USER MOD reduce.3.24.130724 H: found=0, std=0, add=384, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 384 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 Single : A 110 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 111 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 GLN : amide:sc= -0.0484 K(o=-0.048,f=-1.7!) USER MOD Single : A 114 SER OG : rot 171:sc= 1.27 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 127 ASN : amide:sc= -0.036 X(o=-0.036,f=0) USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 133 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 SER OG : rot 38:sc= 0.586 USER MOD Single : A 139 THR OG1 : rot 180:sc= 0 USER MOD Single : A 140 HIS : no HD1:sc= -0.129 X(o=-0.13,f=-0.029) USER MOD Single : A 141 SER OG : rot -67:sc= 0.667 USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD Single : A 146 THR OG1 : rot -160:sc= -0.531 USER MOD Single : A 153 ASN : amide:sc= -0.322 K(o=-0.32,f=-2.3!) USER MOD Single : A 155 SER OG : rot -49:sc= 0.097 USER MOD Single : A 157 LYS NZ :NH3+ -161:sc= -0.77 (180deg=-1.75!) USER MOD Single : A 158 THR OG1 : rot 175:sc= -0.829 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 110 2.314 1.972 0.115 1.00 63.54 N ATOM 2 CA MET A 110 2.973 1.995 -1.186 1.00 61.12 C ATOM 3 C MET A 110 4.163 1.041 -1.210 1.00 60.31 C ATOM 4 O MET A 110 5.071 1.147 -0.386 1.00 41.13 O ATOM 5 CB MET A 110 3.436 3.414 -1.522 1.00 74.01 C ATOM 6 CG MET A 110 2.332 4.454 -1.415 1.00 3.11 C ATOM 7 SD MET A 110 1.096 4.292 -2.718 1.00 3.43 S ATOM 8 CE MET A 110 0.119 5.768 -2.442 1.00 33.41 C ATOM 0 HA MET A 110 2.253 1.668 -1.936 1.00 61.12 H new ATOM 0 HB2 MET A 110 4.250 3.690 -0.852 1.00 74.01 H new ATOM 0 HB3 MET A 110 3.839 3.426 -2.535 1.00 74.01 H new ATOM 0 HG2 MET A 110 1.845 4.362 -0.444 1.00 3.11 H new ATOM 0 HG3 MET A 110 2.772 5.451 -1.458 1.00 3.11 H new ATOM 0 HE1 MET A 110 -0.689 5.811 -3.172 1.00 33.41 H new ATOM 0 HE2 MET A 110 -0.301 5.743 -1.437 1.00 33.41 H new ATOM 0 HE3 MET A 110 0.752 6.649 -2.549 1.00 33.41 H new ATOM 18 N GLN A 111 4.150 0.110 -2.159 1.00 25.24 N ATOM 19 CA GLN A 111 5.229 -0.863 -2.288 1.00 32.13 C ATOM 20 C GLN A 111 6.326 -0.340 -3.209 1.00 24.35 C ATOM 21 O GLN A 111 6.113 0.599 -3.976 1.00 4.00 O ATOM 22 CB GLN A 111 4.686 -2.189 -2.823 1.00 62.32 C ATOM 23 CG GLN A 111 4.045 -3.060 -1.755 1.00 13.11 C ATOM 24 CD GLN A 111 3.545 -4.382 -2.302 1.00 70.44 C ATOM 25 OE1 GLN A 111 2.729 -4.417 -3.224 1.00 64.53 O ATOM 26 NE2 GLN A 111 4.033 -5.480 -1.736 1.00 72.02 N ATOM 0 H GLN A 111 3.405 0.009 -2.849 1.00 25.24 H new ATOM 0 HA GLN A 111 5.658 -1.026 -1.299 1.00 32.13 H new ATOM 0 HB2 GLN A 111 3.951 -1.983 -3.601 1.00 62.32 H new ATOM 0 HB3 GLN A 111 5.500 -2.743 -3.291 1.00 62.32 H new ATOM 0 HG2 GLN A 111 4.770 -3.250 -0.963 1.00 13.11 H new ATOM 0 HG3 GLN A 111 3.213 -2.520 -1.303 1.00 13.11 H new ATOM 0 HE21 GLN A 111 4.707 -5.405 -0.975 1.00 72.02 H new ATOM 0 HE22 GLN A 111 3.733 -6.399 -2.063 1.00 72.02 H new ATOM 35 N THR A 112 7.503 -0.954 -3.127 1.00 72.31 N ATOM 36 CA THR A 112 8.635 -0.550 -3.952 1.00 34.14 C ATOM 37 C THR A 112 9.376 -1.764 -4.501 1.00 11.42 C ATOM 38 O THR A 112 9.464 -2.799 -3.841 1.00 55.23 O ATOM 39 CB THR A 112 9.623 0.325 -3.158 1.00 41.45 C ATOM 40 OG1 THR A 112 10.131 -0.403 -2.035 1.00 73.32 O ATOM 41 CG2 THR A 112 8.950 1.603 -2.679 1.00 22.43 C ATOM 0 H THR A 112 7.697 -1.733 -2.497 1.00 72.31 H new ATOM 0 HA THR A 112 8.231 0.031 -4.781 1.00 34.14 H new ATOM 0 HB THR A 112 10.448 0.593 -3.818 1.00 41.45 H new ATOM 0 HG1 THR A 112 10.760 0.160 -1.537 1.00 73.32 H new ATOM 0 HG21 THR A 112 9.667 2.205 -2.121 1.00 22.43 H new ATOM 0 HG22 THR A 112 8.592 2.170 -3.538 1.00 22.43 H new ATOM 0 HG23 THR A 112 8.108 1.351 -2.034 1.00 22.43 H new ATOM 49 N GLN A 113 9.908 -1.628 -5.711 1.00 61.22 N ATOM 50 CA GLN A 113 10.642 -2.715 -6.348 1.00 62.13 C ATOM 51 C GLN A 113 11.985 -2.941 -5.662 1.00 3.42 C ATOM 52 O GLN A 113 12.651 -1.990 -5.251 1.00 51.02 O ATOM 53 CB GLN A 113 10.859 -2.412 -7.832 1.00 12.32 C ATOM 54 CG GLN A 113 11.888 -1.322 -8.086 1.00 61.30 C ATOM 55 CD GLN A 113 11.799 -0.751 -9.487 1.00 51.42 C ATOM 56 OE1 GLN A 113 10.769 -0.866 -10.153 1.00 4.22 O ATOM 57 NE2 GLN A 113 12.880 -0.129 -9.943 1.00 63.44 N ATOM 0 H GLN A 113 9.845 -0.777 -6.270 1.00 61.22 H new ATOM 0 HA GLN A 113 10.048 -3.624 -6.253 1.00 62.13 H new ATOM 0 HB2 GLN A 113 11.176 -3.324 -8.338 1.00 12.32 H new ATOM 0 HB3 GLN A 113 9.909 -2.114 -8.276 1.00 12.32 H new ATOM 0 HG2 GLN A 113 11.748 -0.520 -7.361 1.00 61.30 H new ATOM 0 HG3 GLN A 113 12.887 -1.726 -7.925 1.00 61.30 H new ATOM 0 HE21 GLN A 113 13.712 -0.057 -9.357 1.00 63.44 H new ATOM 0 HE22 GLN A 113 12.878 0.277 -10.879 1.00 63.44 H new ATOM 66 N SER A 114 12.377 -4.205 -5.540 1.00 45.25 N ATOM 67 CA SER A 114 13.640 -4.555 -4.900 1.00 34.42 C ATOM 68 C SER A 114 14.556 -5.292 -5.872 1.00 31.52 C ATOM 69 O SER A 114 14.154 -5.637 -6.984 1.00 34.35 O ATOM 70 CB SER A 114 13.385 -5.421 -3.664 1.00 65.44 C ATOM 71 OG SER A 114 12.169 -6.138 -3.785 1.00 53.32 O ATOM 0 H SER A 114 11.839 -5.004 -5.876 1.00 45.25 H new ATOM 0 HA SER A 114 14.133 -3.632 -4.594 1.00 34.42 H new ATOM 0 HB2 SER A 114 14.211 -6.120 -3.529 1.00 65.44 H new ATOM 0 HB3 SER A 114 13.352 -4.791 -2.775 1.00 65.44 H new ATOM 0 HG SER A 114 12.100 -6.790 -3.056 1.00 53.32 H new ATOM 77 N THR A 115 15.792 -5.531 -5.445 1.00 30.45 N ATOM 78 CA THR A 115 16.767 -6.226 -6.276 1.00 20.04 C ATOM 79 C THR A 115 16.941 -7.673 -5.827 1.00 53.51 C ATOM 80 O THR A 115 16.940 -7.967 -4.631 1.00 42.14 O ATOM 81 CB THR A 115 18.137 -5.522 -6.242 1.00 72.11 C ATOM 82 OG1 THR A 115 18.656 -5.524 -4.908 1.00 20.14 O ATOM 83 CG2 THR A 115 18.022 -4.091 -6.745 1.00 22.00 C ATOM 0 H THR A 115 16.142 -5.253 -4.528 1.00 30.45 H new ATOM 0 HA THR A 115 16.382 -6.209 -7.296 1.00 20.04 H new ATOM 0 HB THR A 115 18.817 -6.067 -6.896 1.00 72.11 H new ATOM 0 HG1 THR A 115 19.528 -5.076 -4.895 1.00 20.14 H new