USER MOD reduce.3.24.130724 H: found=0, std=0, add=1051, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1053 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 86 CYS SG : rot 87:sc= 0.31 USER MOD Set 1.2: A 90 THR OG1 : rot 88:sc= 1.13 USER MOD Set 2.1: A 19 CYS SG : rot 56:sc= 0.335 USER MOD Set 2.2: A 80 TYR OH : rot 0:sc= -0.826 USER MOD Set 2.3: A 89 GLN : amide:sc= -1.91 X(o=-2.4,f=-2.6!) USER MOD Set 3.1: A 45 CYS SG : rot 134:sc= -2.48 USER MOD Set 3.2: A 69 CYS SG : rot 140:sc= -0.914 USER MOD Single : A 10 MET CE :methyl -113:sc= -1.88 (180deg=-4.9!) USER MOD Single : A 20 TYR OH : rot 150:sc= 0 USER MOD Single : A 21 CYS SG : rot 170:sc= -0.637 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 GLN : amide:sc= -1.7 K(o=-1.7,f=-1.1) USER MOD Single : A 31 MET CE :methyl -152:sc= -0.987 (180deg=-2.48!) USER MOD Single : A 34 GLN : amide:sc= -0.176 X(o=-0.18,f=0) USER MOD Single : A 37 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= -0.326 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 MET CE :methyl -167:sc= -1.62 (180deg=-2.28!) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 82 GLN : amide:sc= -1.61 K(o=-1.6,f=-2.5!) USER MOD Single : A 83 SER OG : rot 141:sc= -0.974 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 SER OG : rot -40:sc= 0.996 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 101 HIS : no HD1:sc= -2.06 X(o=-2.1,f=-2!) USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.108) USER MOD Single : A 109 LYS NZ :NH3+ -155:sc= -0.798 (180deg=-1.51) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= -0.0118 (180deg=-0.0118) USER MOD Single : A 113 MET CE :methyl -104:sc= -3.75 (180deg=-10.7!) USER MOD Single : A 114 LYS NZ :NH3+ 149:sc= -1.31 (180deg=-1.74) USER MOD Single : A 115 LYS NZ :NH3+ -157:sc= -1.9! (180deg=-2.99!) USER MOD Single : A 119 SER OG : rot 180:sc= 0.0433 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 CYS SG : rot 180:sc= -0.244 USER MOD Single : A 129 TYR OH : rot -41:sc= 0.279 USER MOD Single : A 130 THR OG1 : rot 180:sc= -0.135 USER MOD Single : A 131 ASN : amide:sc= 0 X(o=0,f=-0.052) USER MOD Single : A 133 CYS SG : rot 180:sc= 0 USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 135 LYS NZ :NH3+ -165:sc= -0.825 (180deg=-1.43) USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 140 THR OG1 : rot 180:sc= 0 USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 147 SER OG : rot -18:sc= 0.101 USER MOD ----------------------------------------------------------------- ATOM 19 N MET A 10 -7.406 -11.435 -12.761 1.00 0.00 N ATOM 20 CA MET A 10 -6.972 -11.444 -11.368 1.00 0.00 C ATOM 21 C MET A 10 -6.031 -12.615 -11.099 1.00 0.00 C ATOM 22 O MET A 10 -6.466 -13.693 -10.694 1.00 0.00 O ATOM 23 CB MET A 10 -8.185 -11.524 -10.438 1.00 0.00 C