6.037 21.703 1.00 41.40 O ATOM 0 H SER A 28 -5.772 7.081 22.101 1.00 10.34 H new ATOM 0 HA SER A 28 -6.232 6.016 24.745 1.00 71.10 H new ATOM 0 HB2 SER A 28 -8.099 4.891 23.345 1.00 41.55 H new ATOM 0 HB3 SER A 28 -8.176 6.624 23.595 1.00 41.55 H new ATOM 0 HG SER A 28 -8.482 6.045 21.353 1.00 41.40 H new ATOM 422 N SER A 29 -4.627 4.156 24.495 1.00 73.40 N ATOM 423 CA SER A 29 -3.841 2.937 24.537 1.00 70.53 C ATOM 424 C SER A 29 -2.785 2.949 23.426 1.00 71.33 C ATOM 425 O SER A 29 -3.074 2.668 22.262 1.00 14.54 O ATOM 426 CB SER A 29 -4.734 1.665 24.483 1.00 50.24 C ATOM 427 OG SER A 29 -3.972 0.472 24.639 1.00 53.20 O ATOM 0 H SER A 29 -4.446 4.778 25.283 1.00 73.40 H new ATOM 0 HA SER A 29 -3.322 2.901 25.495 1.00 70.53 H new ATOM 0 HB2 SER A 29 -5.489 1.718 25.267 1.00 50.24 H new ATOM 0 HB3 SER A 29 -5.265 1.635 23.531 1.00 50.24 H new ATOM 0 HG SER A 29 -4.569 -0.305 24.601 1.00 53.20 H new ATOM 433 N THR A 30 -1.595 3.349 23.774 1.00 12.33 N ATOM 434 CA THR A 30 -0.508 3.364 22.854 1.00 25.33 C ATOM 435 C THR A 30 0.600 2.464 23.380 1.00 24.42 C ATOM 436 O THR A 30 0.999 2.560 24.553 1.00 13.23 O ATOM 437 CB THR A 30 0.011 4.819 22.558 1.00 61.53 C ATOM 438 OG1 THR A 30 1.147 4.795 21.669 1.00 43.21 O ATOM 439 CG2 THR A 30 0.376 5.575 23.835 1.00 61.25 C ATOM 0 H THR A 30 -1.357 3.675 24.711 1.00 12.33 H new ATOM 0 HA THR A 30 -0.859 2.979 21.897 1.00 25.33 H new ATOM 0 HB THR A 30 -0.812 5.347 22.076 1.00 61.53 H new ATOM 0 HG1 THR A 30 1.449 5.712 21.500 1.00 43.21 H new ATOM 0 HG21 THR A 30 0.729 6.574 23.578 1.00 61.25 H new ATOM 0 HG22 THR A 30 -0.503 5.654 24.475 1.00 61.25 H new ATOM 0 HG23 THR A 30 1.163 5.037 24.364 1.00 61.25 H new ATOM 447 N GLY A 31 1.039 1.562 22.552 1.00 1.34 N ATOM 448 CA GLY A 31 2.068 0.665 22.930 1.00 65.14 C ATOM 449 C GLY A 31 2.846 0.212 21.741 1.00 20.54 C ATOM 450 O GLY A 31 3.092 0.994 20.816 1.00 72.34 O ATOM 0 H GLY A 31 0.690 1.435 21.602 1.00 1.34 H new ATOM 0 HA2 GLY A 31 2.735 1.151 23.642 1.00 65.14 H new ATOM 0 HA3 GLY A 31 1.635 -0.198 23.436 1.00 65.14 H new ATOM 454 N THR A 32 3.212 -1.024 21.733 1.00 44.42 N ATOM 455 CA THR A 32 3.984 -1.571 20.662 1.00 51.34 C ATOM 456 C THR A 32 3.126 -2.547 19.857 1.00 75.20 C ATOM 457 O THR A 32 2.175 -3.134 20.386 1.00 34.53 O ATOM 458 CB THR A 32 5.283 -2.262 21.200 1.00 62.23 C ATOM 459 OG1 THR A 32 6.104 -2.740 20.123 1.00 0.15 O ATOM 460 CG2 THR A 32 4.964 -3.417 22.149 1.00 73.22 C ATOM 0 H THR A 32 2.985 -1.690 22.471 1.00 44.42 H new ATOM 0 HA THR A 32 4.300 -0.762 20.004 1.00 51.34 H new ATOM 0 HB THR A 32 5.831 -1.501 21.755 1.00 62.23 H new ATOM 0 HG1 THR A 32 6.908 -3.165 20.488 1.00 0.15 H new ATOM 0 HG21 THR A 32 5.893 -3.868 22.498 1.00 73.22 H new ATOM 0 HG22 THR A 32 4.399 -3.041 23.002 1.00 73.22 H new ATOM 0 HG23 THR A 32 4.372 -4.167 21.624 1.00 73.22 H new ATOM 468 N ALA A 33 3.432 -2.686 18.591 1.00 22.34 N ATOM 469 CA ALA A 33 2.734 -3.611 17.732 1.00 14.05 C ATOM 470 C ALA A 33 3.310 -5.009 17.936 1.00 5.14 C ATOM 471 O ALA A 33 4.491 -5.240 17.637 1.00 25.21 O ATOM 472 CB ALA A 33 2.872 -3.182 16.274 1.00 13.22 C ATOM 0 H ALA A 33 4.173 -2.161 18.126 1.00 22.34 H new ATOM 0 HA ALA A 33 1.674 -3.618 17.984 1.00 14.05 H new ATOM 0 HB1 ALA A 33 2.341 -3.888 15.635 1.00 13.22 H new ATOM 0 HB2 ALA A 33 2.447 -2.186 16.146 1.00 13.22 H new ATOM 0 HB3 ALA A 33 3.926 -3.165 15.998 1.00 13.22 H new ATOM 478 N PRO A 34 2.524 -5.952 18.475 1.00 62.14 N ATOM 479 CA PRO A 34 2.998 -7.295 18.717 1.00 41.54 C ATOM 480 C PRO A 34 2.987 -8.132 17.454 1.00 43.51 C ATOM 481 O PRO A 34 1.930 -8.391 16.871 1.00 72.25 O ATOM 482 CB PRO A 34 2.030 -7.872 19.754 1.00 53.24 C ATOM 483 CG PRO A 34 0.882 -6.904 19.860 1.00 4.20 C ATOM 484 CD PRO A 34 1.117 -5.793 18.866 1.00 63.14 C ATOM 0 HA PRO A 34 4.032 -7.296 19.063 1.00 41.54 H new ATOM 0 HB2 PRO A 34 1.678 -8.858 19.449 1.00 53.24 H new ATOM 0 HB3 PRO A 34 2.523 -7.994 20.718 1.00 53.24 H new ATOM 0 HG2 PRO A 34 -0.062 -7.408 19.653 1.00 4.20 H new ATOM 0 HG3 PRO A 34 0.814 -6.503 20.871 1.00 4.20 H new ATOM 0 HD2 PRO A 34 0.452 -5.880 18.006 1.00 63.14 H new ATOM 0 HD3 PRO A 34 0.935 -4.815 19.311 1.00 63.14 H new ATOM 492 N ALA A 35 4.157 -8.510 17.024 1.00 73.03 N ATOM 493 CA ALA A 35 4.310 -9.321 15.855 1.00 2.15 C ATOM 494 C ALA A 35 4.452 -10.766 16.259 1.00 3.22 C ATOM 495 O ALA A 35 5.448 -11.157 16.883 1.00 24.53 O ATOM 496 CB ALA A 35 5.514 -8.876 15.060 1.00 61.44 C ATOM 0 H ALA A 35 5.035 -8.261 17.479 1.00 73.03 H new ATOM 0 HA ALA A 35 3.426 -9.211 15.226 1.00 2.15 H new ATOM 0 HB1 ALA A 35 5.617 -9.503 14.174 1.00 61.44 H new ATOM 0 HB2 ALA A 35 5.386 -7.837 14.757 1.00 61.44 H new ATOM 0 HB3 ALA A 35 6.410 -8.967 15.675 1.00 61.44 H new ATOM 502 N SER A 36 3.468 -11.536 15.941 1.00 34.03 N ATOM 503 CA SER A 36 3.440 -12.923 16.269 1.00 64.53 C ATOM 504 C SER A 36 4.337 -13.686 15.306 1.00 44.32 C ATOM 505 O SER A 36 3.991 -13.877 14.127 1.00 1.43 O ATOM 506 CB SER A 36 2.006 -13.432 16.165 1.00 64.24 C ATOM 507 OG SER A 36 1.107 -12.509 16.786 1.00 64.44 O ATOM 0 H SER A 36 2.643 -11.214 15.435 1.00 34.03 H new ATOM 0 HA SER A 36 3.801 -13.073 17.286 1.00 64.53 H new ATOM 0 HB2 SER A 36 1.735 -13.566 15.118 1.00 64.24 H new ATOM 0 HB3 SER A 36 1.924 -14.408 16.643 1.00 64.24 H new ATOM 0 HG SER A 36 0.790 -11.863 16.121 1.00 64.44 H new ATOM 513 N THR A 37 5.489 -14.090 15.769 1.00 72.21 N ATOM 514 CA THR A 37 6.374 -14.818 14.929 1.00 4.14 C ATOM 515 C THR A 37 6.014 -16.297 14.994 1.00 45.20 C ATOM 516 O THR A 37 6.509 -17.049 15.833 1.00 74.34 O ATOM 517 CB THR A 37 7.852 -14.569 15.289 1.00 2.52 C ATOM 518 OG1 THR A 37 8.064 -13.148 15.376 1.00 13.54 O ATOM 519 CG2 THR A 37 8.774 -15.127 14.209 1.00 64.31 C ATOM 0 H THR A 37 5.827 -13.925 16.717 1.00 72.21 H new ATOM 0 HA THR A 37 6.256 -14.467 13.904 1.00 4.14 H new ATOM 0 HB THR A 37 8.075 -15.063 16.235 1.00 2.52 H new ATOM 0 HG1 THR A 37 9.000 -12.970 15.606 1.00 13.54 H new ATOM 0 HG21 THR A 37 9.812 -14.940 14.484 1.00 64.31 H new ATOM 0 HG22 THR A 37 8.612 -16.201 14.112 1.00 64.31 H new ATOM 0 HG23 THR A 37 8.557 -14.640 13.258 1.00 64.31 H new ATOM 527 N GLY A 38 5.035 -16.639 14.197 1.00 32.03 N ATOM 528 CA GLY A 38 4.575 -17.987 14.066 1.00 12.13 C ATOM 529 C GLY A 38 4.381 -18.277 12.620 1.00 75.51 C ATOM 530 O GLY A 38 3.405 -18.890 12.215 1.00 60.40 O ATOM 0 H GLY A 38 4.530 -15.973 13.613 1.00 32.03 H new ATOM 0 HA2 GLY A 38 5.298 -18.679 14.498 1.00 12.13 H new ATOM 0 HA3 GLY A 38 3.640 -18.123 14.609 1.00 12.13 H new ATOM 534 N ALA A 39 5.354 -17.845 11.842 1.00 43.12 N ATOM 535 CA ALA A 39 5.330 -17.918 10.390 1.00 3.35 C ATOM 536 C ALA A 39 5.306 -19.348 9.899 1.00 23.24 C ATOM 537 O ALA A 39 4.918 -19.612 8.771 1.00 13.33 O ATOM 538 CB ALA A 39 6.520 -17.191 9.814 1.00 0.23 C ATOM 0 H ALA A 39 6.206 -17.422 12.210 1.00 43.12 H new ATOM 0 HA ALA A 39 4.413 -17.437 10.050 1.00 3.35 H new ATOM 0 HB1 ALA A 39 6.492 -17.252 8.726 1.00 0.23 H new ATOM 0 HB2 ALA A 39 6.490 -16.145 10.120 1.00 0.23 H new ATOM 0 HB3 ALA A 39 7.439 -17.650 10.180 1.00 0.23 H new ATOM 544 N GLU A 40 5.731 -20.260 10.748 1.00 31.11 N ATOM 545 CA GLU A 40 5.720 -21.686 10.445 1.00 12.24 C ATOM 546 C GLU A 40 4.283 -22.152 10.218 1.00 14.43 C ATOM 547 O GLU A 40 4.008 -22.992 9.353 1.00 11.05 O ATOM 548 CB GLU A 40 6.300 -22.465 11.612 1.00 5.14 C ATOM 549 CG GLU A 40 7.657 -21.989 12.072 1.00 51.02 C ATOM 550 CD GLU A 40 8.724 -22.095 11.016 1.00 72.32 C ATOM 551 OE1 GLU A 40 9.388 -23.134 10.933 1.00 42.43 O ATOM 552 OE2 GLU A 40 8.931 -21.120 10.266 1.00 2.45 O ATOM 0 H GLU A 40 6.097 -20.038 11.674 1.00 31.11 H new ATOM 0 HA GLU A 40 6.316 -21.859 9.549 1.00 12.24 H new ATOM 0 HB2 GLU A 40 5.606 -22.408 12.451 1.00 5.14 H new ATOM 0 HB3 GLU A 40 6.374 -23.515 11.330 1.00 5.14 H new ATOM 0 HG2 GLU A 40 7.578 -20.951 12.394 1.00 51.02 H new ATOM 0 HG3 GLU A 40 7.961 -22.570 12.943 1.00 51.02 H new ATOM 559 N ASN A 41 3.382 -21.581 10.988 1.00 72.23 N ATOM 560 CA ASN A 41 1.962 -21.916 10.935 1.00 3.30 C ATOM 561 C ASN A 41 1.313 -21.356 9.686 1.00 15.44 C ATOM 562 O ASN A 41 0.352 -21.919 9.180 1.00 74.11 O ATOM 563 CB ASN A 41 1.198 -21.396 12.178 1.00 0.00 C ATOM 564 CG ASN A 41 1.635 -22.020 13.497 1.00 53.01 C ATOM 565 OD1 ASN A 41 2.797 -22.378 13.689 1.00 51.43 O ATOM 566 ND2 ASN A 41 0.711 -22.164 14.416 1.00 5.35 N ATOM 0 H ASN A 41 3.609 -20.864 11.677 1.00 72.23 H new ATOM 0 HA ASN A 41 1.903 -23.004 10.918 1.00 3.30 H new ATOM 0 HB2 ASN A 41 1.327 -20.316 12.242 1.00 0.00 H new ATOM 0 HB3 ASN A 41 0.133 -21.582 12.038 1.00 0.00 H new ATOM 0 HD21 ASN A 41 0.948 -22.581 15.316 1.00 5.35 H new ATOM 0 HD22 ASN A 41 -0.244 -21.859 14.231 1.00 5.35 H new ATOM 573 N LEU A 42 1.844 -20.261 9.185 1.00 3.24 N ATOM 574 CA LEU A 42 1.298 -19.606 8.020 1.00 20.13 C ATOM 575 C LEU A 42 1.929 -20.166 6.744 1.00 22.14 C ATOM 576 O LEU A 42 3.107 -19.949 6.498 1.00 43.53 O ATOM 577 CB LEU A 42 1.536 -18.075 8.075 1.00 42.33 C ATOM 578 CG LEU A 42 0.711 -17.226 9.082 1.00 72.01 C ATOM 579 CD1 LEU A 42 -0.779 -17.411 8.881 1.00 45.15 C ATOM 580 CD2 LEU A 42 1.100 -17.488 10.528 1.00 34.01 C ATOM 0 H LEU A 42 2.667 -19.801 9.575 1.00 3.24 H new ATOM 0 HA LEU A 42 0.225 -19.797 8.011 1.00 20.13 H new ATOM 0 HB2 LEU A 42 2.592 -17.912 8.293 1.00 42.33 H new ATOM 0 HB3 LEU A 42 1.351 -17.676 7.078 1.00 42.33 H new ATOM 0 HG LEU A 42 0.955 -16.185 8.871 1.00 72.01 H new ATOM 0 HD11 LEU A 42 -1.322 -16.802 9.603 1.00 45.15 H new ATOM 0 HD12 LEU A 42 -1.051 -17.105 7.871 1.00 45.15 H new ATOM 0 HD13 LEU A 42 -1.038 -18.460 9.024 1.00 45.15 H new ATOM 0 HD21 LEU A 42 0.492 -16.868 11.186 1.00 34.01 H new ATOM 0 HD22 LEU A 42 0.935 -18.539 10.764 1.00 34.01 H new ATOM 0 HD23 LEU A 42 2.153 -17.245 10.671 1.00 34.01 H new ATOM 592 N PRO A 43 1.162 -20.898 5.905 1.00 75.14 N ATOM 593 CA PRO A 43 1.672 -21.447 4.640 1.00 14.35 C ATOM 594 C PRO A 43 1.642 -20.404 3.521 1.00 41.21 C ATOM 595 O PRO A 43 2.004 -20.679 2.367 1.00 15.14 O ATOM 596 CB PRO A 43 0.697 -22.592 4.316 1.00 62.31 C ATOM 597 CG PRO A 43 -0.283 -22.633 5.449 1.00 3.12 C ATOM 598 CD PRO A 43 -0.232 -21.292 6.114 1.00 22.34 C ATOM 0 HA PRO A 43 2.710 -21.769 4.725 1.00 14.35 H new ATOM 0 HB2 PRO A 43 0.190 -22.416 3.367 1.00 62.31 H new ATOM 0 HB3 PRO A 43 1.226 -23.540 4.223 1.00 62.31 H new ATOM 0 HG2 PRO A 43 -1.288 -22.845 5.084 1.00 3.12 H new ATOM 0 HG3 PRO A 43 -0.026 -23.424 6.154 1.00 3.12 H new ATOM 0 HD2 PRO A 43 -0.927 -20.586 5.661 1.00 22.34 H new ATOM 0 HD3 PRO A 43 -0.484 -21.352 7.173 1.00 22.34 H new ATOM 606 N ALA A 44 1.177 -19.228 3.864 1.00 33.20 N ATOM 607 CA ALA A 44 1.123 -18.111 2.966 1.00 54.14 C ATOM 608 C ALA A 44 1.402 -16.854 3.758 1.00 65.53 C ATOM 609 O ALA A 44 0.605 -16.463 4.612 1.00 32.42 O ATOM 610 CB ALA A 44 -0.241 -18.028 2.287 1.00 44.51 C ATOM 0 H ALA A 44 0.819 -19.021 4.796 1.00 33.20 H new ATOM 0 HA ALA A 44 1.870 -18.230 2.182 1.00 54.14 H new ATOM 0 HB1 ALA A 44 -0.259 -17.174 1.610 1.00 44.51 H new ATOM 0 HB2 ALA A 44 -0.422 -18.942 1.722 1.00 44.51 H new ATOM 0 HB3 ALA A 44 -1.017 -17.909 3.043 1.00 44.51 H new ATOM 616 N GLY A 45 2.537 -16.266 3.521 1.00 24.15 N ATOM 617 CA GLY A 45 2.913 -15.061 4.208 1.00 31.20 C ATOM 618 C GLY A 45 3.190 -13.962 3.226 1.00 70.45 C ATOM 619 O GLY A 45 4.223 -13.303 3.274 1.00 10.51 O ATOM 0 H GLY A 45 3.227 -16.604 2.850 1.00 24.15 H new ATOM 0 HA2 GLY A 45 2.116 -14.758 4.887 1.00 31.20 H new ATOM 0 HA3 GLY A 45 3.798 -15.244 4.818 1.00 31.20 H new ATOM 623 N SER A 46 2.294 -13.797 2.300 1.00 40.40 N ATOM 624 CA SER A 46 2.413 -12.785 1.302 1.00 64.12 C ATOM 625 C SER A 46 1.096 -12.045 1.179 1.00 0.20 C ATOM 626 O SER A 46 0.042 -12.568 1.550 1.00 74.53 O ATOM 627 CB SER A 46 2.825 -13.405 -0.027 1.00 20.30 C ATOM 628 OG SER A 46 4.026 -14.168 0.132 1.00 42.43 O ATOM 0 H SER A 46 1.453 -14.368 2.218 1.00 40.40 H new ATOM 0 HA SER A 46 3.186 -12.073 1.590 1.00 64.12 H new ATOM 0 HB2 SER A 46 2.026 -14.045 -0.401 1.00 20.30 H new ATOM 0 HB3 SER A 46 2.979 -12.622 -0.769 1.00 20.30 H new ATOM 0 HG SER A 46 4.279 -14.562 -0.729 1.00 42.43 H new ATOM 634 N ALA A 47 1.168 -10.854 0.662 1.00 52.24 N ATOM 635 CA ALA A 47 0.039 -9.979 0.520 1.00 55.43 C ATOM 636 C ALA A 47 0.421 -8.928 -0.482 1.00 51.02 C ATOM 637 O ALA A 47 1.596 -8.821 -0.832 1.00 31.40 O ATOM 638 CB ALA A 47 -0.269 -9.323 1.858 1.00 1.11 C ATOM 0 H ALA A 47 2.039 -10.452 0.317 1.00 52.24 H new ATOM 0 HA ALA A 47 -0.844 -10.528 0.193 1.00 55.43 H new ATOM 0 HB1 ALA A 47 -1.126 -8.659 1.749 1.00 1.11 H new ATOM 0 HB2 ALA A 47 -0.497 -10.092 2.596 1.00 1.11 H new ATOM 0 HB3 ALA A 47 0.596 -8.748 2.189 1.00 1.11 H new ATOM 644 N LEU A 48 -0.523 -8.178 -0.953 1.00 60.31 N ATOM 645 CA LEU A 48 -0.234 -7.130 -1.885 1.00 52.33 C ATOM 646 C LEU A 48 -0.971 -5.884 -1.474 1.00 53.41 C ATOM 647 O LEU A 48 -1.962 -5.953 -0.722 1.00 51.54 O ATOM 648 CB LEU A 48 -0.598 -7.508 -3.344 1.00 44.21 C ATOM 649 CG LEU A 48 -2.079 -7.439 -3.775 1.00 72.00 C ATOM 650 CD1 LEU A 48 -2.180 -7.715 -5.246 1.00 1.23 C ATOM 651 CD2 LEU A 48 -2.945 -8.428 -3.031 1.00 54.33 C ATOM 0 H LEU A 48 -1.508 -8.271 -0.707 1.00 60.31 H new ATOM 0 HA LEU A 48 0.842 -6.958 -1.865 1.00 52.33 H new ATOM 0 HB2 LEU A 48 -0.029 -6.856 -4.007 1.00 44.21 H new ATOM 0 HB3 LEU A 48 -0.249 -8.525 -3.520 1.00 44.21 H new ATOM 0 HG LEU A 48 -2.440 -6.438 -3.538 1.00 72.00 H new ATOM 0 HD11 LEU A 48 -3.224 -7.667 -5.554 1.00 1.23 H new ATOM 0 HD12 LEU A 48 -1.605 -6.970 -5.796 1.00 1.23 H new ATOM 0 HD13 LEU A 48 -1.784 -8.708 -5.458 1.00 1.23 H new ATOM 0 HD21 LEU A 48 -3.976 -8.337 -3.372 1.00 54.33 H new ATOM 0 HD22 LEU A 48 -2.587 -9.440 -3.221 1.00 54.33 H new ATOM 0 HD23 LEU A 48 -2.897 -8.221 -1.962 1.00 54.33 H new ATOM 663 N LEU A 49 -0.498 -4.776 -1.925 1.00 34.30 N ATOM 664 CA LEU A 49 -1.150 -3.544 -1.698 1.00 62.12 C ATOM 665 C LEU A 49 -1.623 -3.010 -3.027 1.00 44.24 C ATOM 666 O LEU A 49 -0.921 -3.123 -4.041 1.00 44.03 O ATOM 667 CB LEU A 49 -0.259 -2.546 -0.893 1.00 45.13 C ATOM 668 CG LEU A 49 1.108 -2.103 -1.477 1.00 2.40 C ATOM 669 CD1 LEU A 49 0.953 -1.043 -2.562 1.00 42.44 C ATOM 670 CD2 LEU A 49 2.023 -1.600 -0.369 1.00 5.14 C ATOM 0 H LEU A 49 0.363 -4.703 -2.468 1.00 34.30 H new ATOM 0 HA LEU A 49 -2.021 -3.691 -1.060 1.00 62.12 H new ATOM 0 HB2 LEU A 49 -0.849 -1.645 -0.722 1.00 45.13 H new ATOM 0 HB3 LEU A 49 -0.068 -2.992 0.083 1.00 45.13 H new ATOM 0 HG LEU A 49 1.560 -2.979 -1.942 1.00 2.40 H new ATOM 0 HD11 LEU A 49 1.936 -0.764 -2.941 1.00 42.44 H new ATOM 0 HD12 LEU A 49 0.350 -1.442 -3.377 1.00 42.44 H new ATOM 0 HD13 LEU A 49 0.462 -0.164 -2.144 1.00 42.44 H new ATOM 0 HD21 LEU A 49 2.978 -1.293 -0.797 1.00 5.14 H new ATOM 0 HD22 LEU A 49 1.558 -0.749 0.128 1.00 5.14 H new ATOM 0 HD23 LEU A 49 2.189 -2.397 0.356 1.00 5.14 H new ATOM 682 N VAL A 50 -2.807 -2.522 -3.052 1.00 2.33 N ATOM 683 CA VAL A 50 -3.385 -2.001 -4.250 1.00 1.24 C ATOM 684 C VAL A 50 -3.751 -0.570 -4.000 1.00 53.52 C ATOM 685 O VAL A 50 -4.465 -0.270 -3.042 1.00 21.22 O ATOM 686 CB VAL A 50 -4.670 -2.791 -4.660 1.00 23.53 C ATOM 687 CG1 VAL A 50 -5.261 -2.248 -5.953 1.00 22.23 C ATOM 688 CG2 VAL A 50 -4.386 -4.284 -4.791 1.00 74.31 C ATOM 0 H VAL A 50 -3.416 -2.469 -2.235 1.00 2.33 H new ATOM 0 HA VAL A 50 -2.663 -2.094 -5.061 1.00 1.24 H new ATOM 0 HB VAL A 50 -5.402 -2.653 -3.865 1.00 23.53 H new ATOM 0 HG11 VAL A 50 -6.153 -2.817 -6.212 1.00 22.23 H new ATOM 0 HG12 VAL A 50 -5.526 -1.199 -5.820 1.00 22.23 H new ATOM 0 HG13 VAL A 50 -4.528 -2.338 -6.754 1.00 22.23 H new ATOM 0 HG21 VAL A 50 -5.300 -4.804 -5.077 1.00 74.31 H new ATOM 0 HG22 VAL A 50 -3.624 -4.444 -5.553 1.00 74.31 H new ATOM 0 HG23 VAL A 50 -4.031 -4.672 -3.836 1.00 74.31 H new ATOM 698 N VAL A 51 -3.273 0.319 -4.810 1.00 61.15 N ATOM 699 CA VAL A 51 -3.644 1.688 -4.629 1.00 21.20 C ATOM 700 C VAL A 51 -4.835 1.945 -5.486 1.00 4.32 C ATOM 701 O VAL A 51 -4.777 1.839 -6.714 1.00 10.01 O ATOM 702 CB VAL A 51 -2.518 2.687 -4.960 1.00 30.52 C ATOM 703 CG1 VAL A 51 -2.986 4.100 -4.629 1.00 12.31 C ATOM 704 CG2 VAL A 51 -1.257 2.347 -4.173 1.00 14.32 C ATOM 0 H VAL A 51 -2.639 0.131 -5.587 1.00 61.15 H new ATOM 0 HA VAL A 51 -3.863 1.845 -3.573 1.00 21.20 H new ATOM 0 HB VAL A 51 -2.282 2.625 -6.022 1.00 30.52 H new ATOM 0 HG11 VAL A 51 -2.192 4.810 -4.862 1.00 12.31 H new ATOM 0 HG12 VAL A 51 -3.871 4.338 -5.220 1.00 12.31 H new ATOM 0 HG13 VAL A 51 -3.230 4.163 -3.569 1.00 12.31 H new ATOM 0 HG21 VAL A 51 -0.471 3.062 -4.418 1.00 14.32 H new ATOM 0 HG22 VAL A 51 -1.471 2.395 -3.105 1.00 14.32 H new ATOM 0 HG23 VAL A 51 -0.926 1.341 -4.432 1.00 14.32 H new ATOM 714 N LYS A 52 -5.915 2.242 -4.831 1.00 3.45 N ATOM 715 CA LYS A 52 -7.170 2.414 -5.481 1.00 21.31 C ATOM 716 C LYS A 52 -7.309 3.821 -5.995 1.00 65.34 C ATOM 717 O LYS A 52 -7.839 4.047 -7.083 1.00 14.15 O ATOM 718 CB LYS A 52 -8.293 2.027 -4.513 1.00 60.11 C ATOM 719 CG LYS A 52 -9.710 2.223 -5.041 1.00 61.32 C ATOM 720 CD LYS A 52 -10.738 1.436 -4.222 1.00 20.04 C ATOM 721 CE LYS A 52 -10.700 1.757 -2.726 1.00 41.25 C ATOM 722 NZ LYS A 52 -11.698 0.964 -1.964 1.00 14.23 N ATOM 0 H LYS A 52 -5.946 2.372 -3.820 1.00 3.45 H new ATOM 0 HA LYS A 52 -7.235 1.760 -6.350 1.00 21.31 H new ATOM 0 HB2 LYS A 52 -8.168 0.980 -4.238 1.00 60.11 H new ATOM 0 HB3 LYS A 52 -8.180 2.612 -3.600 1.00 60.11 H new ATOM 0 HG2 LYS A 52 -9.963 3.283 -5.019 1.00 61.32 H new ATOM 0 HG3 LYS A 52 -9.756 1.906 -6.083 1.00 61.32 H new ATOM 0 HD2 LYS A 52 -11.736 1.648 -4.606 1.00 20.04 H new ATOM 0 HD3 LYS A 52 -10.562 0.369 -4.361 1.00 20.04 H new ATOM 0 HE2 LYS A 52 -9.702 1.555 -2.337 1.00 41.25 H new ATOM 0 HE3 LYS A 52 -10.891 2.820 -2.578 1.00 41.25 H new ATOM 0 HZ1 LYS A 52 -11.287 0.669 -1.055 1.00 14.23 H new ATOM 0 HZ2 LYS A 52 -12.543 1.545 -1.789 1.00 14.23 H new ATOM 0 HZ3 LYS A 52 -11.965 0.122 -2.513 1.00 14.23 H new ATOM 736 N ARG A 53 -6.795 4.758 -5.244 1.00 64.34 N ATOM 737 CA ARG A 53 -6.901 6.142 -5.638 1.00 10.31 C ATOM 738 C ARG A 53 -5.797 6.961 -5.025 1.00 21.22 C ATOM 739 O ARG A 53 -5.642 6.981 -3.801 1.00 34.15 O ATOM 740 CB ARG A 53 -8.283 6.708 -5.253 1.00 53.33 C ATOM 741 CG ARG A 53 -8.563 8.125 -5.762 1.00 75.34 C ATOM 742 CD ARG A 53 -8.376 8.214 -7.276 1.00 11.35 C ATOM 743 NE ARG A 53 -9.138 7.187 -7.988 1.00 23.44 N ATOM 744 CZ ARG A 53 -8.851 6.715 -9.213 1.00 4.54 C ATOM 745 NH1 ARG A 53 -7.824 7.210 -9.906 1.00 2.15 N ATOM 746 NH2 ARG A 53 -9.595 5.748 -9.726 1.00 32.33 N ATOM 0 H ARG A 53 -6.304 4.594 -4.365 1.00 64.34 H new ATOM 0 HA ARG A 53 -6.797 6.198 -6.722 1.00 10.31 H new ATOM 0 HB2 ARG A 53 -9.053 6.040 -5.638 1.00 53.33 H new ATOM 0 HB3 ARG A 53 -8.372 6.704 -4.167 1.00 53.33 H new ATOM 0 HG2 ARG A 53 -9.581 8.414 -5.501 1.00 75.34 H new ATOM 0 HG3 ARG A 53 -7.895 8.831 -5.268 1.00 75.34 H new ATOM 0 HD2 ARG A 53 -8.687 9.200 -7.622 1.00 11.35 H new ATOM 0 HD3 ARG A 53 -7.318 8.111 -7.516 1.00 11.35 H new ATOM 0 HE ARG A 53 -9.954 6.798 -7.516 1.00 23.44 H new ATOM 0 HH11 ARG A 53 -7.250 7.952 -9.507 1.00 2.15 H new ATOM 0 HH12 ARG A 53 -7.613 6.846 -10.835 1.00 2.15 H new ATOM 0 HH21 ARG A 53 -10.377 5.369 -9.192 1.00 32.33 H new ATOM 0 HH22 ARG A 53 -9.386 5.382 -10.655 1.00 32.33 H new ATOM 760 N GLY A 54 -5.016 7.591 -5.877 1.00 55.05 N ATOM 761 CA GLY A 54 -3.975 8.475 -5.449 1.00 31.32 C ATOM 762 C GLY A 54 -2.975 8.715 -6.557 1.00 10.31 C ATOM 763 O GLY A 54 -2.687 7.814 -7.286 1.00 40.04 O ATOM 0 H GLY A 54 -5.093 7.498 -6.890 1.00 55.05 H new ATOM 0 HA2 GLY A 54 -4.407 9.424 -5.133 1.00 31.32 H new ATOM 0 HA3 GLY A 54 -3.467 8.051 -4.582 1.00 31.32 H new ATOM 767 N PRO A 55 -2.434 9.936 -6.721 1.00 31.24 N ATOM 768 CA PRO A 55 -1.414 10.219 -7.751 1.00 54.21 C ATOM 769 C PRO A 55 -0.088 9.525 -7.436 1.00 44.31 C ATOM 770 O PRO A 55 0.840 9.518 -8.249 1.00 44.41 O ATOM 771 CB PRO A 55 -1.247 11.739 -7.698 1.00 32.32 C ATOM 772 CG PRO A 55 -2.406 12.228 -6.914 1.00 23.22 C ATOM 773 CD PRO A 55 -2.758 11.133 -5.967 1.00 21.33 C ATOM 0 HA PRO A 55 -1.713 9.854 -8.734 1.00 54.21 H new ATOM 0 HB2 PRO A 55 -0.305 12.016 -7.224 1.00 32.32 H new ATOM 0 HB3 PRO A 55 -1.238 12.170 -8.699 1.00 32.32 H new ATOM 0 HG2 PRO A 55 -2.155 13.142 -6.376 1.00 23.22 H new ATOM 0 HG3 PRO A 55 -3.246 12.463 -7.567 1.00 23.22 H new ATOM 0 HD2 PRO A 55 -2.183 11.197 -5.044 1.00 21.33 H new ATOM 0 HD3 PRO A 55 -3.811 11.162 -5.689 1.00 21.33 H new ATOM 781 N ASN A 56 -0.009 8.980 -6.224 1.00 44.02 N ATOM 782 CA ASN A 56 1.119 8.207 -5.774 1.00 32.00 C ATOM 783 C ASN A 56 1.317 6.994 -6.693 1.00 0.31 C ATOM 784 O ASN A 56 2.389 6.816 -7.299 1.00 24.14 O ATOM 785 CB ASN A 56 0.932 7.761 -4.279 1.00 5.15 C ATOM 786 CG ASN A 56 -0.393 7.109 -3.942 1.00 53.15 C ATOM 787 OD1 ASN A 56 -0.554 5.925 -4.065 1.00 71.31 O ATOM 788 ND2 ASN A 56 -1.333 7.894 -3.459 1.00 43.33 N ATOM 0 H ASN A 56 -0.746 9.072 -5.524 1.00 44.02 H new ATOM 0 HA ASN A 56 2.013 8.828 -5.820 1.00 32.00 H new ATOM 0 HB2 ASN A 56 1.732 7.065 -4.025 1.00 5.15 H new ATOM 0 HB3 ASN A 56 1.057 8.636 -3.641 1.00 5.15 H new ATOM 0 HD21 ASN A 56 -2.231 7.501 -3.176 1.00 43.33 H new ATOM 0 HD22 ASN A 56 -1.164 8.896 -3.368 1.00 43.33 H new ATOM 795 N ALA A 57 0.258 6.219 -6.860 1.00 24.12 N ATOM 796 CA ALA A 57 0.268 5.043 -7.670 1.00 32.24 C ATOM 797 C ALA A 57 -1.160 4.616 -7.960 1.00 51.12 C ATOM 798 O ALA A 57 -2.103 5.187 -7.437 1.00 13.32 O ATOM 799 CB ALA A 57 1.034 3.914 -6.981 1.00 64.24 C ATOM 0 H ALA A 57 -0.644 6.406 -6.421 1.00 24.12 H new ATOM 0 HA ALA A 57 0.775 5.266 -8.609 1.00 32.24 H new ATOM 0 HB1 ALA A 57 1.028 3.029 -7.617 1.00 64.24 H new ATOM 0 HB2 ALA A 57 2.063 4.227 -6.805 1.00 64.24 H new ATOM 0 HB3 ALA A 57 0.558 3.680 -6.029 1.00 64.24 H new ATOM 805 N GLY A 58 -1.301 3.628 -8.775 1.00 62.25 N ATOM 806 CA GLY A 58 -2.587 3.107 -9.130 1.00 15.44 C ATOM 807 C GLY A 58 -2.401 1.764 -9.738 1.00 52.40 C ATOM 808 O GLY A 58 -2.835 1.501 -10.864 1.00 2.24 O ATOM 0 H GLY A 58 -0.519 3.149 -9.223 1.00 62.25 H new ATOM 0 HA2 GLY A 58 -3.224 3.039 -8.248 1.00 15.44 H new ATOM 0 HA3 GLY A 58 -3.085 3.775 -9.833 1.00 15.44 H new ATOM 812 N ALA A 59 -1.726 0.920 -9.006 1.00 25.32 N ATOM 813 CA ALA A 59 -1.370 -0.380 -9.455 1.00 30.03 C ATOM 814 C ALA A 59 -1.301 -1.285 -8.261 1.00 64.44 C ATOM 815 O ALA A 59 -1.513 -0.828 -7.116 1.00 32.41 O ATOM 816 CB ALA A 59 -0.019 -0.335 -10.164 1.00 44.44 C ATOM 0 H ALA A 59 -1.405 1.131 -8.061 1.00 25.32 H new ATOM 0 HA ALA A 59 -2.112 -0.752 -10.161 1.00 30.03 H new ATOM 0 HB1 ALA A 59 0.246 -1.336 -10.505 1.00 44.44 H new ATOM 0 HB2 ALA A 59 -0.080 0.336 -11.021 1.00 44.44 H new ATOM 0 HB3 ALA A 59 0.743 0.027 -9.473 1.00 44.44 H new ATOM 822 N ARG A 60 -1.017 -2.522 -8.506 1.00 15.12 N ATOM 823 CA ARG A 60 -0.897 -3.504 -7.476 1.00 23.31 C ATOM 824 C ARG A 60 0.592 -3.754 -7.227 1.00 21.11 C ATOM 825 O ARG A 60 1.395 -3.770 -8.175 1.00 42.34 O ATOM 826 CB ARG A 60 -1.638 -4.794 -7.908 1.00 63.34 C ATOM 827 CG ARG A 60 -0.964 -5.583 -9.041 1.00 52.11 C ATOM 828 CD ARG A 60 -1.867 -6.661 -9.662 1.00 23.02 C ATOM 829 NE ARG A 60 -2.421 -7.628 -8.691 1.00 15.41 N ATOM 830 CZ ARG A 60 -2.256 -8.970 -8.732 1.00 63.41 C ATOM 831 NH1 ARG A 60 -1.409 -9.527 -9.598 1.00 0.53 N ATOM 832 NH2 ARG A 60 -2.942 -9.746 -7.890 1.00 23.02 N ATOM 0 H ARG A 60 -0.859 -2.887 -9.445 1.00 15.12 H new ATOM 0 HA ARG A 60 -1.353 -3.162 -6.547 1.00 23.31 H new ATOM 0 HB2 ARG A 60 -1.736 -5.446 -7.040 1.00 63.34 H new ATOM 0 HB3 ARG A 60 -2.647 -4.527 -8.222 1.00 63.34 H new ATOM 0 HG2 ARG A 60 -0.653 -4.888 -9.821 1.00 52.11 H new ATOM 0 HG3 ARG A 60 -0.060 -6.056 -8.656 1.00 52.11 H new ATOM 0 HD2 ARG A 60 -2.692 -6.172 -10.180 1.00 23.02 H new ATOM 0 HD3 ARG A 60 -1.297 -7.206 -10.414 1.00 23.02 H new ATOM 0 HE ARG A 60 -2.976 -7.250 -7.923 1.00 15.41 H new ATOM 0 HH11 ARG A 60 -0.876 -8.940 -10.240 1.00 0.53 H new ATOM 0 HH12 ARG A 60 -1.294 -10.540 -9.619 1.00 0.53 H new ATOM 0 HH21 ARG A 60 -3.587 -9.326 -7.220 1.00 23.02 H new ATOM 0 HH22 ARG A 60 -2.822 -10.759 -7.917 1.00 23.02 H new ATOM 846 N PHE A 61 0.964 -3.861 -5.980 1.00 72.12 N ATOM 847 CA PHE A 61 2.348 -4.112 -5.606 1.00 31.11 C ATOM 848 C PHE A 61 2.390 -5.225 -4.584 1.00 