USER MOD reduce.3.24.130724 H: found=0, std=0, add=1284, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1284 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 74 ASN : amide:sc= -0.16 X(o=0.17,f=-0.16) USER MOD Set 1.2: A 106 THR OG1 : rot -89:sc= 0.335 USER MOD Set 2.1: A 100 TYR OH : rot 180:sc= 0.226 USER MOD Set 2.2: A 112 TYR OH : rot 50:sc= -0.78 USER MOD Set 2.3: A 138 ASN : amide:sc= 0.162 K(o=-0.39,f=-1.3) USER MOD Set 3.1: A 84 LYS NZ :NH3+ -115:sc= 1.19 (180deg=-2.35!) USER MOD Set 3.2: A 88 TYR OH : rot 50:sc= 0.787 USER MOD Set 4.1: A 28 TYR OH : rot 150:sc= 1.08 USER MOD Set 4.2: A 69 LYS NZ :NH3+ -117:sc= 1.19 (180deg=0) USER MOD Set 5.1: A 63 MET CE :methyl -118:sc= -0.733 (180deg=-1.72) USER MOD Set 5.2: A 82 CYS SG : rot 73:sc= 0.732 USER MOD Set 6.1: A 20 MET CE :methyl -136:sc= -0.301 (180deg=-2.38!) USER MOD Set 6.2: A 40 TYR OH : rot 30:sc= 0 USER MOD Set 7.1: A 11 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 7.2: A 54 TYR OH : rot -143:sc= -0.045 USER MOD Set 8.1: A 7 HIS : no HD1:sc= 0.796 K(o=1.8,f=-2.7) USER MOD Set 8.2: A 9 SER OG : rot 117:sc= 1 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -170:sc= 0 (180deg=-0.166) USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 4 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 6 HIS : no HD1:sc= -0.23 X(o=-0.23,f=-0.58) USER MOD Single : A 8 HIS : no HE2:sc= 0 K(o=0,f=-2.4) USER MOD Single : A 10 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 13 THR OG1 : rot -162:sc= -0.129 USER MOD Single : A 16 ASN : amide:sc= -1.37 K(o=-1.4,f=-0.63) USER MOD Single : A 19 GLN : amide:sc= -0.177 X(o=-0.18,f=-0.0057) USER MOD Single : A 24 HIS : no HD1:sc= -0.309 X(o=-0.31,f=0.064) USER MOD Single : A 25 MET CE :methyl -129:sc= -0.242 (180deg=-2.14) USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=-0.038) USER MOD Single : A 27 SER OG : rot -42:sc= 0.641 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 ASN : amide:sc= -0.369 X(o=-0.37,f=0) USER MOD Single : A 42 GLN : amide:sc= 0.0587 X(o=0.059,f=0) USER MOD Single : A 47 ASN : amide:sc= -3.51! K(o=-3.5!,f=-0.49) USER MOD Single : A 51 ASN : amide:sc= 0 X(o=0,f=-0.046) USER MOD Single : A 52 LYS NZ :NH3+ -139:sc= -0.615 (180deg=-2.6!) USER MOD Single : A 57 THR OG1 : rot 80:sc= 0.719 USER MOD Single : A 61 HIS : no HE2:sc= -1.38 K(o=-1.4,f=-2.7) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0586) USER MOD Single : A 72 TYR OH : rot 180:sc= -1.29 USER MOD Single : A 73 HIS : no HD1:sc= -1.13 K(o=-1.1,f=0) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 TYR OH : rot 179:sc= 0.205 USER MOD Single : A 89 ASN : amide:sc= 0.847 K(o=0.85,f=0) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 93 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 101 ASN : amide:sc= -0.719 X(o=-0.72,f=-0.66) USER MOD Single : A 102 HIS : no HE2:sc= -2.5 K(o=-2.5,f=-3.9!) USER MOD Single : A 108 SER OG : rot -160:sc= 0 USER MOD Single : A 109 SER OG : rot 170:sc= -0.286 USER MOD Single : A 118 HIS : no HD1:sc= -1.79 K(o=-1.8,f=-3.1!) USER MOD Single : A 122 GLN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 126 GLN : amide:sc= -0.455 X(o=-0.46,f=-0.42) USER MOD Single : A 127 HIS : no HD1:sc= -0.0547 K(o=-0.055,f=-0.62) USER MOD Single : A 129 SER OG : rot -83:sc= 0.533 USER MOD Single : A 133 GLN : amide:sc= -0.0616 X(o=-0.062,f=-0.43) USER MOD Single : A 137 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 139 GLN : amide:sc= 0.414 K(o=0.41,f=-1.5!) USER MOD Single : A 147 GLN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 148 GLN : amide:sc= -0.335 K(o=-0.34,f=-1.9!) USER MOD Single : A 149 GLN : amide:sc= -0.586 K(o=-0.59,f=-0.049) USER MOD Single : A 150 TYR OH : rot 180:sc= 0 USER MOD Single : A 154 GLN : amide:sc= -2.52! X(o=-2.5!,f=-2.1) USER MOD Single : A 155 THR OG1 : rot 180:sc= 0 USER MOD Single : A 158 THR OG1 : rot 180:sc= 0 USER MOD Single : A 160 THR OG1 : rot 82:sc= 0.558 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 19.537 18.652 -17.853 1.00 72.10 N ATOM 2 CA MET A 1 20.834 18.998 -18.493 1.00 24.52 C ATOM 3 C MET A 1 21.578 20.084 -17.673 1.00 54.35 C ATOM 4 O MET A 1 21.212 21.261 -17.730 1.00 73.11 O ATOM 5 CB MET A 1 20.588 19.479 -19.952 1.00 4.11 C ATOM 6 CG MET A 1 19.849 18.457 -20.829 1.00 34.21 C ATOM 7 SD MET A 1 20.724 16.880 -20.954 1.00 34.24 S ATOM 8 CE MET A 1 19.624 15.940 -22.018 1.00 3.55 C ATOM 0 H1 MET A 1 19.135 17.812 -18.316 1.00 72.10 H new ATOM 0 H2 MET A 1 19.690 18.452 -16.844 1.00 72.10 H new ATOM 0 H3 MET A 1 18.878 19.450 -17.951 1.00 72.10 H new ATOM 0 HA MET A 1 21.464 18.109 -18.517 1.00 24.52 H new ATOM 0 HB2 MET A 1 20.013 20.404 -19.927 1.00 4.11 H new ATOM 0 HB3 MET A 1 21.547 19.713 -20.414 1.00 4.11 H new ATOM 0 HG2 MET A 1 18.854 18.284 -20.418 1.00 34.21 H new ATOM 0 HG3 MET A 1 19.713 18.872 -21.828 1.00 34.21 H new ATOM 0 HE1 MET A 1 20.038 14.945 -22.181 1.00 3.55 H new ATOM 0 HE2 MET A 1 18.646 15.853 -21.544 1.00 3.55 H new ATOM 0 HE3 MET A 1 19.519 16.451 -22.975 1.00 3.55 H new ATOM 20 N GLY A 2 22.596 19.666 -16.883 1.00 72.41 N ATOM 21 CA GLY A 2 23.457 20.602 -16.128 1.00 33.44 C ATOM 22 C GLY A 2 22.901 21.038 -14.762 1.00 64.33 C ATOM 23 O GLY A 2 21.876 20.527 -14.299 1.00 55.34 O ATOM 0 H GLY A 2 22.840 18.684 -16.753 1.00 72.41 H new ATOM 0 HA2 GLY A 2 24.430 20.134 -15.975 1.00 33.44 H new ATOM 0 HA3 GLY A 2 23.623 21.491 -16.737 1.00 33.44 H new ATOM 27 N HIS A 3 23.606 21.994 -14.112 1.00 72.43 N ATOM 28 CA HIS A 3 23.238 22.546 -12.776 1.00 11.24 C ATOM 29 C HIS A 3 23.415 24.088 -12.739 1.00 15.11 C ATOM 30 O HIS A 3 23.972 24.648 -11.782 1.00 54.32 O ATOM 31 CB HIS A 3 24.103 21.882 -11.663 1.00 42.41 C ATOM 32 CG HIS A 3 23.973 20.382 -11.578 1.00 3.13 C ATOM 33 ND1 HIS A 3 25.001 19.512 -11.877 1.00 63.51 N ATOM 34 CD2 HIS A 3 22.927 19.600 -11.219 1.00 20.12 C ATOM 35 CE1 HIS A 3 24.593 18.274 -11.707 1.00 72.10 C ATOM 36 NE2 HIS A 3 23.343 18.300 -11.308 1.00 64.23 N ATOM 0 H HIS A 3 24.453 22.410 -14.499 1.00 72.43 H new ATOM 0 HA HIS A 3 22.187 22.320 -12.595 1.00 11.24 H new ATOM 0 HB2 HIS A 3 25.149 22.134 -11.836 1.00 42.41 H new ATOM 0 HB3 HIS A 3 23.826 22.313 -10.701 1.00 42.41 H new ATOM 0 HD2 HIS A 3 21.947 19.940 -10.918 1.00 20.12 H new ATOM 0 HE1 HIS A 3 25.186 17.386 -11.868 1.00 72.10 H new ATOM 0 HE2 HIS A 3 22.772 17.481 -11.098 1.00 64.23 H new ATOM 45 N HIS A 4 22.927 24.779 -13.785 1.00 13.31 N ATOM 46 CA HIS A 4 22.973 26.258 -13.850 1.00 2.23 C ATOM 47 C HIS A 4 21.925 26.866 -12.892 1.00 53.12 C ATOM 48 O HIS A 4 20.725 26.864 -13.199 1.00 14.42 O ATOM 49 CB HIS A 4 22.735 26.734 -15.303 1.00 71.50 C ATOM 50 CG HIS A 4 22.931 28.216 -15.531 1.00 14.00 C ATOM 51 ND1 HIS A 4 24.136 28.760 -15.923 1.00 41.40 N ATOM 52 CD2 HIS A 4 22.073 29.266 -15.427 1.00 31.53 C ATOM 53 CE1 HIS A 4 24.010 30.061 -16.052 1.00 62.12 C ATOM 54 NE2 HIS A 4 22.775 30.392 -15.758 1.00 34.43 N ATOM 0 H HIS A 4 22.496 24.340 -14.599 1.00 13.31 H new ATOM 0 HA HIS A 4 23.960 26.598 -13.536 1.00 2.23 H new ATOM 0 HB2 HIS A 4 23.409 26.188 -15.963 1.00 71.50 H new ATOM 0 HB3 HIS A 4 21.719 26.468 -15.594 1.00 71.50 H new ATOM 0 HD2 HIS A 4 21.034 29.219 -15.138 1.00 31.53 H new ATOM 0 HE1 HIS A 4 24.792 30.744 -16.350 1.00 62.12 H new ATOM 0 HE2 HIS A 4 22.398 31.340 -15.774 1.00 34.43 H new ATOM 63 N HIS A 5 22.385 27.352 -11.725 1.00 64.13 N ATOM 64 CA HIS A 5 21.509 27.968 -10.704 1.00 52.43 C ATOM 65 C HIS A 5 20.922 29.320 -11.198 1.00 32.54 C ATOM 66 O HIS A 5 21.464 30.398 -10.940 1.00 32.43 O ATOM 67 CB HIS A 5 22.262 28.124 -9.351 1.00 1.33 C ATOM 68 CG HIS A 5 22.564 26.813 -8.666 1.00 51.15 C ATOM 69 ND1 HIS A 5 21.838 26.337 -7.595 1.00 72.35 N ATOM 70 CD2 HIS A 5 23.515 25.877 -8.902 1.00 4.31 C ATOM 71 CE1 HIS A 5 22.325 25.179 -7.208 1.00 20.21 C ATOM 72 NE2 HIS A 5 23.339 24.879 -7.983 1.00 22.31 N ATOM 0 H HIS A 5 23.370 27.330 -11.461 1.00 64.13 H new ATOM 0 HA HIS A 5 20.665 27.299 -10.537 1.00 52.43 H new ATOM 0 HB2 HIS A 5 23.197 28.656 -9.526 1.00 1.33 H new ATOM 0 HB3 HIS A 5 21.664 28.743 -8.682 1.00 1.33 H new ATOM 0 HD2 HIS A 5 24.271 25.912 -9.672 1.00 4.31 H new ATOM 0 HE1 HIS A 5 21.953 24.578 -6.391 1.00 20.21 H new ATOM 0 HE2 HIS A 5 23.907 24.035 -7.912 1.00 22.31 H new ATOM 81 N HIS A 6 19.823 29.205 -11.961 1.00 53.41 N ATOM 82 CA HIS A 6 19.026 30.342 -12.480 1.00 54.44 C ATOM 83 C HIS A 6 18.180 31.001 -11.357 1.00 5.30 C ATOM 84 O HIS A 6 18.027 30.418 -10.274 1.00 41.13 O ATOM 85 CB HIS A 6 18.119 29.839 -13.646 1.00 42.41 C ATOM 86 CG HIS A 6 17.389 28.537 -13.354 1.00 21.51 C ATOM 87 ND1 HIS A 6 17.828 27.314 -13.819 1.00 23.52 N ATOM 88 CD2 HIS A 6 16.277 28.266 -12.619 1.00 35.35 C ATOM 89 CE1 HIS A 6 17.024 26.364 -13.396 1.00 10.23 C ATOM 90 NE2 HIS A 6 16.076 26.908 -12.665 1.00 1.23 N ATOM 0 H HIS A 6 19.450 28.299 -12.244 1.00 53.41 H new ATOM 0 HA HIS A 6 19.704 31.108 -12.856 1.00 54.44 H new ATOM 0 HB2 HIS A 6 17.384 30.610 -13.878 1.00 42.41 H new ATOM 0 HB3 HIS A 6 18.733 29.706 -14.537 1.00 42.41 H new ATOM 0 HD2 HIS A 6 15.665 28.986 -12.096 1.00 35.35 H new ATOM 0 HE1 HIS A 6 17.125 25.311 -13.613 1.00 10.23 H new ATOM 0 HE2 HIS A 6 15.316 26.404 -12.207 1.00 1.23 H new ATOM 99 N HIS A 7 17.639 32.216 -11.633 1.00 13.00 N ATOM 100 CA HIS A 7 16.781 32.962 -10.669 1.00 72.23 C ATOM 101 C HIS A 7 15.567 32.101 -10.228 1.00 32.01 C ATOM 102 O HIS A 7 14.710 31.748 -11.046 1.00 63.42 O ATOM 103 CB HIS A 7 16.326 34.338 -11.258 1.00 14.11 C ATOM 104 CG HIS A 7 15.490 34.270 -12.516 1.00 15.32 C ATOM 105 ND1 HIS A 7 14.114 34.353 -12.508 1.00 22.30 N ATOM 106 CD2 HIS A 7 15.837 34.133 -13.820 1.00 32.20 C ATOM 107 CE1 HIS A 7 13.659 34.268 -13.735 1.00 4.55 C ATOM 108 NE2 HIS A 7 14.677 34.133 -14.552 1.00 35.33 N ATOM 0 H HIS A 7 17.781 32.703 -12.518 1.00 13.00 H new ATOM 0 HA HIS A 7 17.378 33.173 -9.782 1.00 72.23 H new ATOM 0 HB2 HIS A 7 15.757 34.869 -10.494 1.00 14.11 H new ATOM 0 HB3 HIS A 7 17.214 34.935 -11.466 1.00 14.11 H new ATOM 0 HD2 HIS A 7 16.840 34.041 -14.210 1.00 32.20 H new ATOM 0 HE1 HIS A 7 12.619 34.303 -14.025 1.00 4.55 H new ATOM 0 HE2 HIS A 7 14.616 34.043 -15.566 1.00 35.33 H new ATOM 117 N HIS A 8 15.541 31.728 -8.934 1.00 2.34 N ATOM 118 CA HIS A 8 14.581 30.748 -8.395 1.00 44.51 C ATOM 119 C HIS A 8 13.155 31.346 -8.283 1.00 23.54 C ATOM 120 O HIS A 8 12.733 31.826 -7.227 1.00 63.40 O ATOM 121 CB HIS A 8 15.092 30.166 -7.028 1.00 32.44 C ATOM 122 CG HIS A 8 15.177 28.667 -7.015 1.00 1.21 C ATOM 123 ND1 HIS A 8 16.365 27.975 -7.000 1.00 5.45 N ATOM 124 CD2 HIS A 8 14.206 27.727 -7.068 1.00 40.35 C ATOM 125 CE1 HIS A 8 16.119 26.689 -7.058 1.00 2.23 C ATOM 126 NE2 HIS A 8 14.825 26.514 -7.096 1.00 24.42 N ATOM 0 H HIS A 8 16.185 32.098 -8.234 1.00 2.34 H new ATOM 0 HA HIS A 8 14.512 29.918 -9.098 1.00 44.51 H new ATOM 0 HB2 HIS A 8 16.076 30.581 -6.810 1.00 32.44 H new ATOM 0 HB3 HIS A 8 14.425 30.492 -6.230 1.00 32.44 H new ATOM 0 HD1 HIS A 8 17.293 28.397 -6.951 1.00 5.45 H new ATOM 0 HD2 HIS A 8 13.141 27.905 -7.085 1.00 40.35 H new ATOM 0 HE1 HIS A 8 16.862 25.905 -7.072 1.00 2.23 H new ATOM 135 N SER A 9 12.446 31.331 -9.417 1.00 2.30 N ATOM 136 CA SER A 9 11.065 31.846 -9.544 1.00 52.53 C ATOM 137 C SER A 9 10.048 30.688 -9.636 1.00 22.25 C ATOM 138 O SER A 9 8.909 30.805 -9.179 1.00 50.45 O ATOM 139 CB SER A 9 10.973 32.750 -10.797 1.00 63.34 C ATOM 140 OG SER A 9 11.843 33.870 -10.691 1.00 44.41 O ATOM 0 H SER A 9 12.816 30.956 -10.291 1.00 2.30 H new ATOM 0 HA SER A 9 10.821 32.429 -8.656 1.00 52.53 H new ATOM 0 HB2 SER A 9 11.228 32.172 -11.685 1.00 63.34 H new ATOM 0 HB3 SER A 9 9.947 33.095 -10.925 1.00 63.34 H new ATOM 0 HG SER A 9 12.523 33.824 -11.395 1.00 44.41 H new ATOM 146 N HIS A 10 10.474 29.570 -10.244 1.00 14.03 N ATOM 147 CA HIS A 10 9.646 28.350 -10.398 1.00 35.54 C ATOM 148 C HIS A 10 10.015 27.269 -9.353 1.00 61.41 C ATOM 149 O HIS A 10 10.910 27.461 -8.516 1.00 42.00 O ATOM 150 CB HIS A 10 9.801 27.782 -11.830 1.00 54.21 C ATOM 151 CG HIS A 10 9.339 28.718 -12.918 1.00 42.11 C ATOM 152 ND1 HIS A 10 8.026 28.805 -13.331 1.00 22.14 N ATOM 153 CD2 HIS A 10 10.018 29.613 -13.674 1.00 20.34 C ATOM 154 CE1 HIS A 10 7.923 29.702 -14.286 1.00 72.40 C ATOM 155 NE2 HIS A 10 9.113 30.205 -14.511 1.00 74.13 N ATOM 0 H HIS A 10 11.407 29.480 -10.647 1.00 14.03 H new ATOM 0 HA HIS A 10 8.606 28.631 -10.229 1.00 35.54 H new ATOM 0 HB2 HIS A 10 10.849 27.535 -11.999 1.00 54.21 H new ATOM 0 HB3 HIS A 10 9.238 26.852 -11.903 1.00 54.21 H new ATOM 0 HD2 HIS A 10 11.077 29.821 -13.625 1.00 20.34 H new ATOM 0 HE1 HIS A 10 7.013 29.978 -14.798 1.00 72.40 H new ATOM 0 HE2 HIS A 10 9.329 30.924 -15.201 1.00 74.13 H new ATOM 164 N MET A 11 9.304 26.130 -9.427 1.00 53.12 N ATOM 165 CA MET A 11 9.509 24.968 -8.528 1.00 72.00 C ATOM 166 C MET A 11 10.844 24.205 -8.769 1.00 30.12 C ATOM 167 O MET A 11 11.699 24.625 -9.553 1.00 22.41 O ATOM 168 CB MET A 11 8.290 24.006 -8.638 1.00 21.04 C ATOM 169 CG MET A 11 7.837 23.662 -10.069 1.00 13.21 C ATOM 170 SD MET A 11 9.133 22.920 -11.089 1.00 24.41 S ATOM 171 CE MET A 11 8.264 22.634 -12.632 1.00 71.00 C ATOM 0 H MET A 11 8.565 25.984 -10.115 1.00 53.12 H new ATOM 0 HA MET A 11 9.586 25.364 -7.515 1.00 72.00 H new ATOM 0 HB2 MET A 11 8.535 23.078 -8.121 1.00 21.04 H new ATOM 0 HB3 MET A 11 7.449 24.453 -8.108 1.00 21.04 H new ATOM 0 HG2 MET A 11 6.992 22.976 -10.017 1.00 13.21 H new ATOM 0 HG3 MET A 11 7.481 24.570 -10.555 1.00 13.21 H new ATOM 0 HE1 MET A 11 8.943 22.179 -13.353 1.00 71.00 H new ATOM 0 HE2 MET A 11 7.421 21.966 -12.456 1.00 71.00 H new ATOM 0 HE3 MET A 11 7.899 23.583 -13.025 1.00 71.00 H new ATOM 181 N ASP A 12 11.018 23.095 -8.034 1.00 42.03 N ATOM 182 CA ASP A 12 12.157 22.165 -8.193 1.00 31.34 C ATOM 183 C ASP A 12 11.661 20.763 -8.564 1.00 41.52 C ATOM 184 O ASP A 12 10.521 20.415 -8.271 1.00 14.22 O ATOM 185 CB ASP A 12 12.970 22.099 -6.881 1.00 71.41 C ATOM 186 CG ASP A 12 13.703 23.406 -6.590 1.00 4.21 C ATOM 187 OD1 ASP A 12 13.065 24.368 -6.103 1.00 71.33 O ATOM 188 OD2 ASP A 12 14.914 23.496 -6.871 1.00 14.12 O ATOM 0 H ASP A 12 10.366 22.811 -7.303 1.00 42.03 H new ATOM 0 HA ASP A 12 12.795 22.534 -8.996 1.00 31.34 H new ATOM 0 HB2 ASP A 12 12.301 21.868 -6.052 1.00 71.41 H new ATOM 0 HB3 ASP A 12 13.693 21.285 -6.944 1.00 71.41 H new ATOM 193 N THR A 13 12.542 19.968 -9.197 1.00 75.54 N ATOM 194 CA THR A 13 12.288 18.537 -9.508 1.00 31.14 C ATOM 195 C THR A 13 11.890 17.731 -8.237 1.00 43.23 C ATOM 196 O THR A 13 12.381 18.044 -7.137 1.00 33.02 O ATOM 197 CB THR A 13 13.549 17.873 -10.181 1.00 20.00 C ATOM 198 OG1 THR A 13 13.356 16.455 -10.373 1.00 12.53 O ATOM 199 CG2 THR A 13 14.818 18.099 -9.362 1.00 3.54 C ATOM 0 H THR A 13 13.456 20.295 -9.511 1.00 75.54 H new ATOM 0 HA THR A 13 11.452 18.509 -10.207 1.00 31.14 H new ATOM 0 HB THR A 13 13.669 18.355 -11.151 1.00 20.00 H new ATOM 0 HG1 THR A 13 14.224 16.023 -10.514 1.00 12.53 H new ATOM 0 HG21 THR A 13 15.663 17.625 -9.862 1.00 3.54 H new ATOM 0 HG22 THR A 13 15.005 19.169 -9.269 1.00 3.54 H new ATOM 0 HG23 THR A 13 14.693 17.665 -8.370 1.00 3.54 H new ATOM 207 N PRO A 14 10.982 16.692 -8.367 1.00 13.33 N ATOM 208 CA PRO A 14 10.593 15.791 -7.242 1.00 73.44 C ATOM 209 C PRO A 14 11.799 15.293 -6.412 1.00 54.34 C ATOM 210 O PRO A 14 11.709 15.141 -5.187 1.00 33.15 O ATOM 211 CB PRO A 14 9.908 14.606 -7.957 1.00 1.55 C ATOM 212 CG PRO A 14 9.371 15.161 -9.244 1.00 14.12 C ATOM 213 CD PRO A 14 10.249 16.342 -9.619 1.00 13.23 C ATOM 0 HA PRO A 14 9.959 16.307 -6.520 1.00 73.44 H new ATOM 0 HB2 PRO A 14 10.617 13.800 -8.144 1.00 1.55 H new ATOM 0 HB3 PRO A 14 9.107 14.191 -7.346 1.00 1.55 H new ATOM 0 HG2 PRO A 14 9.388 14.403 -10.028 1.00 14.12 H new ATOM 0 HG3 PRO A 14 8.334 15.474 -9.126 1.00 14.12 H new ATOM 0 HD2 PRO A 14 10.940 16.081 -10.421 1.00 13.23 H new ATOM 0 HD3 PRO A 14 9.651 17.181 -9.974 1.00 13.23 H new ATOM 221 N GLU A 15 12.918 15.054 -7.130 1.00 1.54 N ATOM 222 CA GLU A 15 14.215 14.660 -6.554 1.00 20.12 C ATOM 223 C GLU A 15 14.687 15.625 -5.436 1.00 11.35 C ATOM 224 O GLU A 15 14.882 15.180 -4.316 1.00 4.54 O ATOM 225 CB GLU A 15 15.280 14.581 -7.676 1.00 63.11 C ATOM 226 CG GLU A 15 14.944 13.585 -8.802 1.00 71.01 C ATOM 227 CD GLU A 15 15.997 13.584 -9.918 1.00 72.40 C ATOM 228 OE1 GLU A 15 15.895 14.420 -10.845 1.00 64.12 O ATOM 229 OE2 GLU A 15 16.946 12.766 -9.861 1.00 1.14 O ATOM 0 H GLU A 15 12.942 15.132 -8.147 1.00 1.54 H new ATOM 0 HA GLU A 15 14.085 13.681 -6.094 1.00 20.12 H new ATOM 0 HB2 GLU A 15 15.407 15.573 -8.110 1.00 63.11 H new ATOM 0 HB3 GLU A 15 16.236 14.302 -7.234 1.00 63.11 H new ATOM 0 HG2 GLU A 15 14.862 12.582 -8.383 1.00 71.01 H new ATOM 0 HG3 GLU A 15 13.971 13.834 -9.225 1.00 71.01 H new ATOM 236 N ASN A 16 14.822 16.944 -5.746 1.00 73.43 N ATOM 237 CA ASN A 16 15.277 17.976 -4.762 1.00 74.22 C ATOM 238 C ASN A 16 14.351 18.039 -3.525 1.00 0.32 C ATOM 239 O ASN A 16 14.827 18.018 -2.376 1.00 62.05 O ATOM 240 CB ASN A 16 15.353 19.389 -5.410 1.00 42.41 C ATOM 241 CG ASN A 16 16.440 19.539 -6.469 1.00 13.35 C ATOM 242 OD1 ASN A 16 17.464 18.867 -6.436 1.00 54.43 O ATOM 243 ND2 ASN A 16 16.244 20.457 -7.391 1.00 23.41 N ATOM 0 H ASN A 16 14.622 17.322 -6.672 1.00 73.43 H new ATOM 0 HA ASN A 16 16.274 17.673 -4.442 1.00 74.22 H new ATOM 0 HB2 ASN A 16 14.388 19.621 -5.862 1.00 42.41 H new ATOM 0 HB3 ASN A 16 15.523 20.126 -4.626 1.00 42.41 H new ATOM 0 HD21 ASN A 16 16.955 20.624 -8.103 1.00 23.41 H new ATOM 0 HD22 ASN A 16 15.381 21.001 -7.394 1.00 23.41 H new ATOM 250 N VAL A 17 13.027 18.100 -3.799 1.00 73.11 N ATOM 251 CA VAL A 17 11.962 18.148 -2.762 1.00 52.23 C ATOM 252 C VAL A 17 12.161 17.023 -1.714 1.00 43.41 C ATOM 253 O VAL A 17 12.218 17.257 -0.504 1.00 30.41 O ATOM 254 CB VAL A 17 10.529 17.985 -3.410 1.00 64.14 C ATOM 255 CG1 VAL A 17 9.404 18.183 -2.363 1.00 62.40 C ATOM 256 CG2 VAL A 17 10.339 18.920 -4.631 1.00 11.42 C ATOM 0 H VAL A 17 12.662 18.118 -4.751 1.00 73.11 H new ATOM 0 HA VAL A 17 12.032 19.121 -2.275 1.00 52.23 H new ATOM 0 HB VAL A 17 10.458 16.961 -3.775 1.00 64.14 H new ATOM 0 HG11 VAL A 17 8.434 18.064 -2.845 1.00 62.40 H new ATOM 0 HG12 VAL A 17 9.510 17.442 -1.571 1.00 62.40 H new ATOM 0 HG13 VAL A 17 9.476 19.183 -1.936 1.00 62.40 H new ATOM 0 HG21 VAL A 17 9.342 18.777 -5.047 1.00 11.42 H new ATOM 0 HG22 VAL A 17 10.456 19.957 -4.317 1.00 11.42 H new ATOM 0 HG23 VAL A 17 11.086 18.684 -5.389 1.00 11.42 H new ATOM 266 N LEU A 18 12.323 15.818 -2.248 1.00 20.24 N ATOM 267 CA LEU A 18 12.566 14.584 -1.494 1.00 64.31 C ATOM 268 C LEU A 18 13.939 14.603 -0.760 1.00 70.44 C ATOM 269 O LEU A 18 14.013 14.267 0.420 1.00 73.54 O ATOM 270 CB LEU A 18 12.446 13.425 -2.509 1.00 54.45 C ATOM 271 CG LEU A 18 12.844 11.995 -2.055 1.00 45.12 C ATOM 272 CD1 LEU A 18 12.208 11.597 -0.711 1.00 42.35 C ATOM 273 CD2 LEU A 18 12.471 10.994 -3.151 1.00 4.43 C ATOM 0 H LEU A 18 12.288 15.663 -3.256 1.00 20.24 H new ATOM 0 HA LEU A 18 11.836 14.465 -0.694 1.00 64.31 H new ATOM 0 HB2 LEU A 18 11.411 13.388 -2.849 1.00 54.45 H new ATOM 0 HB3 LEU A 18 13.057 13.679 -3.375 1.00 54.45 H new ATOM 0 HG LEU A 18 13.922 11.985 -1.895 