ATOM 24 CG MET A 10 -7.824 -11.476 -8.962 1.00 0.00 C ATOM 25 SD MET A 10 -9.232 -11.827 -7.891 1.00 0.00 S ATOM 26 CE MET A 10 -9.852 -10.174 -7.594 1.00 0.00 C ATOM 0 HA MET A 10 -6.433 -10.517 -11.173 1.00 0.00 H new ATOM 0 HB2 MET A 10 -8.861 -10.700 -10.665 1.00 0.00 H new ATOM 0 HB3 MET A 10 -8.728 -12.447 -10.641 1.00 0.00 H new ATOM 0 HG2 MET A 10 -7.032 -12.197 -8.762 1.00 0.00 H new ATOM 0 HG3 MET A 10 -7.426 -10.490 -8.721 1.00 0.00 H new ATOM 0 HE1 MET A 10 -9.711 -9.916 -6.544 1.00 0.00 H new ATOM 0 HE2 MET A 10 -9.309 -9.464 -8.218 1.00 0.00 H new ATOM 0 HE3 MET A 10 -10.914 -10.134 -7.838 1.00 0.00 H new ATOM 36 N PRO A 11 -4.719 -12.417 -11.323 1.00 0.00 N ATOM 37 CA PRO A 11 -3.713 -13.462 -11.103 1.00 0.00 C ATOM 38 C PRO A 11 -3.855 -14.129 -9.739 1.00 0.00 C ATOM 39 O PRO A 11 -4.629 -13.680 -8.895 1.00 0.00 O ATOM 40 CB PRO A 11 -2.390 -12.701 -11.193 1.00 0.00 C ATOM 41 CG PRO A 11 -2.683 -11.538 -12.076 1.00 0.00 C ATOM 42 CD PRO A 11 -4.115 -11.161 -11.808 1.00 0.00 C ATOM 0 HA PRO A 11 -3.804 -14.274 -11.824 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -2.052 -12.376 -10.209 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -1.601 -13.326 -11.610 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -2.014 -10.706 -11.859 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -2.538 -11.798 -13.124 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -4.188 -10.367 -11.064 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -4.610 -10.800 -12.709 1.00 0.00 H new ATOM 50 N GLU A 12 -3.100 -15.202 -9.531 1.00 0.00 N ATOM 51 CA GLU A 12 -3.142 -15.931 -8.269 1.00 0.00 C ATOM 52 C GLU A 12 -2.095 -15.399 -7.297 1.00 0.00 C ATOM 53 O GLU A 12 -2.304 -15.394 -6.084 1.00 0.00 O ATOM 54 CB GLU A 12 -2.917 -17.425 -8.511 1.00 0.00 C ATOM 55 CG GLU A 12 -3.786 -17.999 -9.618 1.00 0.00 C ATOM 56 CD GLU A 12 -3.209 -19.267 -10.216 1.00 0.00 C ATOM 57 OE1 GLU A 12 -1.975 -19.450 -10.142 1.00 0.00 O ATOM 58 OE2 GLU A 12 -3.988 -20.077 -10.758 1.00 0.00 O ATOM 0 H GLU A 12 -2.452 -15.586 -10.219 1.00 0.00 H new ATOM 0 HA GLU A 12 -4.128 -15.785 -7.828 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -1.869 -17.590 -8.760 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -3.114 -17.968 -7.587 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -4.780 -18.208 -9.223 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -3.906 -17.253 -10.404 1.00 0.00 H new ATOM 65 N ARG A 13 -0.967 -14.949 -7.838 1.00 0.00 N ATOM 66 CA ARG A 13 0.114 -14.414 -7.015 1.00 0.00 C ATOM 67 C ARG A 13 0.309 -12.924 -7.275 1.00 0.00 C ATOM 68 O ARG A 13 0.538 -12.505 -8.409 1.00 0.00 O ATOM 69 CB ARG A 13 1.416 -15.166 -7.291 1.00 0.00 C ATOM 70 CG ARG A 13 1.242 -16.674 -7.381 1.00 0.00 C ATOM 71 CD ARG A 13 1.102 -17.133 -8.824 