23.22 C ATOM 849 O PHE A 61 1.663 -5.186 -3.591 1.00 21.43 O ATOM 850 CB PHE A 61 3.022 -2.846 -5.041 1.00 13.32 C ATOM 851 CG PHE A 61 3.112 -1.693 -6.012 1.00 64.12 C ATOM 852 CD1 PHE A 61 4.178 -1.593 -6.891 1.00 0.14 C ATOM 853 CD2 PHE A 61 2.131 -0.710 -6.042 1.00 72.31 C ATOM 854 CE1 PHE A 61 4.265 -0.537 -7.779 1.00 71.21 C ATOM 855 CE2 PHE A 61 2.212 0.344 -6.926 1.00 13.34 C ATOM 856 CZ PHE A 61 3.281 0.433 -7.798 1.00 63.40 C ATOM 0 H PHE A 61 0.325 -3.778 -5.189 1.00 72.12 H new ATOM 0 HA PHE A 61 2.900 -4.405 -6.499 1.00 31.11 H new ATOM 0 HB2 PHE A 61 2.470 -2.519 -4.160 1.00 13.32 H new ATOM 0 HB3 PHE A 61 4.028 -3.103 -4.709 1.00 13.32 H new ATOM 0 HD1 PHE A 61 4.950 -2.348 -6.882 1.00 0.14 H new ATOM 0 HD2 PHE A 61 1.293 -0.773 -5.363 1.00 72.31 H new ATOM 0 HE1 PHE A 61 5.102 -0.470 -8.458 1.00 71.21 H new ATOM 0 HE2 PHE A 61 1.441 1.100 -6.938 1.00 13.34 H new ATOM 0 HZ PHE A 61 3.347 1.258 -8.492 1.00 63.40 H new ATOM 866 N LEU A 62 3.221 -6.199 -4.824 1.00 63.12 N ATOM 867 CA LEU A 62 3.312 -7.371 -3.983 1.00 44.23 C ATOM 868 C LEU A 62 4.312 -7.155 -2.858 1.00 52.30 C ATOM 869 O LEU A 62 5.471 -6.767 -3.103 1.00 22.14 O ATOM 870 CB LEU A 62 3.748 -8.581 -4.827 1.00 63.44 C ATOM 871 CG LEU A 62 3.870 -9.924 -4.095 1.00 63.32 C ATOM 872 CD1 LEU A 62 2.512 -10.419 -3.617 1.00 75.22 C ATOM 873 CD2 LEU A 62 4.538 -10.957 -4.986 1.00 31.21 C ATOM 0 H LEU A 62 3.864 -6.207 -5.616 1.00 63.12 H new ATOM 0 HA LEU A 62 2.331 -7.557 -3.546 1.00 44.23 H new ATOM 0 HB2 LEU A 62 3.035 -8.702 -5.643 1.00 63.44 H new ATOM 0 HB3 LEU A 62 4.713 -8.351 -5.279 1.00 63.44 H new ATOM 0 HG LEU A 62 4.494 -9.771 -3.215 1.00 63.32 H new ATOM 0 HD11 LEU A 62 2.633 -11.372 -3.102 1.00 75.22 H new ATOM 0 HD12 LEU A 62 2.079 -9.689 -2.933 1.00 75.22 H new ATOM 0 HD13 LEU A 62 1.850 -10.550 -4.473 1.00 75.22 H new ATOM 0 HD21 LEU A 62 4.616 -11.903 -4.451 1.00 31.21 H new ATOM 0 HD22 LEU A 62 3.943 -11.099 -5.888 1.00 31.21 H new ATOM 0 HD23 LEU A 62 5.535 -10.611 -5.260 1.00 31.21 H new ATOM 885 N LEU A 63 3.879 -7.410 -1.639 1.00 32.31 N ATOM 886 CA LEU A 63 4.750 -7.327 -0.494 1.00 23.31 C ATOM 887 C LEU A 63 5.605 -8.565 -0.461 1.00 31.32 C ATOM 888 O LEU A 63 5.102 -9.687 -0.325 1.00 52.22 O ATOM 889 CB LEU A 63 3.979 -7.177 0.843 1.00 24.31 C ATOM 890 CG LEU A 63 3.328 -5.812 1.165 1.00 43.42 C ATOM 891 CD1 LEU A 63 4.357 -4.701 1.189 1.00 63.21 C ATOM 892 CD2 LEU A 63 2.201 -5.479 0.211 1.00 2.21 C ATOM 0 H LEU A 63 2.920 -7.678 -1.420 1.00 32.31 H new ATOM 0 HA LEU A 63 5.361 -6.430 -0.597 1.00 23.31 H new ATOM 0 HB2 LEU A 63 3.193 -7.932 0.860 1.00 24.31 H new ATOM 0 HB3 LEU A 63 4.668 -7.416 1.653 1.00 24.31 H new ATOM 0 HG LEU A 63 2.897 -5.898 2.162 1.00 43.42 H new ATOM 0 HD11 LEU A 63 3.866 -3.755 1.418 1.00 63.21 H new ATOM 0 HD12 LEU A 63 5.106 -4.915 1.951 1.00 63.21 H new ATOM 0 HD13 LEU A 63 4.841 -4.632 0.215 1.00 63.21 H new ATOM 0 HD21 LEU A 63 1.774 -4.512 0.476 1.00 2.21 H new ATOM 0 HD22 LEU A 63 2.587 -5.439 -0.808 1.00 2.21 H new ATOM 0 HD23 LEU A 63 1.430 -6.246 0.277 1.00 2.21 H new ATOM 904 N ASP A 64 6.869 -8.360 -0.621 1.00 11.45 N ATOM 905 CA ASP A 64 7.838 -9.436 -0.674 1.00 34.01 C ATOM 906 C ASP A 64 9.100 -9.002 0.009 1.00 12.12 C ATOM 907 O ASP A 64 9.593 -9.671 0.900 1.00 65.43 O ATOM 908 CB ASP A 64 8.124 -9.808 -2.136 1.00 64.24 C ATOM 909 CG ASP A 64 9.286 -10.762 -2.313 1.00 1.11 C ATOM 910 OD1 ASP A 64 9.078 -11.995 -2.313 1.00 72.34 O ATOM 911 OD2 ASP A 64 10.424 -10.289 -2.517 1.00 72.51 O ATOM 0 H ASP A 64 7.278 -7.431 -0.722 1.00 11.45 H new ATOM 0 HA ASP A 64 7.439 -10.313 -0.163 1.00 34.01 H new ATOM 0 HB2 ASP A 64 7.230 -10.257 -2.567 1.00 64.24 H new ATOM 0 HB3 ASP A 64 8.326 -8.897 -2.699 1.00 64.24 H new ATOM 916 N GLN A 65 9.609 -7.870 -0.415 1.00 53.03 N ATOM 917 CA GLN A 65 10.796 -7.294 0.169 1.00 21.41 C ATOM 918 C GLN A 65 10.455 -6.806 1.586 1.00 14.23 C ATOM 919 O GLN A 65 9.568 -5.958 1.731 1.00 10.43 O ATOM 920 CB GLN A 65 11.254 -6.130 -0.691 1.00 1.43 C ATOM 921 CG GLN A 65 12.559 -5.498 -0.267 1.00 72.13 C ATOM 922 CD GLN A 65 12.861 -4.289 -1.098 1.00 54.35 C ATOM 923 OE1 GLN A 65 13.496 -4.373 -2.143 1.00 22.42 O ATOM 924 NE2 GLN A 65 12.403 -3.166 -0.655 1.00 50.22 N ATOM 0 H GLN A 65 9.210 -7.321 -1.177 1.00 53.03 H new ATOM 0 HA GLN A 65 11.596 -8.032 0.222 1.00 21.41 H new ATOM 0 HB2 GLN A 65 11.352 -6.475 -1.720 1.00 1.43 H new ATOM 0 HB3 GLN A 65 10.478 -5.365 -0.684 1.00 1.43 H new ATOM 0 HG2 GLN A 65 12.507 -5.218 0.785 1.00 72.13 H new ATOM 0 HG3 GLN A 65 13.367 -6.223 -0.364 1.00 72.13 H new ATOM 0 HE21 GLN A 65 11.879 -3.138 0.220 1.00 50.22 H new ATOM 0 HE22 GLN A 65 12.565 -2.306 -1.180 1.00 50.22 H new ATOM 933 N PRO A 66 11.169 -7.332 2.633 1.00 11.30 N ATOM 934 CA PRO A 66 10.887 -7.070 4.063 1.00 45.22 C ATOM 935 C PRO A 66 10.552 -5.617 4.371 1.00 21.01 C ATOM 936 O PRO A 66 9.526 -5.322 5.002 1.00 55.40 O ATOM 937 CB PRO A 66 12.190 -7.481 4.779 1.00 21.44 C ATOM 938 CG PRO A 66 13.149 -7.868 3.698 1.00 22.30 C ATOM 939 CD PRO A 66 12.321 -8.222 2.502 1.00 61.13 C ATOM 0 HA PRO A 66 10.005 -7.623 4.387 1.00 45.22 H new ATOM 0 HB2 PRO A 66 12.585 -6.658 5.374 1.00 21.44 H new ATOM 0 HB3 PRO A 66 12.015 -8.313 5.461 1.00 21.44 H new ATOM 0 HG2 PRO A 66 13.829 -7.047 3.470 1.00 22.30 H new ATOM 0 HG3 PRO A 66 13.763 -8.713 4.009 1.00 22.30 H new ATOM 0 HD2 PRO A 66 12.861 -8.051 1.571 1.00 61.13 H new ATOM 0 HD3 PRO A 66 12.025 -9.271 2.511 1.00 61.13 H new ATOM 947 N THR A 67 11.392 -4.727 3.924 1.00 54.25 N ATOM 948 CA THR A 67 11.174 -3.345 4.135 1.00 53.54 C ATOM 949 C THR A 67 10.651 -2.699 2.849 1.00 43.42 C ATOM 950 O THR A 67 11.420 -2.453 1.910 1.00 25.02 O ATOM 951 CB THR A 67 12.484 -2.669 4.560 1.00 22.43 C ATOM 952 OG1 THR A 67 13.080 -3.417 5.633 1.00 13.41 O ATOM 953 CG2 THR A 67 12.233 -1.248 5.018 1.00 52.11 C ATOM 0 H THR A 67 12.242 -4.950 3.406 1.00 54.25 H new ATOM 0 HA THR A 67 10.434 -3.218 4.925 1.00 53.54 H new ATOM 0 HB THR A 67 13.156 -2.644 3.702 1.00 22.43 H new ATOM 0 HG1 THR A 67 13.918 -2.988 5.905 1.00 13.41 H new ATOM 0 HG21 THR A 67 13.176 -0.789 5.314 1.00 52.11 H new ATOM 0 HG22 THR A 67 11.791 -0.675 4.202 1.00 52.11 H new ATOM 0 HG23 THR A 67 11.550 -1.255 5.868 1.00 52.11 H new ATOM 961 N THR A 68 9.364 -2.496 2.780 1.00 62.12 N ATOM 962 CA THR A 68 8.762 -1.819 1.666 1.00 25.40 C ATOM 963 C THR A 68 8.545 -0.350 2.081 1.00 72.21 C ATOM 964 O THR A 68 7.784 -0.056 2.989 1.00 2.12 O ATOM 965 CB THR A 68 7.429 -2.507 1.288 1.00 41.11 C ATOM 966 OG1 THR A 68 7.683 -3.892 0.958 1.00 33.45 O ATOM 967 CG2 THR A 68 6.757 -1.817 0.104 1.00 53.11 C ATOM 0 H THR A 68 8.703 -2.796 3.496 1.00 62.12 H new ATOM 0 HA THR A 68 9.403 -1.859 0.786 1.00 25.40 H new ATOM 0 HB THR A 68 6.757 -2.439 2.143 1.00 41.11 H new ATOM 0 HG1 THR A 68 8.376 -4.248 1.552 1.00 33.45 H new ATOM 0 HG21 THR A 68 5.824 -2.328 -0.133 1.00 53.11 H new ATOM 0 HG22 THR A 68 6.548 -0.778 0.359 1.00 53.11 H new ATOM 0 HG23 THR A 68 7.419 -1.852 -0.761 1.00 53.11 H new ATOM 975 N THR A 69 9.235 0.546 1.447 1.00 10.32 N ATOM 976 CA THR A 69 9.247 1.922 1.868 1.00 2.43 C ATOM 977 C THR A 69 8.415 2.837 0.951 1.00 53.45 C ATOM 978 O THR A 69 8.502 2.756 -0.297 1.00 15.00 O ATOM 979 CB THR A 69 10.702 2.401 1.900 1.00 51.33 C ATOM 980 OG1 THR A 69 11.489 1.365 2.515 1.00 45.40 O ATOM 981 CG2 THR A 69 10.838 3.681 2.717 1.00 24.41 C ATOM 0 H THR A 69 9.806 0.350 0.625 1.00 10.32 H new ATOM 0 HA THR A 69 8.790 1.978 2.856 1.00 2.43 H new ATOM 0 HB THR A 69 11.040 2.609 0.885 1.00 51.33 H new ATOM 0 HG1 THR A 69 12.428 1.643 2.548 1.00 45.40 H new ATOM 0 HG21 THR A 69 11.880 3.999 2.724 1.00 24.41 H new ATOM 0 HG22 THR A 69 10.222 4.463 2.273 1.00 24.41 H new ATOM 0 HG23 THR A 69 10.508 3.497 3.740 1.00 24.41 H new ATOM 989 N ALA A 70 7.608 3.686 1.577 1.00 12.25 N ATOM 990 CA ALA A 70 6.828 4.692 0.892 1.00 40.21 C ATOM 991 C ALA A 70 7.430 6.055 1.196 1.00 64.11 C ATOM 992 O ALA A 70 7.470 6.479 2.374 1.00 41.43 O ATOM 993 CB ALA A 70 5.382 4.648 1.362 1.00 45.43 C ATOM 0 H ALA A 70 7.480 3.689 2.589 1.00 12.25 H new ATOM 0 HA ALA A 70 6.845 4.505 -0.182 1.00 40.21 H new ATOM 0 HB1 ALA A 70 4.806 5.411 0.838 1.00 45.43 H new ATOM 0 HB2 ALA A 70 4.960 3.665 1.150 1.00 45.43 H new ATOM 0 HB3 ALA A 70 5.342 4.836 2.435 1.00 45.43 H new ATOM 999 N GLY A 71 7.904 6.735 0.174 1.00 15.41 N ATOM 1000 CA GLY A 71 8.546 8.004 0.386 1.00 62.03 C ATOM 1001 C GLY A 71 8.545 8.826 -0.864 1.00 62.11 C ATOM 1002 O GLY A 71 8.076 8.365 -1.897 1.00 1.35 O ATOM 0 H GLY A 71 7.856 6.431 -0.799 1.00 15.41 H new ATOM 0 HA2 GLY A 71 8.033 8.546 1.181 1.00 62.03 H new ATOM 0 HA3 GLY A 71 9.572 7.845 0.719 1.00 62.03 H new ATOM 1006 N ARG A 72 9.110 10.009 -0.791 1.00 3.33 N ATOM 1007 CA ARG A 72 9.124 10.952 -1.915 1.00 1.33 C ATOM 1008 C ARG A 72 10.390 10.726 -2.785 1.00 14.32 C ATOM 1009 O ARG A 72 10.706 11.501 -3.692 1.00 43.10 O ATOM 1010 CB ARG A 72 9.107 12.389 -1.361 1.00 21.53 C ATOM 1011 CG ARG A 72 8.866 13.483 -2.399 1.00 22.02 C ATOM 1012 CD ARG A 72 9.889 14.594 -2.253 1.00 34.20 C ATOM 1013 NE ARG A 72 11.252 14.089 -2.487 1.00 3.21 N ATOM 1014 CZ ARG A 72 12.357 14.513 -1.869 1.00 41.40 C ATOM 1015 NH1 ARG A 72 12.294 15.513 -0.997 1.00 41.13 N ATOM 1016 NH2 ARG A 72 13.529 13.951 -2.150 1.00 21.12 N ATOM 0 H ARG A 72 9.577 10.357 0.046 1.00 3.33 H new ATOM 0 HA ARG A 72 8.245 10.792 -2.540 1.00 1.33 H new ATOM 0 HB2 ARG A 72 8.332 12.458 -0.597 1.00 21.53 H new ATOM 0 HB3 ARG A 72 10.059 12.582 -0.867 1.00 21.53 H new ATOM 0 HG2 ARG A 72 8.922 13.059 -3.402 1.00 22.02 H new ATOM 0 HG3 ARG A 72 7.861 13.889 -2.281 1.00 22.02 H new ATOM 0 HD2 ARG A 72 9.667 15.393 -2.960 1.00 34.20 H new ATOM 0 HD3 ARG A 72 9.823 15.025 -1.254 1.00 34.20 H new ATOM 0 HE ARG A 72 11.362 13.351 -3.182 1.00 3.21 H new ATOM 0 HH11 ARG A 72 11.399 15.960 -0.797 1.00 41.13 H new ATOM 0 HH12 ARG A 72 13.140 15.834 -0.527 1.00 41.13 H new ATOM 0 HH21 ARG A 72 13.582 13.198 -2.836 1.00 21.12 H new ATOM 0 HH22 ARG A 72 14.375 14.273 -1.679 1.00 21.12 H new ATOM 1030 N HIS A 73 11.102 9.679 -2.498 1.00 65.22 N ATOM 1031 CA HIS A 73 12.305 9.346 -3.242 1.00 72.30 C ATOM 1032 C HIS A 73 11.925 8.475 -4.419 1.00 55.40 C ATOM 1033 O HIS A 73 10.972 7.720 -4.323 1.00 15.31 O ATOM 1034 CB HIS A 73 13.308 8.578 -2.359 1.00 61.14 C ATOM 1035 CG HIS A 73 13.840 9.343 -1.187 1.00 41.23 C ATOM 1036 ND1 HIS A 73 15.101 9.890 -1.136 1.00 15.54 N ATOM 1037 CD2 HIS A 73 13.268 9.615 0.010 1.00 53.32 C ATOM 1038 CE1 HIS A 73 15.257 10.460 0.057 1.00 44.50 C ATOM 1039 NE2 HIS A 73 14.168 10.322 0.797 1.00 32.11 N ATOM 0 H HIS A 73 10.877 9.026 -1.747 1.00 65.22 H new ATOM 0 HA HIS A 73 12.774 10.271 -3.578 1.00 72.30 H new ATOM 0 HB2 HIS A 73 12.826 7.672 -1.993 1.00 61.14 H new ATOM 0 HB3 HIS A 73 14.148 8.264 -2.979 1.00 61.14 H new ATOM 0 HD1 HIS A 73 15.796 9.864 -1.882 1.00 15.54 H new ATOM 0 HD2 HIS A 73 12.270 9.328 0.306 1.00 53.32 H new ATOM 0 HE1 HIS A 73 16.154 10.968 0.379 1.00 44.50 H new ATOM 1047 N PRO A 74 12.628 8.587 -5.565 1.00 23.34 N ATOM 1048 CA PRO A 74 12.400 7.684 -6.704 1.00 34.42 C ATOM 1049 C PRO A 74 12.831 6.267 -6.327 1.00 50.13 C ATOM 1050 O PRO A 74 12.281 5.262 -6.799 1.00 72.10 O ATOM 1051 CB PRO A 74 13.301 8.249 -7.811 1.00 61.25 C ATOM 1052 CG PRO A 74 14.325 9.067 -7.100 1.00 52.35 C ATOM 1053 CD PRO A 74 13.658 9.604 -5.863 1.00 13.30 C ATOM 0 HA PRO A 74 11.355 7.628 -7.010 1.00 34.42 H new ATOM 0 HB2 PRO A 74 13.766 7.449 -8.387 1.00 61.25 H new ATOM 0 HB3 PRO A 74 12.729 8.856 -8.513 1.00 61.25 H new ATOM 0 HG2 PRO A 74 15.194 8.462 -6.841 1.00 52.35 H new ATOM 0 HG3 PRO A 74 14.680 9.880 -7.733 1.00 52.35 H new ATOM 0 HD2 PRO A 74 14.365 9.714 -5.040 1.00 13.30 H new ATOM 0 HD3 PRO A 74 13.216 10.585 -6.038 1.00 13.30 H new ATOM 1061 N GLU A 75 13.795 6.212 -5.430 1.00 41.32 N ATOM 1062 CA GLU A 75 14.303 4.990 -4.908 1.00 14.31 C ATOM 1063 C GLU A 75 13.521 4.614 -3.669 1.00 12.10 C ATOM 1064 O GLU A 75 13.999 4.714 -2.534 1.00 24.15 O ATOM 1065 CB GLU A 75 15.791 5.090 -4.617 1.00 73.35 C ATOM 1066 CG