1.00 45.12 H new ATOM 0 HD11 LEU A 18 12.522 10.588 -0.445 1.00 42.35 H new ATOM 0 HD12 LEU A 18 12.529 12.293 0.064 1.00 42.35 H new ATOM 0 HD13 LEU A 18 11.122 11.628 -0.799 1.00 42.35 H new ATOM 0 HD21 LEU A 18 12.749 9.988 -2.835 1.00 4.43 H new ATOM 0 HD22 LEU A 18 11.397 11.034 -3.330 1.00 4.43 H new ATOM 0 HD23 LEU A 18 13.001 11.246 -4.069 1.00 4.43 H new ATOM 285 N GLN A 19 14.998 15.057 -1.449 1.00 42.45 N ATOM 286 CA GLN A 19 16.374 15.115 -0.886 1.00 54.22 C ATOM 287 C GLN A 19 16.469 16.066 0.326 1.00 2.31 C ATOM 288 O GLN A 19 17.372 15.920 1.155 1.00 10.34 O ATOM 289 CB GLN A 19 17.390 15.524 -1.984 1.00 52.42 C ATOM 290 CG GLN A 19 17.607 14.456 -3.077 1.00 61.33 C ATOM 291 CD GLN A 19 18.424 14.926 -4.279 1.00 41.22 C ATOM 292 OE1 GLN A 19 18.211 14.474 -5.398 1.00 33.01 O ATOM 293 NE2 GLN A 19 19.379 15.817 -4.070 1.00 2.31 N ATOM 0 H GLN A 19 14.935 15.395 -2.409 1.00 42.45 H new ATOM 0 HA GLN A 19 16.621 14.116 -0.528 1.00 54.22 H new ATOM 0 HB2 GLN A 19 17.047 16.445 -2.455 1.00 52.42 H new ATOM 0 HB3 GLN A 19 18.348 15.745 -1.513 1.00 52.42 H new ATOM 0 HG2 GLN A 19 18.106 13.596 -2.631 1.00 61.33 H new ATOM 0 HG3 GLN A 19 16.634 14.113 -3.429 1.00 61.33 H new ATOM 0 HE21 GLN A 19 19.540 16.181 -3.131 1.00 2.31 H new ATOM 0 HE22 GLN A 19 19.954 16.140 -4.848 1.00 2.31 H new ATOM 302 N MET A 20 15.526 17.028 0.426 1.00 12.54 N ATOM 303 CA MET A 20 15.413 17.901 1.616 1.00 60.12 C ATOM 304 C MET A 20 15.078 17.075 2.889 1.00 33.13 C ATOM 305 O MET A 20 15.746 17.233 3.920 1.00 61.25 O ATOM 306 CB MET A 20 14.366 19.027 1.406 1.00 15.00 C ATOM 307 CG MET A 20 14.676 19.987 0.250 1.00 53.14 C ATOM 308 SD MET A 20 13.618 21.461 0.236 1.00 53.34 S ATOM 309 CE MET A 20 11.968 20.757 0.152 1.00 1.05 C ATOM 0 H MET A 20 14.835 17.220 -0.299 1.00 12.54 H new ATOM 0 HA MET A 20 16.385 18.373 1.759 1.00 60.12 H new ATOM 0 HB2 MET A 20 13.392 18.570 1.229 1.00 15.00 H new ATOM 0 HB3 MET A 20 14.284 19.604 2.327 1.00 15.00 H new ATOM 0 HG2 MET A 20 15.719 20.298 0.315 1.00 53.14 H new ATOM 0 HG3 MET A 20 14.560 19.456 -0.695 1.00 53.14 H new ATOM 0 HE1 MET A 20 11.374 21.309 -0.576 1.00 1.05 H new ATOM 0 HE2 MET A 20 12.033 19.712 -0.150 1.00 1.05 H new ATOM 0 HE3 MET A 20 11.494 20.822 1.131 1.00 1.05 H new ATOM 319 N LEU A 21 14.056 16.184 2.819 1.00 50.34 N ATOM 320 CA LEU A 21 13.702 15.323 3.978 1.00 25.03 C ATOM 321 C LEU A 21 14.784 14.244 4.218 1.00 51.33 C ATOM 322 O LEU A 21 15.077 13.900 5.363 1.00 3.21 O ATOM 323 CB LEU A 21 12.253 14.703 3.863 1.00 15.00 C ATOM 324 CG LEU A 21 11.926 13.658 2.719 1.00 33.53 C ATOM 325 CD1 LEU A 21 12.528 12.261 2.985 1.00 21.05 C ATOM 326 CD2 LEU A 21 10.408 13.530 2.478 1.00 2.34 C ATOM 0 H LEU A 21 13.474 16.044 1.993 1.00 50.34 H new ATOM 0 HA LEU A 21 13.676 15.967 4.857 1.00 25.03 H new ATOM 0 HB2 LEU A 21 12.030 14.221 4.815 1.00 15.00 H new ATOM 0 HB3 LEU A 21 11.554 15.532 3.754 1.00 15.00 H new ATOM 0 HG LEU A 21 12.398 14.057 1.821 1.00 33.53 H new ATOM 0 HD11 LEU A 21 12.268 11.591 2.165 1.00 21.05 H new ATOM 0 HD12 LEU A 21 13.613 12.340 3.059 1.00 21.05 H new ATOM 0 HD13 LEU A 21 12.128 11.864 3.918 1.00 21.05 H new ATOM 0 HD21 LEU A 21 10.225 12.804 1.686 1.00 2.34 H new ATOM 0 HD22 LEU A 21 9.921 13.198 3.395 1.00 2.34 H new ATOM 0 HD23 LEU A 21 10.004 14.498 2.183 1.00 2.34 H new ATOM 338 N GLU A 22 15.377 13.731 3.113 1.00 71.40 N ATOM 339 CA GLU A 22 16.403 12.664 3.158 1.00 20.11 C ATOM 340 C GLU A 22 17.655 13.118 3.919 1.00 34.21 C ATOM 341 O GLU A 22 18.188 12.364 4.720 1.00 70.50 O ATOM 342 CB GLU A 22 16.809 12.202 1.734 1.00 1.04 C ATOM 343 CG GLU A 22 15.699 11.507 0.925 1.00 2.35 C ATOM 344 CD GLU A 22 16.210 10.941 -0.411 1.00 12.54 C ATOM 345 OE1 GLU A 22 16.271 11.684 -1.413 1.00 34.02 O ATOM 346 OE2 GLU A 22 16.581 9.752 -0.455 1.00 74.41 O ATOM 0 H GLU A 22 15.157 14.045 2.168 1.00 71.40 H new ATOM 0 HA GLU A 22 15.953 11.824 3.687 1.00 20.11 H new ATOM 0 HB2 GLU A 22 17.155 13.070 1.173 1.00 1.04 H new ATOM 0 HB3 GLU A 22 17.655 11.520 1.819 1.00 1.04 H new ATOM 0 HG2 GLU A 22 15.273 10.699 1.519 1.00 2.35 H new ATOM 0 HG3 GLU A 22 14.896 12.218 0.731 1.00 2.35 H new ATOM 353 N ALA A 23 18.096 14.361 3.652 1.00 75.53 N ATOM 354 CA ALA A 23 19.285 14.956 4.298 1.00 62.41 C ATOM 355 C ALA A 23 19.108 15.089 5.833 1.00 60.31 C ATOM 356 O ALA A 23 20.069 14.926 6.592 1.00 33.21 O ATOM 357 CB ALA A 23 19.603 16.315 3.659 1.00 72.35 C ATOM 0 H ALA A 23 17.640 14.982 2.984 1.00 75.53 H new ATOM 0 HA ALA A 23 20.127 14.283 4.136 1.00 62.41 H new ATOM 0 HB1 ALA A 23 20.480 16.747 4.140 1.00 72.35 H new ATOM 0 HB2 ALA A 23 19.802 16.180 2.596 1.00 72.35 H new ATOM 0 HB3 ALA A 23 18.753 16.985 3.786 1.00 72.35 H new ATOM 363 N HIS A 24 17.870 15.384 6.279 1.00 1.12 N ATOM 364 CA HIS A 24 17.530 15.400 7.720 1.00 24.22 C ATOM 365 C HIS A 24 17.369 13.955 8.261 1.00 13.13 C ATOM 366 O HIS A 24 17.663 13.689 9.431 1.00 42.43 O ATOM 367 CB HIS A 24 16.239 16.226 7.973 1.00 63.43 C ATOM 368 CG HIS A 24 15.931 16.448 9.439 1.00 3.20 C ATOM 369 ND1 HIS A 24 16.503 17.457 10.188 1.00 42.20 N ATOM 370 CD2 HIS A 24 15.142 15.761 10.301 1.00 34.11 C ATOM 371 CE1 HIS A 24 16.081 17.373 11.433 1.00 13.10 C ATOM 372 NE2 HIS A 24 15.257 16.354 11.531 1.00 44.33 N ATOM 0 H HIS A 24 17.089 15.614 5.665 1.00 1.12 H new ATOM 0 HA HIS A 24 18.350 15.877 8.257 1.00 24.22 H new ATOM 0 HB2 HIS A 24 16.336 17.194 7.482 1.00 63.43 H new ATOM 0 HB3 HIS A 24 15.396 15.716 7.508 1.00 63.43 H new ATOM 0 HD2 HIS A 24 14.533 14.902 10.062 1.00 34.11 H new ATOM 0 HE1 HIS A 24 16.365 18.032 12.240 1.00 13.10 H new ATOM 0 HE2 HIS A 24 14.782 16.054 12.382 1.00 44.33 H new ATOM 381 N MET A 25 16.916 13.031 7.391 1.00 74.32 N ATOM 382 CA MET A 25 16.658 11.623 7.765 1.00 73.23 C ATOM 383 C MET A 25 17.968 10.812 7.921 1.00 1.55 C ATOM 384 O MET A 25 17.996 9.805 8.630 1.00 42.23 O ATOM 385 CB MET A 25 15.684 10.965 6.748 1.00 22.21 C ATOM 386 CG MET A 25 15.258 9.522 7.093 1.00 31.42 C ATOM 387 SD MET A 25 13.611 9.115 6.490 1.00 71.42 S ATOM 388 CE MET A 25 12.615 10.216 7.499 1.00 61.45 C ATOM 0 H MET A 25 16.719 13.237 6.412 1.00 74.32 H new ATOM 0 HA MET A 25 16.180 11.617 8.744 1.00 73.23 H new ATOM 0 HB2 MET A 25 14.790 11.583 6.672 1.00 22.21 H new ATOM 0 HB3 MET A 25 16.155 10.964 5.765 1.00 22.21 H new ATOM 0 HG2 MET A 25 15.978 8.824 6.666 1.00 31.42 H new ATOM 0 HG3 MET A 25 15.287 9.389 8.174 1.00 31.42 H new ATOM 0 HE1 MET A 25 11.814 9.649 7.974 1.00 61.45 H new ATOM 0 HE2 MET A 25 13.241 10.672 8.266 1.00 61.45 H new ATOM 0 HE3 MET A 25 12.185 10.996 6.871 1.00 61.45 H new ATOM 398 N GLN A 26 19.058 11.262 7.265 1.00 24.43 N ATOM 399 CA GLN A 26 20.427 10.732 7.527 1.00 74.25 C ATOM 400 C GLN A 26 20.846 10.909 9.015 1.00 15.23 C ATOM 401 O GLN A 26 21.762 10.237 9.492 1.00 64.32 O ATOM 402 CB GLN A 26 21.487 11.405 6.605 1.00 13.34 C ATOM 403 CG GLN A 26 21.150 11.394 5.101 1.00 62.31 C ATOM 404 CD GLN A 26 20.864 10.007 4.505 1.00 5.34 C ATOM 405 OE1 GLN A 26 21.432 8.995 4.907 1.00 2.53 O ATOM 406 NE2 GLN A 26 19.968 9.958 3.535 1.00 63.11 N ATOM 0 H GLN A 26 19.025 11.989 6.550 1.00 24.43 H new ATOM 0 HA GLN A 26 20.389 9.666 7.304 1.00 74.25 H new ATOM 0 HB2 GLN A 26 21.619 12.439 6.924 1.00 13.34 H new ATOM 0 HB3 GLN A 26 22.443 10.902 6.750 1.00 13.34 H new ATOM 0 HG2 GLN A 26 20.280 12.029 4.935 1.00 62.31 H new ATOM 0 HG3 GLN A 26 21.981 11.842 4.556 1.00 62.31 H new ATOM 0 HE21 GLN A 26 19.511 10.813 3.220 1.00 63.11 H new ATOM 0 HE22 GLN A 26 19.734 9.065 3.102 1.00 63.11 H new ATOM 415 N SER A 27 20.159 11.830 9.725 1.00 61.25 N ATOM 416 CA SER A 27 20.372 12.102 11.169 1.00 73.30 C ATOM 417 C SER A 27 19.017 12.130 11.949 1.00 52.11 C ATOM 418 O SER A 27 18.912 12.765 13.007 1.00 64.22 O ATOM 419 CB SER A 27 21.130 13.453 11.308 1.00 44.42 C ATOM 420 OG SER A 27 21.459 13.750 12.656 1.00 40.53 O ATOM 0 H SER A 27 19.432 12.413 9.310 1.00 61.25 H new ATOM 0 HA SER A 27 20.967 11.301 11.607 1.00 73.30 H new ATOM 0 HB2 SER A 27 22.043 13.418 10.713 1.00 44.42 H new ATOM 0 HB3 SER A 27 20.515 14.256 10.901 1.00 44.42 H new ATOM 0 HG SER A 27 20.698 13.532 13.234 1.00 40.53 H new ATOM 426 N TYR A 28 17.981 11.419 11.413 1.00 11.30 N ATOM 427 CA TYR A 28 16.613 11.342 12.031 1.00 15.33 C ATOM 428 C TYR A 28 16.640 10.844 13.510 1.00 71.03 C ATOM 429 O TYR A 28 17.619 10.231 13.957 1.00 22.42 O ATOM 430 CB TYR A 28 15.665 10.434 11.180 1.00 13.32 C ATOM 431 CG TYR A 28 15.870 8.911 11.360 1.00 35.55 C ATOM 432 CD1 TYR A 28 17.116 8.311 11.147 1.00 41.12 C ATOM 433 CD2 TYR A 28 14.822 8.080 11.775 1.00 63.22 C ATOM 434 CE1 TYR A 28 17.303 6.962 11.337 1.00 42.31 C ATOM 435 CE2 TYR A 28 15.014 6.729 11.973 1.00 22.12 C ATOM 436 CZ TYR A 28 16.253 6.178 11.753 1.00 42.34 C ATOM 437 OH TYR A 28 16.452 4.839 11.972 1.00 21.25 O ATOM 0 H TYR A 28 18.065 10.886 10.548 1.00 11.30 H new ATOM 0 HA TYR A 28 16.227 12.361 12.040 1.00 15.33 H new ATOM 0 HB2 TYR A 28 14.633 10.677 11.433 1.00 13.32 H new ATOM 0 HB3 TYR A 28 15.802 10.680 10.127 1.00 13.32 H new ATOM 0 HD1 TYR A 28 17.948 8.920 10.827 1.00 41.12 H new ATOM 0 HD2 TYR A 28 13.844 8.506 11.943 1.00 63.22 H new ATOM 0 HE1 TYR A 28 18.272 6.520 11.160 1.00 42.31 H new ATOM 0 HE2 TYR A 28 14.194 6.107 12.300 1.00 22.12 H new ATOM 0 HH TYR A 28 15.840 4.527 12.671 1.00 21.25 H new ATOM 447 N LYS A 29 15.547 11.092 14.250 1.00 4.03 N ATOM 448 CA LYS A 29 15.470 10.772 15.699 1.00 75.20 C ATOM 449 C LYS A 29 15.052 9.306 15.968 1.00 22.42 C ATOM 450 O LYS A 29 15.482 8.704 16.957 1.00 41.14 O ATOM 451 CB LYS A 29 14.504 11.760 16.418 1.00 63.30 C ATOM 452 CG LYS A 29 14.909 13.256 16.300 1.00 63.12 C ATOM 453 CD LYS A 29 16.376 13.536 16.726 1.00 60.01 C ATOM 454 CE LYS A 29 16.682 13.148 18.186 1.00 40.33 C ATOM 455 NZ LYS A 29 18.128 13.286 18.506 1.00 22.21 N ATOM 0 H LYS A 29 14.698 11.514 13.874 1.00 4.03 H new ATOM 0 HA LYS A 29 16.474 10.889 16.106 1.00 75.20 H new ATOM 0 HB2 LYS A 29 13.503 11.634 16.006 1.00 63.30 H new ATOM 0 HB3 LYS A 29 14.451 11.493 17.473 1.00 63.30 H new ATOM 0 HG2 LYS A 29 14.770 13.582 15.269 1.00 63.12 H new ATOM 0 HG3 LYS A 29 14.239 13.855 16.917 1.00 63.12 H new ATOM 0 HD2 LYS A 29 17.048 12.988 16.065 1.00 60.01 H new ATOM 0 HD3 LYS A 29 16.589 14.596 16.589 1.00 60.01 H new ATOM 0 HE2 LYS A 29 16.100 13.778 18.859 1.00 40.33 H new ATOM 0 HE3 LYS A 29 16.368 12.119 18.361 1.00 40.33 H new ATOM 0 HZ1 LYS A 29 18.292 13.016 19.497 1.00 22.21 H new ATOM 0 HZ2 LYS A 29 18.682 12.666 17.882 1.00 22.21 H new ATOM 0 HZ3 LYS A 29 18.422 14.273 18.363 1.00 22.21 H new ATOM 469 N GLY A 30 14.224 8.741 15.078 1.00 41.42 N ATOM 470 CA GLY A 30 13.671 7.384 15.253 1.00 51.12 C ATOM 471 C GLY A 30 12.190 7.382 15.636 1.00 34.21 C ATOM 472 O GLY A 30 11.475 6.420 15.348 1.00 0.03 O ATOM 0 H GLY A 30 13.919 9.204 14.222 1.00 41.42 H new ATOM 0 HA2 GLY A 30 13.801 6.823 14.327 1.00 51.12 H new ATOM 0 HA3 GLY A 30 14.240 6.863 16.023 1.00 51.12 H new ATOM 476 N ASN A 31 11.734 8.456 16.304 1.00 54.04 N ATOM 477 CA ASN A 31 10.327 8.603 16.739 1.00 31.25 C ATOM 478 C ASN A 31 9.395 8.833 15.529 1.00 10.55 C ATOM 479 O ASN A 31 9.156 9.979 15.130 1.00 31.12 O ATOM 480 CB ASN A 31 10.199 9.763 17.762 1.00 42.44 C ATOM 481 CG ASN A 31 11.079 9.594 19.005 1.00 2.11 C ATOM 482 OD1 ASN A 31 11.558 10.564 19.567 1.00 41.40 O ATOM 483 ND2 ASN A 31 11.272 8.377 19.472 1.00 60.14 N ATOM 0 H ASN A 31 12.326 9.247 16.559 1.00 54.04 H new ATOM 0 HA ASN A 31 10.019 7.677 17.225 1.00 31.25 H new ATOM 0 HB2 ASN A 31 10.459 10.700 17.269 1.00 42.44 H new ATOM 0 HB3 ASN A 31 9.158 9.846 18.074 1.00 42.44 H new ATOM 0 HD21 ASN A 31 11.829 8.237 20.315 1.00 60.14 H new ATOM 0 HD22 ASN A 31 10.865 7.575 18.990 1.00 60.14 H new ATOM 490 N ASP A 32 8.919 7.716 14.940 1.00 50.13 N ATOM 491 CA ASP A 32 8.076 7.703 13.724 1.00 13.40 C ATOM 492 C ASP A 32 8.672 8.554 12.564 1.00 12.34 C ATOM 493 O ASP A 32 8.247 9.697 12.342 1.00 53.31 O ATOM 494 CB ASP A 32 6.612 8.108 14.050 1.00 52.55 C ATOM 495 CG ASP A 32 5.884 7.032 14.867 1.00 32.43 C ATOM 496 OD1 ASP A 32 5.979 7.046 16.114 1.00 52.35 O ATOM 497 OD2 ASP A 32 5.239 6.151 14.261 1.00 24.13 O ATOM 0 H ASP A 32 9.112 6.782 15.301 1.00 50.13 H new ATOM 0 HA ASP A 32 8.063 6.675 13.363 1.00 13.40 H new ATOM 0 HB2 ASP A 32 6.611 9.046 14.605 1.00 52.55 H new ATOM 0 HB3 ASP A 32 6.070 8.286 13.121 1.00 52.55 H new ATOM 502 N PRO A 33 9.700 8.013 11.824 1.00 1.30 N ATOM 503 CA PRO A 33 10.284 8.703 10.641 1.00 22.13 C ATOM 504 C PRO A 33 9.253 8.923 9.502 1.00 43.04 C ATOM 505 O PRO A 33 9.422 9.831 8.680 1.00 31.42 O ATOM 506 CB PRO A 33 11.440 7.764 10.206 1.00 23.12 C ATOM 507 CG PRO A 33 11.105 6.426 10.800 1.00 63.13 C ATOM 508 CD PRO A 33 10.393 6.723 12.100 1.00 33.15 C ATOM 0 HA PRO A 33 10.623 9.711 10.880 1.00 22.13 H new ATOM 0 HB2 PRO A 33 11.512 7.706 9.120 1.00 23.12 H new ATOM 0 HB3 PRO A 33 12.401 8.127 10.571 1.00 23.12 H new ATOM 0 HG2 PRO A 33 10.470 5.848 10.129 1.00 63.13 H new ATOM 0 HG3 PRO A 33 12.006 5.837 10.973 1.00 63.13 H new ATOM 0 HD2 PRO A 33 9.687 5.935 12.361 1.00 33.15 H new ATOM 0 HD3 PRO A 33 11.093 6.812 12.931 1.00 33.15 H new ATOM 516 N LEU A 34 8.181 8.088 9.470 1.00 30.54 N ATOM 517 CA LEU A 34 7.042 8.277 8.539 1.00 45.33 C ATOM 518 C LEU A 34 6.354 9.619 8.788 1.00 23.31 C ATOM 519 O LEU A 34 5.964 10.280 7.837 1.00 55.15 O ATOM 520 CB LEU A 34 6.017 7.117 8.650 1.00 73.34 C ATOM 521 CG LEU A 34 4.732 7.204 7.748 1.00 12.22 C ATOM 522 CD1 LEU A 34 5.079 7.376 6.258 1.00 33.32 C ATOM 523 CD2 LEU A 34 3.818 5.978 7.953 1.00 54.13 C ATOM 0 H LEU A 34 8.084 7.277 10.081 1.00 30.54 H new ATOM 0 HA LEU A 34 7.445 8.273 7.526 1.00 45.33 H new ATOM 0 HB2 LEU A 34 6.533 6.187 8.414 1.00 73.34 H new ATOM 0 HB3 LEU A 34 5.696 7.048 9.689 1.00 73.34 H new ATOM 0 HG LEU A 34 4.189 8.095 8.063 1.00 12.22 H new ATOM 0 HD11 LEU A 34 4.160 7.431 5.674 1.00 33.32 H new ATOM 0 HD12 LEU A 34 5.651 8.293 6.121 1.00 33.32 H new ATOM 0 HD13 LEU A 34 5.672 6.525 5.922 1.00 33.32 H new ATOM 0 HD21 LEU A 34 2.939 6.069 7.315 1.00 54.13 H new ATOM 0 HD22 LEU A 34 4.363 5.070 7.693 1.00 54.13 H new ATOM 0 HD23 LEU A 34 3.506 5.927 8.996 1.00 54.13 H new ATOM 535 N GLY A 35 6.269 10.029 10.072 1.00 10.12 N ATOM 536 CA GLY A 35 5.700 11.330 10.451 1.00 24.13 C ATOM 537 C GLY A 35 6.318 12.521 9.697 1.00 10.41 C ATOM 538 O GLY A 35 5.623 13.482 9.379 1.00 12.42 O ATOM 0 H GLY A 35 6.590 9.471 10.863 1.00 10.12 H new ATOM 0 HA2 GLY A 35 4.626 11.314 10.268 1.00 24.13 H new ATOM 0 HA3 GLY A 35 5.838 11.479 11.522 1.00 24.13 H new ATOM 542 N GLU A 36 7.626 12.409 9.385 1.00 71.53 N ATOM 543 CA GLU A 36 8.384 13.419 8.606 1.00 34.33 C ATOM 544 C GLU A 36 8.009 13.383 7.098 1.00 12.02 C ATOM 545 O GLU A 36 7.894 14.429 6.445 1.00 13.35 O ATOM 546 CB GLU A 36 9.905 13.159 8.774 1.00 33.42 C ATOM 547 CG GLU A 36 10.375 13.059 10.244 1.00 63.43 C ATOM 548 CD GLU A 36 11.881 12.777 10.381 1.00 62.13 C ATOM 549 OE1 GLU A 36 12.674 13.732 10.303 1.00 13.33 O ATOM 550 OE2 GLU A 36 12.280 11.606 10.553 1.00 34.13 O ATOM 0 H GLU A 36 8.193 11.610 9.667 1.00 71.53 H new ATOM 0 HA GLU A 36 8.126 14.407 8.988 1.00 34.33 H new ATOM 0 HB2 GLU A 36 10.163 12.234 8.259 1.00 33.42 H new ATOM 0 HB3 GLU A 36 10.455 13.961 8.283 1.00 33.42 H new ATOM 0 HG2 GLU A 36 10.138 13.990 10.759 1.00 63.43 H new ATOM 0 HG3 GLU A 36 9.817 12.268 10.744 1.00 63.43 H new ATOM 557 N TRP A 37 7.838 12.161 6.556 1.00 11.22 N ATOM 558 CA TRP A 37 7.395 11.946 5.157 1.00 45.24 C ATOM 559 C TRP A 37 5.959 12.446 4.925 1.00 13.22 C ATOM 560 O TRP A 37 5.696 13.078 3.914 1.00 2.11 O ATOM 561 CB TRP A 37 7.469 10.452 4.776 1.00 54.21 C ATOM 562 CG TRP A 37 8.860 9.946 4.521 1.00 25.11 C ATOM 563 CD1 TRP A 37 9.809 9.653 5.442 1.00 41.30 C ATOM 564 CD2 TRP A 37 9.445 9.663 3.243 1.00 24.43 C ATOM 565 NE1 TRP A 37 10.938 9.186 4.822 1.00 60.42 N ATOM 566 CE2 TRP A 37 10.739 9.182 3.476 1.00 44.23 C ATOM 567 CE3 TRP A 37 8.989 9.762 1.928 1.00 71.10 C ATOM 568 CZ2 TRP A 37 11.584 8.798 2.449 1.00 31.51 C ATOM 569 CZ3 TRP A 37 9.833 9.385 0.908 1.00 31.13 C ATOM 570 CH2 TRP A 37 11.117 8.905 1.176 1.00 5.41 C ATOM 0 H TRP A 37 8.001 11.296 7.071 1.00 11.22 H new ATOM 0 HA TRP A 37 8.073 12.521 4.527 1.00 45.24 H new ATOM 0 HB2 TRP A 37 7.022 9.863 5.577 1.00 54.21 H new ATOM 0 HB3 TRP A 37 6.866 10.287 3.883 1.00 54.21 H new ATOM 0 HD1 TRP A 37 9.693 9.770 6.509 1.00 41.30 H new ATOM 0 HE1 TRP A 37 11.792 8.889 5.294 1.00 60.42 H new ATOM 0 HE3 TRP A 37 7.995 10.127 1.715 1.00 71.10 H new ATOM 0 HZ2 TRP A 37 12.578 8.427 2.651 1.00 31.51 H new ATOM 0 HZ3 TRP A 37 9.497 9.462 -0.116 1.00 31.13 H new ATOM 0 HH2 TRP A 37 11.753 8.612 0.354 1.00 5.41 H new ATOM 581 N GLU A 38 5.054 12.160 5.882 1.00 32.21 N ATOM 582 CA GLU A 38 3.620 12.523 5.799 1.00 25.32 C ATOM 583 C GLU A 38 3.434 14.037 5.577 1.00 74.31 C ATOM 584 O GLU A 38 2.518 14.451 4.869 1.00 44.42 O ATOM 585 CB GLU A 38 2.876 12.073 7.083 1.00 60.33 C ATOM 586 CG GLU A 38 2.867 10.547 7.309 1.00 31.12 C ATOM 587 CD GLU A 38 2.056 10.116 8.542 1.00 53.22 C ATOM 588 OE1 GLU A 38 0.814 10.028 8.437 1.00 41.44 O ATOM 589 OE2 GLU A 38 2.647 9.887 9.620 1.00 34.43 O ATOM 0 H GLU A 38 5.297 11.667 6.741 1.00 32.21 H new ATOM 0 HA GLU A 38 3.194 12.004 4.940 1.00 25.32 H new ATOM 0 HB2 GLU A 38 3.339 12.554 7.945 1.00 60.33 H new ATOM 0 HB3 GLU A 38 1.846 12.428 7.036 1.00 60.33 H new ATOM 0 HG2 GLU A 38 2.457 10.059 6.425 1.00 31.12 H new ATOM 0 HG3 GLU A 38 3.894 10.198 7.419 1.00 31.12 H new ATOM 596 N ARG A 39 4.358 14.831 6.163 1.00 63.32 N ATOM 597 CA ARG A 39 4.413 16.301 5.988 1.00 35.14 C ATOM 598 C ARG A 39 4.642 16.671 4.504 1.00 23.52 C ATOM 599 O ARG A 39 4.024 17.593 3.986 1.00 13.14 O ATOM 600 CB ARG A 39 5.550 16.922 6.851 1.00 21.51 C ATOM 601 CG ARG A 39 5.616 16.421 8.307 1.00 61.21 C ATOM 602 CD ARG A 39 4.318 16.645 9.106 1.00 21.03 C ATOM 603 NE ARG A 39 4.374 15.990 10.422 1.00 11.21 N ATOM 604 CZ ARG A 39 3.520 16.179 11.406 1.00 33.21 C ATOM 605 NH1 ARG A 39 2.518 16.998 11.294 1.00 34.34 N ATOM 606 NH2 ARG A 39 3.676 15.522 12.505 1.00 44.23 N ATOM 0 H ARG A 39 5.090 14.469 6.774 1.00 63.32 H new ATOM 0 HA ARG A 39 3.455 16.704 6.315 1.00 35.14 H new ATOM 0 HB2 ARG A 39 6.505 16.715 6.369 1.00 21.51 H new ATOM 0 HB3 ARG A 39 5.426 18.005 6.861 1.00 21.51 H new ATOM 0 HG2 ARG A 39 5.849 15.356 8.304 1.00 61.21 H new ATOM 0 HG3 ARG A 39 6.436 16.926 8.817 1.00 61.21 H new ATOM 0 HD2 ARG A 39 4.151 17.714 9.238 1.00 21.03 H new ATOM 0 HD3 ARG A 39 3.470 16.257 8.541 1.00 21.03 H new ATOM 0 HE ARG A 39 5.138 15.335 10.586 1.00 11.21 H new ATOM 0 HH11 ARG A 39 2.377 17.515 10.426 1.00 34.34 H new ATOM 0 HH12 ARG A 39 1.873 17.124 12.074 1.00 34.34 H new ATOM 0 HH21 ARG A 39 4.452 14.868 12.602 1.00 44.23 H new ATOM 0 HH22 ARG A 39 3.023 15.657 13.277 1.00 44.23 H new ATOM 620 N TYR A 40 5.550 15.930 3.843 1.00 13.41 N ATOM 621 CA TYR A 40 5.886 16.131 2.415 1.00 62.42 C ATOM 622 C TYR A 40 4.828 15.534 1.465 1.00 34.44 C ATOM 623 O TYR A 40 4.586 16.114 0.420 1.00 54.50 O ATOM 624 CB TYR A 40 7.288 15.546 2.102 1.00 55.15 C ATOM 625 CG TYR A 40 8.449 16.481 