ATOM 0 HG21 THR A 115 19.001 -3.614 -6.712 1.00 22.00 H new ATOM 0 HG22 THR A 115 17.655 -4.094 -7.771 1.00 22.00 H new ATOM 0 HG23 THR A 115 17.327 -3.538 -6.113 1.00 22.00 H new ATOM 91 N CYS A 116 17.090 -8.573 -6.793 1.00 52.21 N ATOM 92 CA CYS A 116 17.265 -9.990 -6.498 1.00 50.32 C ATOM 93 C CYS A 116 17.419 -10.798 -7.783 1.00 51.24 C ATOM 94 O CYS A 116 16.988 -10.386 -8.861 1.00 34.15 O ATOM 95 CB CYS A 116 16.076 -10.515 -5.692 1.00 34.12 C ATOM 96 SG CYS A 116 14.453 -9.988 -6.331 1.00 21.13 S ATOM 0 H CYS A 116 17.093 -8.346 -7.787 1.00 52.21 H new ATOM 0 HA CYS A 116 18.174 -10.103 -5.907 1.00 50.32 H new ATOM 0 HB2 CYS A 116 16.113 -11.604 -5.678 1.00 34.12 H new ATOM 0 HB3 CYS A 116 16.174 -10.180 -4.660 1.00 34.12 H new ATOM 101 N PRO A 117 18.048 -11.977 -7.669 1.00 44.31 N ATOM 102 CA PRO A 117 18.273 -12.868 -8.811 1.00 43.00 C ATOM 103 C PRO A 117 16.980 -13.497 -9.319 1.00 43.32 C ATOM 104 O PRO A 117 16.241 -14.118 -8.557 1.00 21.50 O ATOM 105 CB PRO A 117 19.204 -13.943 -8.244 1.00 72.10 C ATOM 106 CG PRO A 117 18.927 -13.950 -6.780 1.00 42.22 C ATOM 107 CD PRO A 117 18.589 -12.531 -6.416 1.00 54.42 C ATOM 0 HA PRO A 117 18.686 -12.336 -9.668 1.00 43.00 H new ATOM 0 HB2 PRO A 117 19.002 -14.917 -8.690 1.00 72.10 H new ATOM 0 HB3 PRO A 117 20.249 -13.710 -8.448 1.00 72.10 H new ATOM 0 HG2 PRO A 117 18.102 -14.621 -6.542 1.00 42.22 H new ATOM 0 HG3 PRO A 117 19.794 -14.300 -6.220 1.00 42.22 H new ATOM 0 HD2 PRO A 117 17.858 -12.486 -5.608 1.00 54.42 H new ATOM 0 HD3 PRO A 117 19.469 -11.982 -6.081 1.00 54.42 H new ATOM 115 N GLU A 118 16.715 -13.330 -10.611 1.00 74.41 N ATOM 116 CA GLU A 118 15.510 -13.882 -11.220 1.00 32.14 C ATOM 117 C GLU A 118 15.372 -15.369 -10.903 1.00 43.42 C ATOM 118 O GLU A 118 16.342 -16.025 -10.522 1.00 11.12 O ATOM 119 CB GLU A 118 15.535 -13.672 -12.735 1.00 70.20 C ATOM 120 CG GLU A 118 14.155 -13.514 -13.351 1.00 31.14 C ATOM 121 CD GLU A 118 14.210 -13.100 -14.808 1.00 63.44 C ATOM 122 OE1 GLU A 118 14.797 -12.037 -15.101 1.00 34.12 O ATOM 123 OE2 GLU A 118 13.668 -13.839 -15.656 1.00 54.14 O ATOM 0 H GLU A 118 17.317 -12.818 -11.255 1.00 74.41 H new ATOM 0 HA GLU A 118 14.650 -13.358 -10.802 1.00 32.14 H new ATOM 0 HB2 GLU A 118 16.128 -12.786 -12.961 1.00 70.20 H new ATOM 0 HB3 GLU A 118 16.037 -14.519 -13.202 1.00 70.20 H new ATOM 0 HG2 GLU A 118 13.613 -14.456 -13.265 1.00 31.14 H new ATOM 0 HG3 GLU A 118 13.593 -12.770 -12.787 1.00 31.14 H new ATOM 130 N ILE A 119 14.162 -15.892 -11.064 1.00 34.11 N ATOM 131 CA ILE A 119 13.897 -17.300 -10.796 1.00 61.32 C ATOM 132 C ILE A 119 14.388 -18.179 -11.941 1.00 63.34 C ATOM 133 O ILE A 119 14.135 -17.911 -13.116 1.00 12.32 O ATOM 134 CB ILE A 119 12.395 -17.559 -10.573 1.00 42.55 C ATOM 135 CG1 ILE A 119 11.866 -16.675 -9.442 1.00 52.01 C ATOM 136 CG2 ILE A 119 12.151 -19.028 -10.264 1.00 53.11 C ATOM 137 CD1 ILE A 119 12.570 -16.897 -8.122 1.00 44.30 C ATOM 0 H ILE A 119 13.349 -15.362 -11.379 1.00 34.11 H new ATOM 0 HA ILE A 119 14.440 -17.555 -9.886 1.00 61.32 H new ATOM 0 HB ILE A 119 11.858 -17.307 -11.487 1.00 42.55 H new ATOM 0 HG12 ILE A 119 11.972 -15.629 -9.730 1.00 52.01 H new ATOM 0 HG13 ILE A 119 10.800 -16.864 -9.312 1.00 52.01 H new ATOM 0 HG21 ILE A 119 11.085 -19.195 -10.109 1.00 53.11 H new ATOM 0 HG22 ILE A 119 12.496 -19.638 -11.099 1.00 53.11 H new ATOM 0 HG23 ILE A 119 12.697 -19.306 -9.362 1.00 53.11 H new ATOM 0 HD11 ILE A 119 12.143 -16.237 -7.367 1.00 44.30 H new ATOM 0 HD12 ILE A 119 12.443 -17.934 -7.812 1.00 44.30 H new ATOM 0 HD13 ILE A 119 13.632 -16.680 -8.235 1.00 44.30 H new ATOM 149 N PRO A 120 15.107 -19.257 -11.594 1.00 3.13 N ATOM 150 CA PRO A 120 15.647 -20.199 -12.578 1.00 24.40 C ATOM 151 C PRO A 120 14.555 -21.024 -13.251 1.00 43.31 C ATOM 152 O PRO A 120 13.786 -21.716 -12.584 1.00 1.54 O ATOM 153 CB PRO A 120 16.560 -21.101 -11.742 1.00 75.04 C ATOM 154 CG PRO A 120 16.003 -21.028 -10.362 1.00 44.23 C ATOM 155 CD PRO A 120 15.448 -19.638 -10.213 1.00 31.52 C ATOM 0 HA PRO A 120 16.160 -19.688 -13.393 1.00 24.40 H new ATOM 0 HB2 PRO A 120 16.556 -22.125 -12.117 1.00 75.04 H new ATOM 0 HB3 PRO A 120 17.593 -20.755 -11.771 1.00 75.04 H new ATOM 0 HG2 PRO A 120 15.225 -21.777 -10.215 1.00 44.23 H new ATOM 0 HG3 PRO A 120 16.776 -21.221 -9.618 1.00 44.23 H new ATOM 0 HD2 PRO A 120 14.572 -19.622 -9.564 1.00 31.52 H new ATOM 0 HD3 PRO A 120 16.180 -18.958 -9.777 1.00 31.52 H new ATOM 163 N ASP A 121 14.493 -20.946 -14.576 1.00 5.32 N ATOM 164 CA ASP A 121 13.496 -21.686 -15.340 1.00 21.34 C ATOM 165 C ASP A 121 14.130 -22.360 -16.552 1.00 45.24 C ATOM 166 O ASP A 121 15.289 -22.105 -16.882 1.00 60.45 O ATOM 167 CB ASP A 121 12.371 -20.753 -15.789 1.00 71.13 C ATOM 168 CG ASP A 121 11.894 -19.842 -14.675 1.00 45.34 C ATOM 169 OD1 ASP A 121 11.511 -20.362 -13.607 1.00 1.10 O ATOM 170 OD2 ASP A 121 11.904 -18.608 -14.872 1.00 62.33 O ATOM 0 H ASP A 121 15.122 -20.377 -15.143 1.00 5.32 H new ATOM 0 HA ASP A 121 13.080 -22.459 -14.694 1.00 21.34 H new ATOM 0 HB2 ASP A 121 12.718 -20.147 -16.626 1.00 71.13 H new ATOM 0 HB3 ASP A 121 11.533 -21.348 -16.152 1.00 71.13 H new ATOM 175 N LYS A 122 13.364 -23.221 -17.213 1.00 20.44 N ATOM 176 CA LYS A 122 13.850 -23.932 -18.389 1.00 74.52 C ATOM 177 C LYS A 122 13.752 -23.056 -19.633 1.00 44.55 C ATOM 178 O LYS A 122 14.219 -23.432 -20.709 1.00 51.44 O ATOM 179 CB LYS A 122 13.051 -25.221 -18.597 1.00 62.42 C ATOM 180 CG LYS A 122 12.893 -26.050 -17.334 1.00 2.53 C ATOM 181 CD LYS A 122 12.560 -27.497 -17.654 1.00 32.02 C ATOM 182 CE LYS A 122 12.945 -28.424 -16.511 1.00 13.54 C ATOM 183 NZ LYS A 122 11.963 -28.362 -15.392 1.00 44.32 N ATOM 0 H LYS A 122 12.403 -23.443 -16.954 1.00 20.44 H new ATOM 0 HA LYS A 122 14.898 -24.183 -18.224 1.00 74.52 H new ATOM 0 HB2 LYS A 122 12.063 -24.968 -18.981 1.00 62.42 H new ATOM 0 HB3 LYS A 122 13.544 -25.825 -19.359 1.00 62.42 H new ATOM 0 HG2 LYS A 122 13.814 -26.008 -16.753 1.00 2.53 H new ATOM 0 HG3 LYS A 122 12.105 -25.623 -16.714 1.00 2.53 H new ATOM 0 HD2 LYS A 122 11.493 -27.590 -17.855 1.00 32.02 H new ATOM 0 HD3 LYS A 122 13.083 -27.800 -18.561 1.00 32.02 H new ATOM 0 HE2 LYS A 122 13.011 -29.448 -16.880 1.00 13.54 H new ATOM 0 HE3 LYS A 122 13.934 -28.154 -16.142 1.00 13.54 H new ATOM 0 HZ1 LYS A 122 12.261 -29.008 -14.633 1.00 44.32 H new ATOM 0 HZ2 LYS A 122 11.918 -27.391 -15.023 1.00 44.32 H new ATOM 0 HZ3 LYS A 122 11.024 -28.644 -15.738 1.00 44.32 H new ATOM 197 N THR A 123 13.144 -21.883 -19.480 1.00 24.21 N ATOM 198 CA THR A 123 12.987 -20.953 -20.590 1.00 54.34 C ATOM 199 C THR A 123 13.837 -19.704 -20.387 1.00 32.04 C ATOM 200 O THR A 123 14.250 -19.058 -21.350 1.00 75.40 O ATOM 201 CB THR A 123 11.515 -20.534 -20.768 1.00 72.50 C ATOM 202 OG1 THR A 123 10.654 -21.646 -20.497 1.00 55.04 O ATOM 203 CG2 THR A 123 11.264 -20.024 -22.179 1.00 11.32 C ATOM 0 H THR A 123 12.752 -21.555 -18.597 1.00 24.21 H new ATOM 0 HA THR A 123 13.321 -21.474 -21.487 1.00 54.34 H new ATOM 0 HB THR A 123 11.301 -19.729 -20.065 1.00 72.50 H new ATOM 0 HG1 THR A 123 9.720 -21.372 -20.610 1.00 55.04 H new ATOM 0 HG21 THR A 123 10.218 -19.734 -22.280 1.00 11.32 H new ATOM 0 HG22 THR A 123 11.900 -19.160 -22.372 1.00 11.32 H new ATOM 0 HG23 THR A 123 11.494 -20.812 -22.897 1.00 11.32 H new ATOM 211 N SER A 124 14.096 -19.369 -19.127 1.00 31.34 N ATOM 212 CA SER A 124 14.895 -18.195 -18.797 1.00 22.14 C ATOM 213 C SER A 124 16.197 -18.599 -18.111 1.00 61.34 C ATOM 214 O SER A 124 16.191 -19.081 -16.978 1.00 60.12 O ATOM 215 CB SER A 124 14.102 -17.250 -17.892 1.00 50.34 C ATOM 216 OG SER A 124 12.879 -16.870 -18.500 1.00 2.24 O ATOM 0 H SER A 124 13.764 -19.894 -18.318 1.00 31.34 H new ATOM 0 HA SER A 124 15.138 -17.679 -19.726 1.00 22.14 H new ATOM 0 HB2 SER A 124 13.902 -17.738 -16.938 1.00 50.34 H new ATOM 0 HB3 SER A 124 14.697 -16.362 -17.678 1.00 50.34 H new ATOM 0 HG SER A 124 12.390 -16.268 -17.902 1.00 2.24 H new ATOM 222 N ILE A 125 17.311 -18.400 -18.807 1.00 42.43 N ATOM 223 CA ILE A 125 18.621 -18.742 -18.266 1.00 52.24 C ATOM 224 C ILE A 125 19.548 -17.531 -18.264 1.00 61.33 C ATOM 225 O ILE A 125 19.320 -16.559 -18.985 1.00 62.43 O ATOM 226 CB ILE A 125 19.281 -19.879 -19.068 1.00 43.11 C ATOM 227 CG1 ILE A 125 18.217 -20.708 -19.790 1.00 22.31 C ATOM 228 CG2 ILE A 125 20.114 -20.760 -18.149 1.00 63.13 C ATOM 229 CD1 ILE A 125 17.255 -21.404 -18.853 1.00 10.02 C ATOM 0 H ILE A 125 17.333 -18.004 -19.747 1.00 42.43 H new ATOM 0 HA ILE A 125 18.462 -19.076 -17.241 1.00 52.24 H new ATOM 0 HB ILE A 125 19.942 -19.441 -19.816 1.00 43.11 H new ATOM 0 HG12 ILE A 125 17.653 -20.058 -20.459 1.00 22.31 H new ATOM 0 HG13 ILE A 125 18.710 -21.455 -20.412 1.00 22.31 H new ATOM 0 HG21 ILE A 125 20.574 -21.559 -18.730 1.00 63.13 H new ATOM 0 HG22 ILE A 125 20.892 -20.160 -17.677 1.00 63.13 H new ATOM 0 HG23 ILE A 125 19.473 -21.193 -17.381 1.00 63.13 H new ATOM 0 HD11 ILE A 125 16.529 -21.973 -19.434 1.00 10.02 H new ATOM 0 HD12 ILE A 125 17.808 -22.080 -18.201 1.00 10.02 H new ATOM 0 HD13 ILE A 125 16.734 -20.661 -18.248 1.00 10.02 H new ATOM 241 N CYS A 126 20.596 -17.597 -17.450 1.00 62.31 N ATOM 242 CA CYS A 126 21.560 -16.508 -17.354 1.00 44.01 C ATOM 243 C CYS A 126 22.889 -16.899 -17.995 1.00 31.33 C ATOM 244 O CYS A 126 23.299 -18.058 -17.939 1.00 51.12 O ATOM 245 CB CYS A 126 21.782 -16.122 -15.890 1.00 75.31 C ATOM 246 SG CYS A 126 23.054 -14.843 -15.642 1.00 43.24 S ATOM 0 H CYS A 126 20.799 -18.394 -16.847 1.00 62.31 H new ATOM 0 HA CYS A 126 21.155 -15.650 -17.892 1.00 44.01 H new ATOM 0 HB2 CYS A 126 20.840 -15.768 -15.472 1.00 75.31 H new ATOM 0 HB3 CYS A 126 22.064 -17.013 -15.329 1.00 75.31 H new ATOM 251 N ASN A 127 23.557 -15.924 -18.602 1.00 54.13 N ATOM 252 CA ASN A 127 24.839 -16.166 -19.254 1.00 12.12 C ATOM 253 C ASN A 127 25.995 -15.728 -18.359 1.00 73.44 C ATOM 254 O ASN A 127 25.783 -15.221 -17.258 1.00 22.42 O ATOM 255 CB ASN A 127 24.904 -15.423 -20.590 1.00 33.31 C ATOM 256 CG ASN A 127 23.589 -15.473 -21.344 1.00 33.23 C ATOM 257 OD1 ASN A 127 23.357 -16.373 -22.151 1.00 61.22 O ATOM 258 ND2 ASN A 127 22.720 -14.503 -21.083 1.00 20.35 N ATOM 0 H ASN A 127 23.232 -14.959 -18.656 1.00 54.13 H new ATOM 0 HA ASN A 127 24.929 -17.237 -19.437 1.00 12.12 H new ATOM 0 HB2 ASN A 127 25.178 -14.383 -20.411 1.00 33.31 H new ATOM 0 HB3 ASN A 127 25.690 -15.858 -21.207 1.00 33.31 H new ATOM 0 HD21 ASN A 127 21.818 -14.484 -21.559 1.00 20.35 H new ATOM 0 HD22 ASN A 127 22.954 -13.777 -20.406 1.00 20.35 H new ATOM 265 N SER A 128 27.217 -15.928 -18.842 1.00 2.34 N ATOM 266 CA SER A 128 28.407 -15.557 -18.085 1.00 3.10 C ATOM 267 C SER A 128 28.436 -14.055 -17.820 1.00 4.30 C ATOM 268 O SER A 128 27.647 -13.298 -18.385 1.00 72.15 O ATOM 269 CB SER A 128 29.669 -15.978 -18.840 1.00 44.54 C ATOM 270 OG SER A 128 30.448 -16.878 -18.072 1.00 33.15 O ATOM 0 H SER A 128 27.409 -16.344 -19.753 1.00 2.34 H new ATOM 0 HA SER A 128 28.375 -16.076 -17.127 1.00 3.10 H new ATOM 0 HB2 SER A 128 29.392 -16.447 -19.784 1.00 44.54 H new ATOM 0 HB3 SER A 128 30.262 -15.096 -19.084 1.00 44.54 H new ATOM 0 HG SER A 128 31.248 -17.133 -18.578 1.00 33.15 H new ATOM 276 N ASP A 129 29.352 -13.631 -16.956 1.00 41.52 N ATOM 277 CA ASP A 129 29.486 -12.219 -16.616 1.00 3.13 C ATOM 278 C ASP A 129 29.663 -11.371 -17.872 1.00 33.32 C ATOM 279 O ASP A 129 29.053 -10.311 -18.008 1.00 33.22 O ATOM 280 CB ASP A 129 30.673 -12.010 -15.674 1.00 31.03 C ATOM 281 CG ASP A 129 30.687 -13.006 -14.531 1.00 10.24 C ATOM 282 OD1 ASP A 129 29.740 -12.988 -13.717 1.00 52.02 O ATOM 283 OD2 ASP A 129 31.646 -13.802 -14.449 1.00 34.41 O ATOM 0 H ASP A 129 30.012 -14.244 -16.479 1.00 41.52 H new ATOM 0 HA ASP A 129 28.572 -11.904 -16.113 1.00 3.13 H new ATOM 0 HB2 ASP A 129 31.601 -12.097 -16.239 1.00 31.03 H new ATOM 0 HB3 ASP A 129 30.639 -10.998 -15.270 1.00 31.03 H new ATOM 288 N ALA A 130 30.502 -11.846 -18.787 1.00 12.24 N ATOM 289 CA ALA A 130 30.758 -11.132 -20.032 1.00 31.44 C ATOM 290 C