1.00 0.00 C ATOM 72 NE ARG A 13 2.319 -17.778 -9.312 1.00 0.00 N ATOM 73 CZ ARG A 13 2.607 -17.941 -10.602 1.00 0.00 C ATOM 74 NH1 ARG A 13 1.768 -17.509 -11.536 1.00 0.00 N ATOM 75 NH2 ARG A 13 3.736 -18.536 -10.959 1.00 0.00 N ATOM 0 H ARG A 13 -0.777 -14.944 -8.840 1.00 0.00 H new ATOM 0 HA ARG A 13 -0.160 -14.550 -5.969 1.00 0.00 H new ATOM 0 HB2 ARG A 13 1.845 -14.802 -8.225 1.00 0.00 H new ATOM 0 HB3 ARG A 13 2.132 -14.938 -6.501 1.00 0.00 H new ATOM 0 HG2 ARG A 13 2.098 -17.168 -6.922 1.00 0.00 H new ATOM 0 HG3 ARG A 13 0.360 -16.974 -6.815 1.00 0.00 H new ATOM 0 HD2 ARG A 13 0.266 -17.828 -8.904 1.00 0.00 H new ATOM 0 HD3 ARG A 13 0.867 -16.277 -9.456 1.00 0.00 H new ATOM 0 HE ARG A 13 2.988 -18.124 -8.624 1.00 0.00 H new ATOM 0 HH11 ARG A 13 0.898 -17.050 -11.267 1.00 0.00 H new ATOM 0 HH12 ARG A 13 1.994 -17.636 -12.523 1.00 0.00 H new ATOM 0 HH21 ARG A 13 4.385 -18.869 -10.246 1.00 0.00 H new ATOM 0 HH22 ARG A 13 3.956 -18.661 -11.947 1.00 0.00 H new ATOM 89 N PHE A 14 0.220 -12.128 -6.215 1.00 0.00 N ATOM 90 CA PHE A 14 0.389 -10.683 -6.324 1.00 0.00 C ATOM 91 C PHE A 14 1.588 -10.216 -5.509 1.00 0.00 C ATOM 92 O PHE A 14 2.201 -11.000 -4.784 1.00 0.00 O ATOM 93 CB PHE A 14 -0.876 -9.963 -5.857 1.00 0.00 C ATOM 94 CG PHE A 14 -2.108 -10.354 -6.621 1.00 0.00 C ATOM 95 CD1 PHE A 14 -2.874 -11.436 -6.221 1.00 0.00 C ATOM 96 CD2 PHE A 14 -2.498 -9.640 -7.744 1.00 0.00 C ATOM 97 CE1 PHE A 14 -4.007 -11.798 -6.924 1.00 0.00 C ATOM 98 CE2 PHE A 14 -3.629 -9.998 -8.450 1.00 0.00 C ATOM 99 CZ PHE A 14 -4.386 -11.079 -8.040 1.00 0.00 C ATOM 0 H PHE A 14 0.031 -12.459 -5.269 1.00 0.00 H new ATOM 0 HA PHE A 14 0.568 -10.439 -7.371 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -1.033 -10.172 -4.799 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -0.727 -8.887 -5.950 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -2.582 -12.003 -5.350 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -1.910 -8.794 -8.070 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -4.596 -12.643 -6.601 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -3.922 -9.433 -9.323 1.00 0.00 H new ATOM 0 HZ PHE A 14 -5.271 -11.360 -8.591 1.00 0.00 H new ATOM 109 N ASP A 15 1.920 -8.936 -5.631 1.00 0.00 N ATOM 110 CA ASP A 15 3.049 -8.370 -4.903 1.00 0.00 C ATOM 111 C ASP A 15 2.582 -7.618 -3.662 1.00 0.00 C ATOM 112 O ASP A 15 2.968 -7.954 -2.543 1.00 0.00 O ATOM 113 CB ASP A 15 3.852 -7.434 -5.806 1.00 0.00 C ATOM 114 CG ASP A 15 4.897 -8.173 -6.620 1.00 0.00 C ATOM 115 OD1 ASP A 15 4.588 -9.273 -7.125 1.00 0.00 O ATOM 116 OD2 ASP A 15 6.024 -7.652 -6.753 1.00 0.00 O ATOM 0 H ASP A 15 1.425 -8.272 -6.226 1.00 0.00 H new ATOM 0 HA ASP A 15 3.687 -9.195 -4.586 1.00 0.00 H new ATOM 0 HB2 ASP A 15 3.173 -6.912 -6.480 1.00 0.00 H new ATOM 0 HB3 ASP