2.472 1.00 32.41 C ATOM 626 CD1 TYR A 40 8.775 16.748 3.806 1.00 51.44 C ATOM 627 CD2 TYR A 40 9.222 17.096 1.481 1.00 31.13 C ATOM 628 CE1 TYR A 40 9.826 17.590 4.130 1.00 35.43 C ATOM 629 CE2 TYR A 40 10.268 17.932 1.809 1.00 25.34 C ATOM 630 CZ TYR A 40 10.567 18.176 3.129 1.00 72.10 C ATOM 631 OH TYR A 40 11.611 19.018 3.448 1.00 10.25 O ATOM 0 H TYR A 40 6.074 15.173 4.282 1.00 13.41 H new ATOM 0 HA TYR A 40 5.897 17.207 2.240 1.00 62.42 H new ATOM 0 HB2 TYR A 40 7.407 14.605 2.639 1.00 55.15 H new ATOM 0 HB3 TYR A 40 7.345 15.315 1.038 1.00 55.15 H new ATOM 0 HD1 TYR A 40 8.198 16.290 4.596 1.00 51.44 H new ATOM 0 HD2 TYR A 40 8.995 16.913 0.441 1.00 31.13 H new ATOM 0 HE1 TYR A 40 10.063 17.786 5.165 1.00 35.43 H new ATOM 0 HE2 TYR A 40 10.853 18.396 1.029 1.00 25.34 H new ATOM 0 HH TYR A 40 11.999 18.747 4.306 1.00 10.25 H new ATOM 641 N ILE A 41 4.220 14.379 1.825 1.00 52.33 N ATOM 642 CA ILE A 41 3.156 13.750 1.000 1.00 14.44 C ATOM 643 C ILE A 41 1.924 14.694 0.909 1.00 11.43 C ATOM 644 O ILE A 41 1.474 15.002 -0.190 1.00 13.10 O ATOM 645 CB ILE A 41 2.739 12.290 1.504 1.00 0.24 C ATOM 646 CG1 ILE A 41 3.726 11.169 0.999 1.00 13.05 C ATOM 647 CG2 ILE A 41 1.293 11.915 1.069 1.00 1.13 C ATOM 648 CD1 ILE A 41 5.166 11.268 1.467 1.00 15.03 C ATOM 0 H ILE A 41 4.445 13.864 2.676 1.00 52.33 H new ATOM 0 HA ILE A 41 3.570 13.605 0.002 1.00 14.44 H new ATOM 0 HB ILE A 41 2.790 12.337 2.592 1.00 0.24 H new ATOM 0 HG12 ILE A 41 3.332 10.202 1.312 1.00 13.05 H new ATOM 0 HG13 ILE A 41 3.721 11.177 -0.091 1.00 13.05 H new ATOM 0 HG21 ILE A 41 1.051 10.916 1.432 1.00 1.13 H new ATOM 0 HG22 ILE A 41 0.589 12.634 1.488 1.00 1.13 H new ATOM 0 HG23 ILE A 41 1.224 11.932 -0.019 1.00 1.13 H new ATOM 0 HD11 ILE A 41 5.741 10.441 1.052 1.00 15.03 H new ATOM 0 HD12 ILE A 41 5.594 12.212 1.130 1.00 15.03 H new ATOM 0 HD13 ILE A 41 5.199 11.222 2.556 1.00 15.03 H new ATOM 660 N GLN A 42 1.419 15.186 2.065 1.00 61.24 N ATOM 661 CA GLN A 42 0.280 16.144 2.079 1.00 11.43 C ATOM 662 C GLN A 42 0.637 17.467 1.346 1.00 55.24 C ATOM 663 O GLN A 42 -0.170 17.993 0.578 1.00 21.43 O ATOM 664 CB GLN A 42 -0.186 16.468 3.532 1.00 75.14 C ATOM 665 CG GLN A 42 0.891 17.133 4.426 1.00 52.03 C ATOM 666 CD GLN A 42 0.334 17.954 5.584 1.00 52.12 C ATOM 667 OE1 GLN A 42 0.112 17.449 6.676 1.00 25.24 O ATOM 668 NE2 GLN A 42 0.119 19.239 5.348 1.00 0.24 N ATOM 0 H GLN A 42 1.774 14.942 2.990 1.00 61.24 H new ATOM 0 HA GLN A 42 -0.538 15.656 1.550 1.00 11.43 H new ATOM 0 HB2 GLN A 42 -1.054 17.126 3.482 1.00 75.14 H new ATOM 0 HB3 GLN A 42 -0.514 15.544 4.008 1.00 75.14 H new ATOM 0 HG2 GLN A 42 1.541 16.356 4.828 1.00 52.03 H new ATOM 0 HG3 GLN A 42 1.512 17.779 3.805 1.00 52.03 H new ATOM 0 HE21 GLN A 42 0.315 19.628 4.426 1.00 0.24 H new ATOM 0 HE22 GLN A 42 -0.243 19.840 6.089 1.00 0.24 H new ATOM 677 N TRP A 43 1.873 17.960 1.584 1.00 30.02 N ATOM 678 CA TRP A 43 2.369 19.236 1.036 1.00 72.32 C ATOM 679 C TRP A 43 2.458 19.184 -0.499 1.00 25.44 C ATOM 680 O TRP A 43 2.075 20.122 -1.184 1.00 31.31 O ATOM 681 CB TRP A 43 3.756 19.563 1.643 1.00 70.34 C ATOM 682 CG TRP A 43 4.380 20.857 1.166 1.00 53.12 C ATOM 683 CD1 TRP A 43 4.167 22.117 1.661 1.00 44.14 C ATOM 684 CD2 TRP A 43 5.326 21.006 0.095 1.00 13.33 C ATOM 685 NE1 TRP A 43 4.918 23.027 0.961 1.00 61.23 N ATOM 686 CE2 TRP A 43 5.634 22.370 -0.004 1.00 43.42 C ATOM 687 CE3 TRP A 43 5.937 20.108 -0.791 1.00 11.13 C ATOM 688 CZ2 TRP A 43 6.524 22.862 -0.950 1.00 64.31 C ATOM 689 CZ3 TRP A 43 6.819 20.600 -1.726 1.00 73.31 C ATOM 690 CH2 TRP A 43 7.103 21.969 -1.800 1.00 1.12 C ATOM 0 H TRP A 43 2.557 17.477 2.167 1.00 30.02 H new ATOM 0 HA TRP A 43 1.664 20.023 1.304 1.00 72.32 H new ATOM 0 HB2 TRP A 43 3.660 19.603 2.728 1.00 70.34 H new ATOM 0 HB3 TRP A 43 4.437 18.744 1.414 1.00 70.34 H new ATOM 0 HD1 TRP A 43 3.506 22.358 2.480 1.00 44.14 H new ATOM 0 HE1 TRP A 43 4.940 24.032 1.132 1.00 61.23 H new ATOM 0 HE3 TRP A 43 5.720 19.051 -0.741 1.00 11.13 H new ATOM 0 HZ2 TRP A 43 6.749 23.917 -1.010 1.00 64.31 H new ATOM 0 HZ3 TRP A 43 7.300 19.919 -2.413 1.00 73.31 H new ATOM 0 HH2 TRP A 43 7.796 22.325 -2.548 1.00 1.12 H new ATOM 701 N VAL A 44 2.979 18.072 -1.013 1.00 31.42 N ATOM 702 CA VAL A 44 3.186 17.872 -2.456 1.00 60.34 C ATOM 703 C VAL A 44 1.843 17.621 -3.203 1.00 43.24 C ATOM 704 O VAL A 44 1.758 17.798 -4.413 1.00 40.32 O ATOM 705 CB VAL A 44 4.229 16.723 -2.715 1.00 25.23 C ATOM 706 CG1 VAL A 44 3.637 15.314 -2.500 1.00 64.44 C ATOM 707 CG2 VAL A 44 4.877 16.864 -4.093 1.00 31.55 C ATOM 0 H VAL A 44 3.272 17.278 -0.443 1.00 31.42 H new ATOM 0 HA VAL A 44 3.601 18.793 -2.866 1.00 60.34 H new ATOM 0 HB VAL A 44 5.011 16.837 -1.965 1.00 25.23 H new ATOM 0 HG11 VAL A 44 4.404 14.564 -2.694 1.00 64.44 H new ATOM 0 HG12 VAL A 44 3.288 15.219 -1.472 1.00 64.44 H new ATOM 0 HG13 VAL A 44 2.801 15.163 -3.183 1.00 64.44 H new ATOM 0 HG21 VAL A 44 5.593 16.056 -4.243 1.00 31.55 H new ATOM 0 HG22 VAL A 44 4.108 16.815 -4.864 1.00 31.55 H new ATOM 0 HG23 VAL A 44 5.393 17.822 -4.156 1.00 31.55 H new ATOM 717 N GLU A 45 0.802 17.194 -2.464 1.00 32.22 N ATOM 718 CA GLU A 45 -0.575 17.090 -3.003 1.00 71.32 C ATOM 719 C GLU A 45 -1.234 18.482 -3.122 1.00 73.52 C ATOM 720 O GLU A 45 -1.796 18.827 -4.160 1.00 10.43 O ATOM 721 CB GLU A 45 -1.446 16.188 -2.101 1.00 50.13 C ATOM 722 CG GLU A 45 -1.005 14.720 -2.057 1.00 64.20 C ATOM 723 CD GLU A 45 -1.860 13.870 -1.111 1.00 14.54 C ATOM 724 OE1 GLU A 45 -2.941 13.408 -1.527 1.00 44.30 O ATOM 725 OE2 GLU A 45 -1.469 13.681 0.052 1.00 41.44 O ATOM 0 H GLU A 45 0.885 16.913 -1.487 1.00 32.22 H new ATOM 0 HA GLU A 45 -0.505 16.648 -3.997 1.00 71.32 H new ATOM 0 HB2 GLU A 45 -1.434 16.589 -1.087 1.00 50.13 H new ATOM 0 HB3 GLU A 45 -2.478 16.234 -2.450 1.00 50.13 H new ATOM 0 HG2 GLU A 45 -1.056 14.300 -3.062 1.00 64.20 H new ATOM 0 HG3 GLU A 45 0.037 14.668 -1.743 1.00 64.20 H new ATOM 732 N GLU A 46 -1.166 19.270 -2.031 1.00 13.55 N ATOM 733 CA GLU A 46 -1.832 20.594 -1.943 1.00 22.45 C ATOM 734 C GLU A 46 -1.108 21.678 -2.792 1.00 23.33 C ATOM 735 O GLU A 46 -1.753 22.560 -3.361 1.00 31.43 O ATOM 736 CB GLU A 46 -1.950 21.041 -0.454 1.00 22.03 C ATOM 737 CG GLU A 46 -0.600 21.189 0.277 1.00 63.12 C ATOM 738 CD GLU A 46 -0.696 21.658 1.738 1.00 20.05 C ATOM 739 OE1 GLU A 46 -1.052 22.834 1.966 1.00 74.32 O ATOM 740 OE2 GLU A 46 -0.376 20.868 2.658 1.00 51.11 O ATOM 0 H GLU A 46 -0.652 19.013 -1.188 1.00 13.55 H new ATOM 0 HA GLU A 46 -2.833 20.484 -2.361 1.00 22.45 H new ATOM 0 HB2 GLU A 46 -2.477 21.994 -0.414 1.00 22.03 H new ATOM 0 HB3 GLU A 46 -2.562 20.316 0.083 1.00 22.03 H new ATOM 0 HG2 GLU A 46 -0.085 20.229 0.253 1.00 63.12 H new ATOM 0 HG3 GLU A 46 0.019 21.896 -0.275 1.00 63.12 H new ATOM 747 N ASN A 47 0.237 21.595 -2.863 1.00 41.12 N ATOM 748 CA ASN A 47 1.081 22.519 -3.666 1.00 62.43 C ATOM 749 C ASN A 47 1.221 22.047 -5.128 1.00 42.45 C ATOM 750 O ASN A 47 1.320 22.876 -6.037 1.00 21.31 O ATOM 751 CB ASN A 47 2.491 22.689 -3.022 1.00 11.13 C ATOM 752 CG ASN A 47 2.516 23.586 -1.776 1.00 12.00 C ATOM 753 OD1 ASN A 47 3.493 24.270 -1.523 1.00 1.32 O ATOM 754 ND2 ASN A 47 1.453 23.610 -0.994 1.00 71.42 N ATOM 0 H ASN A 47 0.774 20.885 -2.365 1.00 41.12 H new ATOM 0 HA ASN A 47 0.576 23.485 -3.672 1.00 62.43 H new ATOM 0 HB2 ASN A 47 2.875 21.705 -2.754 1.00 11.13 H new ATOM 0 HB3 ASN A 47 3.170 23.104 -3.767 1.00 11.13 H new ATOM 0 HD21 ASN A 47 1.442 24.206 -0.166 1.00 71.42 H new ATOM 0 HD22 ASN A 47 0.642 23.033 -1.217 1.00 71.42 H new ATOM 761 N PHE A 48 1.239 20.715 -5.359 1.00 53.35 N ATOM 762 CA PHE A 48 1.374 20.137 -6.728 1.00 34.12 C ATOM 763 C PHE A 48 0.250 19.098 -7.042 1.00 64.52 C ATOM 764 O PHE A 48 0.543 17.914 -7.241 1.00 23.04 O ATOM 765 CB PHE A 48 2.784 19.485 -6.894 1.00 25.35 C ATOM 766 CG PHE A 48 3.960 20.425 -6.630 1.00 23.32 C ATOM 767 CD1 PHE A 48 4.375 21.338 -7.598 1.00 14.23 C ATOM 768 CD2 PHE A 48 4.641 20.406 -5.408 1.00 74.42 C ATOM 769 CE1 PHE A 48 5.431 22.194 -7.355 1.00 3.45 C ATOM 770 CE2 PHE A 48 5.696 21.265 -5.171 1.00 13.12 C ATOM 771 CZ PHE A 48 6.092 22.159 -6.143 1.00 14.33 C ATOM 0 H PHE A 48 1.162 20.016 -4.620 1.00 53.35 H new ATOM 0 HA PHE A 48 1.265 20.952 -7.444 1.00 34.12 H new ATOM 0 HB2 PHE A 48 2.858 18.635 -6.216 1.00 25.35 H new ATOM 0 HB3 PHE A 48 2.871 19.093 -7.907 1.00 25.35 H new ATOM 0 HD1 PHE A 48 3.865 21.376 -8.549 1.00 14.23 H new ATOM 0 HD2 PHE A 48 4.338 19.710 -4.640 1.00 74.42 H new ATOM 0 HE1 PHE A 48 5.741 22.894 -8.116 1.00 3.45 H new ATOM 0 HE2 PHE A 48 6.212 21.236 -4.223 1.00 13.12 H new ATOM 0 HZ PHE A 48 6.917 22.830 -5.957 1.00 14.33 H new ATOM 781 N PRO A 49 -1.065 19.511 -7.107 1.00 31.34 N ATOM 782 CA PRO A 49 -2.163 18.585 -7.513 1.00 32.14 C ATOM 783 C PRO A 49 -2.163 18.302 -9.036 1.00 51.12 C ATOM 784 O PRO A 49 -2.707 17.293 -9.495 1.00 54.41 O ATOM 785 CB PRO A 49 -3.434 19.343 -7.066 1.00 31.42 C ATOM 786 CG PRO A 49 -3.063 20.795 -7.162 1.00 23.22 C ATOM 787 CD PRO A 49 -1.595 20.871 -6.781 1.00 54.23 C ATOM 0 HA PRO A 49 -2.071 17.596 -7.063 1.00 32.14 H new ATOM 0 HB2 PRO A 49 -4.282 19.107 -7.708 1.00 31.42 H new ATOM 0 HB3 PRO A 49 -3.719 19.073 -6.049 1.00 31.42 H new ATOM 0 HG2 PRO A 49 -3.226 21.175 -8.171 1.00 23.22 H new ATOM 0 HG3 PRO A 49 -3.673 21.400 -6.491 1.00 23.22 H new ATOM 0 HD2 PRO A 49 -1.076 21.647 -7.344 1.00 54.23 H new ATOM 0 HD3 PRO A 49 -1.469 21.106 -5.724 1.00 54.23 H new ATOM 795 N GLU A 50 -1.544 19.220 -9.802 1.00 25.31 N ATOM 796 CA GLU A 50 -1.391 19.103 -11.264 1.00 41.51 C ATOM 797 C GLU A 50 -0.126 18.284 -11.630 1.00 14.24 C ATOM 798 O GLU A 50 -0.035 17.720 -12.722 1.00 55.03 O ATOM 799 CB GLU A 50 -1.315 20.517 -11.890 1.00 24.53 C ATOM 800 CG GLU A 50 -2.486 21.448 -11.510 1.00 63.04 C ATOM 801 CD GLU A 50 -2.406 22.830 -12.185 1.00 41.23 C ATOM 802 OE1 GLU A 50 -1.625 23.685 -11.718 1.00 13.11 O ATOM 803 OE2 GLU A 50 -3.122 23.068 -13.185 1.00 40.04 O ATOM 0 H GLU A 50 -1.132 20.071 -9.420 1.00 25.31 H new ATOM 0 HA GLU A 50 -2.257 18.575 -11.663 1.00 41.51 H new ATOM 0 HB2 GLU A 50 -0.380 20.986 -11.584 1.00 24.53 H new ATOM 0 HB3 GLU A 50 -1.282 20.419 -12.975 1.00 24.53 H new ATOM 0 HG2 GLU A 50 -3.426 20.970 -11.786 1.00 63.04 H new ATOM 0 HG3 GLU A 50 -2.501 21.580 -10.428 1.00 63.04 H new ATOM 810 N ASN A 51 0.840 18.222 -10.698 1.00 44.43 N ATOM 811 CA ASN A 51 2.126 17.518 -10.897 1.00 63.14 C ATOM 812 C ASN A 51 2.149 16.217 -10.048 1.00 44.34 C ATOM 813 O ASN A 51 2.649 16.207 -8.913 1.00 12.34 O ATOM 814 CB ASN A 51 3.294 18.456 -10.501 1.00 1.03 C ATOM 815 CG ASN A 51 3.187 19.859 -11.097 1.00 23.50 C ATOM 816 OD1 ASN A 51 2.520 20.727 -10.543 1.00 5.15 O ATOM 817 ND2 ASN A 51 3.852 20.107 -12.207 1.00 40.34 N ATOM 0 H ASN A 51 0.754 18.659 -9.781 1.00 44.43 H new ATOM 0 HA ASN A 51 2.239 17.245 -11.946 1.00 63.14 H new ATOM 0 HB2 ASN A 51 3.332 18.535 -9.415 1.00 1.03 H new ATOM 0 HB3 ASN A 51 4.234 18.006 -10.821 1.00 1.03 H new ATOM 0 HD21 ASN A 51 3.819 21.037 -12.624 1.00 40.34 H new ATOM 0 HD22 ASN A 51 4.400 19.369 -12.649 1.00 40.34 H new ATOM 824 N LYS A 52 1.565 15.131 -10.596 1.00 71.31 N ATOM 825 CA LYS A 52 1.404 13.843 -9.871 1.00 73.41 C ATOM 826 C LYS A 52 2.737 13.076 -9.718 1.00 41.01 C ATOM 827 O LYS A 52 2.936 12.360 -8.731 1.00 42.11 O ATOM 828 CB LYS A 52 0.340 12.958 -10.577 1.00 14.30 C ATOM 829 CG LYS A 52 -0.064 11.682 -9.802 1.00 13.44 C ATOM 830 CD LYS A 52 -0.606 11.956 -8.368 1.00 75.21 C ATOM 831 CE LYS A 52 -2.010 12.613 -8.318 1.00 23.44 C ATOM 832 NZ LYS A 52 -2.038 14.021 -8.819 1.00 74.01 N ATOM 0 H LYS A 52 1.193 15.116 -11.546 1.00 71.31 H new ATOM 0 HA LYS A 52 1.062 14.081 -8.864 1.00 73.41 H new ATOM 0 HB2 LYS A 52 -0.553 13.558 -10.751 1.00 14.30 H new ATOM 0 HB3 LYS A 52 0.723 12.666 -11.555 1.00 14.30 H new ATOM 0 HG2 LYS A 52 -0.826 11.149 -10.371 1.00 13.44 H new ATOM 0 HG3 LYS A 52 0.801 11.023 -9.732 1.00 13.44 H new ATOM 0 HD2 LYS A 52 -0.642 11.013 -7.822 1.00 75.21 H new ATOM 0 HD3 LYS A 52 0.100 12.601 -7.845 1.00 75.21 H new ATOM 0 HE2 LYS A 52 -2.702 12.014 -8.909 1.00 23.44 H new ATOM 0 HE3 LYS A 52 -2.372 12.596 -7.290 1.00 23.44 H new ATOM 0 HZ1 LYS A 52 -2.650 14.596 -8.205 1.00 74.01 H new ATOM 0 HZ2 LYS A 52 -1.074 14.412 -8.811 1.00 74.01 H new ATOM 0 HZ3 LYS A 52 -2.410 14.037 -9.790 1.00 74.01 H new ATOM 846 N GLU A 53 3.640 13.266 -10.694 1.00 64.05 N ATOM 847 CA GLU A 53 4.988 12.645 -10.709 1.00 51.11 C ATOM 848 C GLU A 53 5.780 12.948 -9.414 1.00 65.31 C ATOM 849 O GLU A 53 6.549 12.112 -8.941 1.00 33.13 O ATOM 850 CB GLU A 53 5.781 13.161 -11.938 1.00 55.23 C ATOM 851 CG GLU A 53 5.869 14.702 -12.023 1.00 11.25 C ATOM 852 CD GLU A 53 6.826 15.196 -13.105 1.00 24.14 C ATOM 853 OE1 GLU A 53 6.393 15.382 -14.260 1.00 63.23 O ATOM 854 OE2 GLU A 53 8.015 15.406 -12.804 1.00 25.12 O ATOM 0 H GLU A 53 3.460 13.859 -11.504 1.00 64.05 H new ATOM 0 HA GLU A 53 4.857 11.565 -10.771 1.00 51.11 H new ATOM 0 HB2 GLU A 53 6.790 12.750 -11.906 1.00 55.23 H new ATOM 0 HB3 GLU A 53 5.312 12.783 -12.846 1.00 55.23 H new ATOM 0 HG2 GLU A 53 4.875 15.105 -12.216 1.00 11.25 H new ATOM 0 HG3 GLU A 53 6.190 15.094 -11.058 1.00 11.25 H new ATOM 861 N TYR A 54 5.570 14.162 -8.873 1.00 1.14 N ATOM 862 CA TYR A 54 6.128 14.595 -7.586 1.00 72.12 C ATOM 863 C TYR A 54 5.692 13.654 -6.436 1.00 33.43 C ATOM 864 O TYR A 54 6.532 13.018 -5.795 1.00 52.23 O ATOM 865 CB TYR A 54 5.681 16.041 -7.278 1.00 65.51 C ATOM 866 CG TYR A 54 6.392 17.168 -8.038 1.00 43.41 C ATOM 867 CD1 TYR A 54 6.331 17.264 -9.427 1.00 0.00 C ATOM 868 CD2 TYR A 54 7.110 18.157 -7.352 1.00 72.34 C ATOM 869 CE1 TYR A 54 6.951 18.295 -10.101 1.00 53.33 C ATOM 870 CE2 TYR A 54 7.720 19.187 -8.023 1.00 14.14 C ATOM 871 CZ TYR A 54 7.637 19.253 -9.395 1.00 72.13 C ATOM 872 OH TYR A 54 8.235 20.287 -10.060 1.00 4.03 O ATOM 0 H TYR A 54 5.000 14.876 -9.326 1.00 1.14 H new ATOM 0 HA TYR A 54 7.215 14.557 -7.661 1.00 72.12 H new ATOM 0 HB2 TYR A 54 4.613 16.116 -7.483 1.00 65.51 H new ATOM 0 HB3 TYR A 54 5.814 16.216 -6.210 1.00 65.51 H new ATOM 0 HD1 TYR A 54 5.788 16.517 -9.986 1.00 0.00 H new ATOM 0 HD2 TYR A 54 7.185 18.108 -6.276 1.00 72.34 H new ATOM 0 HE1 TYR A 54 6.897 18.349 -11.178 1.00 53.33 H new ATOM 0 HE2 TYR A 54 8.263 19.943 -7.476 1.00 14.14 H new ATOM 0 HH TYR A 54 9.083 20.511 -9.622 1.00 4.03 H new ATOM 882 N LEU A 55 4.366 13.578 -6.218 1.00 22.23 N ATOM 883 CA LEU A 55 3.744 12.730 -5.177 1.00 23.10 C ATOM 884 C LEU A 55 4.203 11.261 -5.287 1.00 72.30 C ATOM 885 O LEU A 55 4.651 10.680 -4.301 1.00 2.44 O ATOM 886 CB LEU A 55 2.194 12.841 -5.276 1.00 1.05 C ATOM 887 CG LEU A 55 1.348 11.927 -4.323 1.00 32.23 C ATOM 888 CD1 LEU A 55 1.668 12.181 -2.829 1.00 73.12 C ATOM 889 CD2 LEU A 55 -0.162 12.088 -4.606 1.00 54.51 C ATOM 0 H LEU A 55 3.687 14.108 -6.764 1.00 22.23 H new ATOM 0 HA LEU A 55 4.068 13.089 -4.200 1.00 23.10 H new ATOM 0 HB2 LEU A 55 1.917 13.877 -5.084 1.00 1.05 H new ATOM 0 HB3 LEU A 55 1.904 12.618 -6.303 1.00 1.05 H new ATOM 0 HG LEU A 55 1.629 10.895 -4.534 1.00 32.23 H new ATOM 0 HD11 LEU A 55 1.057 11.524 -2.209 1.00 73.12 H new ATOM 0 HD12 LEU A 55 2.723 11.978 -2.643 1.00 73.12 H new ATOM 0 HD13 LEU A 55 1.450 13.220 -2.582 1.00 73.12 H new ATOM 0 HD21 LEU A 55 -0.729 11.445 -3.933 1.00 54.51 H new ATOM 0 HD22 LEU A 55 -0.453 13.126 -4.447 1.00 54.51 H new ATOM 0 HD23 LEU A 55 -0.371 11.807 -5.638 1.00 54.51 H new ATOM 901 N ILE A 56 4.133 10.708 -6.512 1.00 74.31 N ATOM 902 CA ILE A 56 4.534 9.314 -6.806 1.00 40.25 C ATOM 903 C ILE A 56 6.016 9.043 -6.422 1.00 53.11 C ATOM 904 O ILE A 56 6.307 8.007 -5.837 1.00 50.13 O ATOM 905 CB ILE A 56 4.279 8.964 -8.320 1.00 63.32 C ATOM 906 CG1 ILE A 56 2.754 9.076 -8.657 1.00 12.41 C ATOM 907 CG2 ILE A 56 4.824 7.557 -8.677 1.00 14.54 C ATOM 908 CD1 ILE A 56 2.406 8.837 -10.115 1.00 50.00 C ATOM 0 H ILE A 56 3.796 11.215 -7.331 1.00 74.31 H new ATOM 0 HA ILE A 56 3.913 8.663 -6.190 1.00 40.25 H new ATOM 0 HB ILE A 56 4.822 9.687 -8.928 1.00 63.32 H new ATOM 0 HG12 ILE A 56 2.207 8.359 -8.045 1.00 12.41 H new ATOM 0 HG13 ILE A 56 2.405 10.069 -8.373 1.00 12.41 H new ATOM 0 HG21 ILE A 56 4.631 7.348 -9.729 1.00 14.54 H new ATOM 0 HG22 ILE A 56 5.898 7.525 -8.492 1.00 14.54 H new ATOM 0 HG23 ILE A 56 4.327 6.807 -8.061 1.00 14.54 H new ATOM 0 HD11 ILE A 56 1.329 8.935 -10.253 1.00 50.00 H new ATOM 0 HD12 ILE A 56 2.920 9.570 -10.737 1.00 50.00 H new ATOM 0 HD13 ILE A 56 2.719 7.834 -10.404 1.00 50.00 H new ATOM 920 N THR A 57 6.921 9.997 -6.730 1.00 74.35 N ATOM 921 CA THR A 57 8.363 9.915 -6.348 1.00 22.31 C ATOM 922 C THR A 57 8.540 9.788 -4.811 1.00 72.53 C ATOM 923 O THR A 57 9.352 8.992 -4.329 1.00 71.52 O ATOM 924 CB THR A 57 9.155 11.163 -6.882 1.00 42.25 C ATOM 925 OG1 THR A 57 9.201 11.131 -8.320 1.00 61.31 O ATOM 926 CG2 THR A 57 10.591 11.263 -6.332 1.00 63.33 C ATOM 0 H THR A 57 6.683 10.844 -7.247 1.00 74.35 H new ATOM 0 HA THR A 57 8.770 9.016 -6.811 1.00 22.31 H new ATOM 0 HB THR A 57 8.617 12.042 -6.528 1.00 42.25 H new ATOM 0 HG1 THR A 57 8.351 11.459 -8.682 1.00 61.31 H new ATOM 0 HG21 THR A 57 11.077 12.148 -6.743 1.00 63.33 H new ATOM 0 HG22 THR A 57 10.560 11.338 -5.245 1.00 63.33 H new ATOM 0 HG23 THR A 57 11.153 10.374 -6.618 1.00 63.33 H new ATOM 934 N LEU A 58 7.753 10.575 -4.062 1.00 52.02 N ATOM 935 CA LEU A 58 7.725 10.521 -2.580 1.00 14.01 C ATOM 936 C LEU A 58 7.141 9.169 -2.066 1.00 24.32 C ATOM 937 O LEU A 58 7.545 8.679 -1.018 1.00 1.40 O ATOM 938 CB LEU A 58 6.919 11.732 -2.009 1.00 62.03 C ATOM 939 CG LEU A 58 7.684 13.104 -1.872 1.00 42.31 C ATOM 940 CD1 LEU A 58 8.811 13.019 -0.826 1.00 53.13 C ATOM 941 CD2 LEU A 58 8.221 13.632 -3.226 1.00 20.12 C ATOM 0 H LEU A 58 7.117 11.267 -4.459 1.00 52.02 H new ATOM 0 HA LEU A 58 8.752 10.586 -2.221 1.00 14.01 H new ATOM 0 HB2 LEU A 58 6.050 11.891 -2.648 1.00 62.03 H new ATOM 0 HB3 LEU A 58 6.544 11.454 -1.024 1.00 62.03 H new ATOM 0 HG LEU A 58 6.948 13.829 -1.523 1.00 42.31 H new ATOM 0 HD11 LEU A 58 9.317 13.982 -0.757 1.00 53.13 H new ATOM 0 HD12 LEU A 58 8.388 12.762 0.145 1.00 53.13 H new ATOM 0 HD13 LEU A 58 9.527 12.253 -1.124 1.00 53.13 H new ATOM 0 HD21 LEU A 58 8.738 14.579 -3.068 1.00 20.12 H new ATOM 0 HD22 LEU A 58 8.915 12.906 -3.650 1.00 20.12 H new ATOM 0 HD23 LEU A 58 7.389 13.783 -3.913 1.00 20.12 H new ATOM 953 N LEU A 59 6.202 8.576 -2.827 1.00 50.23 N ATOM 954 CA LEU A 59 5.516 7.311 -2.449 1.00 50.23 C ATOM 955 C LEU A 59 6.395 6.053 -2.683 1.00 31.03 C ATOM 956 O LEU A 59 6.514 5.201 -1.798 1.00 3.31 O ATOM 957 CB LEU A 59 4.188 7.185 -3.235 1.00 71.33 C ATOM 958 CG LEU A 59 3.121 8.282 -2.940 1.00 4.04 C ATOM 959 CD1 LEU A 59 1.938 8.185 -3.924 1.00 74.34 C ATOM 960 CD2 LEU A 59 2.646 8.223 -1.466 1.00 44.33 C ATOM 0 H LEU A 59 5.893 8.955 -3.722 1.00 50.23 H new ATOM 0 HA LEU A 59 5.317 7.360 -1.378 1.00 50.23 H new ATOM 0 HB2 LEU A 59 4.415 7.202 -4.301 1.00 71.33 H new ATOM 0 HB3 LEU A 59 3.750 6.211 -3.018 1.00 71.33 H new ATOM 0 HG LEU A 59 3.591 9.254 -3.089 1.00 4.04 H new ATOM 0 HD11 LEU A 59 1.209 8.962 -3.694 1.00 74.34 H new ATOM 0 HD12 LEU A 59 2.301 8.317 -4.943 1.00 74.34 H new ATOM 0 HD13 LEU A 59 1.467 7.207 -3.831 1.00 74.34 