ALA A 130 29.641 -11.373 -21.042 1.00 24.30 C ATOM 291 O ALA A 130 29.659 -10.823 -22.143 1.00 73.54 O ATOM 292 CB ALA A 130 32.099 -11.552 -20.614 1.00 63.12 C ATOM 0 H ALA A 130 31.016 -12.722 -18.689 1.00 12.24 H new ATOM 0 HA ALA A 130 30.788 -10.065 -19.812 1.00 31.44 H new ATOM 0 HB1 ALA A 130 32.278 -11.011 -21.543 1.00 63.12 H new ATOM 0 HB2 ALA A 130 32.892 -11.323 -19.903 1.00 63.12 H new ATOM 0 HB3 ALA A 130 32.089 -12.624 -20.814 1.00 63.12 H new ATOM 298 N ASP A 131 28.673 -12.198 -20.661 1.00 33.45 N ATOM 299 CA ASP A 131 27.547 -12.512 -21.534 1.00 5.14 C ATOM 300 C ASP A 131 26.238 -12.010 -20.934 1.00 12.24 C ATOM 301 O ASP A 131 25.166 -12.195 -21.512 1.00 4.13 O ATOM 302 CB ASP A 131 27.467 -14.020 -21.776 1.00 11.14 C ATOM 303 CG ASP A 131 28.591 -14.525 -22.658 1.00 70.45 C ATOM 304 OD1 ASP A 131 29.765 -14.228 -22.354 1.00 1.53 O ATOM 305 OD2 ASP A 131 28.297 -15.220 -23.654 1.00 13.43 O ATOM 0 H ASP A 131 28.645 -12.662 -19.753 1.00 33.45 H new ATOM 0 HA ASP A 131 27.706 -12.007 -22.487 1.00 5.14 H new ATOM 0 HB2 ASP A 131 27.498 -14.541 -20.819 1.00 11.14 H new ATOM 0 HB3 ASP A 131 26.510 -14.261 -22.239 1.00 11.14 H new ATOM 310 N CYS A 132 26.331 -11.375 -19.770 1.00 41.42 N ATOM 311 CA CYS A 132 25.155 -10.847 -19.090 1.00 55.10 C ATOM 312 C CYS A 132 25.248 -9.331 -18.939 1.00 33.21 C ATOM 313 O CYS A 132 26.244 -8.805 -18.441 1.00 35.25 O ATOM 314 CB CYS A 132 24.999 -11.499 -17.715 1.00 3.03 C ATOM 315 SG CYS A 132 23.281 -11.567 -17.114 1.00 30.02 S ATOM 0 H CYS A 132 27.210 -11.214 -19.278 1.00 41.42 H new ATOM 0 HA CYS A 132 24.280 -11.081 -19.697 1.00 55.10 H new ATOM 0 HB2 CYS A 132 25.398 -12.513 -17.758 1.00 3.03 H new ATOM 0 HB3 CYS A 132 25.603 -10.949 -16.994 1.00 3.03 H new ATOM 320 N THR A 133 24.203 -8.633 -19.373 1.00 35.44 N ATOM 321 CA THR A 133 24.166 -7.179 -19.287 1.00 12.02 C ATOM 322 C THR A 133 22.912 -6.702 -18.563 1.00 21.35 C ATOM 323 O THR A 133 21.853 -7.328 -18.626 1.00 44.45 O ATOM 324 CB THR A 133 24.215 -6.532 -20.684 1.00 71.40 C ATOM 325 OG1 THR A 133 23.013 -6.829 -21.404 1.00 31.04 O ATOM 326 CG2 THR A 133 25.418 -7.032 -21.469 1.00 43.54 C ATOM 0 H THR A 133 23.371 -9.052 -19.788 1.00 35.44 H new ATOM 0 HA THR A 133 25.047 -6.874 -18.722 1.00 12.02 H new ATOM 0 HB THR A 133 24.305 -5.453 -20.558 1.00 71.40 H new ATOM 0 HG1 THR A 133 23.051 -6.413 -22.290 1.00 31.04 H new ATOM 0 HG21 THR A 133 25.432 -6.562 -22.452 1.00 43.54 H new ATOM 0 HG22 THR A 133 26.333 -6.779 -20.933 1.00 43.54 H new ATOM 0 HG23 THR A 133 25.353 -8.114 -21.585 1.00 43.54 H new ATOM 334 N PRO A 134 23.031 -5.568 -17.857 1.00 14.03 N ATOM 335 CA PRO A 134 21.915 -4.982 -17.107 1.00 44.44 C ATOM 336 C PRO A 134 20.836 -4.414 -18.023 1.00 64.33 C ATOM 337 O PRO A 134 20.866 -4.621 -19.236 1.00 0.23 O ATOM 338 CB PRO A 134 22.579 -3.860 -16.304 1.00 33.21 C ATOM 339 CG PRO A 134 23.791 -3.497 -17.090 1.00 11.21 C ATOM 340 CD PRO A 134 24.262 -4.770 -17.736 1.00 64.11 C ATOM 0 HA PRO A 134 21.404 -5.722 -16.491 1.00 44.44 H new ATOM 0 HB2 PRO A 134 21.911 -3.006 -16.190 1.00 33.21 H new ATOM 0 HB3 PRO A 134 22.843 -4.194 -15.301 1.00 33.21 H new ATOM 0 HG2 PRO A 134 23.558 -2.742 -17.840 1.00 11.21 H new ATOM 0 HG3 PRO A 134 24.563 -3.078 -16.445 1.00 11.21 H new ATOM 0 HD2 PRO A 134 24.716 -4.582 -18.709 1.00 64.11 H new ATOM 0 HD3 PRO A 134 25.011 -5.276 -17.127 1.00 64.11 H new ATOM 348 N GLY A 135 19.884 -3.697 -17.435 1.00 33.32 N ATOM 349 CA GLY A 135 18.809 -3.111 -18.214 1.00 14.15 C ATOM 350 C GLY A 135 17.572 -3.987 -18.246 1.00 51.23 C ATOM 351 O GLY A 135 16.724 -3.909 -17.357 1.00 40.13 O ATOM 0 H GLY A 135 19.838 -3.511 -16.433 1.00 33.32 H new ATOM 0 HA2 GLY A 135 18.551 -2.138 -17.796 1.00 14.15 H new ATOM 0 HA3 GLY A 135 19.155 -2.939 -19.233 1.00 14.15 H new ATOM 355 N SER A 136 17.467 -4.822 -19.275 1.00 24.21 N ATOM 356 CA SER A 136 16.322 -5.713 -19.423 1.00 3.20 C ATOM 357 C SER A 136 16.655 -6.876 -20.353 1.00 2.33 C ATOM 358 O SER A 136 16.809 -6.696 -21.561 1.00 2.52 O ATOM 359 CB SER A 136 15.116 -4.942 -19.964 1.00 4.14 C ATOM 360 OG SER A 136 15.424 -4.313 -21.196 1.00 11.24 O ATOM 0 H SER A 136 18.161 -4.900 -20.018 1.00 24.21 H new ATOM 0 HA SER A 136 16.076 -6.115 -18.440 1.00 3.20 H new ATOM 0 HB2 SER A 136 14.276 -5.623 -20.100 1.00 4.14 H new ATOM 0 HB3 SER A 136 14.804 -4.192 -19.237 1.00 4.14 H new ATOM 0 HG SER A 136 15.995 -4.903 -21.731 1.00 11.24 H new ATOM 366 N VAL A 137 16.765 -8.070 -19.780 1.00 70.30 N ATOM 367 CA VAL A 137 17.079 -9.264 -20.556 1.00 35.21 C ATOM 368 C VAL A 137 15.933 -10.269 -20.506 1.00 53.42 C ATOM 369 O VAL A 137 15.797 -11.115 -21.390 1.00 33.02 O ATOM 370 CB VAL A 137 18.364 -9.943 -20.047 1.00 1.12 C ATOM 371 CG1 VAL A 137 18.235 -10.293 -18.572 1.00 61.33 C ATOM 372 CG2 VAL A 137 18.675 -11.182 -20.873 1.00 33.14 C ATOM 0 H VAL A 137 16.641 -8.236 -18.781 1.00 70.30 H new ATOM 0 HA VAL A 137 17.231 -8.941 -21.586 1.00 35.21 H new ATOM 0 HB VAL A 137 19.192 -9.243 -20.158 1.00 1.12 H new ATOM 0 HG11 VAL A 137 19.153 -10.772 -18.230 1.00 61.33 H new ATOM 0 HG12 VAL A 137 18.064 -9.384 -17.996 1.00 61.33 H new ATOM 0 HG13 VAL A 137 17.396 -10.975 -18.432 1.00 61.33 H new ATOM 0 HG21 VAL A 137 19.586 -11.649 -20.499 1.00 33.14 H new ATOM 0 HG22 VAL A 137 17.848 -11.888 -20.796 1.00 33.14 H new ATOM 0 HG23 VAL A 137 18.814 -10.898 -21.916 1.00 33.14 H new ATOM 382 N ASP A 138 15.111 -10.169 -19.468 1.00 15.44 N ATOM 383 CA ASP A 138 13.974 -11.068 -19.303 1.00 2.54 C ATOM 384 C ASP A 138 12.658 -10.318 -19.484 1.00 32.14 C ATOM 385 O ASP A 138 12.128 -9.733 -18.538 1.00 61.30 O ATOM 386 CB ASP A 138 14.014 -11.727 -17.923 1.00 64.23 C ATOM 387 CG ASP A 138 15.096 -12.784 -17.818 1.00 61.24 C ATOM 388 OD1 ASP A 138 14.863 -13.919 -18.285 1.00 4.23 O ATOM 389 OD2 ASP A 138 16.175 -12.477 -17.269 1.00 61.12 O ATOM 0 H ASP A 138 15.210 -9.474 -18.728 1.00 15.44 H new ATOM 0 HA ASP A 138 14.039 -11.841 -20.068 1.00 2.54 H new ATOM 0 HB2 ASP A 138 