A 15 4.341 -6.675 -5.195 1.00 0.00 H new ATOM 121 N ALA A 16 1.754 -6.597 -3.862 1.00 0.00 N ATOM 122 CA ALA A 16 1.251 -5.806 -2.746 1.00 0.00 C ATOM 123 C ALA A 16 -0.156 -5.280 -3.010 1.00 0.00 C ATOM 124 O ALA A 16 -0.710 -5.462 -4.095 1.00 0.00 O ATOM 125 CB ALA A 16 2.197 -4.652 -2.451 1.00 0.00 C ATOM 0 H ALA A 16 1.420 -6.300 -4.779 1.00 0.00 H new ATOM 0 HA ALA A 16 1.199 -6.461 -1.876 1.00 0.00 H new ATOM 0 HB1 ALA A 16 1.810 -4.069 -1.615 1.00 0.00 H new ATOM 0 HB2 ALA A 16 3.181 -5.045 -2.195 1.00 0.00 H new ATOM 0 HB3 ALA A 16 2.279 -4.014 -3.331 1.00 0.00 H new ATOM 131 N PHE A 17 -0.731 -4.624 -2.005 1.00 0.00 N ATOM 132 CA PHE A 17 -2.075 -4.067 -2.120 1.00 0.00 C ATOM 133 C PHE A 17 -2.082 -2.581 -1.770 1.00 0.00 C ATOM 134 O PHE A 17 -1.232 -2.109 -1.016 1.00 0.00 O ATOM 135 CB PHE A 17 -3.040 -4.829 -1.206 1.00 0.00 C ATOM 136 CG PHE A 17 -4.444 -4.295 -1.226 1.00 0.00 C ATOM 137 CD1 PHE A 17 -4.791 -3.192 -0.463 1.00 0.00 C ATOM 138 CD2 PHE A 17 -5.416 -4.899 -2.006 1.00 0.00 C ATOM 139 CE1 PHE A 17 -6.083 -2.702 -0.477 1.00 0.00 C ATOM 140 CE2 PHE A 17 -6.710 -4.412 -2.026 1.00 0.00 C ATOM 141 CZ PHE A 17 -7.044 -3.312 -1.259 1.00 0.00 C ATOM 0 H PHE A 17 -0.286 -4.465 -1.101 1.00 0.00 H new ATOM 0 HA PHE A 17 -2.402 -4.175 -3.154 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -3.056 -5.877 -1.504 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -2.662 -4.793 -0.184 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -4.044 -2.710 0.150 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -5.160 -5.760 -2.605 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -6.341 -1.842 0.123 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -7.459 -4.891 -2.640 1.00 0.00 H new ATOM 0 HZ PHE A 17 -8.054 -2.930 -1.271 1.00 0.00 H new ATOM 151 N ILE A 18 -3.044 -1.847 -2.324 1.00 0.00 N ATOM 152 CA ILE A 18 -3.156 -0.415 -2.069 1.00 0.00 C ATOM 153 C ILE A 18 -4.367 -0.104 -1.193 1.00 0.00 C ATOM 154 O ILE A 18 -5.510 -0.298 -1.608 1.00 0.00 O ATOM 155 CB ILE A 18 -3.270 0.386 -3.383 1.00 0.00 C ATOM 156 CG1 ILE A 18 -2.122 0.023 -4.325 1.00 0.00 C ATOM 157 CG2 ILE A 18 -3.279 1.883 -3.097 1.00 0.00 C ATOM 158 CD1 ILE A 18 -0.758 0.398 -3.787 1.00 0.00 C ATOM 0 H ILE A 18 -3.756 -2.221 -2.952 1.00 0.00 H new ATOM 0 HA ILE A 18 -2.246 -0.117 -1.548 1.00 0.00 H new ATOM 0 HB ILE A 18 -4.211 0.127 -3.869 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -2.146 -1.050 -4.517 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -2.276 0.522 -5.282 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -3.360 2.432 -4.035 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -4.129 2.127 -2.459 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -2.355 2.162 -2.592 1.00 0.00 H new ATOM 0 HD11 ILE A 18 0.009 0.111 -4.507 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -0.716 1.474 -3.621 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -0.583 -0.121 -2.845 1.00 0.00 H new ATOM 170 N CYS A 19 -4.110 0.378 0.021 1.00 0.00 N ATOM 171 CA CYS A 19 -5.184 0.710 0.953 1.00 0.00 C ATOM 172 C CYS A 19 -5.376 2.221 1.070 1.00 0.00 C ATOM 173 O CYS A 19 -4.671 2.891 1.827 1.00 0.00 O ATOM 174 CB CYS A 19 -4.888 0.112 2.331 1.00 0.00 C ATOM 175 SG CYS A 19 -5.966 -1.267 2.783 1.00 0.00 S ATOM 0 H CYS A 19 -3.171 0.547 0.381 1.00 0.00 H new ATOM 0 HA CYS A 19 -6.108 0.283 0.564 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -3.853 -0.228 2.353 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -4.983 0.895 3.083 1.00 0.00 H new ATOM 0 HG CYS A 19 -5.902 -2.186 1.866 1.00 0.00 H new ATOM 181 N TYR A 20 -6.343 2.752 0.322 1.00 0.00 N ATOM 182 CA TYR A 20 -6.638 4.182 0.348 1.00 0.00 C ATOM 183 C TYR A 20 -8.133 4.432 0.154 1.00 0.00 C ATOM 184 O TYR A 20 -8.881 3.524 -0.208 1.00 0.00 O ATOM 185 CB TYR A 20 -5.836 4.913 -0.732 1.00 0.00 C ATOM 186 CG TYR A 20 -5.756 6.412 -0.527 1.00 0.00 C ATOM 187 CD1 TYR A 20 -5.589 6.959 0.741 1.00 0.00 C ATOM 188 CD2 TYR A 20 -5.847 7.280 -1.606 1.00 0.00 C ATOM 189 CE1 TYR A 20 -5.515 8.326 0.925 1.00 0.00 C ATOM 190 CE2 TYR A 20 -5.774 8.649 -1.431 1.00 0.00 C ATOM 191 CZ TYR A 20 -5.607 9.167 -0.164 1.00 0.00 C ATOM 192 OH TYR A 20 -5.535 10.530 0.015 1.00 0.00 O ATOM 0 H TYR A 20 -6.935 2.212 -0.309 1.00 0.00 H new ATOM 0 HA TYR A 20 -6.348 4.570 1.324 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -4.825 4.505 -0.759 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -6.287 4.712 -1.704 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -5.516 6.304 1.596 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -5.977 6.879 -2.600 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -5.386 8.734 1.917 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -5.847 9.310 -2.282 1.00 0.00 H new ATOM 0 HH TYR A 20 -5.146 10.945 -0.783 1.00 0.00 H new ATOM 202 N CYS A 21 -8.562 5.668 0.398 1.00 0.00 N ATOM 203 CA CYS A 21 -9.969 6.038 0.252 1.00 0.00 C ATOM 204 C CYS A 21 -10.277 6.491 -1.175 1.00 0.00 C ATOM 205 O CYS A 21 -9.399 6.981 -1.882 1.00 0.00 O ATOM 206 CB CYS A 21 -10.340 7.147 1.239 1.00 0.00 C ATOM 207 SG CYS A 21 -9.231 8.575 1.205 1.00 0.00 S ATOM 0 H CYS A 21 -7.956 6.431 0.698 1.00 0.00 H new ATOM 0 HA CYS A 21 -10.566 5.153 0.470 1.00 0.00 H new ATOM 0 HB2 CYS A 21 -11.354 7.484 1.024 1.00 0.00 H new ATOM 0 HB3 CYS A 21 -10.349 6.732 2.247 1.00 0.00 H new ATOM 0 HG CYS A 21 -9.743 9.539 1.912 1.00 0.00 H new ATOM 213 N PRO A 22 -11.540 6.325 -1.617 1.00 0.00 N ATOM 214 CA PRO A 22 -11.972 6.711 -2.965 1.00 0.00 C ATOM 215 C PRO A 22 -12.100 8.226 -3.145 1.00 0.00 C ATOM 216 O PRO A 