H new ATOM 0 HD21 LEU A 59 1.902 9.001 -1.292 1.00 44.33 H new ATOM 0 HD22 LEU A 59 2.204 7.247 -1.265 1.00 44.33 H new ATOM 0 HD23 LEU A 59 3.497 8.380 -0.803 1.00 44.33 H new ATOM 972 N GLU A 60 6.984 5.924 -3.885 1.00 14.14 N ATOM 973 CA GLU A 60 7.844 4.767 -4.226 1.00 42.03 C ATOM 974 C GLU A 60 9.205 4.808 -3.483 1.00 10.11 C ATOM 975 O GLU A 60 9.774 3.753 -3.190 1.00 11.00 O ATOM 976 CB GLU A 60 7.992 4.612 -5.771 1.00 62.15 C ATOM 977 CG GLU A 60 8.502 5.844 -6.562 1.00 65.31 C ATOM 978 CD GLU A 60 10.027 5.956 -6.641 1.00 22.24 C ATOM 979 OE1 GLU A 60 10.645 5.183 -7.406 1.00 65.10 O ATOM 980 OE2 GLU A 60 10.617 6.806 -5.953 1.00 31.15 O ATOM 0 H GLU A 60 6.883 6.604 -4.639 1.00 14.14 H new ATOM 0 HA GLU A 60 7.346 3.866 -3.868 1.00 42.03 H new ATOM 0 HB2 GLU A 60 8.672 3.782 -5.963 1.00 62.15 H new ATOM 0 HB3 GLU A 60 7.021 4.329 -6.177 1.00 62.15 H new ATOM 0 HG2 GLU A 60 8.100 5.803 -7.574 1.00 65.31 H new ATOM 0 HG3 GLU A 60 8.107 6.748 -6.098 1.00 65.31 H new ATOM 987 N HIS A 61 9.716 6.016 -3.163 1.00 24.32 N ATOM 988 CA HIS A 61 10.879 6.168 -2.248 1.00 42.53 C ATOM 989 C HIS A 61 10.490 5.930 -0.776 1.00 41.32 C ATOM 990 O HIS A 61 11.356 5.602 0.030 1.00 4.04 O ATOM 991 CB HIS A 61 11.566 7.554 -2.406 1.00 3.22 C ATOM 992 CG HIS A 61 12.786 7.544 -3.288 1.00 40.14 C ATOM 993 ND1 HIS A 61 12.777 7.953 -4.600 1.00 23.52 N ATOM 994 CD2 HIS A 61 14.066 7.185 -3.025 1.00 74.43 C ATOM 995 CE1 HIS A 61 13.986 7.851 -5.100 1.00 63.10 C ATOM 996 NE2 HIS A 61 14.789 7.388 -4.168 1.00 0.11 N ATOM 0 H HIS A 61 9.348 6.898 -3.520 1.00 24.32 H new ATOM 0 HA HIS A 61 11.596 5.400 -2.537 1.00 42.53 H new ATOM 0 HB2 HIS A 61 10.843 8.260 -2.814 1.00 3.22 H new ATOM 0 HB3 HIS A 61 11.848 7.921 -1.419 1.00 3.22 H new ATOM 0 HD1 HIS A 61 11.957 8.285 -5.107 1.00 23.52 H new ATOM 0 HD2 HIS A 61 14.445 6.808 -2.086 1.00 74.43 H new ATOM 0 HE1 HIS A 61 14.273 8.105 -6.110 1.00 63.10 H new ATOM 1005 N LEU A 62 9.205 6.128 -0.430 1.00 24.24 N ATOM 1006 CA LEU A 62 8.688 5.827 0.922 1.00 12.54 C ATOM 1007 C LEU A 62 8.805 4.322 1.224 1.00 45.23 C ATOM 1008 O LEU A 62 9.339 3.930 2.256 1.00 44.20 O ATOM 1009 CB LEU A 62 7.218 6.304 1.067 1.00 35.53 C ATOM 1010 CG LEU A 62 6.529 6.036 2.440 1.00 30.40 C ATOM 1011 CD1 LEU A 62 7.298 6.705 3.585 1.00 4.31 C ATOM 1012 CD2 LEU A 62 5.056 6.483 2.426 1.00 62.31 C ATOM 0 H LEU A 62 8.501 6.497 -1.070 1.00 24.24 H new ATOM 0 HA LEU A 62 9.294 6.369 1.648 1.00 12.54 H new ATOM 0 HB2 LEU A 62 7.187 7.376 0.874 1.00 35.53 H new ATOM 0 HB3 LEU A 62 6.625 5.823 0.289 1.00 35.53 H new ATOM 0 HG LEU A 62 6.545 4.960 2.611 1.00 30.40 H new ATOM 0 HD11 LEU A 62 6.794 6.501 4.530 1.00 4.31 H new ATOM 0 HD12 LEU A 62 8.313 6.309 3.622 1.00 4.31 H new ATOM 0 HD13 LEU A 62 7.335 7.782 3.419 1.00 4.31 H new ATOM 0 HD21 LEU A 62 4.606 6.282 3.398 1.00 62.31 H new ATOM 0 HD22 LEU A 62 5.002 7.551 2.215 1.00 62.31 H new ATOM 0 HD23 LEU A 62 4.516 5.933 1.655 1.00 62.31 H new ATOM 1024 N MET A 63 8.318 3.485 0.296 1.00 63.35 N ATOM 1025 CA MET A 63 8.383 2.019 0.449 1.00 71.21 C ATOM 1026 C MET A 63 9.824 1.486 0.286 1.00 33.42 C ATOM 1027 O MET A 63 10.158 0.475 0.876 1.00 3.43 O ATOM 1028 CB MET A 63 7.390 1.320 -0.513 1.00 72.40 C ATOM 1029 CG MET A 63 7.665 1.541 -2.005 1.00 44.10 C ATOM 1030 SD MET A 63 6.247 1.139 -3.035 1.00 60.53 S ATOM 1031 CE MET A 63 5.030 2.326 -2.456 1.00 51.51 C ATOM 0 H MET A 63 7.875 3.795 -0.569 1.00 63.35 H new ATOM 0 HA MET A 63 8.079 1.777 1.467 1.00 71.21 H new ATOM 0 HB2 MET A 63 7.406 0.249 -0.311 1.00 72.40 H new ATOM 0 HB3 MET A 63 6.383 1.672 -0.289 1.00 72.40 H new ATOM 0 HG2 MET A 63 7.945 2.581 -2.169 1.00 44.10 H new ATOM 0 HG3 MET A 63 8.515 0.930 -2.309 1.00 44.10 H new ATOM 0 HE1 MET A 63 4.179 1.796 -2.030 1.00 51.51 H new ATOM 0 HE2 MET A 63 5.478 2.964 -1.695 1.00 51.51 H new ATOM 0 HE3 MET A 63 4.694 2.939 -3.292 1.00 51.51 H new ATOM 1041 N LYS A 64 10.668 2.186 -0.507 1.00 24.10 N ATOM 1042 CA LYS A 64 12.119 1.871 -0.622 1.00 10.45 C ATOM 1043 C LYS A 64 12.898 2.165 0.684 1.00 74.35 C ATOM 1044 O LYS A 64 13.713 1.352 1.105 1.00 71.22 O ATOM 1045 CB LYS A 64 12.760 2.643 -1.815 1.00 14.12 C ATOM 1046 CG LYS A 64 12.505 2.010 -3.201 1.00 72.43 C ATOM 1047 CD LYS A 64 13.197 0.637 -3.377 1.00 43.34 C ATOM 1048 CE LYS A 64 14.734 0.721 -3.249 1.00 4.41 C ATOM 1049 NZ LYS A 64 15.386 -0.602 -3.443 1.00 41.14 N ATOM 0 H LYS A 64 10.372 2.976 -1.080 1.00 24.10 H new ATOM 0 HA LYS A 64 12.191 0.799 -0.807 1.00 10.45 H new ATOM 0 HB2 LYS A 64 12.375 3.663 -1.819 1.00 14.12 H new ATOM 0 HB3 LYS A 64 13.836 2.709 -1.652 1.00 14.12 H new ATOM 0 HG2 LYS A 64 11.432 1.891 -3.348 1.00 72.43 H new ATOM 0 HG3 LYS A 64 12.859 2.691 -3.975 1.00 72.43 H new ATOM 0 HD2 LYS A 64 12.812 -0.057 -2.630 1.00 43.34 H new ATOM 0 HD3 LYS A 64 12.940 0.228 -4.354 1.00 43.34 H new ATOM 0 HE2 LYS A 64 15.120 1.426 -3.985 1.00 4.41 H new ATOM 0 HE3 LYS A 64 14.994 1.112 -2.265 1.00 4.41 H new ATOM 0 HZ1 LYS A 64 16.417 -0.498 -3.349 1.00 41.14 H new ATOM 0 HZ2 LYS A 64 15.038 -1.269 -2.725 1.00 41.14 H new ATOM 0 HZ3 LYS A 64 15.160 -0.965 -4.391 1.00 41.14 H new ATOM 1063 N GLU A 65 12.645 3.332 1.293 1.00 14.12 N ATOM 1064 CA GLU A 65 13.317 3.763 2.545 1.00 34.33 C ATOM 1065 C GLU A 65 12.867 2.891 3.743 1.00 33.03 C ATOM 1066 O GLU A 65 13.691 2.389 4.518 1.00 12.24 O ATOM 1067 CB GLU A 65 13.004 5.266 2.809 1.00 42.23 C ATOM 1068 CG GLU A 65 13.701 5.885 4.044 1.00 50.14 C ATOM 1069 CD GLU A 65 15.239 5.854 3.958 1.00 1.10 C ATOM 1070 OE1 GLU A 65 15.807 6.563 3.096 1.00 73.02 O ATOM 1071 OE2 GLU A 65 15.888 5.131 4.745 1.00 60.13 O ATOM 0 H GLU A 65 11.970 4.010 0.938 1.00 14.12 H new ATOM 0 HA GLU A 65 14.394 3.636 2.431 1.00 34.33 H new ATOM 0 HB2 GLU A 65 13.290 5.839 1.927 1.00 42.23 H new ATOM 0 HB3 GLU A 65 11.926 5.379 2.927 1.00 42.23 H new ATOM 0 HG2 GLU A 65 13.372 6.918 4.158 1.00 50.14 H new ATOM 0 HG3 GLU A 65 13.384 5.348 4.938 1.00 50.14 H new ATOM 1078 N PHE A 66 11.544 2.689 3.842 1.00 61.40 N ATOM 1079 CA PHE A 66 10.911 1.916 4.933 1.00 51.40 C ATOM 1080 C PHE A 66 10.866 0.411 4.644 1.00 15.45 C ATOM 1081 O PHE A 66 10.280 -0.358 5.414 1.00 3.21 O ATOM 1082 CB PHE A 66 9.506 2.478 5.236 1.00 44.13 C ATOM 1083 CG PHE A 66 9.541 3.878 5.846 1.00 3.42 C ATOM 1084 CD1 PHE A 66 10.019 4.959 5.117 1.00 14.53 C ATOM 1085 CD2 PHE A 66 9.118 4.111 7.147 1.00 51.13 C ATOM 1086 CE1 PHE A 66 10.074 6.211 5.658 1.00 34.23 C ATOM 1087 CE2 PHE A 66 9.171 5.374 7.690 1.00 35.23 C ATOM 1088 CZ PHE A 66 9.647 6.424 6.943 1.00 60.13 C ATOM 0 H PHE A 66 10.875 3.058 3.166 1.00 61.40 H new ATOM 0 HA PHE A 66 11.533 2.031 5.820 1.00 51.40 H new ATOM 0 HB2 PHE A 66 8.925 2.504 4.314 1.00 44.13 H new ATOM 0 HB3 PHE A 66 8.990 1.803 5.919 1.00 44.13 H new ATOM 0 HD1 PHE A 66 10.354 4.806 4.102 1.00 14.53 H new ATOM 0 HD2 PHE A 66 8.743 3.291 7.741 1.00 51.13 H new ATOM 0 HE1 PHE A 66 10.455 7.035 5.073 1.00 34.23 H new ATOM 0 HE2 PHE A 66 8.838 5.540 8.704 1.00 35.23 H new ATOM 0 HZ PHE A 66 9.685 7.416 7.368 1.00 60.13 H new ATOM 1098 N LEU A 67 11.492 0.005 3.531 1.00 53.34 N ATOM 1099 CA LEU A 67 11.739 -1.410 3.223 1.00 23.44 C ATOM 1100 C LEU A 67 12.701 -2.043 4.257 1.00 50.03 C ATOM 1101 O LEU A 67 12.518 -3.197 4.656 1.00 60.50 O ATOM 1102 CB LEU A 67 12.291 -1.556 1.770 1.00 15.44 C ATOM 1103 CG LEU A 67 11.736 -2.759 0.950 1.00 42.14 C ATOM 1104 CD1 LEU A 67 10.186 -2.737 0.891 1.00 43.53 C ATOM 1105 CD2 LEU A 67 12.354 -2.802 -0.468 1.00 31.50 C ATOM 0 H LEU A 67 11.841 0.647 2.820 1.00 53.34 H new ATOM 0 HA LEU A 67 10.794 -1.950 3.285 1.00 23.44 H new ATOM 0 HB2 LEU A 67 12.073 -0.638 1.225 1.00 15.44 H new ATOM 0 HB3 LEU A 67 13.376 -1.646 1.821 1.00 15.44 H new ATOM 0 HG LEU A 67 12.030 -3.673 1.466 1.00 42.14 H new ATOM 0 HD11 LEU A 67 9.832 -3.590 0.312 1.00 43.53 H new ATOM 0 HD12 LEU A 67 9.783 -2.793 1.902 1.00 43.53 H new ATOM 0 HD13 LEU A 67 9.853 -1.813 0.418 1.00 43.53 H new ATOM 0 HD21 LEU A 67 11.948 -3.652 -1.016 1.00 31.50 H new ATOM 0 HD22 LEU A 67 12.114 -1.880 -0.998 1.00 31.50 H new ATOM 0 HD23 LEU A 67 13.436 -2.904 -0.390 1.00 31.50 H new ATOM 1117 N ASP A 68 13.716 -1.278 4.711 1.00 54.32 N ATOM 1118 CA ASP A 68 14.647 -1.733 5.762 1.00 50.14 C ATOM 1119 C ASP A 68 14.063 -1.452 7.174 1.00 3.10 C ATOM 1120 O ASP A 68 14.502 -2.049 8.169 1.00 31.14 O ATOM 1121 CB ASP A 68 16.000 -0.999 5.573 1.00 55.32 C ATOM 1122 CG ASP A 68 17.083 -1.419 6.579 1.00 32.13 C ATOM 1123 OD1 ASP A 68 17.609 -2.546 6.464 1.00 24.21 O ATOM 1124 OD2 ASP A 68 17.408 -0.630 7.490 1.00 53.42 O ATOM 0 H ASP A 68 13.911 -0.339 4.364 1.00 54.32 H new ATOM 0 HA ASP A 68 14.797 -2.809 5.678 1.00 50.14 H new ATOM 0 HB2 ASP A 68 16.365 -1.185 4.563 1.00 55.32 H new ATOM 0 HB3 ASP A 68 15.835 0.075 5.660 1.00 55.32 H new ATOM 1129 N LYS A 69 13.047 -0.562 7.250 1.00 33.00 N ATOM 1130 CA LYS A 69 12.350 -0.255 8.518 1.00 60.15 C ATOM 1131 C LYS A 69 11.222 -1.290 8.733 1.00 24.21 C ATOM 1132 O LYS A 69 10.055 -1.054 8.407 1.00 1.44 O ATOM 1133 CB LYS A 69 11.802 1.210 8.543 1.00 71.32 C ATOM 1134 CG LYS A 69 12.761 2.290 7.973 1.00 1.43 C ATOM 1135 CD LYS A 69 14.172 2.285 8.594 1.00 2.44 C ATOM 1136 CE LYS A 69 14.202 2.747 10.051 1.00 22.51 C ATOM 1137 NZ LYS A 69 15.591 2.768 10.565 1.00 1.15 N ATOM 0 H LYS A 69 12.692 -0.044 6.446 1.00 33.00 H new ATOM 0 HA LYS A 69 13.063 -0.325 9.340 1.00 60.15 H new ATOM 0 HB2 LYS A 69 10.870 1.241 7.978 1.00 71.32 H new ATOM 0 HB3 LYS A 69 11.559 1.471 9.573 1.00 71.32 H new ATOM 0 HG2 LYS A 69 12.851 2.146 6.896 1.00 1.43 H new ATOM 0 HG3 LYS A 69 12.314 3.272 8.127 1.00 1.43 H new ATOM 0 HD2 LYS A 69 14.583 1.277 8.533 1.00 2.44 H new ATOM 0 HD3 LYS A 69 14.822 2.931 8.004 1.00 2.44 H new ATOM 0 HE2 LYS A 69 13.764 3.742 10.131 1.00 22.51 H new ATOM 0 HE3 LYS A 69 13.593 2.080 10.662 1.00 22.51 H new ATOM 0 HZ1 LYS A 69 15.683 2.086 11.345 1.00 1.15 H new ATOM 0 HZ2 LYS A 69 16.248 2.511 9.801 1.00 1.15 H new ATOM 0 HZ3 LYS A 69 15.819 3.722 10.911 1.00 1.15 H new ATOM 1151 N LYS A 70 11.623 -2.457 9.260 1.00 54.13 N ATOM 1152 CA LYS A 70 10.743 -3.634 9.463 1.00 1.52 C ATOM 1153 C LYS A 70 9.692 -3.400 10.581 1.00 50.10 C ATOM 1154 O LYS A 70 8.757 -4.189 10.742 1.00 31.15 O ATOM 1155 CB LYS A 70 11.634 -4.860 9.771 1.00 3.44 C ATOM 1156 CG LYS A 70 12.642 -5.194 8.640 1.00 44.11 C ATOM 1157 CD LYS A 70 13.647 -6.302 9.033 1.00 24.33 C ATOM 1158 CE LYS A 70 14.588 -5.881 10.183 1.00 42.41 C ATOM 1159 NZ LYS A 70 15.574 -6.947 10.522 1.00 52.35 N ATOM 0 H LYS A 70 12.583 -2.619 9.564 1.00 54.13 H new ATOM 0 HA LYS A 70 10.170 -3.810 8.552 1.00 1.52 H new ATOM 0 HB2 LYS A 70 12.184 -4.676 10.694 1.00 3.44 H new ATOM 0 HB3 LYS A 70 10.997 -5.727 9.946 1.00 3.44 H new ATOM 0 HG2 LYS A 70 12.093 -5.508 7.752 1.00 44.11 H new ATOM 0 HG3 LYS A 70 13.191 -4.291 8.372 1.00 44.11 H new ATOM 0 HD2 LYS A 70 13.097 -7.195 9.329 1.00 24.33 H new ATOM 0 HD3 LYS A 70 14.244 -6.569 8.161 1.00 24.33 H new ATOM 0 HE2 LYS A 70 15.120 -4.973 9.901 1.00 42.41 H new ATOM 0 HE3 LYS A 70 13.996 -5.642 11.066 1.00 42.41 H new ATOM 0 HZ1 LYS A 70 16.184 -6.621 11.298 1.00 52.35 H new ATOM 0 HZ2 LYS A 70 15.068 -7.807 10.817 1.00 52.35 H new ATOM 0 HZ3 LYS A 70 16.158 -7.158 9.688 1.00 52.35 H new ATOM 1173 N LYS A 71 9.882 -2.310 11.343 1.00 52.44 N ATOM 1174 CA LYS A 71 8.866 -1.746 12.263 1.00 45.02 C ATOM 1175 C LYS A 71 7.539 -1.390 11.518 1.00 74.55 C ATOM 1176 O LYS A 71 6.436 -1.506 12.069 1.00 24.30 O ATOM 1177 CB LYS A 71 9.469 -0.483 12.951 1.00 72.02 C ATOM 1178 CG LYS A 71 8.449 0.387 13.714 1.00 3.54 C ATOM 1179 CD LYS A 71 9.087 1.592 14.438 1.00 32.10 C ATOM 1180 CE LYS A 71 8.027 2.590 14.937 1.00 64.00 C ATOM 1181 NZ LYS A 71 6.971 1.939 15.762 1.00 74.24 N ATOM 0 H LYS A 71 10.756 -1.785 11.341 1.00 52.44 H new ATOM 0 HA LYS A 71 8.611 -2.496 13.012 1.00 45.02 H new ATOM 0 HB2 LYS A 71 10.246 -0.801 13.646 1.00 72.02 H new ATOM 0 HB3 LYS A 71 9.953 0.131 12.192 1.00 72.02 H new ATOM 0 HG2 LYS A 71 7.697 0.751 13.013 1.00 3.54 H new ATOM 0 HG3 LYS A 71 7.930 -0.233 14.445 1.00 3.54 H new ATOM 0 HD2 LYS A 71 9.677 1.237 15.283 1.00 32.10 H new ATOM 0 HD3 LYS A 71 9.774 2.100 13.761 1.00 32.10 H new ATOM 0 HE2 LYS A 71 8.514 3.368 15.525 1.00 64.00 H new ATOM 0 HE3 LYS A 71 7.563 3.080 14.081 1.00 64.00 H new ATOM 0 HZ1 LYS A 71 6.382 2.669 16.211 1.00 74.24 H new ATOM 0 HZ2 LYS A 71 6.376 1.339 15.155 1.00 74.24 H new ATOM 0 HZ3 LYS A 71 7.416 1.353 16.497 1.00 74.24 H new ATOM 1195 N TYR A 72 7.672 -0.983 10.248 1.00 54.11 N ATOM 1196 CA TYR A 72 6.548 -0.502 9.409 1.00 44.53 C ATOM 1197 C TYR A 72 5.861 -1.616 8.601 1.00 22.43 C ATOM 1198 O TYR A 72 5.065 -1.323 7.704 1.00 61.24 O ATOM 1199 CB TYR A 72 7.047 0.652 8.509 1.00 43.14 C ATOM 1200 CG TYR A 72 7.213 1.950 9.308 1.00 34.14 C ATOM 1201 CD1 TYR A 72 8.338 2.182 10.112 1.00 43.31 C ATOM 1202 CD2 TYR A 72 6.207 2.912 9.313 1.00 31.12 C ATOM 1203 CE1 TYR A 72 8.446 3.334 10.869 1.00 74.13 C ATOM 1204 CE2 TYR A 72 6.310 4.047 10.076 1.00 34.12 C ATOM 1205 CZ TYR A 72 7.422 4.258 10.847 1.00 21.10 C ATOM 1206 OH TYR A 72 7.502 5.399 11.605 1.00 61.14 O ATOM 0 H TYR A 72 8.569 -0.976 9.763 1.00 54.11 H new ATOM 0 HA TYR A 72 5.769 -0.131 10.075 1.00 44.53 H new ATOM 0 HB2 TYR A 72 8.000 0.377 8.056 1.00 43.14 H new ATOM 0 HB3 TYR A 72 6.341 0.812 7.694 1.00 43.14 H new ATOM 0 HD1 TYR A 72 9.132 1.450 10.140 1.00 43.31 H new ATOM 0 HD2 TYR A 72 5.328 2.762 8.704 1.00 31.12 H new ATOM 0 HE1 TYR A 72 9.325 3.509 11.472 1.00 74.13 H new ATOM 0 HE2 TYR A 72 5.513 4.776 10.069 1.00 34.12 H new ATOM 0 HH TYR A 72 6.696 5.939 11.469 1.00 61.14 H new ATOM 1216 N HIS A 73 6.158 -2.888 8.932 1.00 23.02 N ATOM 1217 CA HIS A 73 5.440 -4.053 8.366 1.00 14.23 C ATOM 1218 C HIS A 73 3.906 -3.920 8.522 1.00 2.33 C ATOM 1219 O HIS A 73 3.169 -4.064 7.571 1.00 72.34 O ATOM 1220 CB HIS A 73 5.912 -5.371 9.043 1.00 10.21 C ATOM 1221 CG HIS A 73 7.241 -5.892 8.574 1.00 62.24 C ATOM 1222 ND1 HIS A 73 7.946 -6.856 9.255 1.00 41.33 N ATOM 1223 CD2 HIS A 73 7.974 -5.613 7.469 1.00 55.14 C ATOM 1224 CE1 HIS A 73 9.040 -7.145 8.594 1.00 5.22 C ATOM 1225 NE2 HIS A 73 9.084 -6.406 7.509 1.00 23.32 N ATOM 0 H HIS A 73 6.894 -3.138 9.592 1.00 23.02 H new ATOM 0 HA HIS A 73 5.675 -4.082 7.302 1.00 14.23 H new ATOM 0 HB2 HIS A 73 5.963 -5.209 10.120 1.00 10.21 H new ATOM 0 HB3 HIS A 73 5.158 -6.139 8.871 1.00 10.21 H new ATOM 0 HD2 HIS A 73 7.726 -4.897 6.700 1.00 55.14 H new ATOM 0 HE1 HIS A 73 9.782 -7.871 8.892 1.00 5.22 H new ATOM 0 HE2 HIS A 73 9.827 -6.422 6.810 1.00 23.32 H new ATOM 1234 N ASN A 74 3.446 -3.617 9.736 1.00 70.01 N ATOM 1235 CA ASN A 74 1.996 -3.616 10.066 1.00 31.02 C ATOM 1236 C ASN A 74 1.439 -2.196 10.273 1.00 53.41 C ATOM 1237 O ASN A 74 0.382 -2.024 10.891 1.00 53.31 O ATOM 1238 CB ASN A 74 1.800 -4.483 11.326 1.00 4.21 C ATOM 1239 CG ASN A 74 2.395 -5.890 11.181 1.00 34.42 C ATOM 1240 OD1 ASN A 74 2.899 -6.458 12.137 1.00 22.44 O ATOM 1241 ND2 ASN A 74 2.319 -6.480 9.992 1.00 75.02 N ATOM 0 H ASN A 74 4.049 -3.366 10.519 1.00 70.01 H new ATOM 0 HA ASN A 74 1.437 -4.030 9.227 1.00 31.02 H new ATOM 0 HB2 ASN A 74 2.261 -3.985 12.179 1.00 4.21 H new ATOM 0 HB3 ASN A 74 0.735 -4.565 11.542 1.00 4.21 H new ATOM 0 HD21 ASN A 74 2.685 -7.424 9.867 1.00 75.02 H new ATOM 0 HD22 ASN A 74 1.894 -5.989 9.205 1.00 75.02 H new ATOM 1248 N ASP A 75 2.143 -1.181 9.737 1.00 44.42 N ATOM 1249 CA ASP A 75 1.758 0.235 9.913 1.00 34.42 C ATOM 1250 C ASP A 75 0.585 0.616 8.963 1.00 44.32 C ATOM 1251 O ASP A 75 0.779 0.658 7.745 1.00 10.12 O ATOM 1252 CB ASP A 75 2.986 1.141 9.657 1.00 62.25 C ATOM 1253 CG ASP A 75 2.783 2.581 10.157 1.00 72.23 C ATOM 1254 OD1 ASP A 75 2.101 3.375 9.484 1.00 11.03 O ATOM 1255 OD2 ASP A 75 3.294 2.917 11.240 1.00 44.14 O ATOM 0 H ASP A 75 2.985 -1.315 9.176 1.00 44.42 H new ATOM 0 HA ASP A 75 1.414 0.381 10.937 1.00 34.42 H new ATOM 0 HB2 ASP A 75 3.858 0.710 10.150 1.00 62.25 H new ATOM 0 HB3 ASP A 75 3.201 1.160 8.589 1.00 62.25 H new ATOM 1260 N PRO A 76 -0.640 0.947 9.505 1.00 2.24 N ATOM 1261 CA PRO A 76 -1.837 1.240 8.664 1.00 10.32 C ATOM 1262 C PRO A 76 -1.628 2.444 7.708 1.00 32.40 C ATOM 1263 O PRO A 76 -2.155 2.442 6.591 1.00 12.44 O ATOM 1264 CB PRO A 76 -2.957 1.518 9.709 1.00 11.43 C ATOM 1265 CG PRO A 76 -2.226 1.908 10.961 1.00 14.40 C ATOM 1266 CD PRO A 76 -0.956 1.082 10.954 1.00 54.34 C ATOM 0 HA PRO A 76 -2.074 0.416 7.991 1.00 10.32 H new ATOM 0 HB2 PRO A 76 -3.621 2.315 9.374 1.00 11.43 H new ATOM 0 HB3 PRO A 76 -3.575 0.635 9.871 1.00 11.43 H new ATOM 0 HG2 PRO A 76 -2.002 2.975 10.970 1.00 14.40 H new ATOM 0 HG3 PRO A 76 -2.825 1.701 11.848 1.00 14.40 H new ATOM 0 HD2 PRO A 76 -0.151 1.578 11.496 1.00 54.34 H new ATOM 0 HD3 PRO A 76 -1.106 0.110 11.425 1.00 54.34 H new ATOM 1274 N ARG A 77 -0.834 3.446 8.151 1.00 14.31 N ATOM 1275 CA ARG A 77 -0.526 4.652 7.350 1.00 14.05 C ATOM 1276 C ARG A 77 0.398 4.302 6.165 1.00 73.11 C ATOM 1277 O ARG A 77 0.061 4.580 5.022 1.00 44.33 O ATOM 1278 CB ARG A 77 0.157 5.741 8.213 1.00 20.32 C ATOM 1279 CG ARG A 77 -0.634 6.187 9.451 1.00 35.25 C ATOM 1280 CD ARG A 77 0.140 7.221 10.284 1.00 42.05 C ATOM 1281 NE ARG A 77 -0.641 7.709 11.429 1.00 74.33 N ATOM 1282 CZ ARG A 77 -0.499 8.890 11.998 1.00 45.21 C ATOM 1283 NH1 ARG A 77 0.335 9.774 11.535 1.00 2.40 N ATOM 1284 NH2 ARG A 77 -1.219 9.186 13.029 1.00 73.25 N ATOM 0 H ARG A 77 -0.391 3.441 9.070 1.00 14.31 H new ATOM 0 HA ARG A 77 -1.474 5.037 6.974 1.00 14.05 H new ATOM 0 HB2 ARG A 77 1.128 5.368 8.538 1.00 20.32 H new ATOM 0 HB3 ARG A 77 0.343 6.614 7.587 1.00 20.32 H new ATOM 0 HG2 ARG A 77 -1.587 6.613 9.139 1.00 35.25 H new ATOM 0 HG3 ARG A 77 -0.860 5.318 10.070 1.00 35.25 H new ATOM 0 HD2 ARG A 77 1.068 6.775 10.643 1.00 42.05 H new ATOM 0 HD3 ARG A 77 0.416 8.063 9.649 1.00 42.05 H new ATOM 0 HE ARG A 77 -1.349 7.084 11.814 1.00 74.33 H new ATOM 0 HH11 ARG A 77 0.899 9.561 10.712 1.00 2.40 H new ATOM 0 HH12 ARG A 77 0.425 10.680 11.995 1.00 2.40 H new ATOM 0 HH21 ARG A 77 -1.889 8.509 13.395 1.00 73.25 H new ATOM 0 HH22 ARG A 77 -1.118 10.097 13.477 1.00 73.25 H new ATOM 1298 N PHE A 78 1.561 3.692 6.475 1.00 60.14 N ATOM 1299 CA PHE A 78 2.571 3.276 5.471 1.00 3.51 C ATOM 1300 C PHE A 78 1.951 2.396 4.358 1.00 64.13 C ATOM 1301 O PHE A 78 2.205 2.614 3.166 1.00 10.22 O ATOM 1302 CB PHE A 78 3.735 2.529 6.181 1.00 22.34 C ATOM 1303 CG PHE A 78 4.783 1.941 5.234 1.00 2.53 C ATOM 1304 CD1 PHE A 78 5.506 2.766 4.373 1.00 23.20 C ATOM 1305 CD2 PHE A 78 5.024 0.567 5.183 1.00 55.23 C ATOM 1306 CE1 PHE A 78 6.432 2.234 3.503 1.00 65.43 C ATOM 1307 CE2 PHE A 78 5.953 0.041 4.313 1.00 10.21 C ATOM 1308 CZ PHE A 78 6.657 0.871 3.472 1.00 41.02 C ATOM 0 H PHE A 78 1.830 3.472 7.434 1.00 60.14 H new ATOM 0 HA PHE A 78 2.959 4.172 4.987 1.00 3.51 H new ATOM 0 HB2 PHE A 78 4.229 3.219 6.865 1.00 22.34 H new ATOM 0 HB3 PHE A 78 3.318 1.724 6.786 1.00 22.34 H new ATOM 0 HD1 PHE A 78 5.338 3.833 4.388 1.00 23.20 H new ATOM 0 HD2 PHE A 78 4.473 -0.094 5.836 1.00 55.23 H new ATOM 0 HE1 PHE A 78 6.985 2.885 2.842 1.00 65.43 H new ATOM 0 HE2 PHE A 78 6.129 -1.024 4.291 1.00 10.21 H new ATOM 0 HZ PHE A 