14.181 -10.963 -17.163 1.00 64.23 H new ATOM 0 HB3 ASP A 138 13.045 -12.180 -17.712 1.00 64.23 H new ATOM 394 N THR A 139 12.134 -10.339 -20.705 1.00 50.44 N ATOM 395 CA THR A 139 10.881 -9.660 -21.011 1.00 42.34 C ATOM 396 C THR A 139 9.754 -10.155 -20.113 1.00 33.00 C ATOM 397 O THR A 139 8.768 -9.451 -19.891 1.00 71.05 O ATOM 398 CB THR A 139 10.477 -9.864 -22.484 1.00 14.25 C ATOM 399 OG1 THR A 139 11.543 -9.452 -23.346 1.00 54.43 O ATOM 400 CG2 THR A 139 9.217 -9.076 -22.813 1.00 25.21 C ATOM 0 H THR A 139 12.558 -10.819 -21.499 1.00 50.44 H new ATOM 0 HA THR A 139 11.045 -8.598 -20.831 1.00 42.34 H new ATOM 0 HB THR A 139 10.275 -10.924 -22.639 1.00 14.25 H new ATOM 0 HG1 THR A 139 11.279 -9.586 -24.280 1.00 54.43 H new ATOM 0 HG21 THR A 139 8.951 -9.235 -23.858 1.00 25.21 H new ATOM 0 HG22 THR A 139 8.400 -9.413 -22.175 1.00 25.21 H new ATOM 0 HG23 THR A 139 9.397 -8.015 -22.642 1.00 25.21 H new ATOM 408 N HIS A 140 9.905 -11.371 -19.597 1.00 2.42 N ATOM 409 CA HIS A 140 8.899 -11.960 -18.720 1.00 41.23 C ATOM 410 C HIS A 140 9.044 -11.434 -17.296 1.00 4.54 C ATOM 411 O HIS A 140 8.089 -11.442 -16.520 1.00 13.11 O ATOM 412 CB HIS A 140 9.016 -13.484 -18.728 1.00 35.34 C ATOM 413 CG HIS A 140 8.386 -14.127 -19.925 1.00 35.44 C ATOM 414 ND1 HIS A 140 8.719 -15.392 -20.362 1.00 54.23 N ATOM 415 CD2 HIS A 140 7.436 -13.674 -20.776 1.00 42.02 C ATOM 416 CE1 HIS A 140 8.003 -15.688 -21.432 1.00 53.34 C ATOM 417 NE2 HIS A 140 7.216 -14.662 -21.704 1.00 61.11 N ATOM 0 H HIS A 140 10.714 -11.967 -19.771 1.00 2.42 H new ATOM 0 HA HIS A 140 7.915 -11.676 -19.094 1.00 41.23 H new ATOM 0 HB2 HIS A 140 10.070 -13.759 -18.690 1.00 35.34 H new ATOM 0 HB3 HIS A 140 8.551 -13.881 -17.826 1.00 35.34 H new ATOM 0 HD2 HIS A 140 6.943 -12.714 -20.733 1.00 42.02 H new ATOM 0 HE1 HIS A 140 8.052 -16.612 -21.990 1.00 53.34 H new ATOM 0 HE2 HIS A 140 6.553 -14.612 -22.477 1.00 61.11 H new ATOM 425 N SER A 141 10.246 -10.977 -16.958 1.00 64.12 N ATOM 426 CA SER A 141 10.518 -10.451 -15.625 1.00 71.45 C ATOM 427 C SER A 141 10.105 -8.986 -15.525 1.00 44.01 C ATOM 428 O SER A 141 9.663 -8.525 -14.473 1.00 4.31 O ATOM 429 CB SER A 141 12.003 -10.599 -15.289 1.00 30.23 C ATOM 430 OG SER A 141 12.707 -9.398 -15.551 1.00 44.12 O ATOM 0 H SER A 141 11.047 -10.960 -17.589 1.00 64.12 H new ATOM 0 HA SER A 141 9.932 -11.025 -14.907 1.00 71.45 H new ATOM 0 HB2 SER A 141 12.116 -10.869 -14.239 1.00 30.23 H new ATOM 0 HB3 SER A 141 12.433 -11.411 -15.875 1.00 30.23 H new ATOM 0 HG SER A 141 12.713 -9.226 -16.516 1.00 44.12 H new ATOM 436 N SER A 142 10.254 -8.259 -16.628 1.00 74.11 N ATOM 437 CA SER A 142 9.901 -6.845 -16.665 1.00 15.23 C ATOM 438 C SER A 142 10.642 -6.071 -15.579 1.00 23.53 C ATOM 439 O SER A 142 10.184 -5.025 -15.123 1.00 34.04 O ATOM 440 CB SER A 142 8.391 -6.670 -16.491 1.00 13.45 C ATOM 441 OG SER A 142 7.674 -7.601 -17.283 1.00 45.42 O ATOM 0 H SER A 142 10.617 -8.626 -17.508 1.00 74.11 H new ATOM 0 HA SER A 142 10.197 -6.448 -17.636 1.00 15.23 H new ATOM 0 HB2 SER A 142 8.125 -6.800 -15.442 1.00 13.45 H new ATOM 0 HB3 SER A 142 8.105 -5.656 -16.769 1.00 13.45 H new ATOM 0 HG SER A 142 6.712 -7.469 -17.152 1.00 45.42 H new ATOM 447 N GLY A 143 11.793 -6.596 -15.169 1.00 4.23 N ATOM 448 CA GLY A 143 12.581 -5.943 -14.140 1.00 2.15 C ATOM 449 C GLY A 143 13.806 -5.248 -14.700 1.00 53.55 C ATOM 450 O GLY A 143 13.972 -5.153 -15.917 1.00 4.35 O ATOM 0 H GLY A 143 12.193 -7.461 -15.531 1.00 4.23 H new ATOM 0 HA2 GLY A 143 11.960 -5.214 -13.619 1.00 2.15 H new ATOM 0 HA3 GLY A 143 12.892 -6.682 -13.402 1.00 2.15 H new ATOM 454 N VAL A 144 14.665 -4.758 -13.812 1.00 41.34 N ATOM 455 CA VAL A 144 15.881 -4.067 -14.226 1.00 14.45 C ATOM 456 C VAL A 144 17.108 -4.950 -14.032 1.00 11.00 C ATOM 457 O VAL A 144 17.588 -5.127 -12.913 1.00 14.14 O ATOM 458 CB VAL A 144 16.076 -2.756 -13.440 1.00 33.21 C ATOM 459 CG1 VAL A 144 17.210 -1.939 -14.038 1.00 42.42 C ATOM 460 CG2 VAL A 144 14.784 -1.953 -13.415 1.00 41.01 C ATOM 0 H VAL A 144 14.542 -4.827 -12.802 1.00 41.34 H new ATOM 0 HA VAL A 144 15.768 -3.834 -15.285 1.00 14.45 H new ATOM 0 HB VAL A 144 16.342 -3.004 -12.413 1.00 33.21 H new ATOM 0 HG11 VAL A 144 17.333 -1.017 -13.470 1.00 42.42 H new ATOM 0 HG12 VAL A 144 18.134 -2.516 -13.998 1.00 42.42 H new ATOM 0 HG13 VAL A 144 16.977 -1.698 -15.075 1.00 42.42 H new ATOM 0 HG21 VAL A 144 14.940 -1.030 -12.856 1.00 41.01 H new ATOM 0 HG22 VAL A 144 14.485 -1.713 -14.435 1.00 41.01 H new ATOM 0 HG23 VAL A 144 14.000 -2.540 -12.936 1.00 41.01 H new ATOM 470 N ALA A 145 17.612 -5.502 -15.131 1.00 31.23 N ATOM 471 CA ALA A 145 18.785 -6.365 -15.083 1.00 24.55 C ATOM 472 C ALA A 145 19.970 -5.647 -14.446 1.00 0.31 C ATOM 473 O ALA A 145 20.183 -4.455 -14.674 1.00 32.22 O ATOM 474 CB ALA A 145 19.146 -6.845 -16.481 1.00 12.31 C ATOM 0 H ALA A 145 17.226 -5.367 -16.065 1.00 31.23 H new ATOM 0 HA ALA A 145 18.543 -7.230 -14.465 1.00 24.55 H new ATOM 0 HB1 ALA A 145 20.024 -7.489 -16.429 1.00 12.31 H new ATOM 0 HB2 ALA A 145 18.310 -7.405 -16.901 1.00 12.31 H new ATOM 0 HB3 ALA A 145 19.363 -5.986 -17.116 1.00 12.31 H new ATOM 480 N THR A 146 20.740 -6.378 -13.645 1.00 54.25 N ATOM 481 CA THR A 146 21.902 -5.810 -12.974 1.00 53.43 C ATOM 482 C THR A 146 23.184 -6.122 -13.736 1.00 63.25 C ATOM 483 O THR A 146 24.114 -5.317 -13.764 1.00 12.24 O ATOM 484 CB THR A 146 22.032 -6.338 -11.533 1.00 65.24 C ATOM 485 OG1 THR A 146 20.736 -6.461 -10.937 1.00 64.11 O ATOM 486 CG2 THR A 146 22.897 -5.411 -10.693 1.00 10.40 C ATOM 0 H THR A 146 20.579 -7.365 -13.446 1.00 54.25 H new ATOM 0 HA THR A 146 21.754 -4.730 -12.945 1.00 53.43 H new ATOM 0 HB THR A 146 22.508 -7.318 -11.570 1.00 65.24 H new ATOM 0 HG1 THR A 146 20.825 -6.484 -9.961 1.00 64.11 H new ATOM 0 HG21 THR A 146 22.974 -5.805 -9.679 1.00 10.40 H new ATOM 0 HG22 THR A 146 23.892 -5.344 -11.133 1.00 10.40 H new ATOM 0 HG23 THR A 146 22.446 -4.419 -10.664 1.00 10.40 H new ATOM 494 N GLY A 147 23.228 -7.298 -14.356 1.00 53.11 