GLU A 75 16.631 5.374 -5.845 1.00 43.54 C ATOM 1067 CD GLU A 75 18.085 5.469 -5.518 1.00 74.31 C ATOM 1068 OE1 GLU A 75 18.776 4.427 -5.491 1.00 10.35 O ATOM 1069 OE2 GLU A 75 18.571 6.586 -5.266 1.00 44.40 O ATOM 0 H GLU A 75 14.247 7.041 -5.045 1.00 41.32 H new ATOM 0 HA GLU A 75 14.181 4.205 -5.655 1.00 14.31 H new ATOM 0 HB2 GLU A 75 15.957 5.879 -3.883 1.00 73.35 H new ATOM 0 HB3 GLU A 75 16.128 4.157 -4.164 1.00 73.35 H new ATOM 0 HG2 GLU A 75 16.476 4.585 -6.581 1.00 43.54 H new ATOM 0 HG3 GLU A 75 16.301 6.306 -6.303 1.00 43.54 H new ATOM 1076 N SER A 76 12.288 4.339 -3.899 1.00 42.04 N ATOM 1077 CA SER A 76 11.387 3.866 -2.917 1.00 34.22 C ATOM 1078 C SER A 76 10.882 2.533 -3.420 1.00 71.45 C ATOM 1079 O SER A 76 11.384 2.033 -4.450 1.00 4.54 O ATOM 1080 CB SER A 76 10.248 4.873 -2.761 1.00 35.24 C ATOM 1081 OG SER A 76 9.637 5.142 -4.017 1.00 1.45 O ATOM 0 H SER A 76 11.862 4.443 -4.820 1.00 42.04 H new ATOM 0 HA SER A 76 11.854 3.748 -1.939 1.00 34.22 H new ATOM 0 HB2 SER A 76 9.505 4.483 -2.066 1.00 35.24 H new ATOM 0 HB3 SER A 76 10.631 5.799 -2.332 1.00 35.24 H new ATOM 0 HG SER A 76 8.665 5.055 -3.933 1.00 1.45 H new ATOM 1087 N ASP A 77 9.952 1.933 -2.740 1.00 3.14 N ATOM 1088 CA ASP A 77 9.422 0.680 -3.219 1.00 4.44 C ATOM 1089 C ASP A 77 8.119 0.932 -3.892 1.00 52.24 C ATOM 1090 O ASP A 77 7.831 0.376 -4.943 1.00 10.20 O ATOM 1091 CB ASP A 77 9.319 -0.349 -2.115 1.00 75.15 C ATOM 1092 CG ASP A 77 10.674 -0.637 -1.537 1.00 4.20 C ATOM 1093 OD1 ASP A 77 11.525 -1.205 -2.241 1.00 33.13 O ATOM 1094 OD2 ASP A 77 10.931 -0.258 -0.379 1.00 74.32 O ATOM 0 H ASP A 77 9.547 2.277 -1.869 1.00 3.14 H new ATOM 0 HA ASP A 77 10.111 0.252 -3.948 1.00 4.44 H new ATOM 0 HB2 ASP A 77 8.653 0.014 -1.332 1.00 75.15 H new ATOM 0 HB3 ASP A 77 8.881 -1.268 -2.506 1.00 75.15 H new ATOM 1099 N ILE A 78 7.333 1.790 -3.305 1.00 33.44 N ATOM 1100 CA ILE A 78 6.151 2.253 -3.956 1.00 40.43 C ATOM 1101 C ILE A 78 6.336 3.722 -4.209 1.00 71.22 C ATOM 1102 O ILE A 78 7.070 4.400 -3.463 1.00 5.33 O ATOM 1103 CB ILE A 78 4.835 2.020 -3.160 1.00 64.33 C ATOM 1104 CG1 ILE A 78 4.827 2.801 -1.840 1.00 22.22 C ATOM 1105 CG2 ILE A 78 4.615 0.529 -2.911 1.00 71.43 C ATOM 1106 CD1 ILE A 78 3.467 2.859 -1.182 1.00 64.04 C ATOM 0 H ILE A 78 7.494 2.180 -2.376 1.00 33.44 H new ATOM 0 HA ILE A 78 6.030 1.676 -4.873 1.00 40.43 H new ATOM 0 HB ILE A 78 4.010 2.395 -3.766 1.00 64.33 H new ATOM 0 HG12 ILE A 78 5.536 2.342 -1.151 1.00 22.22 H new ATOM 0 HG13 ILE A 78 5.176 3.817 -2.026 1.00 22.22 H new ATOM 0 HG21 ILE A 78 3.690 0.386 -2.353 1.00 71.43 H new ATOM 0 HG22 ILE A 78 4.548 0.007 -3.865 1.00 71.43 H new ATOM 0 HG23 ILE A 78 5.451 0.129 -2.337 1.00 71.43 H new ATOM 0 HD11 ILE A 78 3.536 3.426 -0.254 1.00 64.04 H new ATOM 0 HD12 ILE A 78 2.759 3.345 -1.853 1.00 64.04 H new ATOM 0 HD13 ILE A 78 3.125 1.847 -0.964 1.00 64.04 H new ATOM 1118 N PHE A 79 5.734 4.211 -5.233 1.00 41.14 N ATOM 1119 CA PHE A 79 5.853 5.598 -5.574 1.00 31.34 C ATOM 1120 C PHE A 79 4.805 6.384 -4.842 1.00 50.40 C ATOM 1121 O PHE A 79 3.659 5.949 -4.719 1.00 41.25 O ATOM 1122 CB PHE A 79 5.787 5.814 -7.087 1.00 42.25 C ATOM 1123 CG PHE A 79 6.875 5.085 -7.831 1.00 44.02 C ATOM 1124 CD1 PHE A 79 8.170 5.580 -7.850 1.00 62.24 C ATOM 1125 CD2 PHE A 79 6.607 3.898 -8.497 1.00 14.24 C ATOM 1126 CE1 PHE A 79 9.173 4.908 -8.519 1.00 54.15 C ATOM 1127 CE2 PHE A 79 7.608 3.221 -9.166 1.00 1.44 C ATOM 1128 CZ PHE A 79 8.893 3.728 -9.178 1.00 11.21 C ATOM 0 H PHE A 79 5.143 3.668 -5.863 1.00 41.14 H new ATOM 0 HA PHE A 79 6.833 5.958 -5.261 1.00 31.34 H new ATOM 0 HB2 PHE A 79 4.816 5.481 -7.455 1.00 42.25 H new ATOM 0 HB3 PHE A 79 5.860 6.880 -7.300 1.00 42.25 H new ATOM 0 HD1 PHE A 79 8.397 6.502 -7.335 1.00 62.24 H new ATOM 0 HD2 PHE A 79 5.604 3.498 -8.492 1.00 14.24 H new ATOM 0 HE1 PHE A 79 10.177 5.306 -8.527 1.00 54.15 H new ATOM 0 HE2 PHE A 79 7.386 2.297 -9.679 1.00 1.44 H new ATOM 0 HZ PHE A 79 9.677 3.202 -9.702 1.00 11.21 H new ATOM 1138 N LEU A 80 5.206 7.491 -4.311 1.00 60.52 N ATOM 1139 CA LEU A 80 4.363 8.297 -3.514 1.00 22.00 C ATOM 1140 C LEU A 80 4.307 9.717 -4.044 1.00 60.21 C ATOM 1141 O LEU A 80 5.327 10.401 -4.185 1.00 44.34 O ATOM 1142 CB LEU A 80 4.840 8.288 -2.069 1.00 24.24 C ATOM 1143 CG LEU A 80 4.000 9.084 -1.076 1.00 43.25 C ATOM 1144 CD1 LEU A 80 2.621 8.470 -0.891 1.00 4.20 C ATOM 1145 CD2 LEU A 80 4.722 9.185 0.235 1.00 74.10 C ATOM 0 H LEU A 80 6.149 7.862 -4.425 1.00 60.52 H new ATOM 0 HA LEU A 80 3.356 7.882 -3.555 1.00 22.00 H new ATOM 0 HB2 LEU A 80 4.883 7.253 -1.729 1.00 24.24 H new ATOM 0 HB3 LEU A 80 5.859 8.674 -2.042 1.00 24.24 H new ATOM 0 HG LEU A 80 3.854 10.086 -1.478 1.00 43.25 H new ATOM 0 HD11 LEU A 80 2.051 9.064 -0.177 1.00 4.20 H new ATOM 0 HD12 LEU A 80 2.099 8.454 -1.848 1.00 4.20 H new ATOM 0 HD13 LEU A 80 2.723 7.452 -0.516 1.00 4.20 H new ATOM 0 HD21 LEU A 80 4.117 9.755 0.941 1.00 74.10 H new ATOM 0 HD22 LEU A 80 4.897 8.185 0.632 1.00 74.10 H new ATOM 0 HD23 LEU A 80 5.677 9.689 0.086 1.00 74.10 H new ATOM 1157 N ASP A 81 3.120 10.136 -4.332 1.00 31.13 N ATOM 1158 CA ASP A 81 2.837 11.459 -4.765 1.00 61.01 C ATOM 1159 C ASP A 81 1.533 11.883 -4.161 1.00 55.44 C ATOM 1160 O ASP A 81 0.467 11.339 -4.458 1.00 44.12 O ATOM 1161 CB ASP A 81 2.812 11.613 -6.279 1.00 42.22 C ATOM 1162 CG ASP A 81 2.481 13.035 -6.676 1.00 21.30 C ATOM 1163 OD1 ASP A 81 3.267 13.957 -6.374 1.00 71.54 O ATOM 1164 OD2 ASP A 81 1.423 13.266 -7.263 1.00 63.00 O ATOM 0 H ASP A 81 2.292 9.543 -4.269 1.00 31.13 H new ATOM 0 HA ASP A 81 3.648 12.104 -4.427 1.00 61.01 H new ATOM 0 HB2 ASP A 81 3.781 11.333 -6.692 1.00 42.22 H new ATOM 0 HB3 ASP A 81 2.075 10.932 -6.705 1.00 42.22 H new ATOM 1169 N ASP A 82 1.666 12.752 -3.253 1.00 2.43 N ATOM 1170 CA ASP A 82 0.575 13.356 -2.497 1.00 31.44 C ATOM 1171 C ASP A 82 0.853 14.853 -2.385 1.00 10.11 C ATOM 1172 O ASP A 82 1.993 15.280 -2.599 1.00 30.42 O ATOM 1173 CB ASP A 82 0.469 12.696 -1.096 1.00 44.44 C ATOM 1174 CG ASP A 82 -0.551 13.360 -0.184 1.00 5.11 C ATOM 1175 OD1 ASP A 82 -1.742 13.137 -0.333 1.00 71.51 O ATOM 1176 OD2 ASP A 82 -0.152 14.161 0.672 1.00 1.01 O ATOM 0 H ASP A 82 2.581 13.106 -2.973 1.00 2.43 H new ATOM 0 HA ASP A 82 -0.378 13.200 -3.003 1.00 31.44 H new ATOM 0 HB2 ASP A 82 0.205 11.645 -1.218 1.00 44.44 H new ATOM 0 HB3 ASP A 82 1.447 12.725 -0.615 1.00 44.44 H new ATOM 1181 N VAL A 83 -0.154 15.639 -2.072 1.00 2.34 N ATOM 1182 CA VAL A 83 -0.018 17.097 -1.998 1.00 72.53 C ATOM 1183 C VAL A 83 0.608 17.553 -0.669 1.00 62.14 C ATOM 1184 O VAL A 83 1.077 18.681 -0.535 1.00 3.21 O ATOM 1185 CB VAL A 83 -1.383 17.807 -2.218 1.00 13.21 C ATOM 1186 CG1 VAL A 83 -1.900 17.520 -3.616 1.00 31.05 C ATOM 1187 CG2 VAL A 83 -2.408 17.359 -1.180 1.00 5.12 C ATOM 0 H VAL A 83 -1.092 15.297 -1.860 1.00 2.34 H new ATOM 0 HA VAL A 83 0.658 17.386 -2.803 1.00 72.53 H new ATOM 0 HB VAL A 83 -1.230 18.880 -2.105 1.00 13.21 H new ATOM 0 HG11 VAL A 83 -2.857 18.022 -3.760 1.00 31.05 H new ATOM 0 HG12 VAL A 83 -1.184 17.886 -4.351 1.00 31.05 H new ATOM 0 HG13 VAL A 83 -2.031 16.445 -3.742 1.00 31.05 H new ATOM 0 HG21 VAL A 83 -3.354 17.871 -1.358 1.00 5.12 H new ATOM 0 HG22 VAL A 83 -2.558 16.282 -1.258 1.00 5.12 H new ATOM 0 HG23 VAL A 83 -2.045 17.603 -0.182 1.00 5.12 H new ATOM 1197 N THR A 84 0.627 16.668 0.278 1.00 22.12 N ATOM 1198 CA THR A 84 1.162 16.907 1.594 1.00 32.42 C ATOM 1199 C THR A 84 2.145 15.796 1.924 1.00 0.10 C ATOM 1200 O THR A 84 2.201 15.274 3.047 1.00 14.12 O ATOM 1201 CB THR A 84 0.014 16.974 2.617 1.00 42.00 C ATOM 1202 OG1 THR A 84 -0.966 15.973 2.309 1.00 23.01 O ATOM 1203 CG2 THR A 84 -0.641 18.338 2.612 1.00 53.14 C ATOM 0 H THR A 84 0.259 15.724 0.158 1.00 22.12 H new ATOM 0 HA THR A 84 1.688 17.861 1.629 1.00 32.42 H new ATOM 0 HB THR A 84 0.430 16.794 3.608 1.00 42.00 H new ATOM 0 HG1 THR A 84 -0.584 15.323 1.682 1.00 23.01 H new ATOM 0 HG21 THR A 84 -1.448 18.357 3.344 1.00 53.14 H new ATOM 0 HG22 THR A 84 0.098 19.097 2.867 1.00 53.14 H new ATOM 0 HG23 THR A 84 -1.045 18.544 1.621 1.00 53.14 H new ATOM 1211 N VAL A 85 2.977 15.522 0.948 1.00 3.50 N ATOM 1212 CA VAL A 85 3.899 14.424 0.985 1.00 22.25 C ATOM 1213 C VAL A 85 5.148 14.790 1.792 1.00 30.34 C ATOM 1214 O VAL A 85 5.638 15.935 1.749 1.00 62.44 O ATOM 1215 CB VAL A 85 4.291 13.988 -0.476 1.00 54.34 C ATOM 1216 CG1 VAL A 85 5.010 15.102 -1.241 1.00 10.13 C ATOM 1217 CG2 VAL A 85 5.111 12.710 -0.488 1.00 21.35 C ATOM 0 H VAL A 85 3.029 16.071 0.090 1.00 3.50 H new ATOM 0 HA VAL A 85 3.412 13.583 1.478 1.00 22.25 H new ATOM 0 HB VAL A 85 3.353 13.787 -0.994 1.00 54.34 H new ATOM 0 HG11 VAL A 85 5.260 14.753 -2.243 1.00 10.13 H new ATOM 0 HG12 VAL A 85 4.359 15.973 -1.312 1.00 10.13 H new ATOM 0 HG13 VAL A 85 5.924 15.374 -0.713 1.00 10.13 H new ATOM 0 HG21 VAL A 85 5.359 12.447 -1.516 1.00 21.35 H new ATOM 0 HG22 VAL A 85 6.029 12.862 0.079 1.00 21.35 H new ATOM 0 HG23 VAL A 85 4.534 11.903 -0.036 1.00 21.35 H new ATOM 1227 N SER A 86 5.604 13.840 2.565 1.00 2.22 N ATOM 1228 CA SER A 86 6.787 13.982 3.356 1.00 54.24 C ATOM 1229 C SER A 86 7.914 13.256 2.621 1.00 30.31 C ATOM 1230 O SER A 86 7.640 12.452 1.717 1.00 20.04 O ATOM 1231 CB SER A 86 6.537 13.351 4.735 1.00 31.21 C ATOM 1232 OG SER A 86 7.612 13.567 5.639 1.00 55.21 O ATOM 0 H SER A 86 5.152 12.931 2.661 1.00 2.22 H new ATOM 0 HA SER A 86 7.056 15.028 3.501 1.00 54.24 H new ATOM 0 HB2 SER A 86 5.622 13.765 5.159 1.00 31.21 H new ATOM 0 HB3 SER A 86 6.377 12.279 4.616 1.00 31.21 H new ATOM 0 HG SER A 86 7.425 13.110 6.485 1.00 55.21 H new ATOM 1238 N ARG A 87 9.162 13.539 2.982 1.00 41.24 N ATOM 1239 CA ARG A 87 10.313 12.891 2.358 1.00 61.01 C ATOM 1240 C ARG A 87 10.228 11.387 2.603 1.00 14.24 C ATOM 1241 O ARG A 87 10.421 10.572 1.690 1.00 54.52 O ATOM 1242 CB ARG A 87 11.621 13.451 2.919 1.00 41.25 C ATOM 1243 CG ARG A 87 12.861 12.897 2.241 1.00 25.51 C ATOM 1244 CD ARG A 87 14.144 13.445 2.841 1.00 54.31 C ATOM 1245 NE ARG A 87 14.267 14.901 2.685 1.00 32.43 N ATOM 1246 CZ ARG A 87 15.428 15.580 2.746 1.00 70.33 C ATOM 1247 NH1 ARG A 87 16.573 14.930 2.941 1.00 32.41 N ATOM 1248 NH2 ARG A 87 15.436 16.901 2.598 1.00 65.32 N ATOM 0 H ARG A 87 9.403 14.215 3.706 1.00 41.24 H new ATOM 0 HA ARG A 87 10.300 13.088 1.286 1.00 61.01 H new ATOM 0 HB2 ARG A 87 11.615 14.536 2.816 1.00 41.25 H new ATOM 0 HB3 ARG A 87 11.672 13.232 3.986 1.00 41.25 H new ATOM 0 HG2 ARG A 87 12.861 11.810 2.322 1.00 25.51 H new ATOM 0 HG3 ARG A 87 12.829 13.137 1.178 1.00 25.51 H new ATOM 0 HD2 ARG A 87 14.181 13.193 3.901 1.00 54.31 H new ATOM 0 HD3 ARG A 87 14.998 12.960 2.368 1.00 54.31 H new ATOM 0 HE ARG A 87 13.414 15.434 2.519 1.00 32.43 H new ATOM 0 HH11 ARG A 87 16.572 13.915 3.045 1.00 32.41 H new ATOM 0 HH12 ARG A 87 17.451 15.447 2.987 1.00 32.41 H new ATOM 0 HH21 ARG A 87 14.562 17.402 2.438 1.00 65.32 H new ATOM 0 HH22 ARG A 87 16.316 17.414 2.644 1.00 65.32 H new ATOM 1262 N ARG A 88 9.885 11.047 3.818 1.00 53.43 N ATOM 1263 CA ARG A 88 9.663 9.682 4.208 1.00 4.03 C ATOM 1264 C ARG A 88 8.247 9.643 4.754 1.00 44.00 C ATOM 1265 O ARG A 88 7.861 10.535 5.511 1.00 74.23 O ATOM 1266 CB ARG A 88 10.713 9.173 5.259 1.00 13.00 C ATOM 1267 CG ARG A 88 10.541 9.651 6.717 1.00 14.42 C ATOM 1268 CD ARG A 88 10.747 11.142 6.920 1.00 53.22 C ATOM 1269 NE ARG A 88 10.373 11.539 8.286 1.00 34.54 N ATOM 1270 CZ ARG A 88 10.177 12.793 8.706 1.00 30.42 C ATOM 1271 NH1 ARG A 88 10.486 13.829 7.920 1.00 43.31 N ATOM 1272 NH2 ARG A 88 9.726 13.009 9.935 1.00 21.03 N ATOM 0 H ARG A 88 9.751 11.720 4.573 1.00 53.43 H new ATOM 0 HA ARG A 88 9.786 9.009 3.359 1.00 4.03 H new ATOM 0 HB2 ARG A 88 10.693 8.083 5.256 1.00 13.00 H new ATOM 0 HB3 ARG A 88 11.704 9.474 4.919 1.00 13.00 H new ATOM 0 HG2 ARG A 88 9.540 9.386 7.057 1.00 14.42 H new ATOM 0 HG3 ARG A 88 11.246 9.110 7.349 1.00 14.42 H new ATOM 0 HD2 ARG A 88 11.790 11.398 6.735 1.00 53.22 H new ATOM 0 HD3 ARG A 88 10.149 11.698 6.198 1.00 53.22 H new ATOM 0 HE ARG A 88 10.253 10.794 8.972 1.00 34.54 H new ATOM 0 HH11 ARG A 88 10.875 13.666 6.991 1.00 43.31 H new ATOM 0 