78 7.384 0.458 2.789 1.00 41.02 H new ATOM 1318 N ILE A 79 1.132 1.415 4.774 1.00 3.15 N ATOM 1319 CA ILE A 79 0.350 0.568 3.851 1.00 14.35 C ATOM 1320 C ILE A 79 -0.659 1.427 3.049 1.00 44.32 C ATOM 1321 O ILE A 79 -0.767 1.256 1.845 1.00 14.12 O ATOM 1322 CB ILE A 79 -0.375 -0.626 4.614 1.00 15.24 C ATOM 1323 CG1 ILE A 79 0.618 -1.806 4.899 1.00 62.00 C ATOM 1324 CG2 ILE A 79 -1.625 -1.164 3.850 1.00 32.11 C ATOM 1325 CD1 ILE A 79 1.802 -1.503 5.805 1.00 3.20 C ATOM 0 H ILE A 79 0.992 1.185 5.758 1.00 3.15 H new ATOM 0 HA ILE A 79 1.045 0.113 3.145 1.00 14.35 H new ATOM 0 HB ILE A 79 -0.721 -0.209 5.560 1.00 15.24 H new ATOM 0 HG12 ILE A 79 0.053 -2.626 5.342 1.00 62.00 H new ATOM 0 HG13 ILE A 79 1.004 -2.163 3.944 1.00 62.00 H new ATOM 0 HG21 ILE A 79 -2.077 -1.977 4.419 1.00 32.11 H new ATOM 0 HG22 ILE A 79 -2.350 -0.360 3.727 1.00 32.11 H new ATOM 0 HG23 ILE A 79 -1.322 -1.532 2.870 1.00 32.11 H new ATOM 0 HD11 ILE A 79 2.410 -2.400 5.922 1.00 3.20 H new ATOM 0 HD12 ILE A 79 2.406 -0.711 5.362 1.00 3.20 H new ATOM 0 HD13 ILE A 79 1.440 -1.181 6.781 1.00 3.20 H new ATOM 1337 N SER A 80 -1.355 2.370 3.723 1.00 71.11 N ATOM 1338 CA SER A 80 -2.341 3.285 3.071 1.00 51.04 C ATOM 1339 C SER A 80 -1.687 4.181 1.984 1.00 2.21 C ATOM 1340 O SER A 80 -2.323 4.494 0.979 1.00 15.20 O ATOM 1341 CB SER A 80 -3.040 4.167 4.134 1.00 52.30 C ATOM 1342 OG SER A 80 -4.004 5.036 3.564 1.00 11.31 O ATOM 0 H SER A 80 -1.256 2.524 4.726 1.00 71.11 H new ATOM 0 HA SER A 80 -3.080 2.657 2.574 1.00 51.04 H new ATOM 0 HB2 SER A 80 -3.523 3.527 4.873 1.00 52.30 H new ATOM 0 HB3 SER A 80 -2.291 4.756 4.663 1.00 52.30 H new ATOM 0 HG SER A 80 -4.420 5.572 4.271 1.00 11.31 H new ATOM 1348 N TYR A 81 -0.410 4.573 2.198 1.00 53.45 N ATOM 1349 CA TYR A 81 0.381 5.360 1.218 1.00 32.20 C ATOM 1350 C TYR A 81 0.853 4.483 0.041 1.00 23.11 C ATOM 1351 O TYR A 81 0.991 4.968 -1.084 1.00 23.45 O ATOM 1352 CB TYR A 81 1.593 6.046 1.898 1.00 51.13 C ATOM 1353 CG TYR A 81 1.205 7.181 2.862 1.00 64.25 C ATOM 1354 CD1 TYR A 81 0.559 8.322 2.386 1.00 23.21 C ATOM 1355 CD2 TYR A 81 1.466 7.114 4.235 1.00 65.20 C ATOM 1356 CE1 TYR A 81 0.185 9.338 3.240 1.00 52.04 C ATOM 1357 CE2 TYR A 81 1.093 8.134 5.088 1.00 25.25 C ATOM 1358 CZ TYR A 81 0.451 9.245 4.583 1.00 41.40 C ATOM 1359 OH TYR A 81 0.047 10.259 5.427 1.00 3.25 O ATOM 0 H TYR A 81 0.102 4.354 3.053 1.00 53.45 H new ATOM 0 HA TYR A 81 -0.275 6.135 0.822 1.00 32.20 H new ATOM 0 HB2 TYR A 81 2.163 5.296 2.446 1.00 51.13 H new ATOM 0 HB3 TYR A 81 2.252 6.446 1.127 1.00 51.13 H new ATOM 0 HD1 TYR A 81 0.348 8.411 1.331 1.00 23.21 H new ATOM 0 HD2 TYR A 81 1.970 6.247 4.636 1.00 65.20 H new ATOM 0 HE1 TYR A 81 -0.319 10.210 2.850 1.00 52.04 H new ATOM 0 HE2 TYR A 81 1.303 8.062 6.145 1.00 25.25 H new ATOM 0 HH TYR A 81 0.295 10.036 6.349 1.00 3.25 H new ATOM 1369 N CYS A 82 1.119 3.195 0.323 1.00 23.21 N ATOM 1370 CA CYS A 82 1.383 2.184 -0.722 1.00 20.25 C ATOM 1371 C CYS A 82 0.108 1.922 -1.571 1.00 61.35 C ATOM 1372 O CYS A 82 0.194 1.737 -2.783 1.00 12.14 O ATOM 1373 CB CYS A 82 1.907 0.874 -0.086 1.00 52.33 C ATOM 1374 SG CYS A 82 3.492 1.055 0.768 1.00 35.35 S ATOM 0 H CYS A 82 1.157 2.826 1.273 1.00 23.21 H new ATOM 0 HA CYS A 82 2.154 2.570 -1.389 1.00 20.25 H new ATOM 0 HB2 CYS A 82 1.165 0.503 0.621 1.00 52.33 H new ATOM 0 HB3 CYS A 82 2.010 0.119 -0.866 1.00 52.33 H new ATOM 0 HG CYS A 82 3.314 1.704 1.880 1.00 35.35 H new ATOM 1380 N LEU A 83 -1.075 1.950 -0.918 1.00 62.33 N ATOM 1381 CA LEU A 83 -2.391 1.833 -1.599 1.00 21.21 C ATOM 1382 C LEU A 83 -2.675 3.096 -2.453 1.00 53.23 C ATOM 1383 O LEU A 83 -3.215 3.012 -3.562 1.00 11.11 O ATOM 1384 CB LEU A 83 -3.539 1.634 -0.567 1.00 12.21 C ATOM 1385 CG LEU A 83 -3.417 0.423 0.411 1.00 74.24 C ATOM 1386 CD1 LEU A 83 -4.627 0.345 1.368 1.00 3.45 C ATOM 1387 CD2 LEU A 83 -3.208 -0.900 -0.343 1.00 13.32 C ATOM 0 H LEU A 83 -1.148 2.054 0.094 1.00 62.33 H new ATOM 0 HA LEU A 83 -2.351 0.960 -2.250 1.00 21.21 H new ATOM 0 HB2 LEU A 83 -3.619 2.543 0.029 1.00 12.21 H new ATOM 0 HB3 LEU A 83 -4.474 1.531 -1.118 1.00 12.21 H new ATOM 0 HG LEU A 83 -2.528 0.589 1.020 1.00 74.24 H new ATOM 0 HD11 LEU A 83 -4.509 -0.509 2.035 1.00 3.45 H new ATOM 0 HD12 LEU A 83 -4.684 1.260 1.957 1.00 3.45 H new ATOM 0 HD13 LEU A 83 -5.543 0.229 0.788 1.00 3.45 H new ATOM 0 HD21 LEU A 83 -3.128 -1.718 0.373 1.00 13.32 H new ATOM 0 HD22 LEU A 83 -4.055 -1.079 -1.005 1.00 13.32 H new ATOM 0 HD23 LEU A 83 -2.293 -0.842 -0.932 1.00 13.32 H new ATOM 1399 N LYS A 84 -2.287 4.260 -1.902 1.00 11.03 N ATOM 1400 CA LYS A 84 -2.407 5.582 -2.557 1.00 54.22 C ATOM 1401 C LYS A 84 -1.474 5.643 -3.802 1.00 2.34 C ATOM 1402 O LYS A 84 -1.803 6.268 -4.800 1.00 51.30 O ATOM 1403 CB LYS A 84 -2.106 6.712 -1.485 1.00 75.40 C ATOM 1404 CG LYS A 84 -1.011 7.759 -1.832 1.00 43.02 C ATOM 1405 CD LYS A 84 -1.509 8.922 -2.725 1.00 74.45 C ATOM 1406 CE LYS A 84 -2.364 9.938 -1.965 1.00 24.41 C ATOM 1407 NZ LYS A 84 -2.943 10.959 -2.873 1.00 52.44 N ATOM 0 H LYS A 84 -1.873 4.313 -0.971 1.00 11.03 H new ATOM 0 HA LYS A 84 -3.419 5.747 -2.928 1.00 54.22 H new ATOM 0 HB2 LYS A 84 -3.035 7.249 -1.292 1.00 75.40 H new ATOM 0 HB3 LYS A 84 -1.821 6.224 -0.553 1.00 75.40 H new ATOM 0 HG2 LYS A 84 -0.612 8.172 -0.906 1.00 43.02 H new ATOM 0 HG3 LYS A 84 -0.188 7.254 -2.337 1.00 43.02 H new ATOM 0 HD2 LYS A 84 -0.649 9.432 -3.160 1.00 74.45 H new ATOM 0 HD3 LYS A 84 -2.090 8.514 -3.552 1.00 74.45 H new ATOM 0 HE2 LYS A 84 -3.167 9.419 -1.443 1.00 24.41 H new ATOM 0 HE3 LYS A 84 -1.756 10.430 -1.206 1.00 24.41 H new ATOM 0 HZ1 LYS A 84 -2.547 11.893 -2.643 1.00 52.44 H new ATOM 0 HZ2 LYS A 84 -2.712 10.719 -3.858 1.00 52.44 H new ATOM 0 HZ3 LYS A 84 -3.976 10.982 -2.756 1.00 52.44 H new ATOM 1421 N PHE A 85 -0.311 4.983 -3.708 1.00 73.34 N ATOM 1422 CA PHE A 85 0.610 4.788 -4.846 1.00 63.23 C ATOM 1423 C PHE A 85 -0.001 3.832 -5.899 1.00 12.12 C ATOM 1424 O PHE A 85 0.060 4.101 -7.101 1.00 71.30 O ATOM 1425 CB PHE A 85 1.957 4.240 -4.307 1.00 62.14 C ATOM 1426 CG PHE A 85 2.978 3.833 -5.371 1.00 62.24 C ATOM 1427 CD1 PHE A 85 3.728 4.791 -6.047 1.00 61.43 C ATOM 1428 CD2 PHE A 85 3.195 2.488 -5.683 1.00 51.44 C ATOM 1429 CE1 PHE A 85 4.659 4.413 -6.992 1.00 3.45 C ATOM 1430 CE2 PHE A 85 4.123 2.116 -6.628 1.00 2.35 C ATOM 1431 CZ PHE A 85 4.858 3.079 -7.284 1.00 34.31 C ATOM 0 H PHE A 85 0.022 4.566 -2.839 1.00 73.34 H new ATOM 0 HA PHE A 85 0.780 5.742 -5.344 1.00 63.23 H new ATOM 0 HB2 PHE A 85 2.408 4.999 -3.668 1.00 62.14 H new ATOM 0 HB3 PHE A 85 1.751 3.375 -3.677 1.00 62.14 H new ATOM 0 HD1 PHE A 85 3.580 5.839 -5.830 1.00 61.43 H new ATOM 0 HD2 PHE A 85 2.624 1.727 -5.173 1.00 51.44 H new ATOM 0 HE1 PHE A 85 5.236 5.166 -7.507 1.00 3.45 H new ATOM 0 HE2 PHE A 85 4.275 1.071 -6.855 1.00 2.35 H new ATOM 0 HZ PHE A 85 5.588 2.791 -8.025 1.00 34.31 H new ATOM 1441 N ALA A 86 -0.608 2.735 -5.403 1.00 15.24 N ATOM 1442 CA ALA A 86 -1.142 1.630 -6.225 1.00 21.22 C ATOM 1443 C ALA A 86 -2.157 2.096 -7.289 1.00 2.24 C ATOM 1444 O ALA A 86 -2.041 1.750 -8.457 1.00 3.40 O ATOM 1445 CB ALA A 86 -1.790 0.580 -5.317 1.00 30.31 C ATOM 0 H ALA A 86 -0.743 2.590 -4.403 1.00 15.24 H new ATOM 0 HA ALA A 86 -0.297 1.202 -6.764 1.00 21.22 H new ATOM 0 HB1 ALA A 86 -2.183 -0.234 -5.926 1.00 30.31 H new ATOM 0 HB2 ALA A 86 -1.045 0.188 -4.624 1.00 30.31 H new ATOM 0 HB3 ALA A 86 -2.603 1.038 -4.754 1.00 30.31 H new ATOM 1451 N GLU A 87 -3.135 2.901 -6.869 1.00 22.34 N ATOM 1452 CA GLU A 87 -4.203 3.417 -7.767 1.00 25.33 C ATOM 1453 C GLU A 87 -3.654 4.200 -8.996 1.00 52.44 C ATOM 1454 O GLU A 87 -4.304 4.249 -10.043 1.00 0.20 O ATOM 1455 CB GLU A 87 -5.162 4.307 -6.946 1.00 32.13 C ATOM 1456 CG GLU A 87 -4.462 5.468 -6.223 1.00 0.02 C ATOM 1457 CD GLU A 87 -5.410 6.304 -5.362 1.00 12.14 C ATOM 1458 OE1 GLU A 87 -5.729 5.884 -4.230 1.00 43.22 O ATOM 1459 OE2 GLU A 87 -5.858 7.370 -5.822 1.00 5.03 O ATOM 0 H GLU A 87 -3.221 3.220 -5.904 1.00 22.34 H new ATOM 0 HA GLU A 87 -4.732 2.555 -8.174 1.00 25.33 H new ATOM 0 HB2 GLU A 87 -5.925 4.712 -7.610 1.00 32.13 H new ATOM 0 HB3 GLU A 87 -5.676 3.689 -6.209 1.00 32.13 H new ATOM 0 HG2 GLU A 87 -3.667 5.068 -5.593 1.00 0.02 H new ATOM 0 HG3 GLU A 87 -3.988 6.114 -6.962 1.00 0.02 H new ATOM 1466 N TYR A 88 -2.450 4.785 -8.856 1.00 30.43 N ATOM 1467 CA TYR A 88 -1.773 5.521 -9.954 1.00 2.22 C ATOM 1468 C TYR A 88 -1.053 4.551 -10.929 1.00 31.25 C ATOM 1469 O TYR A 88 -0.851 4.872 -12.103 1.00 74.43 O ATOM 1470 CB TYR A 88 -0.764 6.555 -9.377 1.00 60.33 C ATOM 1471 CG TYR A 88 -1.375 7.555 -8.371 1.00 54.15 C ATOM 1472 CD1 TYR A 88 -2.669 8.067 -8.548 1.00 74.13 C ATOM 1473 CD2 TYR A 88 -0.667 7.978 -7.238 1.00 34.12 C ATOM 1474 CE1 TYR A 88 -3.224 8.951 -7.641 1.00 51.10 C ATOM 1475 CE2 TYR A 88 -1.225 8.860 -6.333 1.00 34.22 C ATOM 1476 CZ TYR A 88 -2.501 9.342 -6.538 1.00 2.11 C ATOM 1477 OH TYR A 88 -3.057 10.221 -5.633 1.00 52.40 O ATOM 0 H TYR A 88 -1.917 4.765 -7.987 1.00 30.43 H new ATOM 0 HA TYR A 88 -2.540 6.053 -10.517 1.00 2.22 H new ATOM 0 HB2 TYR A 88 0.048 6.017 -8.887 1.00 60.33 H new ATOM 0 HB3 TYR A 88 -0.324 7.114 -10.203 1.00 60.33 H new ATOM 0 HD1 TYR A 88 -3.244 7.764 -9.411 1.00 74.13 H new ATOM 0 HD2 TYR A 88 0.333 7.608 -7.069 1.00 34.12 H new ATOM 0 HE1 TYR A 88 -4.222 9.333 -7.798 1.00 51.10 H new ATOM 0 HE2 TYR A 88 -0.662 9.172 -5.465 1.00 34.22 H new ATOM 0 HH TYR A 88 -3.950 9.907 -5.378 1.00 52.40 H new ATOM 1487 N ASN A 89 -0.672 3.368 -10.422 1.00 62.42 N ATOM 1488 CA ASN A 89 0.037 2.325 -11.204 1.00 24.33 C ATOM 1489 C ASN A 89 -0.935 1.261 -11.771 1.00 53.03 C ATOM 1490 O ASN A 89 -2.057 1.093 -11.283 1.00 33.11 O ATOM 1491 CB ASN A 89 1.114 1.654 -10.317 1.00 54.31 C ATOM 1492 CG ASN A 89 2.269 2.592 -9.994 1.00 23.11 C ATOM 1493 OD1 ASN A 89 3.305 2.578 -10.643 1.00 43.52 O ATOM 1494 ND2 ASN A 89 2.089 3.444 -9.012 1.00 4.41 N ATOM 0 H ASN A 89 -0.845 3.100 -9.453 1.00 62.42 H new ATOM 0 HA ASN A 89 0.513 2.810 -12.056 1.00 24.33 H new ATOM 0 HB2 ASN A 89 0.655 1.314 -9.388 1.00 54.31 H new ATOM 0 HB3 ASN A 89 1.499 0.770 -10.825 1.00 54.31 H new ATOM 0 HD21 ASN A 89 2.822 4.113 -8.777 1.00 4.41 H new ATOM 0 HD22 ASN A 89 1.216 3.437 -8.484 1.00 4.41 H new ATOM 1501 N SER A 90 -0.477 0.553 -12.819 1.00 35.54 N ATOM 1502 CA SER A 90 -1.220 -0.568 -13.446 1.00 60.23 C ATOM 1503 C SER A 90 -0.575 -1.935 -13.103 1.00 23.51 C ATOM 1504 O SER A 90 -1.216 -2.982 -13.236 1.00 43.30 O ATOM 1505 CB SER A 90 -1.277 -0.371 -14.981 1.00 14.05 C ATOM 1506 OG SER A 90 -2.046 -1.386 -15.615 1.00 51.31 O ATOM 0 H SER A 90 0.423 0.739 -13.261 1.00 35.54 H new ATOM 0 HA SER A 90 -2.234 -0.569 -13.046 1.00 60.23 H new ATOM 0 HB2 SER A 90 -1.707 0.605 -15.207 1.00 14.05 H new ATOM 0 HB3 SER A 90 -0.265 -0.375 -15.386 1.00 14.05 H new ATOM 0 HG SER A 90 -2.061 -1.229 -16.582 1.00 51.31 H new ATOM 1512 N ASP A 91 0.687 -1.910 -12.631 1.00 63.30 N ATOM 1513 CA ASP A 91 1.487 -3.131 -12.333 1.00 51.20 C ATOM 1514 C ASP A 91 1.215 -3.681 -10.897 1.00 51.21 C ATOM 1515 O ASP A 91 2.129 -4.091 -10.175 1.00 53.24 O ATOM 1516 CB ASP A 91 2.996 -2.818 -12.545 1.00 24.55 C ATOM 1517 CG ASP A 91 3.533 -1.707 -11.615 1.00 53.34 C ATOM 1518 OD1 ASP A 91 3.208 -0.521 -11.837 1.00 1.44 O ATOM 1519 OD2 ASP A 91 4.298 -2.013 -10.674 1.00 74.41 O ATOM 0 H ASP A 91 1.189 -1.042 -12.442 1.00 63.30 H new ATOM 0 HA ASP A 91 1.182 -3.919 -13.021 1.00 51.20 H new ATOM 0 HB2 ASP A 91 3.574 -3.728 -12.382 1.00 24.55 H new ATOM 0 HB3 ASP A 91 3.155 -2.521 -13.582 1.00 24.55 H new ATOM 1524 N LEU A 92 -0.073 -3.776 -10.543 1.00 3.35 N ATOM 1525 CA LEU A 92 -0.517 -4.037 -9.159 1.00 34.23 C ATOM 1526 C LEU A 92 -0.323 -5.498 -8.690 1.00 21.40 C ATOM 1527 O LEU A 92 -0.034 -5.719 -7.514 1.00 43.24 O ATOM 1528 CB LEU A 92 -1.987 -3.587 -8.990 1.00 35.33 C ATOM 1529 CG LEU A 92 -2.273 -2.094 -9.351 1.00 71.40 C ATOM 1530 CD1 LEU A 92 -3.707 -1.660 -8.951 1.00 1.25 C ATOM 1531 CD2 LEU A 92 -1.207 -1.167 -8.730 1.00 62.51 C ATOM 0 H LEU A 92 -0.841 -3.675 -11.206 1.00 3.35 H new ATOM 0 HA LEU A 92 0.131 -3.448 -8.510 1.00 34.23 H new ATOM 0 HB2 LEU A 92 -2.618 -4.222 -9.612 1.00 35.33 H new ATOM 0 HB3 LEU A 92 -2.285 -3.757 -7.956 1.00 35.33 H new ATOM 0 HG LEU A 92 -2.211 -2.003 -10.435 1.00 71.40 H new ATOM 0 HD11 LEU A 92 -3.860 -0.615 -9.221 1.00 1.25 H new ATOM 0 HD12 LEU A 92 -4.434 -2.280 -9.475 1.00 1.25 H new ATOM 0 HD13 LEU A 92 -3.836 -1.779 -7.875 1.00 1.25 H new ATOM 0 HD21 LEU A 92 -1.426 -0.132 -8.994 1.00 62.51 H new ATOM 0 HD22 LEU A 92 -1.219 -1.275 -7.645 1.00 62.51 H new ATOM 0 HD23 LEU A 92 -0.222 -1.438 -9.111 1.00 62.51 H new ATOM 1543 N HIS A 93 -0.486 -6.504 -9.579 1.00 54.44 N ATOM 1544 CA HIS A 93 -0.233 -7.918 -9.188 1.00 3.23 C ATOM 1545 C HIS A 93 1.275 -8.174 -8.917 1.00 61.31 C ATOM 1546 O HIS A 93 1.630 -9.106 -8.198 1.00 33.30 O ATOM 1547 CB HIS A 93 -0.836 -8.938 -10.201 1.00 14.41 C ATOM 1548 CG HIS A 93 -0.240 -8.997 -11.588 1.00 63.12 C ATOM 1549 ND1 HIS A 93 -0.928 -8.597 -12.715 1.00 40.55 N ATOM 1550 CD2 HIS A 93 0.940 -9.497 -12.043 1.00 60.05 C ATOM 1551 CE1 HIS A 93 -0.208 -8.845 -13.786 1.00 11.14 C ATOM 1552 NE2 HIS A 93 0.927 -9.389 -13.409 1.00 63.14 N ATOM 0 H HIS A 93 -0.783 -6.375 -10.546 1.00 54.44 H new ATOM 0 HA HIS A 93 -0.760 -8.084 -8.249 1.00 3.23 H new ATOM 0 HB2 HIS A 93 -0.757 -9.932 -9.761 1.00 14.41 H new ATOM 0 HB3 HIS A 93 -1.899 -8.718 -10.303 1.00 14.41 H new ATOM 0 HD2 HIS A 93 1.739 -9.903 -11.440 1.00 60.05 H new ATOM 0 HE1 HIS A 93 -0.500 -8.637 -14.805 1.00 11.14 H new ATOM 0 HE2 HIS A 93 1.678 -9.684 -14.033 1.00 63.14 H new ATOM 1561 N GLN A 94 2.152 -7.337 -9.501 1.00 61.15 N ATOM 1562 CA GLN A 94 3.591 -7.300 -9.143 1.00 63.53 C ATOM 1563 C GLN A 94 3.790 -6.580 -7.780 1.00 54.32 C ATOM 1564 O GLN A 94 4.402 -7.124 -6.857 1.00 22.50 O ATOM 1565 CB GLN A 94 4.412 -6.562 -10.240 1.00 3.14 C ATOM 1566 CG GLN A 94 4.415 -7.220 -11.633 1.00 43.21 C ATOM 1567 CD GLN A 94 5.195 -6.418 -12.687 1.00 65.15 C ATOM 1568 OE1 GLN A 94 6.157 -5.723 -12.383 1.00 63.40 O ATOM 1569 NE2 GLN A 94 4.790 -6.508 -13.934 1.00 53.32 N ATOM 0 H GLN A 94 1.891 -6.671 -10.228 1.00 61.15 H new ATOM 0 HA GLN A 94 3.945 -8.328 -9.065 1.00 63.53 H new ATOM 0 HB2 GLN A 94 4.022 -5.549 -10.339 1.00 3.14 H new ATOM 0 HB3 GLN A 94 5.443 -6.475 -9.898 1.00 3.14 H new ATOM 0 HG2 GLN A 94 4.847 -8.218 -11.554 1.00 43.21 H new ATOM 0 HG3 GLN A 94 3.386 -7.344 -11.970 1.00 43.21 H new ATOM 0 HE21 GLN A 94 3.987 -7.092 -14.169 1.00 53.32 H new ATOM 0 HE22 GLN A 94 5.279 -5.994 -14.667 1.00 53.32 H new ATOM 1578 N PHE A 95 3.227 -5.359 -7.688 1.00 41.23 N ATOM 1579 CA PHE A 95 3.410 -4.432 -6.550 1.00 14.43 C ATOM 1580 C PHE A 95 2.890 -4.999 -5.198 1.00 23.25 C ATOM 1581 O PHE A 95 3.657 -5.122 -4.242 1.00 22.44 O ATOM 1582 CB PHE A 95 2.720 -3.080 -6.892 1.00 5.42 C ATOM 1583 CG PHE A 95 2.656 -2.092 -5.731 1.00 13.14 C ATOM 1584 CD1 PHE A 95 3.821 -1.643 -5.109 1.00 12.53 C ATOM 1585 CD2 PHE A 95 1.432 -1.632 -5.243 1.00 63.44 C ATOM 1586 CE1 PHE A 95 3.765 -0.774 -4.048 1.00 71.03 C ATOM 1587 CE2 PHE A 95 1.384 -0.760 -4.184 1.00 43.44 C ATOM 1588 CZ PHE A 95 2.550 -0.331 -3.586 1.00 40.25 C ATOM 0 H PHE A 95 2.620 -4.981 -8.416 1.00 41.23 H new ATOM 0 HA PHE A 95 4.481 -4.287 -6.407 1.00 14.43 H new ATOM 0 HB2 PHE A 95 3.253 -2.614 -7.721 1.00 5.42 H new ATOM 0 HB3 PHE A 95 1.706 -3.281 -7.238 1.00 5.42 H new ATOM 0 HD1 PHE A 95 4.781 -1.984 -5.467 1.00 12.53 H new ATOM 0 HD2 PHE A 95 0.514 -1.965 -5.703 1.00 63.44 H new ATOM 0 HE1 PHE A 95 4.677 -0.439 -3.576 1.00 71.03 H new ATOM 0 HE2 PHE A 95 0.430 -0.409 -3.818 1.00 43.44 H new ATOM 0 HZ PHE A 95 2.508 0.355 -2.753 1.00 40.25 H new ATOM 1598 N PHE A 96 1.585 -5.300 -5.126 1.00 55.41 N ATOM 1599 CA PHE A 96 0.941 -5.850 -3.909 1.00 11.10 C ATOM 1600 C PHE A 96 1.575 -7.186 -3.449 1.00 53.32 C ATOM 1601 O PHE A 96 1.631 -7.468 -2.247 1.00 72.23 O ATOM 1602 CB PHE A 96 -0.564 -6.059 -4.153 1.00 4.52 C ATOM 1603 CG PHE A 96 -1.418 -4.793 -4.147 1.00 15.14 C ATOM 1604 CD1 PHE A 96 -1.994 -4.335 -2.966 1.00 53.14 C ATOM 1605 CD2 PHE A 96 -1.679 -4.089 -5.318 1.00 42.11 C ATOM 1606 CE1 PHE A 96 -2.792 -3.214 -2.957 1.00 43.44 C ATOM 1607 CE2 PHE A 96 -2.485 -2.971 -5.307 1.00 72.32 C ATOM 1608 CZ PHE A 96 -3.044 -2.534 -4.127 1.00 22.24 C ATOM 0 H PHE A 96 0.941 -5.171 -5.906 1.00 55.41 H new ATOM 0 HA PHE A 96 1.097 -5.120 -3.115 1.00 11.10 H new ATOM 0 HB2 PHE A 96 -0.692 -6.557 -5.114 1.00 4.52 H new ATOM 0 HB3 PHE A 96 -0.946 -6.737 -3.390 1.00 4.52 H new ATOM 0 HD1 PHE A 96 -1.812 -4.867 -2.044 1.00 53.14 H new ATOM 0 HD2 PHE A 96 -1.244 -4.423 -6.248 1.00 42.11 H new ATOM 0 HE1 PHE A 96 -3.222 -2.867 -2.029 1.00 43.44 H new ATOM 0 HE2 PHE A 96 -2.678 -2.437 -6.225 1.00 72.32 H new ATOM 0 HZ PHE A 96 -3.678 -1.660 -4.119 1.00 22.24 H new ATOM 1618 N GLU A 97 2.021 -8.009 -4.417 1.00 2.32 N ATOM 1619 CA GLU A 97 2.673 -9.302 -4.124 1.00 31.50 C ATOM 1620 C GLU A 97 4.078 -9.084 -3.519 1.00 63.40 C ATOM 1621 O GLU A 97 4.484 -9.808 -2.610 1.00 73.35 O ATOM 1622 CB GLU A 97 2.725 -10.180 -5.399 1.00 53.03 C ATOM 1623 CG GLU A 97 3.067 -11.664 -5.143 1.00 34.45 C ATOM 1624 CD GLU A 97 2.939 -12.536 -6.403 1.00 60.21 C ATOM 1625 OE1 GLU A 97 1.809 -12.977 -6.719 1.00 74.45 O ATOM 1626 OE2 GLU A 97 3.960 -12.774 -7.089 1.00 13.11 O ATOM 0 H GLU A 97 1.942 -7.801 -5.412 1.00 2.32 H new ATOM 0 HA GLU A 97 2.080 -9.833 -3.379 1.00 31.50 H new ATOM 0 HB2 GLU A 97 1.760 -10.125 -5.902 1.00 53.03 H new ATOM 0 HB3 GLU A 97 3.465 -9.763 -6.082 1.00 53.03 H new ATOM 0 HG2 GLU A 97 4.085 -11.736 -4.760 1.00 34.45 H new ATOM 0 HG3 GLU A 97 2.407 -12.055 -4.369 1.00 34.45 H new ATOM 1633 N PHE A 98 4.780 -8.047 -4.013 1.00 45.23 N ATOM 1634 CA PHE A 98 6.062 -7.579 -3.446 1.00 63.01 C ATOM 1635 C PHE A 98 5.878 -7.158 -1.966 1.00 1.42 C ATOM 1636 O PHE A 98 6.651 -7.584 -1.099 1.00 5.42 O ATOM 1637 CB PHE A 98 6.634 -6.422 -4.346 1.00 23.02 C ATOM 1638 CG PHE A 98 7.382 -5.296 -3.620 1.00 10.44 C ATOM 1639 CD1 PHE A 98 8.624 -5.515 -3.017 1.00 24.24 C ATOM 1640 CD2 PHE A 98 6.823 -4.016 -3.534 1.00 14.51 C ATOM 1641 CE1 PHE A 98 9.276 -4.492 -2.357 1.00 24.41 C ATOM 1642 CE2 PHE A 98 7.479 -2.998 -2.875 1.00 73.21 C ATOM 1643 CZ PHE A 98 8.703 -3.235 -2.287 1.00 1.53 C ATOM 0 H PHE A 98 4.473 -7.506 -4.821 1.00 45.23 H new ATOM 0 HA PHE A 98 6.792 -8.388 -3.445 1.00 63.01 H new ATOM 0 HB2 PHE A 98 7.309 -6.862 -5.080 1.00 23.02 H new ATOM 0 HB3 PHE A 98 5.806 -5.980 -4.900 1.00 23.02 H new ATOM 0 HD1 PHE A 98 9.078 -6.494 -3.068 1.00 24.24 H new ATOM 0 HD2 PHE A 98 5.864 -3.823 -3.991 1.00 14.51 H new ATOM 0 HE1 PHE A 98 10.235 -4.674 -1.895 1.00 24.41 H new ATOM 0 HE2 PHE A 98 7.034 -2.015 -2.820 1.00 73.21 H new ATOM 0 HZ PHE A 98 9.216 -2.437 -1.770 1.00 1.53 H new ATOM 1653 N LEU A 99 4.838 -6.339 -1.700 1.00 71.33 N ATOM 1654 CA LEU A 99 4.501 -5.874 -0.340 1.00 13.22 C ATOM 1655 C LEU A 99 4.289 -7.064 0.622 1.00 60.32 C ATOM 1656 O LEU A 99 5.036 -7.215 1.594 1.00 44.43 O ATOM 1657 CB LEU A 99 3.231 -4.979 -0.363 1.00 52.24 C ATOM 1658 CG LEU A 99 3.338 -3.635 -1.156 1.00 45.33 C ATOM 1659 CD1 LEU A 99 1.991 -2.883 -1.147 1.00 10.31 C ATOM 1660 