N ATOM 495 CA GLY A 147 24.401 -7.696 -15.111 1.00 44.42 C ATOM 496 C GLY A 147 25.176 -8.810 -14.435 1.00 53.33 C ATOM 497 O GLY A 147 25.773 -9.654 -15.104 1.00 15.04 O ATOM 0 H GLY A 147 22.471 -7.982 -14.348 1.00 53.11 H new ATOM 0 HA2 GLY A 147 24.096 -8.022 -16.105 1.00 44.42 H new ATOM 0 HA3 GLY A 147 25.053 -6.833 -15.244 1.00 44.42 H new ATOM 501 N ARG A 148 25.168 -8.812 -13.106 1.00 53.13 N ATOM 502 CA ARG A 148 25.877 -9.829 -12.340 1.00 21.03 C ATOM 503 C ARG A 148 25.124 -11.156 -12.369 1.00 50.31 C ATOM 504 O ARG A 148 23.920 -11.204 -12.116 1.00 31.23 O ATOM 505 CB ARG A 148 26.065 -9.369 -10.893 1.00 10.12 C ATOM 506 CG ARG A 148 27.277 -9.983 -10.211 1.00 12.20 C ATOM 507 CD ARG A 148 27.546 -9.333 -8.863 1.00 31.34 C ATOM 508 NE ARG A 148 28.088 -7.985 -9.003 1.00 40.53 N ATOM 509 CZ ARG A 148 28.158 -7.113 -8.004 1.00 0.44 C ATOM 510 NH1 ARG A 148 27.723 -7.447 -6.797 1.00 12.44 N ATOM 511 NH2 ARG A 148 28.665 -5.904 -8.210 1.00 53.22 N ATOM 0 H ARG A 148 24.678 -8.121 -12.538 1.00 53.13 H new ATOM 0 HA ARG A 148 26.855 -9.976 -12.798 1.00 21.03 H new ATOM 0 HB2 ARG A 148 26.160 -8.283 -10.875 1.00 10.12 H new ATOM 0 HB3 ARG A 148 25.171 -9.620 -10.322 1.00 10.12 H new ATOM 0 HG2 ARG A 148 27.116 -11.052 -10.075 1.00 12.20 H new ATOM 0 HG3 ARG A 148 28.152 -9.871 -10.851 1.00 12.20 H new ATOM 0 HD2 ARG A 148 26.620 -9.293 -8.289 1.00 31.34 H new ATOM 0 HD3 ARG A 148 28.246 -9.948 -8.297 1.00 31.34 H new ATOM 0 HE ARG A 148 28.432 -7.697 -9.919 1.00 40.53 H new ATOM 0 HH11 ARG A 148 27.334 -8.376 -6.634 1.00 12.44 H new ATOM 0 HH12 ARG A 148 27.778 -6.775 -6.031 1.00 12.44 H new ATOM 0 HH21 ARG A 148 29.002 -5.643 -9.137 1.00 53.22 H new ATOM 0 HH22 ARG A 148 28.718 -5.235 -7.441 1.00 53.22 H new ATOM 525 N CYS A 149 25.841 -12.230 -12.680 1.00 71.34 N ATOM 526 CA CYS A 149 25.242 -13.558 -12.744 1.00 53.24 C ATOM 527 C CYS A 149 25.705 -14.421 -11.574 1.00 51.31 C ATOM 528 O CYS A 149 26.863 -14.355 -11.160 1.00 75.12 O ATOM 529 CB CYS A 149 25.599 -14.239 -14.067 1.00 43.51 C ATOM 530 SG CYS A 149 24.536 -15.657 -14.484 1.00 73.45 S ATOM 0 H CYS A 149 26.838 -12.207 -12.892 1.00 71.34 H new ATOM 0 HA CYS A 149 24.160 -13.444 -12.682 1.00 53.24 H new ATOM 0 HB2 CYS A 149 25.537 -13.504 -14.870 1.00 43.51 H new ATOM 0 HB3 CYS A 149 26.635 -14.576 -14.022 1.00 43.51 H new ATOM 535 N VAL A 150 24.793 -15.230 -11.045 1.00 15.30 N ATOM 536 CA VAL A 150 25.107 -16.107 -9.924 1.00 11.14 C ATOM 537 C VAL A 150 24.309 -17.404 -10.000 1.00 44.01 C ATOM 538 O VAL A 150 23.191 -17.445 -10.512 1.00 54.44 O ATOM 539 CB VAL A 150 24.820 -15.419 -8.576 1.00 33.44 C ATOM 540 CG1 VAL A 150 25.570 -14.099 -8.479 1.00 35.53 C ATOM 541 CG2 VAL A 150 23.324 -15.207 -8.394 1.00 64.11 C ATOM 0 H VAL A 150 23.830 -15.296 -11.375 1.00 15.30 H new ATOM 0 HA VAL A 150 26.171 -16.334 -9.989 1.00 11.14 H new ATOM 0 HB VAL A 150 25.172 -16.068 -7.774 1.00 33.44 H new ATOM 0 HG11 VAL A 150 25.355 -13.628 -7.520 1.00 35.53 H new ATOM 0 HG12 VAL A 150 26.641 -14.282 -8.561 1.00 35.53 H new ATOM 0 HG13 VAL A 150 25.252 -13.440 -9.287 1.00 35.53 H new ATOM 0 HG21 VAL A 150 23.139 -14.720 -7.437 1.00 64.11 H new ATOM 0 HG22 VAL A 150 22.945 -14.579 -9.200 1.00 64.11 H new ATOM 0 HG23 VAL A 150 22.815 -16.171 -8.415 1.00 64.11 H new ATOM 551 N PRO A 151 24.897 -18.491 -9.478 1.00 74.24 N ATOM 552 CA PRO A 151 24.258 -19.811 -9.474 1.00 41.35 C ATOM 553 C PRO A 151 23.068 -19.876 -8.523 1.00 24.22 C ATOM 554 O PRO A 151 23.219 -20.206 -7.346 1.00 62.53 O ATOM 555 CB PRO A 151 25.375 -20.744 -8.999 1.00 52.35 C ATOM 556 CG PRO A 151 26.284 -19.872 -8.204 1.00 41.02 C ATOM 557 CD PRO A 151 26.229 -18.516 -8.852 1.00 11.03 C ATOM 0 HA PRO A 151 23.854 -20.072 -10.452 1.00 41.35 H new ATOM 0 HB2 PRO A 151 24.979 -21.559 -8.394 1.00 52.35 H new ATOM 0 HB3 PRO A 151 25.898 -21.197 -9.842 1.00 52.35 H new ATOM 0 HG2 PRO A 151 25.964 -19.820 -7.163 1.00 41.02 H new ATOM 0 HG3 PRO A 151 27.301 -20.264 -8.205 1.00 41.02 H new ATOM 0 HD2 PRO A 151 26.344 -17.716 -8.121 1.00 11.03 H new ATOM 0 HD3 PRO A 151 27.022 -18.390 -9.589 1.00 11.03 H new ATOM 565 N PHE A 152 21.885 -19.560 -9.039 1.00 45.01 N ATOM 566 CA PHE A 152 20.669 -19.583 -8.235 1.00 5.55 C ATOM 567 C PHE A 152 20.437 -20.968 -7.639 1.00 72.12 C ATOM 568 O PHE A 152 20.259 -21.114 -6.431 1.00 31.13 O ATOM 569 CB PHE A 152 19.464 -19.170 -9.082 1.00 61.31 C ATOM 570 CG PHE A 152 18.252 -18.817 -8.269 1.00 32.55 C ATOM 571 CD1 PHE A 152 17.589 -19.787 -7.533 1.00 0.44 C ATOM 572 CD2 PHE A 152 17.775 -17.517 -8.239 1.00 43.22 C ATOM 573 CE1 PHE A 152 16.473 -19.465 -6.784 1.00 12.41 C ATOM 574 CE2 PHE A 152 16.660 -17.189 -7.492 1.00 12.21 C ATOM 575 CZ PHE A 152 16.008 -18.164 -6.762 1.00 44.05 C ATOM 0 H PHE A 152 21.743 -19.285 -10.011 1.00 45.01 H new ATOM 0 HA PHE A 152 20.790 -18.872 -7.418 1.00 5.55 H new ATOM 0 HB2 PHE A 152 19.740 -18.314 -9.699 1.00 61.31 H new ATOM 0 HB3 PHE A 152 19.211 -19.984 -9.761 1.00 61.31 H new ATOM 0 HD1 PHE A 152 17.949 -20.805 -7.545 1.00 0.44 H new ATOM 0 HD2 PHE A 152 18.281 -16.750 -8.807 1.00 43.22 H new ATOM 0 HE1 PHE A 152 15.965 -20.230 -6.216 1.00 12.41 H new ATOM 0 HE2 PHE A 152 16.298 -16.171 -7.479 1.00 12.21 H new ATOM 0 HZ PHE A 152 15.137 -17.910 -6.176 1.00 44.05 H new ATOM 585 N ASN A 153 20.439 -21.983 -8.498 1.00 2.51 N ATOM 586 CA ASN A 153 20.227 -23.357 -8.058 1.00 43.21 C ATOM 587 C ASN A 153 21.506 -24.177 -8.202 1.00 34.23 C ATOM 588 O ASN A 153 22.580 -23.631 -8.451 1.00 32.21 O ATOM 589 CB ASN A 153 19.099 -24.004 -8.864 1.00 23.10 C ATOM 590 CG ASN A 153 18.184 -24.851 -8.001 1.00 11.54 C ATOM 591 OD1 ASN A 153 18.470 -25.097 -6.829 1.00 2.22 O ATOM 592 ND2 ASN A 153 17.076 -25.301 -8.578 1.00 12.43 N ATOM 0 H ASN A 153 20.585 -21.879 -9.502 1.00 2.51 H new ATOM 0 HA ASN A 153 19.946 -23.336 -7.005 1.00 43.21 H new ATOM 0 HB2 ASN A 153 18.514 -23.226 -9.354 1.00 23.10 H new ATOM 0 HB3 ASN A 153 19.528 -24.624 -9.651 1.00 23.10 H new ATOM 0 HD21 