HH12 ARG A 88 10.333 14.782 8.249 1.00 43.31 H new ATOM 0 HH21 ARG A 88 9.531 12.221 10.553 1.00 21.03 H new ATOM 0 HH22 ARG A 88 9.574 13.963 10.262 1.00 21.03 H new ATOM 1286 N HIS A 89 7.459 8.690 4.356 1.00 53.03 N ATOM 1287 CA HIS A 89 6.071 8.706 4.761 1.00 64.04 C ATOM 1288 C HIS A 89 5.756 7.551 5.690 1.00 2.11 C ATOM 1289 O HIS A 89 5.539 7.741 6.892 1.00 21.34 O ATOM 1290 CB HIS A 89 5.178 8.686 3.516 1.00 73.13 C ATOM 1291 CG HIS A 89 3.713 8.871 3.771 1.00 30.34 C ATOM 1292 ND1 HIS A 89 3.103 10.082 3.578 1.00 4.31 N ATOM 1293 CD2 HIS A 89 2.796 7.977 4.184 1.00 11.42 C ATOM 1294 CE1 HIS A 89 1.837 9.890 3.883 1.00 74.21 C ATOM 1295 NE2 HIS A 89 1.606 8.636 4.260 1.00 70.23 N ATOM 0 H HIS A 89 7.736 7.906 3.765 1.00 53.03 H new ATOM 0 HA HIS A 89 5.874 9.621 5.319 1.00 64.04 H new ATOM 0 HB2 HIS A 89 5.513 9.470 2.837 1.00 73.13 H new ATOM 0 HB3 HIS A 89 5.323 7.736 3.002 1.00 73.13 H new ATOM 0 HD1 HIS A 89 3.538 10.950 3.264 1.00 4.31 H new ATOM 0 HD2 HIS A 89 2.970 6.936 4.412 1.00 11.42 H new ATOM 0 HE1 HIS A 89 1.079 10.657 3.833 1.00 74.21 H new ATOM 1303 N ALA A 90 5.783 6.359 5.160 1.00 74.41 N ATOM 1304 CA ALA A 90 5.435 5.196 5.929 1.00 65.33 C ATOM 1305 C ALA A 90 6.255 4.028 5.484 1.00 40.21 C ATOM 1306 O ALA A 90 6.724 3.982 4.335 1.00 23.14 O ATOM 1307 CB ALA A 90 3.947 4.881 5.789 1.00 22.00 C ATOM 0 H ALA A 90 6.044 6.167 4.193 1.00 74.41 H new ATOM 0 HA ALA A 90 5.644 5.399 6.980 1.00 65.33 H new ATOM 0 HB1 ALA A 90 3.705 3.997 6.379 1.00 22.00 H new ATOM 0 HB2 ALA A 90 3.361 5.728 6.146 1.00 22.00 H new ATOM 0 HB3 ALA A 90 3.712 4.693 4.741 1.00 22.00 H new ATOM 1313 N GLU A 91 6.448 3.113 6.367 1.00 62.03 N ATOM 1314 CA GLU A 91 7.185 1.937 6.071 1.00 51.34 C ATOM 1315 C GLU A 91 6.259 0.741 6.228 1.00 34.12 C ATOM 1316 O GLU A 91 5.592 0.578 7.264 1.00 2.10 O ATOM 1317 CB GLU A 91 8.389 1.838 7.012 1.00 31.03 C ATOM 1318 CG GLU A 91 9.359 0.714 6.696 1.00 20.44 C ATOM 1319 CD GLU A 91 10.534 0.710 7.640 1.00 41.35 C ATOM 1320 OE1 GLU A 91 11.474 1.515 7.443 1.00 42.24 O ATOM 1321 OE2 GLU A 91 10.532 -0.075 8.617 1.00 40.13 O ATOM 0 H GLU A 91 6.096 3.160 7.323 1.00 62.03 H new ATOM 0 HA GLU A 91 7.562 1.962 5.049 1.00 51.34 H new ATOM 0 HB2 GLU A 91 8.931 2.783 6.985 1.00 31.03 H new ATOM 0 HB3 GLU A 91 8.025 1.708 8.031 1.00 31.03 H new ATOM 0 HG2 GLU A 91 8.840 -0.243 6.757 1.00 20.44 H new ATOM 0 HG3 GLU A 91 9.716 0.818 5.671 1.00 20.44 H new ATOM 1328 N PHE A 92 6.208 -0.059 5.209 1.00 54.21 N ATOM 1329 CA PHE A 92 5.412 -1.247 5.184 1.00 31.42 C ATOM 1330 C PHE A 92 6.319 -2.411 5.456 1.00 51.11 C ATOM 1331 O PHE A 92 7.253 -2.687 4.692 1.00 10.32 O ATOM 1332 CB PHE A 92 4.701 -1.415 3.831 1.00 35.41 C ATOM 1333 CG PHE A 92 3.667 -0.363 3.529 1.00 64.01 C ATOM 1334 CD1 PHE A 92 4.023 0.840 2.933 1.00 24.43 C ATOM 1335 CD2 PHE A 92 2.337 -0.582 3.839 1.00 62.35 C ATOM 1336 CE1 PHE A 92 3.068 1.797 2.657 1.00 50.22 C ATOM 1337 CE2 PHE A 92 1.378 0.373 3.565 1.00 13.31 C ATOM 1338 CZ PHE A 92 1.744 1.565 2.974 1.00 72.05 C ATOM 0 H PHE A 92 6.733 0.100 4.349 1.00 54.21 H new ATOM 0 HA PHE A 92 4.633 -1.186 5.944 1.00 31.42 H new ATOM 0 HB2 PHE A 92 5.450 -1.407 3.039 1.00 35.41 H new ATOM 0 HB3 PHE A 92 4.222 -2.394 3.807 1.00 35.41 H new ATOM 0 HD1 PHE A 92 5.057 1.028 2.683 1.00 24.43 H new ATOM 0 HD2 PHE A 92 2.044 -1.513 4.302 1.00 62.35 H new ATOM 0 HE1 PHE A 92 3.356 2.728 2.193 1.00 50.22 H new ATOM 0 HE2 PHE A 92 0.343 0.187 3.813 1.00 13.31 H new ATOM 0 HZ PHE A 92 0.997 2.315 2.760 1.00 72.05 H new ATOM 1348 N ARG A 93 6.081 -3.051 6.544 1.00 74.15 N ATOM 1349 CA ARG A 93 6.897 -4.132 6.985 1.00 42.25 C ATOM 1350 C ARG A 93 6.140 -5.421 6.778 1.00 42.14 C ATOM 1351 O ARG A 93 5.011 -5.593 7.279 1.00 63.53 O ATOM 1352 CB ARG A 93 7.271 -3.904 8.453 1.00 25.14 C ATOM 1353 CG ARG A 93 8.006 -2.581 8.650 1.00 72.31 C ATOM 1354 CD ARG A 93 8.215 -2.217 10.108 1.00 25.53 C ATOM 1355 NE ARG A 93 9.071 -3.160 10.824 1.00 22.10 N ATOM 1356 CZ ARG A 93 10.350 -2.933 11.139 1.00 14.01 C ATOM 1357 NH1 ARG A 93 11.019 -1.926 10.565 1.00 22.24 N ATOM 1358 NH2 ARG A 93 10.976 -3.751 11.975 1.00 2.41 N ATOM 0 H ARG A 93 5.301 -2.837 7.166 1.00 74.15 H new ATOM 0 HA ARG A 93 7.824 -4.192 6.414 1.00 42.25 H new ATOM 0 HB2 ARG A 93 6.368 -3.913 9.064 1.00 25.14 H new ATOM 0 HB3 ARG A 93 7.899 -4.724 8.800 1.00 25.14 H new ATOM 0 HG2 ARG A 93 8.975 -2.636 8.155 1.00 72.31 H new ATOM 0 HG3 ARG A 93 7.443 -1.785 8.162 1.00 72.31 H new ATOM 0 HD2 ARG A 93 8.655 -1.221 10.167 1.00 25.53 H new ATOM 0 HD3 ARG A 93 7.246 -2.167 10.605 1.00 25.53 H new ATOM 0 HE ARG A 93 8.665 -4.053 11.103 1.00 22.10 H new ATOM 0 HH11 ARG A 93 10.553 -1.327 9.883 1.00 22.24 H new ATOM 0 HH12 ARG A 93 11.995 -1.757 10.809 1.00 22.24 H new ATOM 0 HH21 ARG A 93 10.481 -4.549 12.374 1.00 2.41 H new ATOM 0 HH22 ARG A 93 11.952 -3.582 12.219 1.00 2.41 H new ATOM 1372 N ILE A 94 6.729 -6.305 6.044 1.00 52.21 N ATOM 1373 CA ILE A 94 6.088 -7.538 5.709 1.00 1.14 C ATOM 1374 C ILE A 94 6.846 -8.692 6.315 1.00 54.14 C ATOM 1375 O ILE A 94 8.021 -8.924 6.015 1.00 73.34 O ATOM 1376 CB ILE A 94 5.943 -7.712 4.142 1.00 34.25 C ATOM 1377 CG1 ILE A 94 5.485 -9.128 3.732 1.00 73.32 C ATOM 1378 CG2 ILE A 94 7.208 -7.330 3.399 1.00 34.12 C ATOM 1379 CD1 ILE A 94 4.092 -9.485 4.169 1.00 34.52 C ATOM 0 H ILE A 94 7.667 -6.196 5.659 1.00 52.21 H new ATOM 0 HA ILE A 94 5.080 -7.523 6.124 1.00 1.14 H new ATOM 0 HB ILE A 94 5.156 -7.017 3.849 1.00 34.25 H new ATOM 0 HG12 ILE A 94 5.545 -9.215 2.647 1.00 73.32 H new ATOM 0 HG13 ILE A 94 6.181 -9.856 4.149 1.00 73.32 H new ATOM 0 HG21 ILE A 94 7.057 -7.467 2.328 1.00 34.12 H new ATOM 0 HG22 ILE A 94 7.447 -6.286 3.601 1.00 34.12 H new ATOM 0 HG23 ILE A 94 8.031 -7.962 3.733 1.00 34.12 H new ATOM 0 HD11 ILE A 94 3.855 -10.496 3.838 1.00 34.52 H new ATOM 0 HD12 ILE A 94 4.027 -9.434 5.256 1.00 34.52 H new ATOM 0 HD13 ILE A 94 3.382 -8.784 3.730 1.00 34.52 H new ATOM 1391 N ASN A 95 6.186 -9.368 7.202 1.00 22.14 N ATOM 1392 CA ASN A 95 6.699 -10.531 7.812 1.00 63.00 C ATOM 1393 C ASN A 95 5.733 -11.601 7.419 1.00 14.51 C ATOM 1394 O ASN A 95 4.541 -11.329 7.301 1.00 4.44 O ATOM 1395 CB ASN A 95 6.735 -10.337 9.351 1.00 3.01 C ATOM 1396 CG ASN A 95 7.370 -11.486 10.143 1.00 63.32 C ATOM 1397 OD1 ASN A 95 7.327 -12.650 9.755 1.00 53.40 O ATOM 1398 ND2 ASN A 95 7.936 -11.163 11.275 1.00 31.20 N ATOM 0 H ASN A 95 5.253 -9.111 7.523 1.00 22.14 H new ATOM 0 HA ASN A 95 7.717 -10.772 7.507 1.00 63.00 H new ATOM 0 HB2 ASN A 95 7.281 -9.420 9.572 1.00 3.01 H new ATOM 0 HB3 ASN A 95 5.715 -10.194 9.706 1.00 3.01 H new ATOM 0 HD21 ASN A 95 8.356 -11.886 11.860 1.00 31.20 H new ATOM 0 HD22 ASN A 95 7.958 -10.188 11.574 1.00 31.20 H new ATOM 1405 N GLU A 96 6.206 -12.781 7.180 1.00 64.44 N ATOM 1406 CA GLU A 96 5.327 -13.867 6.813 1.00 31.51 C ATOM 1407 C GLU A 96 4.470 -14.328 8.000 1.00 62.44 C ATOM 1408 O GLU A 96 3.542 -15.123 7.847 1.00 53.31 O ATOM 1409 CB GLU A 96 6.091 -14.997 6.127 1.00 3.24 C ATOM 1410 CG GLU A 96 7.392 -15.381 6.792 1.00 54.34 C ATOM 1411 CD GLU A 96 8.096 -16.458 6.031 1.00 1.43 C ATOM 1412 OE1 GLU A 96 7.811 -17.651 6.259 1.00 73.15 O ATOM 1413 OE2 GLU A 96 8.935 -16.135 5.159 1.00 70.11 O ATOM 0 H GLU A 96 7.195 -13.027 7.230 1.00 64.44 H new ATOM 0 HA GLU A 96 4.620 -13.496 6.071 1.00 31.51 H new ATOM 0 HB2 GLU A 96 5.448 -15.876 6.084 1.00 3.24 H new ATOM 0 HB3 GLU A 96 6.299 -14.703 5.098 1.00 3.24 H new ATOM 0 HG2 GLU A 96 8.037 -14.505 6.867 1.00 54.34 H new ATOM 0 HG3 GLU A 96 7.196 -15.720 7.809 1.00 54.34 H new ATOM 1420 N GLY A 97 4.800 -13.813 9.175 1.00 51.22 N ATOM 1421 CA GLY A 97 3.987 -14.010 10.338 1.00 22.22 C ATOM 1422 C GLY A 97 2.808 -13.042 10.352 1.00 1.25 C ATOM 1423 O GLY A 97 1.650 -13.475 10.382 1.00 35.32 O ATOM 0 H GLY A 97 5.636 -13.252 9.336 1.00 51.22 H new ATOM 0 HA2 GLY A 97 3.620 -15.036 10.360 1.00 22.22 H new ATOM 0 HA3 GLY A 97 4.589 -13.868 11.235 1.00 22.22 H new ATOM 1427 N GLU A 98 3.097 -11.728 10.267 1.00 44.52 N ATOM 1428 CA GLU A 98 2.073 -10.690 10.301 1.00 52.11 C ATOM 1429 C GLU A 98 2.501 -9.497 9.475 1.00 13.51 C ATOM 1430 O GLU A 98 3.676 -9.348 9.139 1.00 3.14 O ATOM 1431 CB GLU A 98 1.730 -10.233 11.726 1.00 32.34 C ATOM 1432 CG GLU A 98 0.930 -11.231 12.540 1.00 62.42 C ATOM 1433 CD GLU A 98 0.473 -10.688 13.862 1.00 23.11 C ATOM 1434 OE1 GLU A 98 1.225 -10.751 14.825 1.00 11.34 O ATOM 1435 OE2 GLU A 98 -0.682 -10.222 13.965 1.00 0.11 O ATOM 0 H GLU A 98 4.047 -11.368 10.173 1.00 44.52 H new ATOM 0 HA GLU A 98 1.172 -11.133 9.877 1.00 52.11 H new ATOM 0 HB2 GLU A 98 2.658 -10.015 12.255 1.00 32.34 H new ATOM 0 HB3 GLU A 98 1.169 -9.300 11.668 1.00 32.34 H new ATOM 0 HG2 GLU A 98 0.060 -11.545 11.964 1.00 62.42 H new ATOM 0 HG3 GLU A 98 1.537 -12.120 12.711 1.00 62.42 H new ATOM 1442 N PHE A 99 1.567 -8.632 9.201 1.00 72.03 N ATOM 1443 CA PHE A 99 1.797 -7.497 8.347 1.00 11.05 C ATOM 1444 C PHE A 99 1.743 -6.231 9.217 1.00 63.54 C ATOM 1445 O PHE A 99 0.773 -6.029 9.967 1.00 63.53 O ATOM 1446 CB PHE A 99 0.698 -7.453 7.272 1.00 45.21 C ATOM 1447 CG PHE A 99 0.322 -8.806 6.702 1.00 14.44 C ATOM 1448 CD1 PHE A 99 1.079 -9.403 5.721 1.00 41.04 C ATOM 1449 CD2 PHE A 99 -0.807 -9.473 7.166 1.00 31.04 C ATOM 1450 CE1 PHE A 99 0.731 -10.639 5.205 1.00 30.21 C ATOM 1451 CE2 PHE A 99 -1.161 -10.706 6.657 1.00 71.20 C ATOM 1452 CZ PHE A 99 -0.390 -11.290 5.675 1.00 3.41 C ATOM 0 H PHE A 99 0.616 -8.693 9.566 1.00 72.03 H new ATOM 0 HA PHE A 99 2.768 -7.565 7.856 1.00 11.05 H new ATOM 0 HB2 PHE A 99 -0.193 -6.993 7.700 1.00 45.21 H new ATOM 0 HB3 PHE A 99 1.030 -6.809 6.457 1.00 45.21 H new ATOM 0 HD1 PHE A 99 1.958 -8.899 5.348 1.00 41.04 H new ATOM 0 HD2 PHE A 99 -1.415 -9.020 7.935 1.00 31.04 H new ATOM 0 HE1 PHE A 99 1.337 -11.093 4.435 1.00 30.21 H new ATOM 0 HE2 PHE A 99 -2.040 -11.212 7.027 1.00 71.20 H new ATOM 0 HZ PHE A 99 -0.663 -12.255 5.275 1.00 3.41 H new ATOM 1462 N GLU A 100 2.751 -5.389 9.120 1.00 61.23 N ATOM 1463 CA GLU A 100 2.862 -4.227 9.993 1.00 14.53 C ATOM 1464 C GLU A 100 3.124 -2.958 9.181 1.00 71.51 C ATOM 1465 O GLU A 100 3.908 -2.973 8.236 1.00 5.52 O ATOM 1466 CB GLU A 100 4.010 -4.459 10.982 1.00 15.10 C ATOM 1467 CG GLU A 100 4.161 -3.405 12.070 1.00 14.14 C ATOM 1468 CD GLU A 100 5.401 -3.624 12.911 1.00 30.21 C ATOM 1469 OE1 GLU A 100 5.632 -4.762 13.387 1.00 64.33 O ATOM 1470 OE2 GLU A 100 6.157 -2.671 13.130 1.00 11.04 O ATOM 0 H GLU A 100 3.510 -5.484 8.445 1.00 61.23 H new ATOM 0 HA GLU A 100 1.924 -4.095 10.532 1.00 14.53 H new ATOM 0 HB2 GLU A 100 3.866 -5.429 11.458 1.00 15.10 H new ATOM 0 HB3 GLU A 100 4.943 -4.514 10.422 1.00 15.10 H new ATOM 0 HG2 GLU A 100 4.204 -2.417 11.612 1.00 14.14 H new ATOM 0 HG3 GLU A 100 3.281 -3.420 12.713 1.00 14.14 H new ATOM 1477 N VAL A 101 2.445 -1.887 9.509 1.00 41.52 N ATOM 1478 CA VAL A 101 2.696 -0.617 8.856 1.00 54.04 C ATOM 1479 C VAL A 101 2.991 0.460 9.896 1.00 71.14 C ATOM 1480 O VAL A 101 2.250 0.622 10.876 1.00 30.30 O ATOM 1481 CB VAL A 101 1.544 -0.190 7.895 1.00 2.02 C ATOM 1482 CG1 VAL A 101 0.209 -0.101 8.615 1.00 50.24 C ATOM 1483 CG2 VAL A 101 1.867 1.130 7.198 1.00 4.13 C ATOM 0 H VAL A 101 1.715 -1.864 10.221 1.00 41.52 H new ATOM 0 HA VAL A 101 3.575 -0.744 8.225 1.00 54.04 H new ATOM 0 HB VAL A 101 1.458 -0.968 7.136 1.00 2.02 H new ATOM 0 HG11 VAL A 101 -0.566 0.199 7.909 1.00 50.24 H new ATOM 0 HG12 VAL A 101 -0.042 -1.074 9.037 1.00 50.24 H new ATOM 0 HG13 VAL A 101 0.276 0.636 9.416 1.00 50.24 H new ATOM 0 HG21 VAL A 101 1.046 1.402 6.535 1.00 4.13 H new ATOM 0 HG22 VAL A 101 2.004 1.912 7.945 1.00 4.13 H new ATOM 0 HG23 VAL A 101 2.782 1.020 6.616 1.00 4.13 H new ATOM 1493 N VAL A 102 4.099 1.131 9.721 1.00 12.04 N ATOM 1494 CA VAL A 102 4.531 2.166 10.632 1.00 64.44 C ATOM 1495 C VAL A 102 4.633 3.494 9.894 1.00 5.24 C ATOM 1496 O VAL A 102 5.180 3.548 8.790 1.00 13.20 O ATOM 1497 CB VAL A 102 5.927 1.822 11.248 1.00 45.45 C ATOM 1498 CG1 VAL A 102 6.375 2.874 12.254 1.00 24.14 C ATOM 1499 CG2 VAL A 102 5.917 0.445 11.892 1.00 32.41 C ATOM 0 H VAL A 102 4.734 0.976 8.938 