CD2 LEU A 99 4.481 -2.739 -0.610 1.00 12.50 C ATOM 0 H LEU A 99 4.211 -5.983 -2.421 1.00 71.33 H new ATOM 0 HA LEU A 99 5.342 -5.284 0.023 1.00 13.22 H new ATOM 0 HB2 LEU A 99 2.412 -5.560 -0.786 1.00 52.24 H new ATOM 0 HB3 LEU A 99 2.959 -4.747 0.667 1.00 52.24 H new ATOM 0 HG LEU A 99 3.583 -3.881 -2.189 1.00 45.33 H new ATOM 0 HD11 LEU A 99 2.090 -1.952 -1.705 1.00 10.31 H new ATOM 0 HD12 LEU A 99 1.225 -3.504 -1.611 1.00 10.31 H new ATOM 0 HD13 LEU A 99 1.705 -2.661 -0.119 1.00 10.31 H new ATOM 0 HD21 LEU A 99 4.525 -1.814 -1.185 1.00 12.50 H new ATOM 0 HD22 LEU A 99 4.292 -2.506 0.438 1.00 12.50 H new ATOM 0 HD23 LEU A 99 5.431 -3.267 -0.698 1.00 12.50 H new ATOM 1672 N TYR A 100 3.305 -7.920 0.292 1.00 34.34 N ATOM 1673 CA TYR A 100 2.935 -9.093 1.110 1.00 72.54 C ATOM 1674 C TYR A 100 4.151 -10.005 1.408 1.00 3.05 C ATOM 1675 O TYR A 100 4.409 -10.339 2.569 1.00 13.43 O ATOM 1676 CB TYR A 100 1.811 -9.900 0.409 1.00 42.34 C ATOM 1677 CG TYR A 100 1.386 -11.169 1.174 1.00 23.32 C ATOM 1678 CD1 TYR A 100 0.708 -11.082 2.394 1.00 61.12 C ATOM 1679 CD2 TYR A 100 1.687 -12.448 0.691 1.00 40.10 C ATOM 1680 CE1 TYR A 100 0.350 -12.216 3.095 1.00 74.50 C ATOM 1681 CE2 TYR A 100 1.322 -13.579 1.394 1.00 50.13 C ATOM 1682 CZ TYR A 100 0.658 -13.457 2.593 1.00 32.54 C ATOM 1683 OH TYR A 100 0.296 -14.586 3.297 1.00 62.42 O ATOM 0 H TYR A 100 2.741 -7.819 -0.552 1.00 34.34 H new ATOM 0 HA TYR A 100 2.569 -8.722 2.067 1.00 72.54 H new ATOM 0 HB2 TYR A 100 0.941 -9.256 0.280 1.00 42.34 H new ATOM 0 HB3 TYR A 100 2.148 -10.184 -0.588 1.00 42.34 H new ATOM 0 HD1 TYR A 100 0.460 -10.110 2.795 1.00 61.12 H new ATOM 0 HD2 TYR A 100 2.213 -12.552 -0.246 1.00 40.10 H new ATOM 0 HE1 TYR A 100 -0.171 -12.128 4.037 1.00 74.50 H new ATOM 0 HE2 TYR A 100 1.557 -14.558 1.003 1.00 50.13 H new ATOM 0 HH TYR A 100 0.585 -15.384 2.807 1.00 62.42 H new ATOM 1693 N ASN A 101 4.907 -10.366 0.355 1.00 22.14 N ATOM 1694 CA ASN A 101 6.074 -11.271 0.476 1.00 22.03 C ATOM 1695 C ASN A 101 7.270 -10.608 1.207 1.00 12.12 C ATOM 1696 O ASN A 101 8.150 -11.310 1.709 1.00 22.43 O ATOM 1697 CB ASN A 101 6.515 -11.786 -0.913 1.00 31.23 C ATOM 1698 CG ASN A 101 5.435 -12.600 -1.631 1.00 71.21 C ATOM 1699 OD1 ASN A 101 4.582 -13.225 -1.009 1.00 23.24 O ATOM 1700 ND2 ASN A 101 5.472 -12.610 -2.946 1.00 12.25 N ATOM 0 H ASN A 101 4.732 -10.044 -0.597 1.00 22.14 H new ATOM 0 HA ASN A 101 5.752 -12.115 1.085 1.00 22.03 H new ATOM 0 HB2 ASN A 101 6.793 -10.936 -1.536 1.00 31.23 H new ATOM 0 HB3 ASN A 101 7.407 -12.402 -0.798 1.00 31.23 H new ATOM 0 HD21 ASN A 101 4.781 -13.146 -3.472 1.00 12.25 H new ATOM 0 HD22 ASN A 101 6.191 -12.082 -3.440 1.00 12.25 H new ATOM 1707 N HIS A 102 7.308 -9.261 1.252 1.00 70.13 N ATOM 1708 CA HIS A 102 8.330 -8.522 2.034 1.00 70.52 C ATOM 1709 C HIS A 102 7.898 -8.350 3.531 1.00 73.24 C ATOM 1710 O HIS A 102 8.652 -7.816 4.354 1.00 4.32 O ATOM 1711 CB HIS A 102 8.612 -7.143 1.373 1.00 3.00 C ATOM 1712 CG HIS A 102 9.914 -6.527 1.809 1.00 22.40 C ATOM 1713 ND1 HIS A 102 10.079 -5.920 3.032 1.00 14.23 N ATOM 1714 CD2 HIS A 102 11.136 -6.521 1.226 1.00 63.23 C ATOM 1715 CE1 HIS A 102 11.334 -5.582 3.187 1.00 1.42 C ATOM 1716 NE2 HIS A 102 11.999 -5.933 2.109 1.00 10.21 N ATOM 0 H HIS A 102 6.647 -8.661 0.759 1.00 70.13 H new ATOM 0 HA HIS A 102 9.249 -9.107 2.031 1.00 70.52 H new ATOM 0 HB2 HIS A 102 8.620 -7.262 0.290 1.00 3.00 H new ATOM 0 HB3 HIS A 102 7.797 -6.460 1.613 1.00 3.00 H new ATOM 0 HD1 HIS A 102 9.337 -5.758 3.713 1.00 14.23 H new ATOM 0 HD2 HIS A 102 11.383 -6.908 0.248 1.00 63.23 H new ATOM 0 HE1 HIS A 102 11.753 -5.096 4.056 1.00 1.42 H new ATOM 1725 N GLY A 103 6.679 -8.809 3.870 1.00 14.14 N ATOM 1726 CA GLY A 103 6.125 -8.675 5.230 1.00 35.35 C ATOM 1727 C GLY A 103 5.295 -7.404 5.421 1.00 35.51 C ATOM 1728 O GLY A 103 4.771 -7.160 6.513 1.00 15.12 O ATOM 0 H GLY A 103 6.055 -9.280 3.215 1.00 14.14 H new ATOM 0 HA2 GLY A 103 5.503 -9.543 5.449 1.00 35.35 H new ATOM 0 HA3 GLY A 103 6.943 -8.679 5.950 1.00 35.35 H new ATOM 1732 N ILE A 104 5.181 -6.591 4.354 1.00 54.30 N ATOM 1733 CA ILE A 104 4.415 -5.330 4.372 1.00 52.33 C ATOM 1734 C ILE A 104 2.893 -5.634 4.251 1.00 13.31 C ATOM 1735 O ILE A 104 2.456 -6.268 3.288 1.00 5.42 O ATOM 1736 CB ILE A 104 4.852 -4.360 3.200 1.00 13.21 C ATOM 1737 CG1 ILE A 104 6.415 -4.216 3.084 1.00 45.45 C ATOM 1738 CG2 ILE A 104 4.176 -2.971 3.326 1.00 30.11 C ATOM 1739 CD1 ILE A 104 7.126 -3.690 4.324 1.00 64.10 C ATOM 0 H ILE A 104 5.618 -6.790 3.454 1.00 54.30 H new ATOM 0 HA ILE A 104 4.623 -4.832 5.319 1.00 52.33 H new ATOM 0 HB ILE A 104 4.505 -4.823 2.276 1.00 13.21 H new ATOM 0 HG12 ILE A 104 6.833 -5.191 2.835 1.00 45.45 H new ATOM 0 HG13 ILE A 104 6.639 -3.551 2.250 1.00 45.45 H new ATOM 0 HG21 ILE A 104 4.500 -2.333 2.504 1.00 30.11 H new ATOM 0 HG22 ILE A 104 3.093 -3.089 3.289 1.00 30.11 H new ATOM 0 HG23 ILE A 104 4.459 -2.513 4.274 1.00 30.11 H new ATOM 0 HD11 ILE A 104 8.197 -3.631 4.132 1.00 64.10 H new ATOM 0 HD12 ILE A 104 6.746 -2.698 4.568 1.00 64.10 H new ATOM 0 HD13 ILE A 104 6.944 -4.364 5.161 1.00 64.10 H new ATOM 1751 N GLY A 105 2.122 -5.185 5.247 1.00 23.22 N ATOM 1752 CA GLY A 105 0.661 -5.282 5.264 1.00 44.45 C ATOM 1753 C GLY A 105 0.086 -6.628 5.688 1.00 55.15 C ATOM 1754 O GLY A 105 -1.061 -6.930 5.347 1.00 15.43 O ATOM 0 H GLY A 105 2.505 -4.736 6.079 1.00 23.22 H new ATOM 0 HA2 GLY A 105 0.274 -4.516 5.936 1.00 44.45 H new ATOM 0 HA3 GLY A 105 0.289 -5.049 4.266 1.00 44.45 H new ATOM 1758 N THR A 106 0.850 -7.424 6.454 1.00 3.31 N ATOM 1759 CA THR A 106 0.390 -8.752 6.933 1.00 42.45 C ATOM 1760 C THR A 106 -0.705 -8.639 8.024 1.00 64.34 C ATOM 1761 O THR A 106 -1.600 -9.488 8.099 1.00 61.14 O ATOM 1762 CB THR A 106 1.572 -9.620 7.463 1.00 5.40 C ATOM 1763 OG1 THR A 106 2.243 -8.935 8.530 1.00 74.30 O ATOM 1764 CG2 THR A 106 2.583 -9.957 6.347 1.00 11.44 C ATOM 0 H THR A 106 1.791 -7.177 6.759 1.00 3.31 H new ATOM 0 HA THR A 106 -0.045 -9.246 6.065 1.00 42.45 H new ATOM 0 HB THR A 106 1.153 -10.557 7.830 1.00 5.40 H new ATOM 0 HG1 THR A 106 2.953 -8.370 8.160 1.00 74.30 H new ATOM 0 HG21 THR A 106 3.390 -10.563 6.758 1.00 11.44 H new ATOM 0 HG22 THR A 106 2.080 -10.512 5.556 1.00 11.44 H new ATOM 0 HG23 THR A 106 2.994 -9.034 5.938 1.00 11.44 H new ATOM 1772 N LEU A 107 -0.625 -7.581 8.865 1.00 64.35 N ATOM 1773 CA LEU A 107 -1.697 -7.242 9.845 1.00 51.21 C ATOM 1774 C LEU A 107 -2.566 -6.061 9.342 1.00 31.40 C ATOM 1775 O LEU A 107 -3.269 -5.417 10.130 1.00 14.33 O ATOM 1776 CB LEU A 107 -1.114 -6.922 11.257 1.00 2.32 C ATOM 1777 CG LEU A 107 -0.436 -8.104 12.032 1.00 11.24 C ATOM 1778 CD1 LEU A 107 0.049 -7.655 13.433 1.00 1.31 C ATOM 1779 CD2 LEU A 107 -1.384 -9.314 12.148 1.00 53.44 C ATOM 0 H LEU A 107 0.171 -6.943 8.888 1.00 64.35 H new ATOM 0 HA LEU A 107 -2.331 -8.124 9.937 1.00 51.21 H new ATOM 0 HB2 LEU A 107 -0.380 -6.124 11.147 1.00 2.32 H new ATOM 0 HB3 LEU A 107 -1.921 -6.530 11.876 1.00 2.32 H new ATOM 0 HG LEU A 107 0.436 -8.412 11.456 1.00 11.24 H new ATOM 0 HD11 LEU A 107 0.514 -8.498 13.944 1.00 1.31 H new ATOM 0 HD12 LEU A 107 0.776 -6.850 13.326 1.00 1.31 H new ATOM 0 HD13 LEU A 107 -0.801 -7.301 14.016 1.00 1.31 H new ATOM 0 HD21 LEU A 107 -0.885 -10.117 12.690 1.00 53.44 H new ATOM 0 HD22 LEU A 107 -2.286 -9.020 12.685 1.00 53.44 H new ATOM 0 HD23 LEU A 107 -1.653 -9.662 11.151 1.00 53.44 H new ATOM 1791 N SER A 108 -2.561 -5.811 8.018 1.00 13.05 N ATOM 1792 CA SER A 108 -3.339 -4.714 7.398 1.00 22.15 C ATOM 1793 C SER A 108 -4.365 -5.271 6.388 1.00 10.40 C ATOM 1794 O SER A 108 -4.010 -5.593 5.252 1.00 2.01 O ATOM 1795 CB SER A 108 -2.388 -3.714 6.702 1.00 22.21 C ATOM 1796 OG SER A 108 -1.412 -3.215 7.603 1.00 52.24 O ATOM 0 H SER A 108 -2.021 -6.359 7.349 1.00 13.05 H new ATOM 0 HA SER A 108 -3.885 -4.193 8.184 1.00 22.15 H new ATOM 0 HB2 SER A 108 -1.894 -4.203 5.863 1.00 22.21 H new ATOM 0 HB3 SER A 108 -2.965 -2.885 6.293 1.00 22.21 H new ATOM 0 HG SER A 108 -1.039 -2.380 7.252 1.00 52.24 H new ATOM 1802 N SER A 109 -5.633 -5.395 6.829 1.00 1.50 N ATOM 1803 CA SER A 109 -6.778 -5.817 5.970 1.00 43.32 C ATOM 1804 C SER A 109 -6.941 -4.972 4.670 1.00 71.32 C ATOM 1805 O SER A 109 -7.053 -5.573 3.594 1.00 12.24 O ATOM 1806 CB SER A 109 -8.100 -5.809 6.776 1.00 61.42 C ATOM 1807 OG SER A 109 -9.241 -6.084 5.975 1.00 22.24 O ATOM 0 H SER A 109 -5.902 -5.206 7.795 1.00 1.50 H new ATOM 0 HA SER A 109 -6.544 -6.832 5.649 1.00 43.32 H new ATOM 0 HB2 SER A 109 -8.037 -6.548 7.574 1.00 61.42 H new ATOM 0 HB3 SER A 109 -8.223 -4.836 7.252 1.00 61.42 H new ATOM 0 HG SER A 109 -10.020 -6.225 6.553 1.00 22.24 H new ATOM 1813 N PRO A 110 -6.929 -3.577 4.716 1.00 60.35 N ATOM 1814 CA PRO A 110 -7.087 -2.728 3.485 1.00 2.51 C ATOM 1815 C PRO A 110 -6.095 -3.065 2.330 1.00 13.10 C ATOM 1816 O PRO A 110 -6.379 -2.755 1.170 1.00 43.12 O ATOM 1817 CB PRO A 110 -6.881 -1.275 4.011 1.00 51.31 C ATOM 1818 CG PRO A 110 -6.227 -1.430 5.355 1.00 63.22 C ATOM 1819 CD PRO A 110 -6.786 -2.707 5.927 1.00 33.04 C ATOM 0 HA PRO A 110 -8.060 -2.896 3.022 1.00 2.51 H new ATOM 0 HB2 PRO A 110 -6.254 -0.696 3.333 1.00 51.31 H new ATOM 0 HB3 PRO A 110 -7.832 -0.748 4.094 1.00 51.31 H new ATOM 0 HG2 PRO A 110 -5.142 -1.484 5.260 1.00 63.22 H new ATOM 0 HG3 PRO A 110 -6.449 -0.580 6.000 1.00 63.22 H new ATOM 0 HD2 PRO A 110 -6.115 -3.148 6.665 1.00 33.04 H new ATOM 0 HD3 PRO A 110 -7.743 -2.544 6.423 1.00 33.04 H new ATOM 1827 N LEU A 111 -4.942 -3.699 2.657 1.00 24.34 N ATOM 1828 CA LEU A 111 -3.988 -4.202 1.640 1.00 43.54 C ATOM 1829 C LEU A 111 -4.620 -5.345 0.812 1.00 51.33 C ATOM 1830 O LEU A 111 -4.671 -5.282 -0.419 1.00 75.03 O ATOM 1831 CB LEU A 111 -2.676 -4.726 2.289 1.00 5.21 C ATOM 1832 CG LEU A 111 -1.584 -5.193 1.263 1.00 54.13 C ATOM 1833 CD1 LEU A 111 -0.965 -3.988 0.530 1.00 40.43 C ATOM 1834 CD2 LEU A 111 -0.504 -6.084 1.912 1.00 45.43 C ATOM 0 H LEU A 111 -4.651 -3.874 3.619 1.00 24.34 H new ATOM 0 HA LEU A 111 -3.750 -3.360 0.991 1.00 43.54 H new ATOM 0 HB2 LEU A 111 -2.256 -3.939 2.915 1.00 5.21 H new ATOM 0 HB3 LEU A 111 -2.919 -5.560 2.947 1.00 5.21 H new ATOM 0 HG LEU A 111 -2.086 -5.815 0.522 1.00 54.13 H new ATOM 0 HD11 LEU A 111 -0.211 -4.339 -0.175 1.00 40.43 H new ATOM 0 HD12 LEU A 111 -1.745 -3.451 -0.010 1.00 40.43 H new ATOM 0 HD13 LEU A 111 -0.500 -3.320 1.255 1.00 40.43 H new ATOM 0 HD21 LEU A 111 0.226 -6.379 1.158 1.00 45.43 H new ATOM 0 HD22 LEU A 111 -0.003 -5.529 2.705 1.00 45.43 H new ATOM 0 HD23 LEU A 111 -0.971 -6.975 2.332 1.00 45.43 H new ATOM 1846 N TYR A 112 -5.100 -6.383 1.526 1.00 74.32 N ATOM 1847 CA TYR A 112 -5.714 -7.585 0.921 1.00 54.23 C ATOM 1848 C TYR A 112 -7.005 -7.238 0.152 1.00 41.51 C ATOM 1849 O TYR A 112 -7.268 -7.805 -0.904 1.00 3.32 O ATOM 1850 CB TYR A 112 -6.027 -8.640 2.014 1.00 2.02 C ATOM 1851 CG TYR A 112 -4.797 -9.127 2.799 1.00 22.32 C ATOM 1852 CD1 TYR A 112 -4.039 -10.215 2.361 1.00 54.05 C ATOM 1853 CD2 TYR A 112 -4.403 -8.505 3.987 1.00 5.02 C ATOM 1854 CE1 TYR A 112 -2.951 -10.668 3.078 1.00 50.13 C ATOM 1855 CE2 TYR A 112 -3.311 -8.952 4.699 1.00 13.52 C ATOM 1856 CZ TYR A 112 -2.591 -10.032 4.246 1.00 33.13 C ATOM 1857 OH TYR A 112 -1.522 -10.494 4.978 1.00 25.30 O ATOM 0 H TYR A 112 -5.073 -6.412 2.545 1.00 74.32 H new ATOM 0 HA TYR A 112 -4.995 -7.997 0.212 1.00 54.23 H new ATOM 0 HB2 TYR A 112 -6.746 -8.216 2.715 1.00 2.02 H new ATOM 0 HB3 TYR A 112 -6.507 -9.499 1.545 1.00 2.02 H new ATOM 0 HD1 TYR A 112 -4.310 -10.712 1.441 1.00 54.05 H new ATOM 0 HD2 TYR A 112 -4.965 -7.659 4.354 1.00 5.02 H new ATOM 0 HE1 TYR A 112 -2.384 -11.517 2.726 1.00 50.13 H new ATOM 0 HE2 TYR A 112 -3.021 -8.454 5.612 1.00 13.52 H new ATOM 0 HH TYR A 112 -0.747 -10.607 4.389 1.00 25.30 H new ATOM 1867 N ILE A 113 -7.797 -6.307 0.716 1.00 70.35 N ATOM 1868 CA ILE A 113 -9.049 -5.808 0.099 1.00 62.01 C ATOM 1869 C ILE A 113 -8.763 -5.066 -1.240 1.00 12.45 C ATOM 1870 O ILE A 113 -9.483 -5.259 -2.229 1.00 41.42 O ATOM 1871 CB ILE A 113 -9.827 -4.856 1.093 1.00 52.22 C ATOM 1872 CG1 ILE A 113 -10.083 -5.570 2.463 1.00 71.24 C ATOM 1873 CG2 ILE A 113 -11.160 -4.332 0.488 1.00 34.25 C ATOM 1874 CD1 ILE A 113 -10.903 -6.852 2.393 1.00 61.25 C ATOM 0 H ILE A 113 -7.589 -5.875 1.616 1.00 70.35 H new ATOM 0 HA ILE A 113 -9.675 -6.674 -0.117 1.00 62.01 H new ATOM 0 HB ILE A 113 -9.191 -3.988 1.265 1.00 52.22 H new ATOM 0 HG12 ILE A 113 -9.120 -5.800 2.918 1.00 71.24 H new ATOM 0 HG13 ILE A 113 -10.591 -4.871 3.128 1.00 71.24 H new ATOM 0 HG21 ILE A 113 -11.657 -3.683 1.209 1.00 34.25 H new ATOM 0 HG22 ILE A 113 -10.950 -3.770 -0.422 1.00 34.25 H new ATOM 0 HG23 ILE A 113 -11.809 -5.175 0.252 1.00 34.25 H new ATOM 0 HD11 ILE A 113 -11.020 -7.264 3.395 1.00 61.25 H new ATOM 0 HD12 ILE A 113 -11.885 -6.633 1.973 1.00 61.25 H new ATOM 0 HD13 ILE A 113 -10.391 -7.577 1.760 1.00 61.25 H new ATOM 1886 N ALA A 114 -7.702 -4.233 -1.256 1.00 30.14 N ATOM 1887 CA ALA A 114 -7.277 -3.477 -2.462 1.00 32.30 C ATOM 1888 C ALA A 114 -6.689 -4.401 -3.558 1.00 4.12 C ATOM 1889 O ALA A 114 -6.980 -4.231 -4.748 1.00 22.21 O ATOM 1890 CB ALA A 114 -6.256 -2.401 -2.065 1.00 25.23 C ATOM 0 H ALA A 114 -7.115 -4.063 -0.439 1.00 30.14 H new ATOM 0 HA ALA A 114 -8.163 -3.004 -2.886 1.00 32.30 H new ATOM 0 HB1 ALA A 114 -5.946 -1.848 -2.952 1.00 25.23 H new ATOM 0 HB2 ALA A 114 -6.710 -1.715 -1.350 1.00 25.23 H new ATOM 0 HB3 ALA A 114 -5.386 -2.875 -1.611 1.00 25.23 H new ATOM 1896 N TRP A 115 -5.859 -5.370 -3.130 1.00 52.31 N ATOM 1897 CA TRP A 115 -5.236 -6.371 -4.022 1.00 22.24 C ATOM 1898 C TRP A 115 -6.325 -7.245 -4.692 1.00 13.15 C ATOM 1899 O TRP A 115 -6.393 -7.329 -5.920 1.00 75.32 O ATOM 1900 CB TRP A 115 -4.245 -7.246 -3.198 1.00 21.21 C ATOM 1901 CG TRP A 115 -3.343 -8.190 -3.989 1.00 5.03 C ATOM 1902 CD1 TRP A 115 -3.263 -8.360 -5.352 1.00 2.04 C ATOM 1903 CD2 TRP A 115 -2.353 -9.073 -3.431 1.00 54.15 C ATOM 1904 NE1 TRP A 115 -2.332 -9.321 -5.657 1.00 2.24 N ATOM 1905 CE2 TRP A 115 -1.758 -9.767 -4.499 1.00 72.33 C ATOM 1906 CE3 TRP A 115 -1.922 -9.350 -2.124 1.00 24.24 C ATOM 1907 CZ2 TRP A 115 -0.767 -10.720 -4.302 1.00 54.31 C ATOM 1908 CZ3 TRP A 115 -0.938 -10.299 -1.933 1.00 21.32 C ATOM 1909 CH2 TRP A 115 -0.369 -10.974 -3.016 1.00 3.40 C ATOM 0 H TRP A 115 -5.599 -5.483 -2.150 1.00 52.31 H new ATOM 0 HA TRP A 115 -4.684 -5.863 -4.813 1.00 22.24 H new ATOM 0 HB2 TRP A 115 -3.611 -6.581 -2.612 1.00 21.21 H new ATOM 0 HB3 TRP A 115 -4.823 -7.841 -2.491 1.00 21.21 H new ATOM 0 HD1 TRP A 115 -3.849 -7.815 -6.078 1.00 2.04 H new ATOM 0 HE1 TRP A 115 -2.105 -9.649 -6.596 1.00 2.24 H new ATOM 0 HE3 TRP A 115 -2.353 -8.829 -1.282 1.00 24.24 H new ATOM 0 HZ2 TRP A 115 -0.324 -11.244 -5.136 1.00 54.31 H new ATOM 0 HZ3 TRP A 115 -0.603 -10.523 -0.931 1.00 21.32 H new ATOM 0 HH2 TRP A 115 0.400 -11.711 -2.836 1.00 3.40 H new ATOM 1920 N ALA A 116 -7.183 -7.857 -3.855 1.00 22.03 N ATOM 1921 CA ALA A 116 -8.298 -8.714 -4.305 1.00 13.53 C ATOM 1922 C ALA A 116 -9.333 -7.949 -5.156 1.00 75.40 C ATOM 1923 O ALA A 116 -9.911 -8.521 -6.079 1.00 10.51 O ATOM 1924 CB ALA A 116 -8.982 -9.353 -3.099 1.00 52.43 C ATOM 0 H ALA A 116 -7.123 -7.771 -2.840 1.00 22.03 H new ATOM 0 HA ALA A 116 -7.870 -9.487 -4.944 1.00 13.53 H new ATOM 0 HB1 ALA A 116 -9.804 -9.984 -3.439 1.00 52.43 H new ATOM 0 HB2 ALA A 116 -8.261 -9.960 -2.551 1.00 52.43 H new ATOM 0 HB3 ALA A 116 -9.370 -8.572 -2.445 1.00 52.43 H new ATOM 1930 N GLY A 117 -9.554 -6.660 -4.822 1.00 23.43 N ATOM 1931 CA GLY A 117 -10.420 -5.772 -5.614 1.00 55.34 C ATOM 1932 C GLY A 117 -9.888 -5.535 -7.034 1.00 41.14 C ATOM 1933 O GLY A 117 -10.656 -5.541 -8.004 1.00 60.44 O ATOM 0 H GLY A 117 -9.140 -6.213 -4.004 1.00 23.43 H new ATOM 0 HA2 GLY A 117 -11.419 -6.204 -5.672 1.00 55.34 H new ATOM 0 HA3 GLY A 117 -10.516 -4.814 -5.102 1.00 55.34 H new ATOM 1937 N HIS A 118 -8.558 -5.341 -7.148 1.00 73.40 N ATOM 1938 CA HIS A 118 -7.866 -5.227 -8.448 1.00 24.32 C ATOM 1939 C HIS A 118 -7.983 -6.532 -9.274 1.00 32.14 C ATOM 1940 O HIS A 118 -8.342 -6.495 -10.453 1.00 71.04 O ATOM 1941 CB HIS A 118 -6.372 -4.861 -8.232 1.00 63.42 C ATOM 1942 CG HIS A 118 -5.538 -4.945 -9.492 1.00 63.42 C ATOM 1943 ND1 HIS A 118 -5.638 -4.042 -10.531 1.00 0.33 N ATOM 1944 CD2 HIS A 118 -4.632 -5.867 -9.898 1.00 2.34 C ATOM 1945 CE1 HIS A 118 -4.842 -4.410 -11.511 1.00 34.30 C ATOM 1946 NE2 HIS A 118 -4.221 -5.510 -11.153 1.00 45.21 N ATOM 0 H HIS A 118 -7.935 -5.259 -6.344 1.00 73.40 H new ATOM 0 HA HIS A 118 -8.352 -4.431 -9.013 1.00 24.32 H new ATOM 0 HB2 HIS A 118 -6.309 -3.849 -7.832 1.00 63.42 H new ATOM 0 HB3 HIS A 118 -5.948 -5.528 -7.481 1.00 63.42 H new ATOM 0 HD2 HIS A 118 -4.296 -6.725 -9.335 1.00 2.34 H new ATOM 0 HE1 HIS A 118 -4.720 -3.894 -12.452 1.00 34.30 H new ATOM 0 HE2 HIS A 118 -3.541 -6.017 -11.720 1.00 45.21 H new ATOM 1955 N LEU A 119 -7.658 -7.673 -8.639 1.00 74.41 N ATOM 1956 CA LEU A 119 -7.667 -8.999 -9.295 1.00 20.33 C ATOM 1957 C LEU A 119 -9.086 -9.358 -9.802 1.00 62.53 C ATOM 1958 O LEU A 119 -9.245 -9.835 -10.917 1.00 33.12 O ATOM 1959 CB LEU A 119 -7.149 -10.077 -8.310 1.00 30.50 C ATOM 1960 CG LEU A 119 -5.684 -9.899 -7.790 1.00 32.33 C ATOM 1961 CD1 LEU A 119 -5.336 -10.954 -6.718 1.00 14.32 C ATOM 1962 CD2 LEU A 119 -4.661 -9.924 -8.944 1.00 55.35 C ATOM 0 H LEU A 119 -7.382 -7.705 -7.658 1.00 74.41 H new ATOM 0 HA LEU A 119 -7.005 -8.963 -10.160 1.00 20.33 H new ATOM 0 HB2 LEU A 119 -7.816 -10.101 -7.449 1.00 30.50 H new ATOM 0 HB3 LEU A 119 -7.222 -11.049 -8.798 1.00 30.50 H new ATOM 0 HG LEU A 119 -5.626 -8.916 -7.323 1.00 32.33 H new ATOM 0 HD11 LEU A 119 -4.312 -10.803 -6.378 1.00 14.32 H new ATOM 0 HD12 LEU A 119 -6.018 -10.853 -5.873 1.00 14.32 H new ATOM 0 HD13 LEU A 119 -5.433 -11.952 -7.145 1.00 14.32 H new ATOM 0 HD21 LEU A 119 -3.656 -9.797 -8.542 1.00 55.35 H new ATOM 0 HD22 LEU A 119 -4.725 -10.878 -9.467 1.00 55.35 H new ATOM 0 HD23 LEU A 119 -4.878 -9.114 -9.640 1.00 55.35 H new ATOM 1974 N GLU A 120 -10.098 -9.081 -8.965 1.00 60.15 N ATOM 1975 CA GLU A 120 -11.533 -9.230 -9.307 1.00 43.33 C ATOM 1976 C GLU A 120 -11.911 -8.459 -10.599 1.00 43.23 C ATOM 1977 O GLU A 120 -12.616 -8.994 -11.467 1.00 31.43 O ATOM 1978 CB GLU A 120 -12.384 -8.724 -8.119 1.00 72.55 C ATOM 1979 CG GLU A 120 -13.907 -8.781 -8.332 1.00 74.32 C ATOM 1980 CD GLU A 120 -14.705 -8.222 -7.146 1.00 72.13 C ATOM 1981 OE1 GLU A 120 -14.589 -7.011 -6.859 1.00 42.43 O ATOM 1982 OE2 GLU A 120 -15.464 -8.978 -6.511 1.00 54.14 O ATOM 0 H GLU A 120 -9.946 -8.741 -8.015 1.00 60.15 H new ATOM 0 HA GLU A 120 -11.731 -10.285 -9.496 1.00 43.33 H new ATOM 0 HB2 GLU A 120 -12.134 -9.314 -7.237 1.00 72.55 H new ATOM 0 HB3 GLU A 120 -12.102 -7.693 -7.904 1.00 72.55 H new ATOM 0 HG2 GLU A 120 -14.163 -8.220 -9.231 1.00 74.32 H new ATOM 0 HG3 GLU A 120 -14.204 -9.815 -8.507 1.00 74.32 H new ATOM 1989 N ALA A 121 -11.409 -7.211 -10.715 1.00 53.12 N ATOM 1990 CA ALA A 121 -11.634 -6.348 -11.899 1.00 2.32 C ATOM 1991 C ALA A 121 -11.010 -6.958 -13.181 1.00 14.22 C ATOM 1992 O ALA A 121 -11.525 -6.772 -14.288 1.00 52.22 O ATOM 1993 CB ALA A 121 -11.074 -4.936 -11.636 1.00 23.11 C ATOM 0 H ALA A 121 -10.837 -6.772 -9.993 1.00 53.12 H new