22 -12.506 8.696 -4.208 1.00 0.00 O ATOM 217 CB PRO A 22 -13.349 6.042 -3.120 1.00 0.00 C ATOM 218 CG PRO A 22 -13.516 5.164 -1.922 1.00 0.00 C ATOM 219 CD PRO A 22 -12.647 5.746 -0.848 1.00 0.00 C ATOM 0 HA PRO A 22 -11.242 6.400 -3.712 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -14.142 6.788 -3.171 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -13.399 5.460 -4.040 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -14.558 5.134 -1.605 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -13.222 4.139 -2.147 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -13.174 6.500 -0.264 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -12.301 4.985 -0.148 1.00 0.00 H new ATOM 227 N SER A 23 -11.754 8.990 -2.111 1.00 0.00 N ATOM 228 CA SER A 23 -11.835 10.443 -2.177 1.00 0.00 C ATOM 229 C SER A 23 -10.744 10.983 -3.087 1.00 0.00 C ATOM 230 O SER A 23 -11.004 11.798 -3.974 1.00 0.00 O ATOM 231 CB SER A 23 -11.703 11.052 -0.781 1.00 0.00 C ATOM 232 OG SER A 23 -12.973 11.216 -0.172 1.00 0.00 O ATOM 0 H SER A 23 -11.416 8.626 -1.220 1.00 0.00 H new ATOM 0 HA SER A 23 -12.808 10.719 -2.584 1.00 0.00 H new ATOM 0 HB2 SER A 23 -11.078 10.411 -0.159 1.00 0.00 H new ATOM 0 HB3 SER A 23 -11.201 12.017 -0.848 1.00 0.00 H new ATOM 0 HG SER A 23 -12.860 11.605 0.720 1.00 0.00 H new ATOM 238 N ASP A 24 -9.523 10.513 -2.869 1.00 0.00 N ATOM 239 CA ASP A 24 -8.391 10.936 -3.676 1.00 0.00 C ATOM 240 C ASP A 24 -7.616 9.726 -4.188 1.00 0.00 C ATOM 241 O ASP A 24 -6.400 9.786 -4.376 1.00 0.00 O ATOM 242 CB ASP A 24 -7.469 11.850 -2.868 1.00 0.00 C ATOM 243 CG ASP A 24 -6.541 12.662 -3.751 1.00 0.00 C ATOM 244 OD1 ASP A 24 -6.989 13.112 -4.827 1.00 0.00 O ATOM 245 OD2 ASP A 24 -5.367 12.847 -3.367 1.00 0.00 O ATOM 0 H ASP A 24 -9.293 9.838 -2.139 1.00 0.00 H new ATOM 0 HA ASP A 24 -8.771 11.493 -4.532 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -8.072 12.526 -2.261 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -6.876 11.247 -2.180 1.00 0.00 H new ATOM 250 N ILE A 25 -8.332 8.628 -4.408 1.00 0.00 N ATOM 251 CA ILE A 25 -7.723 7.396 -4.893 1.00 0.00 C ATOM 252 C ILE A 25 -7.120 7.580 -6.284 1.00 0.00 C ATOM 253 O ILE A 25 -6.040 7.064 -6.575 1.00 0.00 O ATOM 254 CB ILE A 25 -8.753 6.246 -4.921 1.00 0.00 C ATOM 255 CG1 ILE A 25 -8.041 4.892 -4.967 1.00 0.00 C ATOM 256 CG2 ILE A 25 -9.706 6.399 -6.101 1.00 0.00 C ATOM 257 CD1 ILE A 25 -7.336 4.613 -6.276 1.00 0.00 C ATOM 0 H ILE A 25 -9.339 8.567 -4.257 1.00 0.00 H new ATOM 0 HA ILE A 25 -6.921 7.139 -4.200 1.00 0.00 H new ATOM 0 HB ILE A 25 -9.343 6.292 -4.006 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -7.313 4.848 -4.157 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -8.770 4.103 -4.783 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -10.422 5.577 -6.099 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -10.240 7.346 -6.017 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -9.138 6.384 -7.031 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -6.856 3.635 -6.230 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -8.062 4.623 -7.089 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -6.582 5.379 -6.454 1.00 0.00 H new ATOM 269 N GLN A 26 -7.826 8.317 -7.139 1.00 0.00 N ATOM 270 CA GLN A 26 -7.365 8.570 -8.503 1.00 0.00 C ATOM 271 C GLN A 26 -5.883 8.929 -8.531 1.00 0.00 C ATOM 272 O GLN A 26 -5.130 8.449 -9.379 1.00 0.00 O ATOM 273 CB GLN A 26 -8.185 9.697 -9.137 1.00 0.00 C ATOM 274 CG GLN A 26 -9.561 9.256 -9.610 1.00 0.00 C ATOM 275 CD GLN A 26 -10.124 10.161 -10.688 1.00 0.00 C ATOM 276 OE1 GLN A 26 -10.178 11.380 -10.528 1.00 0.00 O ATOM 277 NE2 GLN A 26 -10.550 9.565 -11.796 1.00 0.00 N ATOM 0 H GLN A 26 -8.721 8.750 -6.911 1.00 0.00 H new ATOM 0 HA GLN A 26 -7.504 7.654 -9.077 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -8.300 10.503 -8.413 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -7.633 10.105 -9.983 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -9.501 8.237 -9.991 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -10.245 9.239 -8.761 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -10.486 8.551 -11.886 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -10.941 10.121 -12.556 1.00 0.00 H new ATOM 286 N PHE A 27 -5.473 9.772 -7.593 1.00 0.00 N ATOM 287 CA PHE A 27 -4.081 10.198 -7.500 1.00 0.00 C ATOM 288 C PHE A 27 -3.167 9.010 -7.222 1.00 0.00 C ATOM 289 O PHE A 27 -2.218 8.754 -7.966 1.00 0.00 O ATOM 290 CB PHE A 27 -3.920 11.249 -6.402 1.00 0.00 C ATOM 291 CG PHE A 27 -2.613 11.988 -6.462 1.00 0.00 C ATOM 292 CD1 PHE A 27 -2.345 12.862 -7.503 1.00 0.00 C ATOM 293 CD2 PHE A 27 -1.652 11.805 -5.481 1.00 0.00 C ATOM 294 CE1 PHE A 27 -1.143 13.543 -7.562 1.00 0.00 C ATOM 295 CE2 PHE A 27 -0.449 12.483 -5.535 1.00 0.00 C ATOM 296 CZ PHE A 27 -0.195 13.354 -6.577 1.00 0.00 C ATOM 0 H PHE A 27 -6.085 10.176 -6.884 1.00 0.00 H new ATOM 0 HA PHE A 27 -3.796 10.636 -8.456 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -4.737 11.967 -6.475 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -4.009 10.763 -5.430 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -3.083 13.013 -8.277 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -1.845 11.125 -4.665 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -0.946 14.222 -8.378 1.00 0.00 H new ATOM 0 HE2 PHE A 27 0.292 12.332 -4.764 1.00 0.00 H new ATOM 0 HZ PHE A 27 0.744 13.886 -6.621 1.00 0.00 H new ATOM 306 N VAL A 28 -3.459 8.286 -6.146 1.00 0.00 N ATOM 307 CA VAL A 28 -2.665 7.125 -5.767 1.00 0.00 C ATOM 308 C VAL A 28 -2.572 6.120 -6.911 1.00 0.00 C ATOM 309 O VAL