1.00 12.04 H new ATOM 0 HA VAL A 102 3.796 2.237 11.434 1.00 64.44 H new ATOM 0 HB VAL A 102 6.645 1.816 10.428 1.00 45.45 H new ATOM 0 HG11 VAL A 102 7.349 2.599 12.659 1.00 24.14 H new ATOM 0 HG12 VAL A 102 6.448 3.843 11.759 1.00 24.14 H new ATOM 0 HG13 VAL A 102 5.649 2.935 13.065 1.00 24.14 H new ATOM 0 HG21 VAL A 102 6.900 0.233 12.312 1.00 32.41 H new ATOM 0 HG22 VAL A 102 5.170 0.420 12.686 1.00 32.41 H new ATOM 0 HG23 VAL A 102 5.673 -0.306 11.141 1.00 32.41 H new ATOM 1509 N ASP A 103 4.102 4.540 10.471 1.00 24.15 N ATOM 1510 CA ASP A 103 4.280 5.872 9.917 1.00 30.01 C ATOM 1511 C ASP A 103 5.615 6.380 10.399 1.00 4.53 C ATOM 1512 O ASP A 103 5.931 6.266 11.600 1.00 40.05 O ATOM 1513 CB ASP A 103 3.184 6.820 10.404 1.00 41.22 C ATOM 1514 CG ASP A 103 3.306 8.214 9.820 1.00 31.14 C ATOM 1515 OD1 ASP A 103 4.073 9.051 10.359 1.00 54.11 O ATOM 1516 OD2 ASP A 103 2.626 8.505 8.840 1.00 21.40 O ATOM 0 H ASP A 103 3.542 4.504 11.323 1.00 24.15 H new ATOM 0 HA ASP A 103 4.231 5.829 8.829 1.00 30.01 H new ATOM 0 HB2 ASP A 103 2.210 6.406 10.142 1.00 41.22 H new ATOM 0 HB3 ASP A 103 3.222 6.883 11.492 1.00 41.22 H new ATOM 1521 N VAL A 104 6.409 6.895 9.500 1.00 74.42 N ATOM 1522 CA VAL A 104 7.733 7.359 9.851 1.00 24.34 C ATOM 1523 C VAL A 104 7.859 8.879 9.742 1.00 54.55 C ATOM 1524 O VAL A 104 8.970 9.426 9.669 1.00 21.25 O ATOM 1525 CB VAL A 104 8.862 6.625 9.054 1.00 32.21 C ATOM 1526 CG1 VAL A 104 8.954 5.168 9.489 1.00 74.33 C ATOM 1527 CG2 VAL A 104 8.620 6.688 7.556 1.00 13.22 C ATOM 0 H VAL A 104 6.166 7.006 8.516 1.00 74.42 H new ATOM 0 HA VAL A 104 7.875 7.099 10.900 1.00 24.34 H new ATOM 0 HB VAL A 104 9.800 7.135 9.273 1.00 32.21 H new ATOM 0 HG11 VAL A 104 9.743 4.669 8.926 1.00 74.33 H new ATOM 0 HG12 VAL A 104 9.181 5.120 10.554 1.00 74.33 H new ATOM 0 HG13 VAL A 104 8.003 4.671 9.298 1.00 74.33 H new ATOM 0 HG21 VAL A 104 9.424 6.168 7.035 1.00 13.22 H new ATOM 0 HG22 VAL A 104 7.668 6.212 7.321 1.00 13.22 H new ATOM 0 HG23 VAL A 104 8.594 7.729 7.235 1.00 13.22 H new ATOM 1537 N GLY A 105 6.732 9.564 9.767 1.00 61.33 N ATOM 1538 CA GLY A 105 6.765 10.996 9.789 1.00 42.20 C ATOM 1539 C GLY A 105 6.083 11.646 8.630 1.00 54.24 C ATOM 1540 O GLY A 105 6.689 12.480 7.944 1.00 10.54 O ATOM 0 H GLY A 105 5.799 9.151 9.772 1.00 61.33 H new ATOM 0 HA2 GLY A 105 6.299 11.344 10.711 1.00 42.20 H new ATOM 0 HA3 GLY A 105 7.804 11.323 9.814 1.00 42.20 H new ATOM 1544 N SER A 106 4.840 11.316 8.406 1.00 72.41 N ATOM 1545 CA SER A 106 4.098 11.929 7.338 1.00 23.52 C ATOM 1546 C SER A 106 3.624 13.320 7.767 1.00 14.23 C ATOM 1547 O SER A 106 3.321 13.554 8.943 1.00 41.03 O ATOM 1548 CB SER A 106 2.912 11.065 6.949 1.00 0.44 C ATOM 1549 OG SER A 106 2.056 10.862 8.050 1.00 50.21 O ATOM 0 H SER A 106 4.320 10.626 8.948 1.00 72.41 H new ATOM 0 HA SER A 106 4.749 12.027 6.469 1.00 23.52 H new ATOM 0 HB2 SER A 106 2.361 11.540 6.138 1.00 0.44 H new ATOM 0 HB3 SER A 106 3.264 10.104 6.575 1.00 0.44 H new ATOM 0 HG SER A 106 2.390 10.116 8.591 1.00 50.21 H new ATOM 1555 N LEU A 107 3.573 14.242 6.839 1.00 24.45 N ATOM 1556 CA LEU A 107 3.113 15.584 7.141 1.00 63.54 C ATOM 1557 C LEU A 107 1.595 15.616 7.173 1.00 53.13 C ATOM 1558 O LEU A 107 0.987 16.365 7.925 1.00 32.12 O ATOM 1559 CB LEU A 107 3.626 16.576 6.100 1.00 0.52 C ATOM 1560 CG LEU A 107 5.148 16.740 5.993 1.00 12.14 C ATOM 1561 CD1 LEU A 107 5.501 17.715 4.883 1.00 11.34 C ATOM 1562 CD2 LEU A 107 5.745 17.207 7.318 1.00 4.55 C ATOM 0 H LEU A 107 3.843 14.093 5.867 1.00 24.45 H new ATOM 0 HA LEU A 107 3.502 15.870 8.118 1.00 63.54 H new ATOM 0 HB2 LEU A 107 3.248 16.271 5.124 1.00 0.52 H new ATOM 0 HB3 LEU A 107 3.193 17.552 6.319 1.00 0.52 H new ATOM 0 HG LEU A 107 5.575 15.766 5.753 1.00 12.14 H new ATOM 0 HD11 LEU A 107 6.584 17.819 4.821 1.00 11.34 H new ATOM 0 HD12 LEU A 107 5.118 17.340 3.934 1.00 11.34 H new ATOM 0 HD13 LEU A 107 5.055 18.686 5.096 1.00 11.34 H new ATOM 0 HD21 LEU A 107 6.825 17.315 7.213 1.00 4.55 H new ATOM 0 HD22 LEU A 107 5.310 18.167 7.595 1.00 4.55 H new ATOM 0 HD23 LEU A 107 5.528 16.473 8.094 1.00 4.55 H new ATOM 1574 N ASN A 108 1.009 14.772 6.371 1.00 52.41 N ATOM 1575 CA ASN A 108 -0.436 14.697 6.235 1.00 3.11 C ATOM 1576 C ASN A 108 -1.081 13.809 7.283 1.00 25.44 C ATOM 1577 O ASN A 108 -2.260 13.982 7.604 1.00 63.21 O ATOM 1578 CB ASN A 108 -0.830 14.252 4.815 1.00 0.14 C ATOM 1579 CG ASN A 108 -0.135 12.974 4.345 1.00 25.30 C ATOM 1580 OD1 ASN A 108 0.190 12.104 5.128 1.00 55.32 O ATOM 1581 ND2 ASN A 108 0.130 12.874 3.069 1.00 23.32 N ATOM 0 H ASN A 108 1.515 14.108 5.785 1.00 52.41 H new ATOM 0 HA ASN A 108 -0.819 15.703 6.404 1.00 3.11 H new ATOM 0 HB2 ASN A 108 -1.909 14.100 4.780 1.00 0.14 H new ATOM 0 HB3 ASN A 108 -0.599 15.056 4.117 1.00 0.14 H new ATOM 0 HD21 ASN A 108 0.619 12.053 2.713 1.00 23.32 H new ATOM 0 HD22 ASN A 108 -0.152 13.617 2.430 1.00 23.32 H new ATOM 1588 N GLY A 109 -0.318 12.876 7.812 1.00 64.05 N ATOM 1589 CA GLY A 109 -0.837 11.972 8.796 1.00 44.31 C ATOM 1590 C GLY A 109 -1.456 10.742 8.159 1.00 1.23 C ATOM 1591 O GLY A 109 -2.538 10.816 7.557 1.00 54.24 O ATOM 0 H GLY A 109 0.663 12.730 7.572 1.00 64.05 H new ATOM 0 HA2 GLY A 109 -0.036 11.668 9.470 1.00 44.31 H new ATOM 0 HA3 GLY A 109 -1.585 12.484 9.401 1.00 44.31 H new ATOM 1595 N THR A 110 -0.768 9.641 8.245 1.00 11.24 N ATOM 1596 CA THR A 110 -1.274 8.382 7.759 1.00 32.35 C ATOM 1597 C THR A 110 -2.320 7.856 8.747 1.00 54.14 C ATOM 1598 O THR A 110 -2.040 7.736 9.947 1.00 42.32 O ATOM 1599 CB THR A 110 -0.118 7.371 7.641 1.00 42.42 C ATOM 1600 OG1 THR A 110 0.946 7.970 6.888 1.00 62.45 O ATOM 1601 CG2 THR A 110 -0.569 6.098 6.941 1.00 73.41 C ATOM 0 H THR A 110 0.164 9.587 8.655 1.00 11.24 H new ATOM 0 HA THR A 110 -1.728 8.519 6.778 1.00 32.35 H new ATOM 0 HB THR A 110 0.219 7.109 8.644 1.00 42.42 H new ATOM 0 HG1 THR A 110 0.712 7.972 5.936 1.00 62.45 H new ATOM 0 HG21 THR A 110 0.269 5.404 6.873 1.00 73.41 H new ATOM 0 HG22 THR A 110 -1.377 5.637 7.509 1.00 73.41 H new ATOM 0 HG23 THR A 110 -0.923 6.340 5.939 1.00 73.41 H new ATOM 1609 N TYR A 111 -3.522 7.591 8.266 1.00 54.04 N ATOM 1610 CA TYR A 111 -4.579 7.096 9.117 1.00 10.22 C ATOM 1611 C TYR A 111 -5.319 5.986 8.418 1.00 14.33 C ATOM 1612 O TYR A 111 -5.368 5.939 7.196 1.00 52.44 O ATOM 1613 CB TYR A 111 -5.571 8.208 9.511 1.00 44.41 C ATOM 1614 CG TYR A 111 -4.986 9.330 10.352 1.00 32.25 C ATOM 1615 CD1 TYR A 111 -4.594 9.109 11.661 1.00 14.21 C ATOM 1616 CD2 TYR A 111 -4.856 10.612 9.842 1.00 22.12 C ATOM 1617 CE1 TYR A 111 -4.086 10.127 12.442 1.00 43.45 C ATOM 1618 CE2 TYR A 111 -4.341 11.640 10.613 1.00 51.04 C ATOM 1619 CZ TYR A 111 -3.961 11.389 11.915 1.00 71.25 C ATOM 1620 OH TYR A 111 -3.464 12.412 12.698 1.00 0.55 O ATOM 0 H TYR A 111 -3.786 7.712 7.288 1.00 54.04 H new ATOM 0 HA TYR A 111 -4.117 6.721 10.031 1.00 10.22 H new ATOM 0 HB2 TYR A 111 -5.990 8.638 8.601 1.00 44.41 H new ATOM 0 HB3 TYR A 111 -6.398 7.757 10.060 1.00 44.41 H new ATOM 0 HD1 TYR A 111 -4.688 8.118 12.080 1.00 14.21 H new ATOM 0 HD2 TYR A 111 -5.162 10.813 8.826 1.00 22.12 H new ATOM 0 HE1 TYR A 111 -3.788 9.932 13.462 1.00 43.45 H new ATOM 0 HE2 TYR A 111 -4.237 12.632 10.198 1.00 51.04 H new ATOM 0 HH TYR A 111 -3.438 13.241 12.176 1.00 0.55 H new ATOM 1630 N VAL A 112 -5.899 5.121 9.179 1.00 0.30 N ATOM 1631 CA VAL A 112 -6.650 4.014 8.660 1.00 4.44 C ATOM 1632 C VAL A 112 -8.104 4.424 8.701 1.00 63.44 C ATOM 1633 O VAL A 112 -8.512 5.111 9.632 1.00 21.31 O ATOM 1634 CB VAL A 112 -6.442 2.749 9.524 1.00 31.45 C ATOM 1635 CG1 VAL A 112 -7.110 1.536 8.904 1.00 62.10 C ATOM 1636 CG2 VAL A 112 -4.962 2.496 9.762 1.00 31.14 C ATOM 0 H VAL A 112 -5.868 5.158 10.198 1.00 0.30 H new ATOM 0 HA VAL A 112 -6.325 3.774 7.648 1.00 4.44 H new ATOM 0 HB VAL A 112 -6.917 2.925 10.489 1.00 31.45 H new ATOM 0 HG11 VAL A 112 -6.943 0.665 9.538 1.00 62.10 H new ATOM 0 HG12 VAL A 112 -8.181 1.718 8.811 1.00 62.10 H new ATOM 0 HG13 VAL A 112 -6.686 1.352 7.917 1.00 62.10 H new ATOM 0 HG21 VAL A 112 -4.839 1.601 10.372 1.00 31.14 H new ATOM 0 HG22 VAL A 112 -4.459 2.355 8.806 1.00 31.14 H new ATOM 0 HG23 VAL A 112 -4.525 3.350 10.279 1.00 31.14 H new ATOM 1646 N ASN A 113 -8.878 4.032 7.699 1.00 30.45 N ATOM 1647 CA ASN A 113 -10.294 4.454 7.574 1.00 73.32 C ATOM 1648 C ASN A 113 -11.126 4.121 8.834 1.00 24.20 C ATOM 1649 O ASN A 113 -12.135 4.771 9.118 1.00 51.22 O ATOM 1650 CB ASN A 113 -10.947 3.861 6.295 1.00 62.25 C ATOM 1651 CG ASN A 113 -11.176 2.350 6.326 1.00 40.40 C ATOM 1652 OD1 ASN A 113 -10.494 1.608 7.024 1.00 21.35 O ATOM 1653 ND2 ASN A 113 -12.112 1.888 5.534 1.00 63.41 N ATOM 0 H ASN A 113 -8.560 3.418 6.949 1.00 30.45 H new ATOM 0 HA ASN A 113 -10.290 5.540 7.480 1.00 73.32 H new ATOM 0 HB2 ASN A 113 -11.905 4.355 6.132 1.00 62.25 H new ATOM 0 HB3 ASN A 113 -10.316 4.100 5.439 1.00 62.25 H new ATOM 0 HD21 ASN A 113 -12.290 0.885 5.486 1.00 63.41 H new ATOM 0 HD22 ASN A 113 -12.663 2.532 4.966 1.00 63.41 H new ATOM 1660 N ARG A 114 -10.691 3.120 9.576 1.00 70.14 N ATOM 1661 CA ARG A 114 -11.345 2.732 10.815 1.00 71.14 C ATOM 1662 C ARG A 114 -10.604 3.263 12.037 1.00 52.44 C ATOM 1663 O ARG A 114 -11.217 3.573 13.054 1.00 23.51 O ATOM 1664 CB ARG A 114 -11.361 1.232 10.950 1.00 33.31 C ATOM 1665 CG ARG A 114 -12.104 0.463 9.889 1.00 61.20 C ATOM 1666 CD ARG A 114 -11.745 -1.005 10.011 1.00 55.44 C ATOM 1667 NE ARG A 114 -10.325 -1.221 9.700 1.00 2.21 N ATOM 1668 CZ ARG A 114 -9.315 -1.367 10.586 1.00 21.10 C ATOM 1669 NH1 ARG A 114 -9.559 -1.462 11.894 1.00 71.24 N ATOM 1670 NH2 ARG A 114 -8.070 -1.446 10.141 1.00 21.24 N ATOM 0 H ARG A 114 -9.877 2.553 9.339 1.00 70.14 H new ATOM 0 HA ARG A 114 -12.352 3.146 10.773 1.00 71.14 H new ATOM 0 HB2 ARG A 114 -10.329 0.881 10.964 1.00 33.31 H new ATOM 0 HB3 ARG A 114 -11.796 0.983 11.918 1.00 33.31 H new ATOM 0 HG2 ARG A 114 -13.179 0.600 10.006 1.00 61.20 H new ATOM 0 HG3 ARG A 114 -11.841 0.835 8.899 1.00 61.20 H new ATOM 0 HD2 ARG A 114 -11.958 -1.354 11.022 1.00 55.44 H new ATOM 0 HD3 ARG A 114 -12.364 -1.593 9.334 1.00 55.44 H new ATOM 0 HE ARG A 114 -10.076 -1.265 8.712 1.00 2.21 H new ATOM 0 HH11 ARG A 114 -10.519 -1.425 12.238 1.00 71.24 H new ATOM 0 HH12 ARG A 114 -8.786 -1.572 12.550 1.00 71.24 H new ATOM 0 HH21 ARG A 114 -7.882 -1.397 9.140 1.00 21.24 H new ATOM 0 HH22 ARG A 114 -7.299 -1.556 10.800 1.00 21.24 H new ATOM 1684 N GLU A 115 -9.295 3.367 11.943 1.00 21.34 N ATOM 1685 CA GLU A 115 -8.481 3.651 13.109 1.00 54.22 C ATOM 1686 C GLU A 115 -7.505 4.790 12.847 1.00 13.54 C ATOM 1687 O GLU A 115 -6.701 4.719 11.925 1.00 63.15 O ATOM 1688 CB GLU A 115 -7.693 2.392 13.533 1.00 53.12 C ATOM 1689 CG GLU A 115 -8.554 1.185 13.874 1.00 24.54 C ATOM 1690 CD GLU A 115 -7.747 0.004 14.364 1.00 33.21 C ATOM 1691 OE1 GLU A 115 -7.313 0.021 15.535 1.00 0.43 O ATOM 1692 OE2 GLU A 115 -7.572 -0.994 13.613 1.00 41.14 O ATOM 0 H GLU A 115 -8.772 3.260 11.074 1.00 21.34 H new ATOM 0 HA GLU A 115 -9.155 3.952 13.911 1.00 54.22 H new ATOM 0 HB2 GLU A 115 -7.012 2.119 12.727 1.00 53.12 H new ATOM 0 HB3 GLU A 115 -7.079 2.639 14.399 1.00 53.12 H new ATOM 0 HG2 GLU A 115 -9.278 1.466 14.639 1.00 24.54 H new ATOM 0 HG3 GLU A 115 -9.122 0.889 12.992 1.00 24.54 H new ATOM 1699 N PRO A 116 -7.520 5.836 13.678 1.00 53.20 N ATOM 1700 CA PRO A 116 -6.602 6.982 13.538 1.00 34.21 C ATOM 1701 C PRO A 116 -5.174 6.652 14.055 1.00 54.13 C ATOM 1702 O PRO A 116 -4.483 7.497 14.633 1.00 42.44 O ATOM 1703 CB PRO A 116 -7.263 8.049 14.414 1.00 65.41 C ATOM 1704 CG PRO A 116 -7.980 7.285 15.465 1.00 74.22 C ATOM 1705 CD PRO A 116 -8.448 6.011 14.819 1.00 50.21 C ATOM 0 HA PRO A 116 -6.462 7.285 12.500 1.00 34.21 H new ATOM 0 HB2 PRO A 116 -6.521 8.719 14.849 1.00 65.41 H new ATOM 0 HB3 PRO A 116 -7.950 8.666 13.835 1.00 65.41 H new ATOM 0 HG2 PRO A 116 -7.323 7.074 16.308 1.00 74.22 H new ATOM 0 HG3 PRO A 116 -8.823 7.856 15.853 1.00 74.22 H new ATOM 0 HD2 PRO A 116 -8.397 5.169 15.510 1.00 50.21 H new ATOM 0 HD3 PRO A 116 -9.483 6.087 14.486 1.00 50.21 H new ATOM 1713 N ARG A 117 -4.732 5.453 13.776 1.00 51.54 