ATOM 0 HA ALA A 121 -12.709 -6.278 -12.066 1.00 2.32 H new ATOM 0 HB1 ALA A 121 -11.244 -4.309 -12.511 1.00 23.11 H new ATOM 0 HB2 ALA A 121 -11.578 -4.500 -10.773 1.00 23.11 H new ATOM 0 HB3 ALA A 121 -10.004 -5.000 -11.437 1.00 23.11 H new ATOM 1999 N GLN A 122 -9.896 -7.694 -13.005 1.00 2.15 N ATOM 2000 CA GLN A 122 -9.190 -8.390 -14.108 1.00 5.15 C ATOM 2001 C GLN A 122 -9.824 -9.774 -14.418 1.00 1.22 C ATOM 2002 O GLN A 122 -9.679 -10.291 -15.528 1.00 60.10 O ATOM 2003 CB GLN A 122 -7.694 -8.557 -13.735 1.00 54.52 C ATOM 2004 CG GLN A 122 -6.982 -7.239 -13.361 1.00 53.14 C ATOM 2005 CD GLN A 122 -6.927 -6.206 -14.499 1.00 2.51 C ATOM 2006 OE1 GLN A 122 -6.868 -6.541 -15.677 1.00 35.43 O ATOM 2007 NE2 GLN A 122 -6.949 -4.939 -14.154 1.00 43.44 N ATOM 0 H GLN A 122 -9.456 -7.825 -12.094 1.00 2.15 H new ATOM 0 HA GLN A 122 -9.282 -7.783 -15.008 1.00 5.15 H new ATOM 0 HB2 GLN A 122 -7.616 -9.249 -12.897 1.00 54.52 H new ATOM 0 HB3 GLN A 122 -7.171 -9.013 -14.575 1.00 54.52 H new ATOM 0 HG2 GLN A 122 -7.491 -6.794 -12.506 1.00 53.14 H new ATOM 0 HG3 GLN A 122 -5.965 -7.467 -13.043 1.00 53.14 H new ATOM 0 HE21 GLN A 122 -6.998 -4.679 -13.169 1.00 43.44 H new ATOM 0 HE22 GLN A 122 -6.917 -4.214 -14.871 1.00 43.44 H new ATOM 2016 N GLY A 123 -10.520 -10.363 -13.422 1.00 54.44 N ATOM 2017 CA GLY A 123 -11.142 -11.701 -13.554 1.00 32.52 C ATOM 2018 C GLY A 123 -10.446 -12.777 -12.707 1.00 11.52 C ATOM 2019 O GLY A 123 -10.880 -13.925 -12.666 1.00 42.54 O ATOM 0 H GLY A 123 -10.667 -9.930 -12.510 1.00 54.44 H new ATOM 0 HA2 GLY A 123 -12.190 -11.638 -13.261 1.00 32.52 H new ATOM 0 HA3 GLY A 123 -11.122 -12.002 -14.601 1.00 32.52 H new ATOM 2023 N GLU A 124 -9.385 -12.370 -12.006 1.00 73.14 N ATOM 2024 CA GLU A 124 -8.516 -13.260 -11.194 1.00 20.33 C ATOM 2025 C GLU A 124 -9.088 -13.511 -9.760 1.00 15.04 C ATOM 2026 O GLU A 124 -8.350 -13.434 -8.771 1.00 72.05 O ATOM 2027 CB GLU A 124 -7.090 -12.626 -11.113 1.00 1.01 C ATOM 2028 CG GLU A 124 -6.497 -12.147 -12.459 1.00 23.13 C ATOM 2029 CD GLU A 124 -6.308 -13.277 -13.484 1.00 72.54 C ATOM 2030 OE1 GLU A 124 -5.265 -13.965 -13.441 1.00 74.45 O ATOM 2031 OE2 GLU A 124 -7.207 -13.491 -14.330 1.00 31.14 O ATOM 0 H GLU A 124 -9.090 -11.394 -11.979 1.00 73.14 H new ATOM 0 HA GLU A 124 -8.472 -14.234 -11.681 1.00 20.33 H new ATOM 0 HB2 GLU A 124 -7.127 -11.778 -10.430 1.00 1.01 H new ATOM 0 HB3 GLU A 124 -6.410 -13.358 -10.676 1.00 1.01 H new ATOM 0 HG2 GLU A 124 -7.152 -11.387 -12.885 1.00 23.13 H new ATOM 0 HG3 GLU A 124 -5.534 -11.671 -12.274 1.00 23.13 H new ATOM 2038 N LEU A 125 -10.395 -13.862 -9.662 1.00 21.12 N ATOM 2039 CA LEU A 125 -11.085 -14.105 -8.360 1.00 13.34 C ATOM 2040 C LEU A 125 -10.550 -15.332 -7.579 1.00 2.03 C ATOM 2041 O LEU A 125 -10.709 -15.397 -6.357 1.00 54.51 O ATOM 2042 CB LEU A 125 -12.620 -14.231 -8.535 1.00 21.23 C ATOM 2043 CG LEU A 125 -13.381 -12.896 -8.853 1.00 62.03 C ATOM 2044 CD1 LEU A 125 -13.345 -12.546 -10.350 1.00 55.33 C ATOM 2045 CD2 LEU A 125 -14.819 -12.929 -8.294 1.00 22.22 C ATOM 0 H LEU A 125 -11.000 -13.985 -10.474 1.00 21.12 H new ATOM 0 HA LEU A 125 -10.858 -13.222 -7.762 1.00 13.34 H new ATOM 0 HB2 LEU A 125 -12.818 -14.941 -9.338 1.00 21.23 H new ATOM 0 HB3 LEU A 125 -13.037 -14.657 -7.623 1.00 21.23 H new ATOM 0 HG LEU A 125 -12.852 -12.091 -8.343 1.00 62.03 H new ATOM 0 HD11 LEU A 125 -13.885 -11.614 -10.519 1.00 55.33 H new ATOM 0 HD12 LEU A 125 -12.310 -12.429 -10.672 1.00 55.33 H new ATOM 0 HD13 LEU A 125 -13.814 -13.346 -10.922 1.00 55.33 H new ATOM 0 HD21 LEU A 125 -15.322 -11.991 -8.529 1.00 22.22 H new ATOM 0 HD22 LEU A 125 -15.366 -13.757 -8.745 1.00 22.22 H new ATOM 0 HD23 LEU A 125 -14.786 -13.062 -7.213 1.00 22.22 H new ATOM 2057 N GLN A 126 -9.940 -16.303 -8.276 1.00 52.53 N ATOM 2058 CA GLN A 126 -9.380 -17.517 -7.629 1.00 73.40 C ATOM 2059 C GLN A 126 -8.109 -17.176 -6.828 1.00 60.22 C ATOM 2060 O GLN A 126 -7.867 -17.741 -5.754 1.00 0.31 O ATOM 2061 CB GLN A 126 -9.100 -18.627 -8.689 1.00 72.11 C ATOM 2062 CG GLN A 126 -10.355 -19.352 -9.240 1.00 2.13 C ATOM 2063 CD GLN A 126 -11.409 -18.434 -9.874 1.00 54.43 C ATOM 2064 OE1 GLN A 126 -11.362 -18.131 -11.057 1.00 72.23 O ATOM 2065 NE2 GLN A 126 -12.359 -17.971 -9.077 1.00 23.23 N ATOM 0 H GLN A 126 -9.818 -16.278 -9.288 1.00 52.53 H new ATOM 0 HA GLN A 126 -10.120 -17.903 -6.927 1.00 73.40 H new ATOM 0 HB2 GLN A 126 -8.563 -18.180 -9.526 1.00 72.11 H new ATOM 0 HB3 GLN A 126 -8.437 -19.370 -8.246 1.00 72.11 H new ATOM 0 HG2 GLN A 126 -10.037 -20.082 -9.984 1.00 2.13 H new ATOM 0 HG3 GLN A 126 -10.821 -19.908 -8.427 1.00 2.13 H new ATOM 0 HE21 GLN A 126 -12.375 -18.240 -8.093 1.00 23.23 H new ATOM 0 HE22 GLN A 126 -13.075 -17.346 -9.447 1.00 23.23 H new ATOM 2074 N HIS A 127 -7.312 -16.233 -7.358 1.00 53.24 N ATOM 2075 CA HIS A 127 -6.118 -15.718 -6.670 1.00 10.44 C ATOM 2076 C HIS A 127 -6.494 -14.608 -5.660 1.00 1.42 C ATOM 2077 O HIS A 127 -5.862 -14.476 -4.622 1.00 4.23 O ATOM 2078 CB HIS A 127 -5.082 -15.195 -7.693 1.00 14.23 C ATOM 2079 CG HIS A 127 -3.804 -14.715 -7.054 1.00 14.53 C ATOM 2080 ND1 HIS A 127 -3.266 -13.463 -7.252 1.00 44.22 N ATOM 2081 CD2 HIS A 127 -2.979 -15.329 -6.181 1.00 20.35 C ATOM 2082 CE1 HIS A 127 -2.181 -13.338 -6.527 1.00 5.23 C ATOM 2083 NE2 HIS A 127 -1.982 -14.452 -5.872 1.00 61.04 N ATOM 0 H HIS A 127 -7.477 -15.809 -8.271 1.00 53.24 H new ATOM 0 HA HIS A 127 -5.669 -16.541 -6.114 1.00 10.44 H new ATOM 0 HB2 HIS A 127 -4.849 -15.989 -8.403 1.00 14.23 H new ATOM 0 HB3 HIS A 127 -5.525 -14.378 -8.263 1.00 14.23 H new ATOM 0 HD2 HIS A 127 -3.088 -16.332 -5.797 1.00 20.35 H new ATOM 0 HE1 HIS A 127 -1.555 -12.460 -6.479 1.00 5.23 H new ATOM 0 HE2 HIS A 127 -1.207 -14.635 -5.234 1.00 61.04 H new ATOM 2092 N ALA A 128 -7.509 -13.807 -5.998 1.00 31.02 N ATOM 2093 CA ALA A 128 -8.023 -12.727 -5.129 1.00 51.22 C ATOM 2094 C ALA A 128 -8.588 -13.260 -3.796 1.00 0.13 C ATOM 2095 O ALA A 128 -8.305 -12.718 -2.728 1.00 63.14 O ATOM 2096 CB ALA A 128 -9.077 -11.939 -5.893 1.00 1.01 C ATOM 0 H ALA A 128 -8.005 -13.885 -6.886 1.00 31.02 H new ATOM 0 HA ALA A 128 -7.191 -12.074 -4.865 1.00 51.22 H new ATOM 0 HB1 ALA A 128 -9.463 -11.139 -5.261 1.00 1.01 H new ATOM 0 HB2 ALA A 128 -8.631 -11.509 -6.790 1.00 1.01 H new ATOM 0 HB3 ALA A 128 -9.893 -12.603 -6.177 1.00 1.01 H new ATOM 2102 N SER A 129 -9.391 -14.327 -3.885 1.00 12.22 N ATOM 2103 CA SER A 129 -9.878 -15.069 -2.703 1.00 73.03 C ATOM 2104 C SER A 129 -8.712 -15.751 -1.956 1.00 30.03 C ATOM 2105 O SER A 129 -8.703 -15.798 -0.726 1.00 60.01 O ATOM 2106 CB SER A 129 -10.913 -16.117 -3.125 1.00 64.33 C ATOM 2107 OG SER A 129 -10.361 -17.087 -4.006 1.00 50.10 O ATOM 0 H SER A 129 -9.724 -14.704 -4.773 1.00 12.22 H new ATOM 0 HA SER A 129 -10.347 -14.355 -2.026 1.00 73.03 H new ATOM 0 HB2 SER A 129 -11.307 -16.615 -2.239 1.00 64.33 H new ATOM 0 HB3 SER A 129 -11.753 -15.621 -3.612 1.00 64.33 H new ATOM 0 HG SER A 129 -10.366 -16.738 -4.922 1.00 50.10 H new ATOM 2113 N ALA A 130 -7.728 -16.266 -2.735 1.00 61.52 N ATOM 2114 CA ALA A 130 -6.459 -16.821 -2.200 1.00 15.15 C ATOM 2115 C ALA A 130 -5.637 -15.762 -1.429 1.00 43.53 C ATOM 2116 O ALA A 130 -4.820 -16.113 -0.597 1.00 42.10 O ATOM 2117 CB ALA A 130 -5.612 -17.433 -3.329 1.00 32.21 C ATOM 0 H ALA A 130 -7.792 -16.308 -3.752 1.00 61.52 H new ATOM 0 HA ALA A 130 -6.729 -17.605 -1.493 1.00 15.15 H new ATOM 0 HB1 ALA A 130 -4.687 -17.833 -2.914 1.00 32.21 H new ATOM 0 HB2 ALA A 130 -6.171 -18.236 -3.809 1.00 32.21 H new ATOM 0 HB3 ALA A 130 -5.376 -16.664 -4.065 1.00 32.21 H new ATOM 2123 N VAL A 131 -5.856 -14.473 -1.741 1.00 35.02 N ATOM 2124 CA VAL A 131 -5.260 -13.331 -1.008 1.00 44.42 C ATOM 2125 C VAL A 131 -6.053 -13.017 0.289 1.00 32.34 C ATOM 2126 O VAL A 131 -5.466 -12.816 1.354 1.00 20.51 O ATOM 2127 CB VAL A 131 -5.205 -12.057 -1.946 1.00 32.53 C ATOM 2128 CG1 VAL A 131 -4.912 -10.751 -1.172 1.00 21.34 C ATOM 2129 CG2 VAL A 131 -4.183 -12.266 -3.093 1.00 11.53 C ATOM 0 H VAL A 131 -6.456 -14.187 -2.515 1.00 35.02 H new ATOM 0 HA VAL A 131 -4.246 -13.604 -0.717 1.00 44.42 H new ATOM 0 HB VAL A 131 -6.199 -11.941 -2.378 1.00 32.53 H new ATOM 0 HG11 VAL A 131 -4.887 -9.913 -1.869 1.00 21.34 H new ATOM 0 HG12 VAL A 131 -5.694 -10.584 -0.431 1.00 21.34 H new ATOM 0 HG13 VAL A 131 -3.948 -10.834 -0.669 1.00 21.34 H new ATOM 0 HG21 VAL A 131 -4.160 -11.379 -3.726 1.00 11.53 H new ATOM 0 HG22 VAL A 131 -3.192 -12.436 -2.671 1.00 11.53 H new ATOM 0 HG23 VAL A 131 -4.477 -13.130 -3.689 1.00 11.53 H new ATOM 2139 N LEU A 132 -7.388 -12.994 0.182 1.00 55.41 N ATOM 2140 CA LEU A 132 -8.287 -12.623 1.305 1.00 25.21 C ATOM 2141 C LEU A 132 -8.203 -13.639 2.477 1.00 30.22 C ATOM 2142 O LEU A 132 -8.171 -13.245 3.648 1.00 24.05 O ATOM 2143 CB LEU A 132 -9.746 -12.495 0.803 1.00 3.34 C ATOM 2144 CG LEU A 132 -10.041 -11.357 -0.221 1.00 62.55 C ATOM 2145 CD1 LEU A 132 -11.494 -11.434 -0.744 1.00 31.34 C ATOM 2146 CD2 LEU A 132 -9.743 -9.964 0.382 1.00 62.30 C ATOM 0 H LEU A 132 -7.883 -13.230 -0.678 1.00 55.41 H new ATOM 0 HA LEU A 132 -7.954 -11.658 1.688 1.00 25.21 H new ATOM 0 HB2 LEU A 132 -10.033 -13.443 0.349 1.00 3.34 H new ATOM 0 HB3 LEU A 132 -10.391 -12.348 1.669 1.00 3.34 H new ATOM 0 HG LEU A 132 -9.373 -11.502 -1.070 1.00 62.55 H new ATOM 0 HD11 LEU A 132 -11.668 -10.627 -1.456 1.00 31.34 H new ATOM 0 HD12 LEU A 132 -11.653 -12.393 -1.237 1.00 31.34 H new ATOM 0 HD13 LEU A 132 -12.187 -11.336 0.092 1.00 31.34 H new ATOM 0 HD21 LEU A 132 -9.959 -9.193 -0.358 1.00 62.30 H new ATOM 0 HD22 LEU A 132 -10.367 -9.807 1.262 1.00 62.30 H new ATOM 0 HD23 LEU A 132 -8.693 -9.908 0.667 1.00 62.30 H new ATOM 2158 N GLN A 133 -8.142 -14.943 2.137 1.00 72.21 N ATOM 2159 CA GLN A 133 -7.970 -16.034 3.130 1.00 43.22 C ATOM 2160 C GLN A 133 -6.617 -15.900 3.884 1.00 4.42 C ATOM 2161 O GLN A 133 -6.532 -16.235 5.071 1.00 75.13 O ATOM 2162 CB GLN A 133 -8.066 -17.429 2.451 1.00 21.13 C ATOM 2163 CG GLN A 133 -7.007 -17.677 1.364 1.00 21.34 C ATOM 2164 CD GLN A 133 -6.938 -19.123 0.866 1.00 1.14 C ATOM 2165 OE1 GLN A 133 -7.598 -19.502 -0.097 1.00 63.24 O ATOM 2166 NE2 GLN A 133 -6.145 -19.949 1.527 1.00 54.21 N ATOM 0 H GLN A 133 -8.210 -15.272 1.174 1.00 72.21 H new ATOM 0 HA GLN A 133 -8.779 -15.944 3.855 1.00 43.22 H new ATOM 0 HB2 GLN A 133 -7.972 -18.200 3.216 1.00 21.13 H new ATOM 0 HB3 GLN A 133 -9.056 -17.538 2.009 1.00 21.13 H new ATOM 0 HG2 GLN A 133 -7.214 -17.023 0.517 1.00 21.34 H new ATOM 0 HG3 GLN A 133 -6.030 -17.393 1.755 1.00 21.34 H new ATOM 0 HE21 GLN A 133 -5.606 -19.610 2.324 1.00 54.21 H new ATOM 0 HE22 GLN A 133 -6.072 -20.925 1.240 1.00 54.21 H new ATOM 2175 N ARG A 134 -5.575 -15.392 3.171 1.00 44.32 N ATOM 2176 CA ARG A 134 -4.248 -15.107 3.760 1.00 44.21 C ATOM 2177 C ARG A 134 -4.352 -14.055 4.867 1.00 64.33 C ATOM 2178 O ARG A 134 -3.792 -14.241 5.931 1.00 35.43 O ATOM 2179 CB ARG A 134 -3.242 -14.624 2.687 1.00 72.14 C ATOM 2180 CG ARG A 134 -2.853 -15.698 1.670 1.00 44.12 C ATOM 2181 CD ARG A 134 -1.891 -15.181 0.585 1.00 1.21 C ATOM 2182 NE ARG A 134 -1.285 -16.285 -0.177 1.00 62.42 N ATOM 2183 CZ ARG A 134 -0.277 -16.165 -1.017 1.00 72.41 C ATOM 2184 NH1 ARG A 134 0.195 -15.001 -1.355 1.00 74.12 N ATOM 2185 NH2 ARG A 134 0.238 -17.228 -1.539 1.00 13.20 N ATOM 0 H ARG A 134 -5.636 -15.171 2.177 1.00 44.32 H new ATOM 0 HA ARG A 134 -3.883 -16.041 4.186 1.00 44.21 H new ATOM 0 HB2 ARG A 134 -3.673 -13.775 2.156 1.00 72.14 H new ATOM 0 HB3 ARG A 134 -2.341 -14.266 3.184 1.00 72.14 H new ATOM 0 HG2 ARG A 134 -2.387 -16.533 2.193 1.00 44.12 H new ATOM 0 HG3 ARG A 134 -3.755 -16.083 1.194 1.00 44.12 H new ATOM 0 HD2 ARG A 134 -2.430 -14.522 -0.096 1.00 1.21 H new ATOM 0 HD3 ARG A 134 -1.105 -14.585 1.049 1.00 1.21 H new ATOM 0 HE ARG A 134 -1.677 -17.217 -0.044 1.00 62.42 H new ATOM 0 HH11 ARG A 134 -0.216 -14.152 -0.967 1.00 74.12 H new ATOM 0 HH12 ARG A 134 0.976 -14.937 -2.008 1.00 74.12 H new ATOM 0 HH21 ARG A 134 -0.136 -18.146 -1.300 1.00 13.20 H new ATOM 0 HH22 ARG A 134 1.019 -17.149 -2.191 1.00 13.20 H new ATOM 2199 N GLY A 135 -5.086 -12.965 4.603 1.00 24.23 N ATOM 2200 CA GLY A 135 -5.313 -11.928 5.613 1.00 30.43 C ATOM 2201 C GLY A 135 -6.019 -12.439 6.869 1.00 44.14 C ATOM 2202 O GLY A 135 -5.596 -12.154 7.983 1.00 24.33 O ATOM 0 H GLY A 135 -5.529 -12.781 3.703 1.00 24.23 H new ATOM 0 HA2 GLY A 135 -4.355 -11.493 5.897 1.00 30.43 H new ATOM 0 HA3 GLY A 135 -5.908 -11.128 5.172 1.00 30.43 H new ATOM 2206 N ILE A 136 -7.075 -13.222 6.657 1.00 44.33 N ATOM 2207 CA ILE A 136 -7.876 -13.842 7.731 1.00 70.40 C ATOM 2208 C ILE A 136 -7.014 -14.741 8.667 1.00 13.31 C ATOM 2209 O ILE A 136 -7.086 -14.610 9.898 1.00 71.24 O ATOM 2210 CB ILE A 136 -9.058 -14.652 7.081 1.00 51.11 C ATOM 2211 CG1 ILE A 136 -10.040 -13.663 6.369 1.00 44.33 C ATOM 2212 CG2 ILE A 136 -9.800 -15.543 8.110 1.00 70.32 C ATOM 2213 CD1 ILE A 136 -11.058 -14.321 5.468 1.00 54.14 C ATOM 0 H ILE A 136 -7.410 -13.452 5.722 1.00 44.33 H new ATOM 0 HA ILE A 136 -8.281 -13.053 8.365 1.00 70.40 H new ATOM 0 HB ILE A 136 -8.636 -15.332 6.341 1.00 51.11 H new ATOM 0 HG12 ILE A 136 -10.567 -13.086 7.129 1.00 44.33 H new ATOM 0 HG13 ILE A 136 -9.457 -12.956 5.779 1.00 44.33 H new ATOM 0 HG21 ILE A 136 -10.606 -16.081 7.611 1.00 70.32 H new ATOM 0 HG22 ILE A 136 -9.101 -16.258 8.543 1.00 70.32 H new ATOM 0 HG23 ILE A 136 -10.216 -14.918 8.900 1.00 70.32 H new ATOM 0 HD11 ILE A 136 -11.694 -13.558 5.019 1.00 54.14 H new ATOM 0 HD12 ILE A 136 -10.544 -14.874 4.682 1.00 54.14 H new ATOM 0 HD13 ILE A 136 -11.672 -15.007 6.052 1.00 54.14 H new ATOM 2225 N GLN A 137 -6.177 -15.620 8.077 1.00 1.13 N ATOM 2226 CA GLN A 137 -5.276 -16.509 8.863 1.00 11.32 C ATOM 2227 C GLN A 137 -4.073 -15.733 9.474 1.00 61.11 C ATOM 2228 O GLN A 137 -3.598 -16.089 10.556 1.00 53.23 O ATOM 2229 CB GLN A 137 -4.787 -17.707 8.005 1.00 14.31 C ATOM 2230 CG GLN A 137 -3.979 -17.308 6.766 1.00 52.53 C ATOM 2231 CD GLN A 137 -3.503 -18.493 5.927 1.00 71.31 C ATOM 2232 OE1 GLN A 137 -2.420 -19.027 6.138 1.00 13.13 O ATOM 2233 NE2 GLN A 137 -4.294 -18.904 4.957 1.00 11.04 N ATOM 0 H GLN A 137 -6.102 -15.738 7.067 1.00 1.13 H new ATOM 0 HA GLN A 137 -5.861 -16.901 9.695 1.00 11.32 H new ATOM 0 HB2 GLN A 137 -4.175 -18.359 8.628 1.00 14.31 H new ATOM 0 HB3 GLN A 137 -5.653 -18.289 7.688 1.00 14.31 H new ATOM 0 HG2 GLN A 137 -4.589 -16.656 6.141 1.00 52.53 H new ATOM 0 HG3 GLN A 137 -3.112 -16.728 7.082 1.00 52.53 H new ATOM 0 HE21 GLN A 137 -5.191 -18.444 4.801 1.00 11.04 H new ATOM 0 HE22 GLN A 137 -4.010 -19.682 4.362 1.00 11.04 H new ATOM 2242 N ASN A 138 -3.612 -14.657 8.786 1.00 31.02 N ATOM 2243 CA ASN A 138 -2.514 -13.779 9.278 1.00 24.05 C ATOM 2244 C ASN A 138 -3.016 -12.781 10.346 1.00 63.10 C ATOM 2245 O ASN A 138 -2.205 -12.049 10.906 1.00 53.12 O ATOM 2246 CB ASN A 138 -1.850 -12.985 8.109 1.00 50.35 C ATOM 2247 CG ASN A 138 -1.047 -13.861 7.147 1.00 41.21 C ATOM 2248 OD1 ASN A 138 -0.514 -14.896 7.524 1.00 72.31 O ATOM 2249 ND2 ASN A 138 -0.952 -13.449 5.898 1.00 22.21 N ATOM 0 H ASN A 138 -3.987 -14.373 7.881 1.00 31.02 H new ATOM 0 HA ASN A 138 -1.772 -14.437 9.730 1.00 24.05 H new ATOM 0 HB2 ASN A 138 -2.626 -12.464 7.549 1.00 50.35 H new ATOM 0 HB3 ASN A 138 -1.192 -12.223 8.527 1.00 50.35 H new ATOM 0 HD21 ASN A 138 -0.424 -13.997 5.219 1.00 22.21 H new ATOM 0 HD22 ASN A 138 -1.406 -12.582 5.611 1.00 22.21 H new ATOM 2256 N GLN A 139 -4.354 -12.744 10.589 1.00 11.53 N ATOM 2257 CA GLN A 139 -4.991 -11.873 11.616 1.00 51.44 C ATOM 2258 C GLN A 139 -4.900 -10.368 11.237 1.00 35.43 C ATOM 2259 O GLN A 139 -4.696 -9.500 12.090 1.00 60.35 O ATOM 2260 CB GLN A 139 -4.402 -12.155 13.040 1.00 74.40 C ATOM 2261 CG GLN A 139 -4.626 -13.592 13.559 1.00 73.41 C ATOM 2262 CD GLN A 139 -6.105 -13.941 13.744 1.00 4.10 C ATOM 2263 OE1 GLN A 139 -6.680 -13.700 14.795 1.00 24.52 O ATOM 2264 NE2 GLN A 139 -6.736 -14.503 12.731 1.00 35.12 N ATOM 0 H GLN A 139 -5.023 -13.319 10.077 1.00 11.53 H new ATOM 0 HA GLN A 139 -6.051 -12.123 11.646 1.00 51.44 H new ATOM 0 HB2 GLN A 139 -3.331 -11.953 13.022 1.00 74.40 H new ATOM 0 HB3 GLN A 139 -4.846 -11.455 13.747 1.00 74.40 H new ATOM 0 HG2 GLN A 139 -4.177 -14.298 12.860 1.00 73.41 H new ATOM 0 HG3 GLN A 139 -4.109 -13.713 14.511 1.00 73.41 H new ATOM 0 HE21 GLN A 139 -6.237 -14.695 11.863 1.00 35.12 H new ATOM 0 HE22 GLN A 139 -7.723 -14.745 12.816 1.00 35.12 H new ATOM 2273 N ALA A 140 -5.127 -10.077 9.949 1.00 73.55 N ATOM 2274 CA ALA A 140 -5.013 -8.721 9.388 1.00 4.23 C ATOM 2275 C ALA A 140 -6.202 -7.818 9.785 1.00 4.34 C ATOM 2276 O ALA A 140 -7.341 -8.065 9.385 1.00 65.24 O ATOM 2277 CB ALA A 140 -4.860 -8.793 7.870 1.00 45.02 C ATOM 0 H ALA A 140 -5.397 -10.780 9.261 1.00 73.55 H new ATOM 0 HA ALA A 140 -4.120 -8.262 9.813 1.00 4.23 H new ATOM 0 HB1 ALA A 140 -4.776 -7.785 7.465 1.00 45.02 H new ATOM 0 HB2 ALA A 140 -3.963 -9.360 7.621 1.00 45.02 H new ATOM 0 HB3 ALA A 140 -5.732 -9.286 7.439 1.00 45.02 H new ATOM 2283 N GLU A 141 -5.896 -6.766 10.565 1.00 43.13 N ATOM 2284 CA GLU A 141 -6.901 -5.847 11.129 1.00 41.13 C ATOM 2285 C GLU A 141 -7.338 -4.764 10.108 1.00 21.02 C ATOM 2286 O GLU A 141 -6.480 -4.186 9.430 1.00 11.40 O ATOM 2287 CB GLU A 141 -6.331 -5.181 12.412 1.00 74.25 C ATOM 2288 CG GLU A 141 -5.932 -6.172 13.532 1.00 3.32 C ATOM 2289 CD GLU A 141 -7.099 -6.891 14.257 1.00 53.01 C ATOM 2290 OE1 GLU A 141 -8.247 -6.949 13.745 1.00 62.34 O ATOM 2291 OE2 GLU A 141 -6.858 -7.429 15.354 1.00 21.45 O ATOM 0 H GLU A 141 -4.938 -6.528 10.823 1.00 43.13 H new ATOM 0 HA GLU A 141 -7.788 -6.429 11.378 1.00 41.13 H new ATOM 0 HB2 GLU A 141 -5.457 -4.590 12.140 1.00 74.25 H new ATOM 0 HB3 GLU A 141 -7.074 -4.488 12.806 1.00 74.25 H new ATOM 0 HG2 GLU A 141 -5.277 -6.930 13.102 1.00 3.32 H new ATOM 0 HG3 GLU A 141 -5.348 -5.631 14.276 1.00 3.32 H new ATOM 2298 N PRO A 142 -8.679 -4.457 9.972 1.00 34.34 N ATOM 2299 CA PRO A 142 -9.801 -5.169 10.679 1.00 22.21 C ATOM 2300 C PRO A 142 -10.135 -6.606 10.121 1.00 44.45 C ATOM 2301 O PRO A 142 -10.427 -6.780 8.930 1.00 41.11 O ATOM 2302 CB PRO A 142 -10.982 -4.180 10.499 1.00 22.42 C ATOM 2303 CG PRO A 142 -10.691 -3.443 9.229 1.00 43.40 C ATOM 2304 CD PRO A 142 -9.185 -3.311 9.161 1.00 73.22 C ATOM 0 HA PRO A 142 -9.549 -5.389 11.716 1.00 22.21 H new ATOM 0 HB2 PRO A 142 -11.933 -4.710 10.437 1.00 22.42 H new ATOM 0 HB3 PRO A 142 -11.053 -3.495 11.344 1.00 22.42 H new ATOM 0 HG2 PRO A 142 -11.075 -3.986 8.366 1.00 43.40 H new ATOM 0 HG3 PRO A 142 -11.169 -2.464 9.228 1.00 43.40 H new ATOM 0 HD2 PRO A 142 -8.827 -3.362 8.133 1.00 73.22 H new ATOM 0 HD3 PRO A 142 -8.850 -2.357 9.568 1.00 73.22 H new ATOM 2312 N ARG A 143 -10.100 -7.621 11.028 1.00 35.43 N ATOM 2313 CA ARG A 143 -10.290 -9.066 10.685 1.00 21.03 C ATOM 2314 C ARG A 143 -11.728 -9.411 10.213 1.00 74.10 C ATOM 2315 O ARG A 143 -11.898 -10.004 9.147 1.00 52.23 O ATOM 2316 CB ARG A 143 -9.907 -9.959 11.902 1.00 24.14 C ATOM 2317 CG ARG A 143 -8.398 -10.004 12.207 1.00 30.54 C ATOM 2318 CD ARG A 143 -8.076 -10.707 13.540 1.00 13.24 C ATOM 2319 NE ARG A 143 -8.470 -9.889 14.696 1.00 11.32 N ATOM 2320 CZ ARG A 143 -8.450 -10.273 15.955 1.00 22.42 C ATOM 2321 NH1 