ASN A 153 16.422 -25.875 -8.047 1.00 12.43 H new ATOM 0 HD22 ASN A 153 16.879 -25.072 -9.552 1.00 12.43 H new ATOM 599 N GLU A 154 21.380 -25.491 -8.043 1.00 61.13 N ATOM 600 CA GLU A 154 22.526 -26.386 -8.155 1.00 73.23 C ATOM 601 C GLU A 154 22.976 -26.515 -9.608 1.00 11.43 C ATOM 602 O GLU A 154 24.097 -26.144 -9.957 1.00 14.55 O ATOM 603 CB GLU A 154 22.179 -27.767 -7.593 1.00 44.43 C ATOM 604 CG GLU A 154 23.384 -28.680 -7.438 1.00 74.20 C ATOM 605 CD GLU A 154 24.394 -28.149 -6.439 1.00 74.34 C ATOM 606 OE1 GLU A 154 25.282 -27.374 -6.851 1.00 24.14 O ATOM 607 OE2 GLU A 154 24.296 -28.509 -5.248 1.00 11.24 O ATOM 0 H GLU A 154 20.497 -25.959 -7.837 1.00 61.13 H new ATOM 0 HA GLU A 154 23.345 -25.960 -7.575 1.00 73.23 H new ATOM 0 HB2 GLU A 154 21.699 -27.645 -6.622 1.00 44.43 H new ATOM 0 HB3 GLU A 154 21.453 -28.246 -8.250 1.00 44.43 H new ATOM 0 HG2 GLU A 154 23.049 -29.667 -7.120 1.00 74.20 H new ATOM 0 HG3 GLU A 154 23.868 -28.804 -8.407 1.00 74.20 H new ATOM 614 N SER A 155 22.094 -27.043 -10.450 1.00 30.41 N ATOM 615 CA SER A 155 22.401 -27.225 -11.864 1.00 21.32 C ATOM 616 C SER A 155 21.768 -26.120 -12.704 1.00 5.02 C ATOM 617 O SER A 155 21.445 -26.322 -13.874 1.00 52.13 O ATOM 618 CB SER A 155 21.907 -28.592 -12.343 1.00 3.30 C ATOM 619 OG SER A 155 22.564 -28.981 -13.537 1.00 32.32 O ATOM 0 H SER A 155 21.161 -27.352 -10.178 1.00 30.41 H new ATOM 0 HA SER A 155 23.483 -27.175 -11.985 1.00 21.32 H new ATOM 0 HB2 SER A 155 22.083 -29.338 -11.568 1.00 3.30 H new ATOM 0 HB3 SER A 155 20.831 -28.555 -12.512 1.00 3.30 H new ATOM 0 HG SER A 155 22.529 -28.246 -14.184 1.00 32.32 H new ATOM 625 N VAL A 156 21.595 -24.950 -12.097 1.00 70.01 N ATOM 626 CA VAL A 156 21.002 -23.811 -12.788 1.00 22.11 C ATOM 627 C VAL A 156 21.558 -22.495 -12.255 1.00 71.21 C ATOM 628 O VAL A 156 21.841 -22.364 -11.064 1.00 32.50 O ATOM 629 CB VAL A 156 19.469 -23.804 -12.644 1.00 53.43 C ATOM 630 CG1 VAL A 156 18.871 -22.605 -13.365 1.00 14.02 C ATOM 631 CG2 VAL A 156 18.878 -25.102 -13.172 1.00 63.51 C ATOM 0 H VAL A 156 21.857 -24.766 -11.129 1.00 70.01 H new ATOM 0 HA VAL A 156 21.260 -23.910 -13.842 1.00 22.11 H new ATOM 0 HB VAL A 156 19.221 -23.723 -11.586 1.00 53.43 H new ATOM 0 HG11 VAL A 156 17.787 -22.616 -13.253 1.00 14.02 H new ATOM 0 HG12 VAL A 156 19.271 -21.686 -12.936 1.00 14.02 H new ATOM 0 HG13 VAL A 156 19.126 -22.652 -14.424 1.00 14.02 H new ATOM 0 HG21 VAL A 156 17.794 -25.079 -13.062 1.00 63.51 H new ATOM 0 HG22 VAL A 156 19.134 -25.216 -14.225 1.00 63.51 H new ATOM 0 HG23 VAL A 156 19.282 -25.942 -12.607 1.00 63.51 H new ATOM 641 N LYS A 157 21.712 -21.521 -13.145 1.00 40.13 N ATOM 642 CA LYS A 157 22.232 -20.213 -12.766 1.00 44.30 C ATOM 643 C LYS A 157 21.392 -19.095 -13.376 1.00 30.23 C ATOM 644 O LYS A 157 20.944 -19.194 -14.519 1.00 14.35 O ATOM 645 CB LYS A 157 23.689 -20.071 -13.213 1.00 23.42 C ATOM 646 CG LYS A 157 24.041 -20.925 -14.418 1.00 63.55 C ATOM 647 CD LYS A 157 23.252 -20.507 -15.648 1.00 32.44 C ATOM 648 CE LYS A 157 24.064 -20.691 -16.921 1.00 11.45 C ATOM 649 NZ LYS A 157 23.201 -21.033 -18.085 1.00 32.44 N ATOM 0 H LYS A 157 21.484 -21.613 -14.135 1.00 40.13 H new ATOM 0 HA LYS A 157 22.181 -20.131 -11.680 1.00 44.30 H new ATOM 0 HB2 LYS A 157 23.888 -19.025 -13.449 1.00 23.42 H new ATOM 0 HB3 LYS A 157 24.343 -20.341 -12.384 1.00 23.42 H new ATOM 0 HG2 LYS A 157 25.108 -20.843 -14.624 1.00 63.55 H new ATOM 0 HG3 LYS A 157 23.839 -21.973 -14.194 1.00 63.55 H new ATOM 0 HD2 LYS A 157 22.336 -21.095 -15.711 1.00 32.44 H new ATOM 0 HD3 LYS A 157 22.954 -19.463 -15.553 1.00 32.44 H new ATOM 0 HE2 LYS A 157 24.616 -19.776 -17.135 1.00 11.45 H new ATOM 0 HE3 LYS A 157 24.801 -21.480 -16.771 1.00 11.45 H new ATOM 0 HZ1 LYS A 157 23.782 -21.459 -18.835 1.00 32.44 H new ATOM 0 HZ2 LYS A 157 22.470 -21.710 -17.788 1.00 32.44 H new ATOM 0 HZ3 LYS A 157 22.747 -20.170 -18.446 1.00 32.44 H new ATOM 663 N THR A 158 21.183 -18.031 -12.607 1.00 32.13 N ATOM 664 CA THR A 158 20.397 -16.895 -13.071 1.00 71.02 C ATOM 665 C THR A 158 21.175 -15.592 -12.926 1.00 70.24 C ATOM 666 O THR A 158 22.282 -15.575 -12.387 1.00 12.31 O ATOM 667 CB THR A 158 19.070 -16.776 -12.298 1.00 21.02 C ATOM 668 OG1 THR A 158 18.725 -18.040 -11.719 1.00 42.32 O ATOM 669 CG2 THR A 158 17.949 -16.309 -13.215 1.00 23.55 C ATOM 0 H THR A 158 21.548 -17.933 -11.659 1.00 32.13 H new ATOM 0 HA THR A 158 20.180 -17.070 -14.125 1.00 71.02 H new ATOM 0 HB THR A 158 19.201 -16.038 -11.506 1.00 21.02 H new ATOM 0 HG1 THR A 158 17.924 -17.938 -11.164 1.00 42.32 H new ATOM 0 HG21 THR A 158 17.022 -16.233 -12.647 1.00 23.55 H new ATOM 0 HG22 THR A 158 18.201 -15.333 -13.631 1.00 23.55 H new ATOM 0 HG23 THR A 158 17.819 -17.026 -14.026 1.00 23.55 H new ATOM 677 N CYS A 159 20.590 -14.502 -13.411 1.00 13.03 N ATOM 678 CA CYS A 159 21.228 -13.193 -13.335 1.00 73.32 C ATOM 679 C CYS A 159 20.470 -12.273 -12.383 1.00 13.21 C ATOM 680 O CYS A 159 19.271 -12.443 -12.163 1.00 50.53 O ATOM 681 CB CYS A 159 21.302 -12.558 -14.725 1.00 71.00 C ATOM 682 SG CYS A 159 22.991 -12.435 -15.397 1.00 74.01 S ATOM 0 H CYS A 159 19.675 -14.499 -13.861 1.00 13.03 H new ATOM 0 HA CYS A 159 22.239 -13.330 -12.951 1.00 73.32 H new ATOM 0 HB2 CYS A 159 20.690 -13.142 -15.413 1.00 71.00 H new ATOM 0 HB3 CYS A 159 20.867 -11.560 -14.680 1.00 71.00 H new ATOM 687 N GLU A 160 21.178 -11.298 -11.821 1.00 64.24 N ATOM 688 CA GLU A 160 20.572 -10.352 -10.893 1.00 3.54 C ATOM 689 C GLU A 160 19.670 -9.367 -11.631 1.00 34.22 C ATOM 690 O GLU A 160 20.029 -8.852 -12.690 1.00 32.13 O ATOM 691 CB GLU A 160 21.656 -9.590 -10.126 1.00 32.42 C ATOM 692 CG GLU A 160 21.664 -9.881 -8.635 1.00 23.35 C ATOM 693 CD GLU A 160 22.461 -8.861 -7.846 1.00 3.44 C ATOM 694 OE1 GLU A 160 21.882 -7.825 -7.459 1.00 14.42 O ATOM 695 OE2 GLU A 160 23.665 -9.099 -7.615 1.00 4.11 O ATOM 0 H GLU A 160 22.171 -11.143 -11.993 1.00 64.24 H new ATOM 0 HA GLU A 160 19.964 -10.916 -10.186 1.00 3.54 H new ATOM 0 HB2 GLU A 160 