N ATOM 1714 CA ARG A 117 -3.451 4.951 14.219 1.00 4.02 C ATOM 1715 C ARG A 117 -2.382 5.257 13.188 1.00 44.14 C ATOM 1716 O ARG A 117 -2.590 5.042 12.004 1.00 72.51 O ATOM 1717 CB ARG A 117 -3.527 3.438 14.421 1.00 35.42 C ATOM 1718 CG ARG A 117 -4.502 2.989 15.486 1.00 50.21 C ATOM 1719 CD ARG A 117 -4.057 3.407 16.868 1.00 0.41 C ATOM 1720 NE ARG A 117 -5.043 3.039 17.875 1.00 61.34 N ATOM 1721 CZ ARG A 117 -4.821 2.994 19.181 1.00 31.35 C ATOM 1722 NH1 ARG A 117 -3.593 3.115 19.662 1.00 54.22 N ATOM 1723 NH2 ARG A 117 -5.832 2.797 20.004 1.00 12.21 N ATOM 0 H ARG A 117 -5.263 4.781 13.222 1.00 51.54 H new ATOM 0 HA ARG A 117 -3.196 5.437 15.161 1.00 4.02 H new ATOM 0 HB2 ARG A 117 -3.804 2.973 13.475 1.00 35.42 H new ATOM 0 HB3 ARG A 117 -2.534 3.070 14.679 1.00 35.42 H new ATOM 0 HG2 ARG A 117 -5.486 3.410 15.278 1.00 50.21 H new ATOM 0 HG3 ARG A 117 -4.605 1.904 15.450 1.00 50.21 H new ATOM 0 HD2 ARG A 117 -3.102 2.937 17.102 1.00 0.41 H new ATOM 0 HD3 ARG A 117 -3.896 4.485 16.890 1.00 0.41 H new ATOM 0 HE ARG A 117 -5.979 2.797 17.549 1.00 61.34 H new ATOM 0 HH11 ARG A 117 -2.806 3.244 19.026 1.00 54.22 H new ATOM 0 HH12 ARG A 117 -3.434 3.079 20.669 1.00 54.22 H new ATOM 0 HH21 ARG A 117 -6.775 2.681 19.634 1.00 12.21 H new ATOM 0 HH22 ARG A 117 -5.671 2.761 21.011 1.00 12.21 H new ATOM 1737 N ASN A 118 -1.267 5.804 13.642 1.00 43.24 N ATOM 1738 CA ASN A 118 -0.114 6.046 12.763 1.00 31.01 C ATOM 1739 C ASN A 118 0.648 4.757 12.541 1.00 32.32 C ATOM 1740 O ASN A 118 1.150 4.496 11.452 1.00 10.14 O ATOM 1741 CB ASN A 118 0.799 7.148 13.314 1.00 30.23 C ATOM 1742 CG ASN A 118 0.303 8.564 13.042 1.00 25.44 C ATOM 1743 OD1 ASN A 118 1.098 9.499 12.957 1.00 25.43 O ATOM 1744 ND2 ASN A 118 -0.986 8.738 12.873 1.00 23.02 N ATOM 0 H ASN A 118 -1.127 6.092 14.611 1.00 43.24 H new ATOM 0 HA ASN A 118 -0.487 6.399 11.801 1.00 31.01 H new ATOM 0 HB2 ASN A 118 0.905 7.012 14.390 1.00 30.23 H new ATOM 0 HB3 ASN A 118 1.792 7.033 12.879 1.00 30.23 H new ATOM 0 HD21 ASN A 118 -1.352 9.667 12.665 1.00 23.02 H new ATOM 0 HD22 ASN A 118 -1.622 7.944 12.949 1.00 23.02 H new ATOM 1751 N ALA A 119 0.761 3.957 13.577 1.00 0.31 N ATOM 1752 CA ALA A 119 1.279 2.633 13.413 1.00 31.23 C ATOM 1753 C ALA A 119 0.091 1.725 13.518 1.00 22.04 C ATOM 1754 O ALA A 119 -0.756 1.916 14.409 1.00 2.30 O ATOM 1755 CB ALA A 119 2.308 2.312 14.487 1.00 5.44 C ATOM 0 H ALA A 119 0.501 4.204 14.532 1.00 0.31 H new ATOM 0 HA ALA A 119 1.792 2.517 12.458 1.00 31.23 H new ATOM 0 HB1 ALA A 119 2.685 1.300 14.339 1.00 5.44 H new ATOM 0 HB2 ALA A 119 3.134 3.020 14.423 1.00 5.44 H new ATOM 0 HB3 ALA A 119 1.843 2.385 15.470 1.00 5.44 H new ATOM 1761 N GLN A 120 0.022 0.741 12.679 1.00 13.21 N ATOM 1762 CA GLN A 120 -1.155 -0.071 12.606 1.00 51.12 C ATOM 1763 C GLN A 120 -0.822 -1.531 12.437 1.00 40.41 C ATOM 1764 O GLN A 120 0.123 -1.899 11.713 1.00 12.44 O ATOM 1765 CB GLN A 120 -2.032 0.405 11.429 1.00 23.50 C ATOM 1766 CG GLN A 120 -3.296 -0.418 11.178 1.00 0.11 C ATOM 1767 CD GLN A 120 -4.343 -0.283 12.268 1.00 12.11 C ATOM 1768 OE1 GLN A 120 -4.464 0.746 12.914 1.00 5.44 O ATOM 1769 NE2 GLN A 120 -5.057 -1.335 12.522 1.00 34.24 N ATOM 0 H GLN A 120 0.767 0.478 12.033 1.00 13.21 H new ATOM 0 HA GLN A 120 -1.697 0.035 13.546 1.00 51.12 H new ATOM 0 HB2 GLN A 120 -2.323 1.440 11.610 1.00 23.50 H new ATOM 0 HB3 GLN A 120 -1.428 0.398 10.522 1.00 23.50 H new ATOM 0 HG2 GLN A 120 -3.734 -0.113 10.227 1.00 0.11 H new ATOM 0 HG3 GLN A 120 -3.021 -1.468 11.080 1.00 0.11 H new ATOM 0 HE21 GLN A 120 -4.934 -2.181 11.966 1.00 34.24 H new ATOM 0 HE22 GLN A 120 -5.741 -1.317 13.278 1.00 34.24 H new ATOM 1778 N VAL A 121 -1.572 -2.355 13.116 1.00 61.44 N ATOM 1779 CA VAL A 121 -1.526 -3.766 12.888 1.00 64.45 C ATOM 1780 C VAL A 121 -2.493 -4.007 11.734 1.00 21.43 C ATOM 1781 O VAL A 121 -3.680 -3.669 11.835 1.00 61.23 O ATOM 1782 CB VAL A 121 -1.972 -4.578 14.140 1.00 12.54 C ATOM 1783 CG1 VAL A 121 -1.845 -6.077 13.888 1.00 43.45 C ATOM 1784 CG2 VAL A 121 -1.164 -4.176 15.370 1.00 35.31 C ATOM 0 H VAL A 121 -2.229 -2.065 13.840 1.00 61.44 H new ATOM 0 HA VAL A 121 -0.510 -4.094 12.668 1.00 64.45 H new ATOM 0 HB VAL A 121 -3.020 -4.347 14.330 1.00 12.54 H new ATOM 0 HG11 VAL A 121 -2.162 -6.623 14.776 1.00 43.45 H new ATOM 0 HG12 VAL A 121 -2.475 -6.359 13.044 1.00 43.45 H new ATOM 0 HG13 VAL A 121 -0.807 -6.321 13.663 1.00 43.45 H new ATOM 0 HG21 VAL A 121 -1.496 -4.758 16.230 1.00 35.31 H new ATOM 0 HG22 VAL A 121 -0.106 -4.367 15.189 1.00 35.31 H new ATOM 0 HG23 VAL A 121 -1.312 -3.115 15.572 1.00 35.31 H new ATOM 1794 N MET A 122 -1.985 -4.508 10.638 1.00 52.42 N ATOM 1795 CA MET A 122 -2.773 -4.666 9.413 1.00 41.30 C ATOM 1796 C MET A 122 -4.005 -5.527 9.567 1.00 35.04 C ATOM 1797 O MET A 122 -4.056 -6.445 10.398 1.00 1.33 O ATOM 1798 CB MET A 122 -1.930 -5.237 8.298 1.00 63.24 C ATOM 1799 CG MET A 122 -1.081 -4.235 7.549 1.00 15.33 C ATOM 1800 SD MET A 122 -2.085 -3.059 6.635 1.00 30.42 S ATOM 1801 CE MET A 122 -0.829 -2.220 5.684 1.00 2.55 C ATOM 0 H MET A 122 -1.018 -4.821 10.555 1.00 52.42 H new ATOM 0 HA MET A 122 -3.110 -3.657 9.173 1.00 41.30 H new ATOM 0 HB2 MET A 122 -1.276 -6.002 8.715 1.00 63.24 H new ATOM 0 HB3 MET A 122 -2.588 -5.734 7.586 1.00 63.24 H new ATOM 0 HG2 MET A 122 -0.445 -3.699 8.254 1.00 15.33 H new ATOM 0 HG3 MET A 122 -0.421 -4.761 6.860 1.00 15.33 H new ATOM 0 HE1 MET A 122 -1.156 -2.130 4.648 1.00 2.55 H new ATOM 0 HE2 MET A 122 -0.661 -1.226 6.099 1.00 2.55 H new ATOM 0 HE3 MET A 122 0.099 -2.791 5.723 1.00 2.55 H new ATOM 1811 N GLN A 123 -4.987 -5.209 8.772 1.00 63.32 N ATOM 1812 CA GLN A 123 -6.175 -5.988 8.637 1.00 65.31 C ATOM 1813 C GLN A 123 -6.296 -6.266 7.162 1.00 62.21 C ATOM 1814 O GLN A 123 -6.158 -5.357 6.343 1.00 22.01 O ATOM 1815 CB GLN A 123 -7.417 -5.249 9.162 1.00 23.54 C ATOM 1816 CG GLN A 123 -8.696 -6.087 9.096 1.00 72.42 C ATOM 1817 CD GLN A 123 -9.913 -5.371 9.645 1.00 3.44 C ATOM 1818 OE1 GLN A 123 -9.810 -4.529 10.532 1.00 33.41 O ATOM 1819 NE2 GLN A 123 -11.072 -5.704 9.139 1.00 13.51 N ATOM 0 H GLN A 123 -4.978 -4.375 8.185 1.00 63.32 H new ATOM 0 HA GLN A 123 -6.115 -6.902 9.227 1.00 65.31 H new ATOM 0 HB2 GLN A 123 -7.242 -4.948 10.195 1.00 23.54 H new ATOM 0 HB3 GLN A 123 -7.559 -4.336 8.583 1.00 23.54 H new ATOM 0 HG2 GLN A 123 -8.885 -6.367 8.060 1.00 72.42 H new ATOM 0 HG3 GLN A 123 -8.545 -7.011 9.654 1.00 72.42 H new ATOM 0 HE21 GLN A 123 -11.124 -6.408 8.402 1.00 13.51 H new ATOM 0 HE22 GLN A 123 -11.924 -5.260 9.481 1.00 13.51 H new ATOM 1828 N THR A 124 -6.482 -7.487 6.814 1.00 75.11 N ATOM 1829 CA THR A 124 -6.498 -7.864 5.441 1.00 54.03 C ATOM 1830 C THR A 124 -7.873 -7.617 4.831 1.00 32.13 C ATOM 1831 O THR A 124 -8.881 -8.114 5.335 1.00 40.44 O ATOM 1832 CB THR A 124 -6.070 -9.326 5.316 1.00 24.43 C ATOM 1833 OG1 THR A 124 -6.911 -10.137 6.142 1.00 42.01 O ATOM 1834 CG2 THR A 124 -4.633 -9.483 5.788 1.00 5.54 C ATOM 0 H THR A 124 -6.628 -8.255 7.469 1.00 75.11 H new ATOM 0 HA THR A 124 -5.791 -7.251 4.883 1.00 54.03 H new ATOM 0 HB THR A 124 -6.153 -9.634 4.274 1.00 24.43 H new ATOM 0 HG1 THR A 124 -7.811 -9.751 6.172 1.00 42.01 H new ATOM 0 HG21 THR A 124 -4.332 -10.527 5.697 1.00 5.54 H new ATOM 0 HG22 THR A 124 -3.979 -8.862 5.176 1.00 5.54 H new ATOM 0 HG23 THR A 124 -4.556 -9.173 6.830 1.00 5.54 H new ATOM 1842 N GLY A 125 -7.912 -6.839 3.772 1.00 42.24 N ATOM 1843 CA GLY A 125 -9.169 -6.466 3.175 1.00 43.34 C ATOM 1844 C GLY A 125 -9.637 -5.171 3.762 1.00 12.10 C ATOM 1845 O GLY A 125 -10.830 -4.976 4.021 1.00 75.25 O ATOM 0 H GLY A 125 -7.088 -6.455 3.310 1.00 42.24 H new ATOM 0 HA2 GLY A 125 -9.056 -6.368 2.095 1.00 43.34 H new ATOM 0 HA3 GLY A 125 -9.911 -7.245 3.348 1.00 43.34 H new ATOM 1849 N ASP A 126 -8.697 -4.292 3.988 1.00 24.52 N ATOM 1850 CA ASP A 126 -8.958 -3.023 4.625 1.00 25.22 C ATOM 1851 C ASP A 126 -8.131 -1.969 3.899 1.00 43.34 C ATOM 1852 O ASP A 126 -7.278 -2.342 3.064 1.00 5.42 O ATOM 1853 CB ASP A 126 -8.576 -3.132 6.103 1.00 35.51 C ATOM 1854 CG ASP A 126 -9.004 -1.959 6.922 1.00 31.21 C ATOM 1855 OD1 ASP A 126 -10.225 -1.723 7.040 1.00 44.23 O ATOM 1856 OD2 ASP A 126 -8.155 -1.274 7.482 1.00 54.32 O ATOM 0 H ASP A 126 -7.720 -4.435 3.734 1.00 24.52 H new ATOM 0 HA ASP A 126 -10.010 -2.743 4.573 1.00 25.22 H new ATOM 0 HB2 ASP A 126 -9.021 -4.036 6.519 1.00 35.51 H new ATOM 0 HB3 ASP A 126 -7.495 -3.244 6.182 1.00 35.51 H new ATOM 1861 N GLU A 127 -8.350 -0.693 4.178 1.00 3.13 N ATOM 1862 CA GLU A 127 -7.685 0.351 3.439 1.00 35.04 C ATOM 1863 C GLU A 127 -7.241 1.525 4.317 1.00 43.22 C ATOM 1864 O GLU A 127 -7.947 1.971 5.232 1.00 3.03 O ATOM 1865 CB GLU A 127 -8.524 0.780 2.226 1.00 73.13 C ATOM 1866 CG GLU A 127 -9.957 1.157 2.538 1.00 3.33 C ATOM 1867 CD GLU A 127 -10.785 1.315 1.288 1.00 42.42 C ATOM 1868 OE1 GLU A 127 -11.229 0.300 0.724 1.00 50.20 O ATOM 1869 OE2 GLU A 127 -11.020 2.447 0.836 1.00 72.44 O ATOM 0 H GLU A 127 -8.981 -0.364 4.909 1.00 3.13 H new ATOM 0 HA GLU A 127 -6.754 -0.066 3.055 1.00 35.04 H new ATOM 0 HB2 GLU A 127 -8.037 1.630 1.749 1.00 73.13 H new ATOM 0 HB3 GLU A 127 -8.528 -0.033 1.501 1.00 73.13 H new ATOM 0 HG2 GLU A 127 -10.403 0.392 3.174 1.00 3.33 H new ATOM 0 HG3 GLU A 127 -9.972 2.089 3.103 1.00 3.33 H new ATOM 1876 N ILE A 128 -6.068 2.009 4.017 1.00 63.44 N ATOM 1877 CA ILE A 128 -5.406 3.047 4.768 1.00 52.30 C ATOM 1878 C ILE A 128 -5.319 4.318 3.934 1.00 33.42 C ATOM 1879 O ILE A 128 -4.935 4.273 2.753 1.00 55.05 O ATOM 1880 CB ILE A 128 -3.981 2.590 5.203 1.00 35.33 C ATOM 1881 CG1 ILE A 128 -4.079 1.303 6.040 1.00 34.25 C ATOM 1882 CG2 ILE A 128 -3.262 3.690 5.990 1.00 64.31 C ATOM 1883 CD1 ILE A 128 -2.749 0.767 6.512 1.00 34.10 C ATOM 0 H ILE A 128 -5.526 1.683 3.217 1.00 63.44 H new ATOM 0 HA ILE A 128 -5.989 3.250 5.666 1.00 52.30 H new ATOM 0 HB ILE A 128 -3.395 2.389 4.306 1.00 35.33 H new ATOM 0 HG12 ILE A 128 -4.709 1.495 6.908 1.00 34.25 H new ATOM 0 HG13 ILE A 128 -4.578 0.535 5.448 1.00 34.25 H new ATOM 0 HG21 ILE A 128 -2.271 3.341 6.280 1.00 64.31 H new ATOM 0 HG22 ILE A 128 -3.166 4.580 5.367 1.00 64.31 H new ATOM 0 HG23 ILE A 128 -3.837 3.933 6.884 1.00 64.31 H new ATOM 0 HD11 ILE A 128 -2.908 -0.141 7.094 1.00 34.10 H new ATOM 0 HD12 ILE A 128 -2.122 0.540 5.650 1.00 34.10 H new ATOM 0 HD13 ILE A 128 -2.255 1.514 7.133 1.00 34.10 H new ATOM 1895 N GLN A 129 -5.696 5.431 4.523 1.00 61.10 N ATOM 1896 CA GLN A 129 -5.685 6.683 3.836 1.00 1.44 C ATOM 1897 C GLN A 129 -4.375 7.412 4.091 1.00 4.13 C ATOM 1898 O GLN A 129 -4.067 7.831 5.219 1.00 61.14 O ATOM 1899 CB GLN A 129 -6.894 7.555 4.230 1.00 72.10 C ATOM 1900 CG GLN A 129 -6.905 8.935 3.574 1.00 5.33 C ATOM 1901 CD GLN A 129 -8.157 9.748 3.874 1.00 60.33 C ATOM 1902 OE1 GLN A 129 -9.249 9.209 4.051 1.00 42.02 O ATOM 1903 NE2 GLN A 129 -8.006 11.040 3.956 1.00 34.50 N ATOM 0 H GLN A 129 -6.017 5.484 5.490 1.00 61.10 H new ATOM 0 HA GLN A 129 -5.767 6.484 2.767 1.00 1.44 H new ATOM 0 HB2 GLN A 129 -7.811 7.029 3.962 1.00 72.10 H new ATOM 0 HB3 GLN A 129 -6.902 7.679 5.313 1.00 72.10 H new ATOM 0 HG2 GLN A 129 -6.031 9.494 3.910 1.00 5.33 H new ATOM 0 HG3 GLN A 129 -6.811 8.815 2.495 1.00 5.33 H new ATOM 0 HE21 GLN A 129 -7.088 11.457 3.804 1.00 34.50 H new ATOM 0 HE22 GLN A 129 -8.806 11.634 4.172 1.00 34.50 H new ATOM 1912 N ILE A 130 -3.614 7.531 3.056 1.00 24.13 N ATOM 1913 CA ILE A 130 -2.383 8.247 3.071 1.00 22.41 C ATOM 1914 C ILE A 130 -2.663 9.655 2.572 1.00 55.42 C ATOM 1915 O ILE A 130 -2.848 9.894 1.369 1.00 65.54 O ATOM 1916 CB ILE A 130 -1.267 7.529 2.234 1.00 0.41 C ATOM 1917 CG1 ILE A 130 -1.763 7.154 0.812 1.00 42.13 C ATOM 1918 CG2 ILE A 130 -0.766 6.293 2.974 1.00 71.10 C ATOM 1919 CD1 ILE A 130 -0.717 6.486 -0.063 1.00 21.43 C ATOM 0 H ILE A 130 -3.838 7.121 2.149 1.00 24.13 H new ATOM 0 HA ILE A 130 -1.990 8.287 4.087 1.00 22.41 H new ATOM 0 HB ILE A 130 -0.440 8.229 2.113 1.00 0.41 H new ATOM 0 HG12 ILE A 130 -2.621 6.488 0.904 1.00 42.13 H new ATOM 0 HG13 ILE A 130 -2.113 8.058 0.313 1.00 42.13 H new ATOM 0 HG21 ILE A 130 0.008 5.804 2.383 1.00 71.10 H new ATOM 0 HG22 