ARG A 143 -8.144 -11.490 16.295 1.00 55.15 N ATOM 2322 NH2 ARG A 143 -8.735 -9.414 16.876 1.00 72.11 N ATOM 0 H ARG A 143 -9.939 -7.463 12.023 1.00 35.43 H new ATOM 0 HA ARG A 143 -9.629 -9.268 9.842 1.00 21.03 H new ATOM 0 HB2 ARG A 143 -10.433 -9.595 12.784 1.00 24.14 H new ATOM 0 HB3 ARG A 143 -10.259 -10.974 11.717 1.00 24.14 H new ATOM 0 HG2 ARG A 143 -7.884 -10.520 11.396 1.00 30.54 H new ATOM 0 HG3 ARG A 143 -8.008 -8.987 12.235 1.00 30.54 H new ATOM 0 HD2 ARG A 143 -8.593 -11.666 13.580 1.00 13.24 H new ATOM 0 HD3 ARG A 143 -7.008 -10.918 13.591 1.00 13.24 H new ATOM 0 HE ARG A 143 -8.787 -8.939 14.506 1.00 11.32 H new ATOM 0 HH11 ARG A 143 -7.911 -12.177 15.578 1.00 55.15 H new ATOM 0 HH12 ARG A 143 -8.137 -11.758 17.279 1.00 55.15 H new ATOM 0 HH21 ARG A 143 -8.971 -8.454 16.623 1.00 72.11 H new ATOM 0 HH22 ARG A 143 -8.724 -9.695 17.856 1.00 72.11 H new ATOM 2336 N GLU A 144 -12.748 -9.044 11.021 1.00 73.54 N ATOM 2337 CA GLU A 144 -14.185 -9.309 10.714 1.00 23.20 C ATOM 2338 C GLU A 144 -14.593 -8.660 9.372 1.00 74.42 C ATOM 2339 O GLU A 144 -15.417 -9.202 8.630 1.00 72.42 O ATOM 2340 CB GLU A 144 -15.082 -8.768 11.863 1.00 5.24 C ATOM 2341 CG GLU A 144 -16.593 -9.026 11.693 1.00 5.21 C ATOM 2342 CD GLU A 144 -17.453 -8.334 12.767 1.00 32.04 C ATOM 2343 OE1 GLU A 144 -17.853 -7.165 12.556 1.00 1.54 O ATOM 2344 OE2 GLU A 144 -17.733 -8.950 13.820 1.00 14.21 O ATOM 0 H GLU A 144 -12.606 -8.556 11.905 1.00 73.54 H new ATOM 0 HA GLU A 144 -14.324 -10.387 10.627 1.00 23.20 H new ATOM 0 HB2 GLU A 144 -14.756 -9.219 12.800 1.00 5.24 H new ATOM 0 HB3 GLU A 144 -14.921 -7.694 11.953 1.00 5.24 H new ATOM 0 HG2 GLU A 144 -16.905 -8.679 10.708 1.00 5.21 H new ATOM 0 HG3 GLU A 144 -16.777 -10.100 11.726 1.00 5.21 H new ATOM 2351 N PHE A 145 -13.986 -7.497 9.085 1.00 70.13 N ATOM 2352 CA PHE A 145 -14.138 -6.800 7.801 1.00 65.32 C ATOM 2353 C PHE A 145 -13.580 -7.642 6.626 1.00 15.02 C ATOM 2354 O PHE A 145 -14.207 -7.735 5.571 1.00 13.23 O ATOM 2355 CB PHE A 145 -13.439 -5.429 7.857 1.00 51.55 C ATOM 2356 CG PHE A 145 -13.523 -4.632 6.556 1.00 41.12 C ATOM 2357 CD1 PHE A 145 -14.729 -4.053 6.154 1.00 2.22 C ATOM 2358 CD2 PHE A 145 -12.405 -4.469 5.733 1.00 73.20 C ATOM 2359 CE1 PHE A 145 -14.813 -3.345 4.971 1.00 35.31 C ATOM 2360 CE2 PHE A 145 -12.496 -3.759 4.555 1.00 13.13 C ATOM 2361 CZ PHE A 145 -13.696 -3.194 4.176 1.00 22.54 C ATOM 0 H PHE A 145 -13.373 -7.013 9.741 1.00 70.13 H new ATOM 0 HA PHE A 145 -15.203 -6.652 7.624 1.00 65.32 H new ATOM 0 HB2 PHE A 145 -13.882 -4.840 8.660 1.00 51.55 H new ATOM 0 HB3 PHE A 145 -12.390 -5.578 8.112 1.00 51.55 H new ATOM 0 HD1 PHE A 145 -15.606 -4.160 6.775 1.00 2.22 H new ATOM 0 HD2 PHE A 145 -11.460 -4.904 6.023 1.00 73.20 H new ATOM 0 HE1 PHE A 145 -15.754 -2.909 4.668 1.00 35.31 H new ATOM 0 HE2 PHE A 145 -11.625 -3.645 3.927 1.00 13.13 H new ATOM 0 HZ PHE A 145 -13.761 -2.633 3.256 1.00 22.54 H new ATOM 2371 N LEU A 146 -12.402 -8.252 6.828 1.00 24.12 N ATOM 2372 CA LEU A 146 -11.760 -9.104 5.804 1.00 62.40 C ATOM 2373 C LEU A 146 -12.619 -10.358 5.517 1.00 74.02 C ATOM 2374 O LEU A 146 -12.729 -10.792 4.370 1.00 12.44 O ATOM 2375 CB LEU A 146 -10.322 -9.506 6.261 1.00 55.24 C ATOM 2376 CG LEU A 146 -9.191 -9.248 5.223 1.00 61.02 C ATOM 2377 CD1 LEU A 146 -7.820 -9.426 5.867 1.00 61.23 C ATOM 2378 CD2 LEU A 146 -9.346 -10.135 3.974 1.00 22.34 C ATOM 0 H LEU A 146 -11.869 -8.173 7.694 1.00 24.12 H new ATOM 0 HA LEU A 146 -11.681 -8.534 4.878 1.00 62.40 H new ATOM 0 HB2 LEU A 146 -10.084 -8.960 7.174 1.00 55.24 H new ATOM 0 HB3 LEU A 146 -10.323 -10.566 6.514 1.00 55.24 H new ATOM 0 HG LEU A 146 -9.277 -8.214 4.888 1.00 61.02 H new ATOM 0 HD11 LEU A 146 -7.043 -9.241 5.125 1.00 61.23 H new ATOM 0 HD12 LEU A 146 -7.711 -8.720 6.691 1.00 61.23 H new ATOM 0 HD13 LEU A 146 -7.725 -10.444 6.246 1.00 61.23 H new ATOM 0 HD21 LEU A 146 -8.537 -9.924 3.275 1.00 22.34 H new ATOM 0 HD22 LEU A 146 -9.308 -11.184 4.266 1.00 22.34 H new ATOM 0 HD23 LEU A 146 -10.303 -9.926 3.496 1.00 22.34 H new ATOM 2390 N GLN A 147 -13.228 -10.908 6.582 1.00 11.10 N ATOM 2391 CA GLN A 147 -14.075 -12.111 6.501 1.00 72.42 C ATOM 2392 C GLN A 147 -15.439 -11.816 5.836 1.00 15.13 C ATOM 2393 O GLN A 147 -15.926 -12.628 5.047 1.00 13.33 O ATOM 2394 CB GLN A 147 -14.285 -12.722 7.905 1.00 50.11 C ATOM 2395 CG GLN A 147 -12.985 -13.016 8.674 1.00 72.13 C ATOM 2396 CD GLN A 147 -13.218 -13.792 9.964 1.00 24.32 C ATOM 2397 OE1 GLN A 147 -13.473 -13.213 11.010 1.00 61.43 O ATOM 2398 NE2 GLN A 147 -13.123 -15.108 9.901 1.00 20.50 N ATOM 0 H GLN A 147 -13.146 -10.530 7.526 1.00 11.10 H new ATOM 0 HA GLN A 147 -13.552 -12.832 5.873 1.00 72.42 H new ATOM 0 HB2 GLN A 147 -14.896 -12.040 8.497 1.00 50.11 H new ATOM 0 HB3 GLN A 147 -14.850 -13.649 7.803 1.00 50.11 H new ATOM 0 HG2 GLN A 147 -12.310 -13.583 8.032 1.00 72.13 H new ATOM 0 HG3 GLN A 147 -12.487 -12.075 8.908 1.00 72.13 H new ATOM 0 HE21 GLN A 147 -12.909 -15.562 9.013 1.00 20.50 H new ATOM 0 HE22 GLN A 147 -13.264 -15.670 10.740 1.00 20.50 H new ATOM 2407 N GLN A 148 -16.057 -10.654 6.160 1.00 24.34 N ATOM 2408 CA GLN A 148 -17.340 -10.247 5.539 1.00 62.34 C ATOM 2409 C GLN A 148 -17.135 -9.962 4.034 1.00 3.44 C ATOM 2410 O GLN A 148 -17.959 -10.346 3.215 1.00 15.41 O ATOM 2411 CB GLN A 148 -17.989 -9.023 6.265 1.00 52.34 C ATOM 2412 CG GLN A 148 -17.324 -7.661 6.002 1.00 24.34 C ATOM 2413 CD GLN A 148 -17.935 -6.509 6.797 1.00 64.31 C ATOM 2414 OE1 GLN A 148 -17.523 -6.220 7.912 1.00 33.23 O ATOM 2415 NE2 GLN A 148 -18.926 -5.844 6.240 1.00 60.02 N ATOM 0 H GLN A 148 -15.692 -9.988 6.841 1.00 24.34 H new ATOM 0 HA GLN A 148 -18.039 -11.077 5.648 1.00 62.34 H new ATOM 0 HB2 GLN A 148 -19.035 -8.959 5.966 1.00 52.34 H new ATOM 0 HB3 GLN A 148 -17.975 -9.212 7.338 1.00 52.34 H new ATOM 0 HG2 GLN A 148 -16.263 -7.733 6.243 1.00 24.34 H new ATOM 0 HG3 GLN A 148 -17.394 -7.433 4.938 1.00 24.34 H new ATOM 0 HE21 GLN A 148 -19.254 -6.102 5.309 1.00 60.02 H new ATOM 0 HE22 GLN A 148 -19.366 -5.071 6.739 1.00 60.02 H new ATOM 2424 N GLN A 149 -15.994 -9.336 3.678 1.00 24.22 N ATOM 2425 CA GLN A 149 -15.627 -9.099 2.267 1.00 0.13 C ATOM 2426 C GLN A 149 -15.260 -10.419 1.555 1.00 14.24 C ATOM 2427 O GLN A 149 -15.517 -10.557 0.371 1.00 75.44 O ATOM 2428 CB GLN A 149 -14.469 -8.074 2.152 1.00 31.52 C ATOM 2429 CG GLN A 149 -14.817 -6.648 2.636 1.00 32.34 C ATOM 2430 CD GLN A 149 -15.962 -5.995 1.855 1.00 20.11 C ATOM 2431 OE1 GLN A 149 -15.745 -5.344 0.840 1.00 24.23 O ATOM 2432 NE2 GLN A 149 -17.185 -6.157 2.325 1.00 65.22 N ATOM 0 H GLN A 149 -15.311 -8.985 4.349 1.00 24.22 H new ATOM 0 HA GLN A 149 -16.500 -8.678 1.769 1.00 0.13 H new ATOM 0 HB2 GLN A 149 -13.619 -8.441 2.727 1.00 31.52 H new ATOM 0 HB3 GLN A 149 -14.150 -8.022 1.111 1.00 31.52 H new ATOM 0 HG2 GLN A 149 -15.085 -6.688 3.692 1.00 32.34 H new ATOM 0 HG3 GLN A 149 -13.930 -6.020 2.556 1.00 32.34 H new ATOM 0 HE21 GLN A 149 -17.337 -6.704 3.172 1.00 65.22 H new ATOM 0 HE22 GLN A 149 -17.977 -5.735 1.841 1.00 65.22 H new ATOM 2441 N TYR A 150 -14.672 -11.373 2.306 1.00 13.42 N ATOM 2442 CA TYR A 150 -14.317 -12.716 1.794 1.00 71.31 C ATOM 2443 C TYR A 150 -15.567 -13.512 1.356 1.00 74.14 C ATOM 2444 O TYR A 150 -15.611 -13.996 0.238 1.00 3.42 O ATOM 2445 CB TYR A 150 -13.524 -13.504 2.867 1.00 62.43 C ATOM 2446 CG TYR A 150 -13.050 -14.916 2.447 1.00 45.43 C ATOM 2447 CD1 TYR A 150 -11.877 -15.096 1.714 1.00 72.14 C ATOM 2448 CD2 TYR A 150 -13.770 -16.064 2.793 1.00 21.34 C ATOM 2449 CE1 TYR A 150 -11.440 -16.350 1.339 1.00 43.22 C ATOM 2450 CE2 TYR A 150 -13.335 -17.318 2.417 1.00 61.40 C ATOM 2451 CZ TYR A 150 -12.169 -17.453 1.694 1.00 25.31 C ATOM 2452 OH TYR A 150 -11.738 -18.700 1.316 1.00 0.33 O ATOM 0 H TYR A 150 -14.429 -11.235 3.287 1.00 13.42 H new ATOM 0 HA TYR A 150 -13.690 -12.580 0.913 1.00 71.31 H new ATOM 0 HB2 TYR A 150 -12.651 -12.917 3.151 1.00 62.43 H new ATOM 0 HB3 TYR A 150 -14.147 -13.599 3.756 1.00 62.43 H new ATOM 0 HD1 TYR A 150 -11.295 -14.231 1.432 1.00 72.14 H new ATOM 0 HD2 TYR A 150 -14.682 -15.967 3.364 1.00 21.34 H new ATOM 0 HE1 TYR A 150 -10.529 -16.461 0.769 1.00 43.22 H new ATOM 0 HE2 TYR A 150 -13.907 -18.193 2.689 1.00 61.40 H new ATOM 0 HH TYR A 150 -12.365 -19.377 1.646 1.00 0.33 H new ATOM 2462 N ARG A 151 -16.573 -13.638 2.248 1.00 15.32 N ATOM 2463 CA ARG A 151 -17.812 -14.415 1.962 1.00 62.42 C ATOM 2464 C ARG A 151 -18.681 -13.757 0.859 1.00 71.33 C ATOM 2465 O ARG A 151 -19.260 -14.457 0.014 1.00 12.44 O ATOM 2466 CB ARG A 151 -18.645 -14.623 3.256 1.00 2.32 C ATOM 2467 CG ARG A 151 -19.022 -13.325 3.995 1.00 43.42 C ATOM 2468 CD ARG A 151 -20.016 -13.543 5.146 1.00 73.44 C ATOM 2469 NE ARG A 151 -21.348 -13.929 4.648 1.00 62.43 N ATOM 2470 CZ ARG A 151 -22.501 -13.445 5.069 1.00 13.33 C ATOM 2471 NH1 ARG A 151 -22.571 -12.625 6.074 1.00 34.12 N ATOM 2472 NH2 ARG A 151 -23.593 -13.819 4.487 1.00 44.23 N ATOM 0 H ARG A 151 -16.557 -13.213 3.175 1.00 15.32 H new ATOM 0 HA ARG A 151 -17.494 -15.387 1.586 1.00 62.42 H new ATOM 0 HB2 ARG A 151 -19.560 -15.158 3.001 1.00 2.32 H new ATOM 0 HB3 ARG A 151 -18.081 -15.261 3.936 1.00 2.32 H new ATOM 0 HG2 ARG A 151 -18.116 -12.865 4.390 1.00 43.42 H new ATOM 0 HG3 ARG A 151 -19.452 -12.622 3.282 1.00 43.42 H new ATOM 0 HD2 ARG A 151 -19.638 -14.318 5.812 1.00 73.44 H new ATOM 0 HD3 ARG A 151 -20.098 -12.629 5.734 1.00 73.44 H new ATOM 0 HE ARG A 151 -21.382 -14.634 3.911 1.00 62.43 H new ATOM 0 HH11 ARG A 151 -21.721 -12.339 6.559 1.00 34.12 H new ATOM 0 HH12 ARG A 151 -23.476 -12.267 6.378 1.00 34.12 H new ATOM 0 HH21 ARG A 151 -23.557 -14.481 3.712 1.00 44.23 H new ATOM 0 HH22 ARG A 151 -24.491 -13.452 4.803 1.00 44.23 H new ATOM 2486 N LEU A 152 -18.739 -12.407 0.854 1.00 53.20 N ATOM 2487 CA LEU A 152 -19.447 -11.646 -0.200 1.00 13.11 C ATOM 2488 C LEU A 152 -18.704 -11.792 -1.544 1.00 44.35 C ATOM 2489 O LEU A 152 -19.315 -11.737 -2.596 1.00 32.12 O ATOM 2490 CB LEU A 152 -19.576 -10.147 0.197 1.00 73.51 C ATOM 2491 CG LEU A 152 -20.431 -9.847 1.473 1.00 41.11 C ATOM 2492 CD1 LEU A 152 -20.341 -8.355 1.873 1.00 73.51 C ATOM 2493 CD2 LEU A 152 -21.900 -10.302 1.301 1.00 72.30 C ATOM 0 H LEU A 152 -18.304 -11.822 1.568 1.00 53.20 H new ATOM 0 HA LEU A 152 -20.452 -12.053 -0.310 1.00 13.11 H new ATOM 0 HB2 LEU A 152 -18.575 -9.745 0.352 1.00 73.51 H new ATOM 0 HB3 LEU A 152 -20.010 -9.605 -0.643 1.00 73.51 H new ATOM 0 HG LEU A 152 -20.009 -10.432 2.290 1.00 41.11 H new ATOM 0 HD11 LEU A 152 -20.946 -8.180 2.763 1.00 73.51 H new ATOM 0 HD12 LEU A 152 -19.303 -8.097 2.083 1.00 73.51 H new ATOM 0 HD13 LEU A 152 -20.711 -7.736 1.055 1.00 73.51 H new ATOM 0 HD21 LEU A 152 -22.460 -10.076 2.209 1.00 72.30 H new ATOM 0 HD22 LEU A 152 -22.348 -9.775 0.458 1.00 72.30 H new ATOM 0 HD23 LEU A 152 -21.929 -11.376 1.115 1.00 72.30 H new ATOM 2505 N PHE A 153 -17.373 -11.943 -1.474 1.00 13.25 N ATOM 2506 CA PHE A 153 -16.521 -12.281 -2.632 1.00 43.42 C ATOM 2507 C PHE A 153 -16.747 -13.748 -3.112 1.00 74.15 C ATOM 2508 O PHE A 153 -16.747 -14.017 -4.319 1.00 53.30 O ATOM 2509 CB PHE A 153 -15.040 -12.054 -2.236 1.00 20.02 C ATOM 2510 CG PHE A 153 -14.085 -11.901 -3.400 1.00 75.35 C ATOM 2511 CD1 PHE A 153 -13.452 -13.004 -3.961 1.00 1.13 C ATOM 2512 CD2 PHE A 153 -13.821 -10.641 -3.933 1.00 54.02 C ATOM 2513 CE1 PHE A 153 -12.592 -12.851 -5.018 1.00 41.41 C ATOM 2514 CE2 PHE A 153 -12.959 -10.494 -4.988 1.00 75.43 C ATOM 2515 CZ PHE A 153 -12.349 -11.595 -5.531 1.00 13.31 C ATOM 0 H PHE A 153 -16.850 -11.834 -0.605 1.00 13.25 H new ATOM 0 HA PHE A 153 -16.788 -11.635 -3.468 1.00 43.42 H new ATOM 0 HB2 PHE A 153 -14.978 -11.161 -1.614 1.00 20.02 H new ATOM 0 HB3 PHE A 153 -14.711 -12.893 -1.623 1.00 20.02 H new ATOM 0 HD1 PHE A 153 -13.639 -13.990 -3.561 1.00 1.13 H new ATOM 0 HD2 PHE A 153 -14.301 -9.771 -3.510 1.00 54.02 H new ATOM 0 HE1 PHE A 153 -12.105 -13.714 -5.448 1.00 41.41 H new ATOM 0 HE2 PHE A 153 -12.760 -9.512 -5.391 1.00 75.43 H new ATOM 0 HZ PHE A 153 -11.674 -11.478 -6.366 1.00 13.31 H new ATOM 2525 N GLN A 154 -16.936 -14.679 -2.150 1.00 73.34 N ATOM 2526 CA GLN A 154 -17.152 -16.121 -2.435 1.00 10.33 C ATOM 2527 C GLN A 154 -18.469 -16.366 -3.187 1.00 33.21 C ATOM 2528 O GLN A 154 -18.513 -17.182 -4.119 1.00 24.34 O ATOM 2529 CB GLN A 154 -17.107 -16.968 -1.128 1.00 73.20 C ATOM 2530 CG GLN A 154 -15.711 -17.049 -0.481 1.00 23.43 C ATOM 2531 CD GLN A 154 -14.666 -17.697 -1.388 1.00 34.24 C ATOM 2532 OE1 GLN A 154 -14.952 -18.627 -2.133 1.00 1.11 O ATOM 2533 NE2 GLN A 154 -13.460 -17.182 -1.371 1.00 2.45 N ATOM 0 H GLN A 154 -16.944 -14.455 -1.155 1.00 73.34 H new ATOM 0 HA GLN A 154 -16.335 -16.441 -3.082 1.00 10.33 H new ATOM 0 HB2 GLN A 154 -17.806 -16.543 -0.408 1.00 73.20 H new ATOM 0 HB3 GLN A 154 -17.453 -17.978 -1.350 1.00 73.20 H new ATOM 0 HG2 GLN A 154 -15.381 -16.044 -0.217 1.00 23.43 H new ATOM 0 HG3 GLN A 154 -15.780 -17.616 0.447 1.00 23.43 H new ATOM 0 HE21 GLN A 154 -13.245 -16.408 -0.742 1.00 2.45 H new ATOM 0 HE22 GLN A 154 -12.737 -17.555 -1.986 1.00 2.45 H new ATOM 2542 N THR A 155 -19.527 -15.616 -2.806 1.00 11.11 N ATOM 2543 CA THR A 155 -20.850 -15.731 -3.464 1.00 24.53 C ATOM 2544 C THR A 155 -20.786 -15.240 -4.940 1.00 73.24 C ATOM 2545 O THR A 155 -21.570 -15.669 -5.779 1.00 40.22 O ATOM 2546 CB THR A 155 -21.985 -14.987 -2.673 1.00 4.13 C ATOM 2547 OG1 THR A 155 -23.275 -15.399 -3.158 1.00 22.22 O ATOM 2548 CG2 THR A 155 -21.884 -13.459 -2.771 1.00 70.32 C ATOM 0 H THR A 155 -19.493 -14.929 -2.052 1.00 11.11 H new ATOM 0 HA THR A 155 -21.108 -16.790 -3.463 1.00 24.53 H new ATOM 0 HB THR A 155 -21.859 -15.260 -1.625 1.00 4.13 H new ATOM 0 HG1 THR A 155 -23.977 -14.932 -2.659 1.00 22.22 H new ATOM 0 HG21 THR A 155 -22.696 -13.004 -2.204 1.00 70.32 H new ATOM 0 HG22 THR A 155 -20.928 -13.131 -2.363 1.00 70.32 H new ATOM 0 HG23 THR A 155 -21.956 -13.156 -3.815 1.00 70.32 H new ATOM 2556 N ARG A 156 -19.810 -14.359 -5.248 1.00 42.21 N ATOM 2557 CA ARG A 156 -19.561 -13.869 -6.622 1.00 14.12 C ATOM 2558 C ARG A 156 -18.868 -14.948 -7.492 1.00 11.14 C ATOM 2559 O ARG A 156 -19.373 -15.313 -8.557 1.00 61.24 O ATOM 2560 CB ARG A 156 -18.683 -12.590 -6.565 1.00 74.42 C ATOM 2561 CG ARG A 156 -19.262 -11.473 -5.668 1.00 75.12 C ATOM 2562 CD ARG A 156 -18.270 -10.322 -5.411 1.00 24.22 C ATOM 2563 NE ARG A 156 -18.694 -9.460 -4.289 1.00 54.42 N ATOM 2564 CZ ARG A 156 -17.906 -8.639 -3.611 1.00 2.54 C ATOM 2565 NH1 ARG A 156 -16.660 -8.482 -3.927 1.00 11.14 N ATOM 2566 NH2 ARG A 156 -18.384 -7.964 -2.616 1.00 35.12 N ATOM 0 H ARG A 156 -19.174 -13.968 -4.553 1.00 42.21 H new ATOM 0 HA ARG A 156 -20.522 -13.637 -7.081 1.00 14.12 H new ATOM 0 HB2 ARG A 156 -17.691 -12.858 -6.200 1.00 74.42 H new ATOM 0 HB3 ARG A 156 -18.557 -12.202 -7.576 1.00 74.42 H new ATOM 0 HG2 ARG A 156 -20.161 -11.071 -6.135 1.00 75.12 H new ATOM 0 HG3 ARG A 156 -19.564 -11.903 -4.713 1.00 75.12 H new ATOM 0 HD2 ARG A 156 -17.284 -10.735 -5.197 1.00 24.22 H new ATOM 0 HD3 ARG A 156 -18.174 -9.719 -6.314 1.00 24.22 H new ATOM 0 HE ARG A 156 -19.675 -9.500 -4.013 1.00 54.42 H new ATOM 0 HH11 ARG A 156 -16.265 -8.997 -4.714 1.00 11.14 H new ATOM 0 HH12 ARG A 156 -16.074 -7.844 -3.389 1.00 11.14 H new ATOM 0 HH21 ARG A 156 -19.365 -8.065 -2.356 1.00 35.12 H new ATOM 0 HH22 ARG A 156 -17.780 -7.331 -2.092 1.00 35.12 H new ATOM 2580 N LEU A 157 -17.714 -15.465 -7.006 1.00 53.22 N ATOM 2581 CA LEU A 157 -16.870 -16.410 -7.783 1.00 5.23 C ATOM 2582 C LEU A 157 -17.533 -17.795 -7.980 1.00 63.44 C ATOM 2583 O LEU A 157 -17.266 -18.463 -8.984 1.00 1.23 O ATOM 2584 CB LEU A 157 -15.440 -16.525 -7.160 1.00 50.00 C ATOM 2585 CG LEU A 157 -15.320 -16.964 -5.655 1.00 15.52 C ATOM 2586 CD1 LEU A 157 -15.421 -18.496 -5.465 1.00 35.43 C ATOM 2587 CD2 LEU A 157 -14.028 -16.417 -5.015 1.00 0.23 C ATOM 0 H LEU A 157 -17.345 -15.245 -6.081 1.00 53.22 H new ATOM 0 HA LEU A 157 -16.767 -15.991 -8.784 1.00 5.23 H new ATOM 0 HB2 LEU A 157 -14.871 -17.235 -7.761 1.00 50.00 H new ATOM 0 HB3 LEU A 157 -14.952 -15.556 -7.264 1.00 50.00 H new ATOM 0 HG LEU A 157 -16.175 -16.526 -5.140 1.00 15.52 H new ATOM 0 HD11 LEU A 157 -15.331 -18.738 -4.406 1.00 35.43 H new ATOM 0 HD12 LEU A 157 -16.384 -18.846 -5.837 1.00 35.43 H new ATOM 0 HD13 LEU A 157 -14.619 -18.985 -6.018 1.00 35.43 H new ATOM 0 HD21 LEU A 157 -13.974 -16.737 -3.975 1.00 0.23 H new ATOM 0 HD22 LEU A 157 -13.163 -16.799 -5.558 1.00 0.23 H new ATOM 0 HD23 LEU A 157 -14.033 -15.328 -5.060 1.00 0.23 H new ATOM 2599 N THR A 158 -18.392 -18.228 -7.028 1.00 62.23 N ATOM 2600 CA THR A 158 -19.138 -19.513 -7.158 1.00 55.03 C ATOM 2601 C THR A 158 -20.167 -19.458 -8.315 1.00 2.10 C ATOM 2602 O THR A 158 -20.480 -20.478 -8.933 1.00 52.15 O ATOM 2603 CB THR A 158 -19.868 -19.932 -5.830 1.00 12.13 C ATOM 2604 OG1 THR A 158 -20.477 -21.230 -5.982 1.00 20.13 O ATOM 2605 CG2 THR A 158 -20.940 -18.921 -5.402 1.00 51.11 C ATOM 0 H THR A 158 -18.588 -17.716 -6.168 1.00 62.23 H new ATOM 0 HA THR A 158 -18.385 -20.269 -7.380 1.00 55.03 H new ATOM 0 HB THR A 158 -19.106 -19.961 -5.051 1.00 12.13 H new ATOM 0 HG1 THR A 158 -20.927 -21.480 -5.148 1.00 20.13 H new ATOM 0 HG21 THR A 158 -21.412 -19.260 -4.480 1.00 51.11 H new ATOM 0 HG22 THR A 158 -20.477 -17.948 -5.237 1.00 51.11 H new ATOM 0 HG23 THR A 158 -21.693 -18.836 -6.185 1.00 51.11 H new ATOM 2613 N GLU A 159 -20.675 -18.246 -8.605 1.00 71.42 N ATOM 2614 CA GLU A 159 -21.654 -18.008 -9.691 1.00 10.14 C ATOM 2615 C GLU A 159 -20.958 -17.558 -11.003 1.00 31.34 C ATOM 2616 O GLU A 159 -21.631 -17.295 -12.005 1.00 64.31 O ATOM 2617 CB GLU A 159 -22.685 -16.938 -9.229 1.00 42.15 C ATOM 2618 CG GLU A 159 -23.392 -17.236 -7.881 1.00 2.43 C ATOM 2619 CD GLU A 159 -24.208 -18.545 -7.867 1.00 21.13 C ATOM 2620 OE1 GLU A 159 -25.394 -18.522 -8.270 1.00 55.54 O ATOM 2621 OE2 GLU A 159 -23.673 -19.598 -7.450 1.00 44.04 O ATOM 0 H GLU A 159 -20.420 -17.401 -8.094 1.00 71.42 H new ATOM 0 HA GLU A 159 -22.167 -18.946 -9.903 1.00 10.14 H new ATOM 0 HB2 GLU A 159 -22.176 -15.978 -9.149 1.00 42.15 H new ATOM 0 HB3 GLU A 159 -23.445 -16.832 -10.003 1.00 42.15 H new ATOM 0 HG2 GLU A 159 -22.641 -17.282 -7.093 1.00 2.43 H new ATOM 0 HG3 GLU A 159 -24.056 -16.405 -7.641 1.00 2.43 H new ATOM 2628 N THR A 160 -19.606 -17.471 -10.991 1.00 23.31 N ATOM 2629 CA THR A 160 -18.802 -17.026 -12.164 1.00 72.25 C ATOM 2630 C THR A 160 -17.714 -18.086 -12.533 1.00 52.11 C ATOM 2631 O THR A 160 -16.657 -18.137 -11.861 1.00 54.21 O ATOM 2632 CB THR A 160 -18.134 -15.624 -11.887 1.00 40.25 C ATOM 2633 OG1 THR A 160 -19.135 -14.690 -11.441 1.00 35.01 O ATOM 2634 CG2 THR A 160 -17.444 -15.041 -13.138 1.00 31.52 C ATOM 2635 OXT THR A 160 -17.911 -18.853 -13.503 1.00 37.70 O ATOM 0 H THR A 160 -19.041 -17.705 -10.175 1.00 23.31 H new ATOM 0 HA THR A 160 -19.479 -16.923 -13.012 1.00 72.25 H new ATOM 0 HB THR A 160 -17.374 -15.780 -11.121 1.00 40.25 H new ATOM 0 HG1 THR A 160 -19.294 -14.814 -10.482 1.00 35.01 H new ATOM 0 HG21 THR A 160 -17.001 -14.076 -12.893 1.00 31.52 H new ATOM 0 HG22 THR A 160 -16.664 -15.724 -13.475 1.00 31.52 H new ATOM 0 HG23 THR A 160 -18.179 -14.911 -13.932 1.00 31.52 H new TER 2643 THR A 160