22.631 -9.844 -10.543 1.00 32.42 H new ATOM 0 HB3 GLU A 160 21.513 -8.520 -10.278 1.00 32.42 H new ATOM 0 HG2 GLU A 160 20.638 -9.899 -8.267 1.00 23.35 H new ATOM 0 HG3 GLU A 160 22.081 -10.873 -8.465 1.00 23.35 H new ATOM 702 N VAL A 161 18.495 -9.111 -11.064 1.00 12.01 N ATOM 703 CA VAL A 161 17.540 -8.189 -11.667 1.00 1.43 C ATOM 704 C VAL A 161 16.733 -7.458 -10.600 1.00 34.35 C ATOM 705 O VAL A 161 16.708 -7.866 -9.439 1.00 13.45 O ATOM 706 CB VAL A 161 16.573 -8.922 -12.614 1.00 74.25 C ATOM 707 CG1 VAL A 161 17.345 -9.726 -13.649 1.00 23.42 C ATOM 708 CG2 VAL A 161 15.631 -9.819 -11.825 1.00 1.34 C ATOM 0 H VAL A 161 18.182 -9.529 -10.188 1.00 12.01 H new ATOM 0 HA VAL A 161 18.119 -7.465 -12.241 1.00 1.43 H new ATOM 0 HB VAL A 161 15.974 -8.178 -13.139 1.00 74.25 H new ATOM 0 HG11 VAL A 161 16.644 -10.237 -14.309 1.00 23.42 H new ATOM 0 HG12 VAL A 161 17.973 -9.056 -14.236 1.00 23.42 H new ATOM 0 HG13 VAL A 161 17.971 -10.462 -13.145 1.00 23.42 H new ATOM 0 HG21 VAL A 161 14.955 -10.329 -12.511 1.00 1.34 H new ATOM 0 HG22 VAL A 161 16.211 -10.557 -11.271 1.00 1.34 H new ATOM 0 HG23 VAL A 161 15.052 -9.214 -11.127 1.00 1.34 H new ATOM 718 N ALA A 162 16.073 -6.377 -11.001 1.00 53.03 N ATOM 719 CA ALA A 162 15.262 -5.591 -10.080 1.00 54.21 C ATOM 720 C ALA A 162 13.774 -5.814 -10.331 1.00 1.22 C ATOM 721 O ALA A 162 13.244 -5.419 -11.369 1.00 61.40 O ATOM 722 CB ALA A 162 15.604 -4.114 -10.204 1.00 41.52 C ATOM 0 H ALA A 162 16.084 -6.025 -11.958 1.00 53.03 H new ATOM 0 HA ALA A 162 15.486 -5.921 -9.066 1.00 54.21 H new ATOM 0 HB1 ALA A 162 14.991 -3.539 -9.510 1.00 41.52 H new ATOM 0 HB2 ALA A 162 16.657 -3.963 -9.968 1.00 41.52 H new ATOM 0 HB3 ALA A 162 15.409 -3.780 -11.223 1.00 41.52 H new ATOM 728 N ALA A 163 13.106 -6.449 -9.373 1.00 61.04 N ATOM 729 CA ALA A 163 11.679 -6.723 -9.490 1.00 63.24 C ATOM 730 C ALA A 163 11.021 -6.804 -8.117 1.00 64.21 C ATOM 731 O ALA A 163 11.654 -6.526 -7.098 1.00 71.03 O ATOM 732 CB ALA A 163 11.451 -8.014 -10.264 1.00 5.52 C ATOM 0 H ALA A 163 13.530 -6.783 -8.508 1.00 61.04 H new ATOM 0 HA ALA A 163 11.220 -5.899 -10.036 1.00 63.24 H new ATOM 0 HB1 ALA A 163 10.381 -8.206 -10.344 1.00 5.52 H new ATOM 0 HB2 ALA A 163 11.878 -7.920 -11.262 1.00 5.52 H new ATOM 0 HB3 ALA A 163 11.930 -8.841 -9.741 1.00 5.52 H new ATOM 738 N TRP A 164 9.750 -7.186 -8.097 1.00 55.44 N ATOM 739 CA TRP A 164 9.006 -7.302 -6.848 1.00 70.21 C ATOM 740 C TRP A 164 9.322 -8.619 -6.147 1.00 45.40 C ATOM 741 O TRP A 164 8.857 -9.681 -6.560 1.00 72.11 O ATOM 742 CB TRP A 164 7.503 -7.200 -7.114 1.00 1.03 C ATOM 743 CG TRP A 164 7.135 -6.058 -8.012 1.00 61.55 C ATOM 744 CD1 TRP A 164 6.849 -6.125 -9.346 1.00 51.22 C ATOM 745 CD2 TRP A 164 7.016 -4.681 -7.643 1.00 14.45 C ATOM 746 NE1 TRP A 164 6.559 -4.871 -9.828 1.00 12.03 N ATOM 747 CE2 TRP A 164 6.653 -3.968 -8.802 1.00 43.22 C ATOM 748 CE3 TRP A 164 7.177 -3.980 -6.444 1.00 44.24 C ATOM 749 CZ2 TRP A 164 6.452 -2.590 -8.796 1.00 61.14 C ATOM 750 CZ3 TRP A 164 6.978 -2.612 -6.440 1.00 73.43 C ATOM 751 CH2 TRP A 164 6.617 -1.929 -7.610 1.00 24.35 C ATOM 0 H TRP A 164 9.212 -7.421 -8.931 1.00 55.44 H new ATOM 0 HA TRP A 164 9.309 -6.483 -6.196 1.00 70.21 H new ATOM 0 HB2 TRP A 164 7.157 -8.131 -7.562 1.00 1.03 H new ATOM 0 HB3 TRP A 164 6.980 -7.089 -6.164 1.00 1.03 H new ATOM 0 HD1 TRP A 164 6.851 -7.030 -9.935 1.00 51.22 H new ATOM 0 HE1 TRP A 164 6.314 -4.649 -10.793 1.00 12.03 H new ATOM 0 HE3 TRP A 164 7.452 -4.498 -5.537 1.00 44.24 H new ATOM 0 HZ2 TRP A 164 6.175 -2.062 -9.696 1.00 61.14 H new ATOM 0 HZ3 TRP A 164 7.103 -2.060 -5.520 1.00 73.43 H new ATOM 0 HH2 TRP A 164 6.466 -0.860 -7.574 1.00 24.35 H new ATOM 762 N CYS A 165 10.117 -8.542 -5.084 1.00 73.14 N ATOM 763 CA CYS A 165 10.496 -9.728 -4.326 1.00 11.24 C ATOM 764 C CYS A 165 10.836 -9.365 -2.883 1.00 12.40 C ATOM 765 O CYS A 165 11.243 -8.243 -2.578 1.00 74.22 O ATOM 766 CB CYS A 165 11.691 -10.420 -4.984 1.00 40.31 C ATOM 767 SG CYS A 165 13.267 -9.527 -4.790 1.00 11.23 S ATOM 0 H CYS A 165 10.511 -7.671 -4.729 1.00 73.14 H new ATOM 0 HA CYS A 165 9.647 -10.412 -4.321 1.00 11.24 H new ATOM 0 HB2 CYS A 165 11.797 -11.419 -4.561 1.00 40.31 H new ATOM 0 HB3 CYS A 165 11.485 -10.545 -6.047 1.00 40.31 H new ATOM 772 N PRO A 166 10.666 -10.335 -1.973 1.00 30.12 N ATOM 773 CA PRO A 166 10.950 -10.142 -0.548 1.00 34.24 C ATOM 774 C PRO A 166 12.442 -10.005 -0.267 1.00 21.31 C ATOM 775 O PRO A 166 13.274 -10.275 -1.133 1.00 43.22 O ATOM 776 CB PRO A 166 10.398 -11.415 0.099 1.00 24.42 C ATOM 777 CG PRO A 166 10.440 -12.439 -0.983 1.00 12.51 C ATOM 778 CD PRO A 166 10.184 -11.696 -2.265 1.00 45.31 C ATOM 0 HA PRO A 166 10.504 -9.224 -0.164 1.00 34.24 H new ATOM 0 HB2 PRO A 166 11.002 -11.718 0.954 1.00 24.42 H new ATOM 0 HB3 PRO A 166 9.382 -11.265 0.463 1.00 24.42 H new ATOM 0 HG2 PRO A 166 11.408 -12.940 -1.009 1.00 12.51 H new ATOM 0 HG3 PRO A 166 9.686 -13.209 -0.821 1.00 12.51 H new ATOM 0 HD2 PRO A 166 10.722 -12.142 -3.102 1.00 45.31 H new ATOM 0 HD3 PRO A 166 9.126 -11.700 -2.527 1.00 45.31 H new ATOM 786 N VAL A 167 12.775 -9.585 0.950 1.00 73.24 N ATOM 787 CA VAL A 167 14.168 -9.414 1.345 1.00 34.10 C ATOM 788 C VAL A 167 14.620 -10.543 2.265 1.00 44.44 C ATOM 789 O VAL A 167 15.628 -11.201 2.007 1.00 41.31 O ATOM 790 CB VAL A 167 14.387 -8.066 2.058 1.00 63.43 C ATOM 791 CG1 VAL A 167 15.839 -7.919 2.487 1.00 62.52 C ATOM 792 CG2 VAL A 167 13.970 -6.914 1.157 1.00 14.32 C ATOM 0 H VAL A 167 12.099 -9.357 1.679 1.00 73.24 H new ATOM 0 HA VAL A 167 14.762 -9.434 0.431 1.00 34.10 H new ATOM 0 HB VAL A 167 13.764 -8.042 2.952 1.00 63.43 H new ATOM 0 HG11 VAL A 167 15.975 -6.961 2.989 1.00 62.52 H new ATOM 0 HG12 VAL A 167 16.100 -8.727 3.171 1.00 62.52 H new ATOM 0 HG13 VAL A 167 16.484 -7.964 1.609 1.00 62.52 H new ATOM 0 HG21 VAL A 167 14.131 -5.969 1.676 1.00 14.32 H new ATOM 0 HG22 VAL A 167 14.565 -6.932 0.244 1.00 14.32 H new ATOM 0 HG23 VAL A 167 12.914 -7.013 0.904 1.00 14.32 H new TER 802 VAL A 167