ILE A 130 -0.353 6.589 3.939 1.00 71.10 H new ATOM 0 HG23 ILE A 130 -1.594 5.602 3.130 1.00 71.10 H new ATOM 0 HD11 ILE A 130 -1.149 6.259 -1.038 1.00 21.43 H new ATOM 0 HD12 ILE A 130 0.133 7.156 -0.190 1.00 21.43 H new ATOM 0 HD13 ILE A 130 -0.383 5.563 0.410 1.00 21.43 H new ATOM 1931 N GLY A 131 -2.810 10.555 3.509 1.00 73.13 N ATOM 1932 CA GLY A 131 -3.149 11.904 3.187 1.00 15.31 C ATOM 1933 C GLY A 131 -4.601 12.009 2.831 1.00 52.35 C ATOM 1934 O GLY A 131 -5.462 12.029 3.706 1.00 31.10 O ATOM 0 H GLY A 131 -2.698 10.370 4.506 1.00 73.13 H new ATOM 0 HA2 GLY A 131 -2.928 12.553 4.035 1.00 15.31 H new ATOM 0 HA3 GLY A 131 -2.538 12.250 2.353 1.00 15.31 H new ATOM 1938 N LYS A 132 -4.880 12.028 1.559 1.00 34.23 N ATOM 1939 CA LYS A 132 -6.244 12.101 1.067 1.00 21.34 C ATOM 1940 C LYS A 132 -6.490 10.993 0.075 1.00 33.21 C ATOM 1941 O LYS A 132 -7.523 10.952 -0.591 1.00 50.05 O ATOM 1942 CB LYS A 132 -6.497 13.460 0.405 1.00 11.43 C ATOM 1943 CG LYS A 132 -6.417 14.648 1.358 1.00 20.33 C ATOM 1944 CD LYS A 132 -7.556 14.674 2.372 1.00 32.01 C ATOM 1945 CE LYS A 132 -8.897 14.932 1.703 1.00 34.32 C ATOM 1946 NZ LYS A 132 -8.903 16.220 0.974 1.00 71.41 N ATOM 0 H LYS A 132 -4.173 11.994 0.825 1.00 34.23 H new ATOM 0 HA LYS A 132 -6.928 11.988 1.908 1.00 21.34 H new ATOM 0 HB2 LYS A 132 -5.771 13.602 -0.395 1.00 11.43 H new ATOM 0 HB3 LYS A 132 -7.483 13.447 -0.059 1.00 11.43 H new ATOM 0 HG2 LYS A 132 -5.465 14.618 1.889 1.00 20.33 H new ATOM 0 HG3 LYS A 132 -6.431 15.572 0.780 1.00 20.33 H new ATOM 0 HD2 LYS A 132 -7.591 13.723 2.904 1.00 32.01 H new ATOM 0 HD3 LYS A 132 -7.365 15.448 3.115 1.00 32.01 H new ATOM 0 HE2 LYS A 132 -9.121 14.120 1.011 1.00 34.32 H new ATOM 0 HE3 LYS A 132 -9.685 14.936 2.456 1.00 34.32 H new ATOM 0 HZ1 LYS A 132 -9.885 16.512 0.793 1.00 71.41 H new ATOM 0 HZ2 LYS A 132 -8.426 16.945 1.547 1.00 71.41 H new ATOM 0 HZ3 LYS A 132 -8.403 16.109 0.069 1.00 71.41 H new ATOM 1960 N PHE A 133 -5.557 10.078 -0.005 1.00 3.43 N ATOM 1961 CA PHE A 133 -5.620 9.021 -0.978 1.00 41.11 C ATOM 1962 C PHE A 133 -5.649 7.682 -0.275 1.00 12.42 C ATOM 1963 O PHE A 133 -5.198 7.580 0.852 1.00 72.23 O ATOM 1964 CB PHE A 133 -4.458 9.169 -1.953 1.00 15.13 C ATOM 1965 CG PHE A 133 -4.468 10.532 -2.599 1.00 60.52 C ATOM 1966 CD1 PHE A 133 -5.505 10.902 -3.448 1.00 53.33 C ATOM 1967 CD2 PHE A 133 -3.473 11.452 -2.329 1.00 54.13 C ATOM 1968 CE1 PHE A 133 -5.546 12.162 -4.008 1.00 15.42 C ATOM 1969 CE2 PHE A 133 -3.505 12.715 -2.894 1.00 5.22 C ATOM 1970 CZ PHE A 133 -4.544 13.070 -3.731 1.00 21.00 C ATOM 0 H PHE A 133 -4.737 10.046 0.600 1.00 3.43 H new ATOM 0 HA PHE A 133 -6.538 9.083 -1.563 1.00 41.11 H new ATOM 0 HB2 PHE A 133 -3.515 9.018 -1.427 1.00 15.13 H new ATOM 0 HB3 PHE A 133 -4.522 8.398 -2.721 1.00 15.13 H new ATOM 0 HD1 PHE A 133 -6.289 10.194 -3.672 1.00 53.33 H new ATOM 0 HD2 PHE A 133 -2.661 11.182 -1.670 1.00 54.13 H new ATOM 0 HE1 PHE A 133 -6.360 12.437 -4.662 1.00 15.42 H new ATOM 0 HE2 PHE A 133 -2.718 13.423 -2.680 1.00 5.22 H new ATOM 0 HZ PHE A 133 -4.573 14.057 -4.168 1.00 21.00 H new ATOM 1980 N ARG A 134 -6.153 6.654 -0.922 1.00 30.31 N ATOM 1981 CA ARG A 134 -6.390 5.408 -0.214 1.00 55.10 C ATOM 1982 C ARG A 134 -5.732 4.192 -0.857 1.00 21.44 C ATOM 1983 O ARG A 134 -5.841 3.949 -2.084 1.00 71.42 O ATOM 1984 CB ARG A 134 -7.896 5.198 0.027 1.00 13.02 C ATOM 1985 CG ARG A 134 -8.746 5.131 -1.233 1.00 22.11 C ATOM 1986 CD ARG A 134 -10.231 5.120 -0.899 1.00 35.30 C ATOM 1987 NE ARG A 134 -10.672 6.385 -0.297 1.00 53.23 N ATOM 1988 CZ ARG A 134 -11.834 6.570 0.364 1.00 70.42 C ATOM 1989 NH1 ARG A 134 -12.651 5.541 0.591 1.00 30.34 N ATOM 1990 NH2 ARG A 134 -12.163 7.775 0.814 1.00 24.25 N ATOM 0 H ARG A 134 -6.402 6.650 -1.911 1.00 30.31 H new ATOM 0 HA ARG A 134 -5.897 5.506 0.753 1.00 55.10 H new ATOM 0 HB2 ARG A 134 -8.033 4.274 0.589 1.00 13.02 H new ATOM 0 HB3 ARG A 134 -8.265 6.010 0.653 1.00 13.02 H new ATOM 0 HG2 ARG A 134 -8.521 5.985 -1.872 1.00 22.11 H new ATOM 0 HG3 ARG A 134 -8.492 4.235 -1.798 1.00 22.11 H new ATOM 0 HD2 ARG A 134 -10.805 4.932 -1.806 1.00 35.30 H new ATOM 0 HD3 ARG A 134 -10.442 4.300 -0.213 1.00 35.30 H new ATOM 0 HE ARG A 134 -10.050 7.188 -0.386 1.00 53.23 H new ATOM 0 HH11 ARG A 134 -12.399 4.608 0.265 1.00 30.34 H new ATOM 0 HH12 ARG A 134 -13.528 5.687 1.091 1.00 30.34 H new ATOM 0 HH21 ARG A 134 -11.537 8.565 0.661 1.00 24.25 H new ATOM 0 HH22 ARG A 134 -13.042 7.911 1.313 1.00 24.25 H new ATOM 2004 N LEU A 135 -5.057 3.445 -0.020 1.00 65.35 N ATOM 2005 CA LEU A 135 -4.346 2.244 -0.385 1.00 2.24 C ATOM 2006 C LEU A 135 -5.021 1.059 0.309 1.00 52.31 C ATOM 2007 O LEU A 135 -5.333 1.133 1.487 1.00 52.12 O ATOM 2008 CB LEU A 135 -2.854 2.418 0.030 1.00 51.44 C ATOM 2009 CG LEU A 135 -1.860 1.242 -0.170 1.00 75.34 C ATOM 2010 CD1 LEU A 135 -0.439 1.783 -0.177 1.00 72.05 C ATOM 2011 CD2 LEU A 135 -1.980 0.223 0.967 1.00 40.32 C ATOM 0 H LEU A 135 -4.984 3.665 0.973 1.00 65.35 H new ATOM 0 HA LEU A 135 -4.372 2.057 -1.458 1.00 2.24 H new ATOM 0 HB2 LEU A 135 -2.461 3.274 -0.518 1.00 51.44 H new ATOM 0 HB3 LEU A 135 -2.838 2.682 1.087 1.00 51.44 H new ATOM 0 HG LEU A 135 -2.096 0.753 -1.115 1.00 75.34 H new ATOM 0 HD11 LEU A 135 0.263 0.961 -0.317 1.00 72.05 H new ATOM 0 HD12 LEU A 135 -0.326 2.499 -0.991 1.00 72.05 H new ATOM 0 HD13 LEU A 135 -0.233 2.278 0.772 1.00 72.05 H new ATOM 0 HD21 LEU A 135 -1.273 -0.590 0.803 1.00 40.32 H new ATOM 0 HD22 LEU A 135 -1.759 0.710 1.917 1.00 40.32 H new ATOM 0 HD23 LEU A 135 -2.994 -0.177 0.992 1.00 40.32 H new ATOM 2023 N VAL A 136 -5.243 -0.004 -0.423 1.00 71.44 N ATOM 2024 CA VAL A 136 -5.936 -1.180 0.081 1.00 14.31 C ATOM 2025 C VAL A 136 -4.925 -2.301 0.273 1.00 55.44 C ATOM 2026 O VAL A 136 -4.038 -2.487 -0.565 1.00 43.33 O ATOM 2027 CB VAL A 136 -7.010 -1.660 -0.935 1.00 53.14 C ATOM 2028 CG1 VAL A 136 -7.839 -2.807 -0.372 1.00 24.20 C ATOM 2029 CG2 VAL A 136 -7.903 -0.510 -1.385 1.00 73.43 C ATOM 0 H VAL A 136 -4.948 -0.085 -1.396 1.00 71.44 H new ATOM 0 HA VAL A 136 -6.421 -0.924 1.023 1.00 14.31 H new ATOM 0 HB VAL A 136 -6.481 -2.034 -1.812 1.00 53.14 H new ATOM 0 HG11 VAL A 136 -8.580 -3.117 -1.109 1.00 24.20 H new ATOM 0 HG12 VAL A 136 -7.186 -3.648 -0.139 1.00 24.20 H new ATOM 0 HG13 VAL A 136 -8.346 -2.478 0.535 1.00 24.20 H new ATOM 0 HG21 VAL A 136 -8.643 -0.880 -2.095 1.00 73.43 H new ATOM 0 HG22 VAL A 136 -8.411 -0.084 -0.520 1.00 73.43 H new ATOM 0 HG23 VAL A 136 -7.294 0.258 -1.862 1.00 73.43 H new ATOM 2039 N PHE A 137 -5.053 -3.036 1.351 1.00 71.15 N ATOM 2040 CA PHE A 137 -4.135 -4.114 1.642 1.00 2.54 C ATOM 2041 C PHE A 137 -4.880 -5.452 1.623 1.00 60.43 C ATOM 2042 O PHE A 137 -5.892 -5.622 2.323 1.00 14.43 O ATOM 2043 CB PHE A 137 -3.487 -3.873 3.004 1.00 10.22 C ATOM 2044 CG PHE A 137 -2.358 -4.806 3.318 1.00 71.22 C ATOM 2045 CD1 PHE A 137 -1.085 -4.537 2.847 1.00 75.14 C ATOM 2046 CD2 PHE A 137 -2.560 -5.937 4.090 1.00 44.51 C ATOM 2047 CE1 PHE A 137 -0.035 -5.375 3.137 1.00 1.20 C ATOM 2048 CE2 PHE A 137 -1.514 -6.778 4.380 1.00 20.23 C ATOM 2049 CZ PHE A 137 -0.248 -6.494 3.903 1.00 33.21 C ATOM 0 H PHE A 137 -5.788 -2.907 2.046 1.00 71.15 H new ATOM 0 HA PHE A 137 -3.354 -4.148 0.882 1.00 2.54 H new ATOM 0 HB2 PHE A 137 -3.118 -2.848 3.043 1.00 10.22 H new ATOM 0 HB3 PHE A 137 -4.248 -3.967 3.778 1.00 10.22 H new ATOM 0 HD1 PHE A 137 -0.914 -3.657 2.244 1.00 75.14 H new ATOM 0 HD2 PHE A 137 -3.547 -6.160 4.467 1.00 44.51 H new ATOM 0 HE1 PHE A 137 0.954 -5.154 2.764 1.00 1.20 H new ATOM 0 HE2 PHE A 137 -1.680 -7.660 4.980 1.00 20.23 H new ATOM 0 HZ PHE A 137 0.575 -7.154 4.133 1.00 33.21 H new ATOM 2059 N LEU A 138 -4.385 -6.395 0.839 1.00 23.54 N ATOM 2060 CA LEU A 138 -5.030 -7.700 0.681 1.00 2.12 C ATOM 2061 C LEU A 138 -4.016 -8.820 0.813 1.00 32.42 C ATOM 2062 O LEU A 138 -2.935 -8.745 0.253 1.00 71.10 O ATOM 2063 CB LEU A 138 -5.702 -7.783 -0.695 1.00 33.23 C ATOM 2064 CG LEU A 138 -6.872 -6.835 -0.926 1.00 33.43 C ATOM 2065 CD1 LEU A 138 -7.213 -6.764 -2.403 1.00 20.41 C ATOM 2066 CD2 LEU A 138 -8.087 -7.297 -0.143 1.00 31.00 C ATOM 0 H LEU A 138 -3.530 -6.285 0.294 1.00 23.54 H new ATOM 0 HA LEU A 138 -5.779 -7.810 1.465 1.00 2.12 H new ATOM 0 HB2 LEU A 138 -4.948 -7.590 -1.458 1.00 33.23 H new ATOM 0 HB3 LEU A 138 -6.053 -8.804 -0.845 1.00 33.23 H new ATOM 0 HG LEU A 138 -6.582 -5.843 -0.581 1.00 33.43 H new ATOM 0 HD11 LEU A 138 -8.051 -6.083 -2.551 1.00 20.41 H new ATOM 0 HD12 LEU A 138 -6.348 -6.402 -2.959 1.00 20.41 H new ATOM 0 HD13 LEU A 138 -7.485 -7.757 -2.762 1.00 20.41 H new ATOM 0 HD21 LEU A 138 -8.915 -6.610 -0.318 1.00 31.00 H new ATOM 0 HD22 LEU A 138 -8.371 -8.298 -0.469 1.00 31.00 H new ATOM 0 HD23 LEU A 138 -7.849 -7.315 0.921 1.00 31.00 H new ATOM 2078 N ALA A 139 -4.383 -9.869 1.517 1.00 61.00 N ATOM 2079 CA ALA A 139 -3.502 -11.042 1.726 1.00 62.12 C ATOM 2080 C ALA A 139 -3.966 -12.167 0.820 1.00 43.30 C ATOM 2081 O ALA A 139 -3.969 -13.350 1.187 1.00 25.32 O ATOM 2082 CB ALA A 139 -3.542 -11.483 3.178 1.00 11.03 C ATOM 0 H ALA A 139 -5.294 -9.952 1.968 1.00 61.00 H new ATOM 0 HA ALA A 139 -2.473 -10.775 1.484 1.00 62.12 H new ATOM 0 HB1 ALA A 139 -2.890 -12.345 3.314 1.00 11.03 H new ATOM 0 HB2 ALA A 139 -3.203 -10.667 3.816 1.00 11.03 H new ATOM 0 HB3 ALA A 139 -4.563 -11.754 3.448 1.00 11.03 H new ATOM 2088 N GLY A 140 -4.304 -11.777 -0.367 1.00 71.44 N ATOM 2089 CA GLY A 140 -4.872 -12.665 -1.343 1.00 73.13 C ATOM 2090 C GLY A 140 -3.896 -13.633 -2.028 1.00 30.21 C ATOM 2091 O GLY A 140 -4.175 -14.836 -2.053 1.00 15.42 O ATOM 0 H GLY A 140 -4.193 -10.818 -0.696 1.00 71.44 H new ATOM 0 HA2 GLY A 140 -5.653 -13.251 -0.859 1.00 73.13 H new ATOM 0 HA3 GLY A 140 -5.355 -12.064 -2.113 1.00 73.13 H new ATOM 2095 N PRO A 141 -2.733 -13.165 -2.576 1.00 13.24 N ATOM 2096 CA PRO A 141 -1.887 -13.998 -3.407 1.00 34.32 C ATOM 2097 C PRO A 141 -1.078 -15.039 -2.670 1.00 40.15 C ATOM 2098 O PRO A 141 -0.273 -14.734 -1.776 1.00 12.13 O ATOM 2099 CB PRO A 141 -0.949 -13.024 -4.118 1.00 60.32 C ATOM 2100 CG PRO A 141 -1.385 -11.662 -3.695 1.00 2.32 C ATOM 2101 CD PRO A 141 -2.141 -11.845 -2.416 1.00 73.32 C ATOM 0 HA PRO A 141 -2.520 -14.583 -4.074 1.00 34.32 H new ATOM 0 HB2 PRO A 141 0.089 -13.207 -3.840 1.00 60.32 H new ATOM 0 HB3 PRO A 141 -1.014 -13.137 -5.200 1.00 60.32 H new ATOM 0 HG2 PRO A 141 -0.527 -11.006 -3.550 1.00 2.32 H new ATOM 0 HG3 PRO A 141 -2.014 -11.200 -4.456 1.00 2.32 H new ATOM 0 HD2 PRO A 141 -1.484 -11.799 -1.548 1.00 73.32 H new ATOM 0 HD3 PRO A 141 -2.901 -11.075 -2.282 1.00 73.32 H new ATOM 2109 N ALA A 142 -1.304 -16.247 -3.061 1.00 30.00 N ATOM 2110 CA ALA A 142 -0.563 -17.379 -2.618 1.00 44.01 C ATOM 2111 C ALA A 142 0.240 -17.837 -3.807 1.00 63.02 C ATOM 2112 O ALA A 142 -0.333 -17.998 -4.898 1.00 21.13 O ATOM 2113 CB ALA A 142 -1.503 -18.477 -2.147 1.00 74.32 C ATOM 0 H ALA A 142 -2.041 -16.483 -3.726 1.00 30.00 H new ATOM 0 HA ALA A 142 0.083 -17.133 -1.775 1.00 44.01 H new ATOM 0 HB1 ALA A 142 -0.921 -19.335 -1.812 1.00 74.32 H new ATOM 0 HB2 ALA A 142 -2.111 -18.106 -1.322 1.00 74.32 H new ATOM 0 HB3 ALA A 142 -2.152 -18.778 -2.969 1.00 74.32 H new ATOM 2119 N GLU A 143 1.532 -17.981 -3.643 1.00 24.04 N ATOM 2120 CA GLU A 143 2.397 -18.361 -4.710 1.00 51.13 C ATOM 2121 C GLU A 143 2.080 -19.767 -5.246 1.00 62.51 C ATOM 2122 O GLU A 143 1.352 -19.863 -6.251 1.00 36.99 O ATOM 2123 CB GLU A 143 3.886 -18.156 -4.332 1.00 24.43 C ATOM 2124 CG GLU A 143 4.491 -19.028 -3.211 1.00 14.22 C ATOM 2125 CD GLU A 143 3.770 -18.938 -1.887 1.00 62.33 C ATOM 2126 OE1 GLU A 143 3.544 -17.818 -1.401 1.00 62.20 O ATOM 2127 OE2 GLU A 143 3.392 -19.992 -1.325 1.00 73.10 O ATOM 2128 OXT GLU A 143 2.497 -20.779 -4.654 1.00 36.99 O ATOM 0 H GLU A 143 2.008 -17.834 -2.753 1.00 24.04 H new ATOM 0 HA GLU A 143 2.205 -17.691 -5.548 1.00 51.13 H new ATOM 0 HB2 GLU A 143 4.481 -18.314 -5.232 1.00 24.43 H new ATOM 0 HB3 GLU A 143 4.014 -17.112 -4.045 1.00 24.43 H new ATOM 0 HG2 GLU A 143 4.494 -20.068 -3.539 1.00 14.22 H new ATOM 0 HG3 GLU A 143 5.531 -18.738 -3.064 1.00 14.22 H new TER 2135 GLU A 143