A 28 -1.477 5.776 -7.356 1.00 0.00 O ATOM 310 CB VAL A 28 -3.251 6.425 -4.527 1.00 0.00 C ATOM 311 CG1 VAL A 28 -2.338 5.300 -4.062 1.00 0.00 C ATOM 312 CG2 VAL A 28 -3.478 7.429 -3.408 1.00 0.00 C ATOM 0 H VAL A 28 -4.241 8.484 -5.521 1.00 0.00 H new ATOM 0 HA VAL A 28 -1.666 7.491 -5.530 1.00 0.00 H new ATOM 0 HB VAL A 28 -4.213 5.991 -4.800 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -2.771 4.819 -3.185 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -2.228 4.567 -4.861 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -1.360 5.707 -3.807 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -3.892 6.918 -2.539 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -2.530 7.893 -3.138 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -4.175 8.197 -3.744 1.00 0.00 H new ATOM 322 N GLN A 29 -3.724 5.651 -7.386 1.00 0.00 N ATOM 323 CA GLN A 29 -3.768 4.686 -8.475 1.00 0.00 C ATOM 324 C GLN A 29 -2.863 5.117 -9.624 1.00 0.00 C ATOM 325 O GLN A 29 -2.242 4.284 -10.282 1.00 0.00 O ATOM 326 CB GLN A 29 -5.203 4.517 -8.971 1.00 0.00 C ATOM 327 CG GLN A 29 -5.812 5.790 -9.530 1.00 0.00 C ATOM 328 CD GLN A 29 -7.010 5.521 -10.421 1.00 0.00 C ATOM 329 OE1 GLN A 29 -6.862 5.269 -11.618 1.00 0.00 O ATOM 330 NE2 GLN A 29 -8.203 5.571 -9.842 1.00 0.00 N ATOM 0 H GLN A 29 -4.640 5.926 -7.031 1.00 0.00 H new ATOM 0 HA GLN A 29 -3.407 3.730 -8.097 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -5.223 3.747 -9.742 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -5.822 4.160 -8.148 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -6.115 6.436 -8.706 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -5.055 6.331 -10.098 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -8.279 5.783 -8.847 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -9.044 5.397 -10.392 1.00 0.00 H new ATOM 339 N GLU A 30 -2.781 6.423 -9.851 1.00 0.00 N ATOM 340 CA GLU A 30 -1.936 6.956 -10.910 1.00 0.00 C ATOM 341 C GLU A 30 -0.474 6.648 -10.613 1.00 0.00 C ATOM 342 O GLU A 30 0.291 6.264 -11.499 1.00 0.00 O ATOM 343 CB GLU A 30 -2.136 8.468 -11.046 1.00 0.00 C ATOM 344 CG GLU A 30 -1.805 9.004 -12.429 1.00 0.00 C ATOM 345 CD GLU A 30 -2.750 8.487 -13.496 1.00 0.00 C ATOM 346 OE1 GLU A 30 -3.860 8.038 -13.139 1.00 0.00 O ATOM 347 OE2 GLU A 30 -2.382 8.531 -14.689 1.00 0.00 O ATOM 0 H GLU A 30 -3.288 7.129 -9.317 1.00 0.00 H new ATOM 0 HA GLU A 30 -2.217 6.483 -11.851 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -3.172 8.712 -10.809 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -1.513 8.976 -10.310 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -1.844 10.093 -12.411 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -0.783 8.725 -12.688 1.00 0.00 H new ATOM 354 N MET A 31 -0.099 6.809 -9.348 1.00 0.00 N ATOM 355 CA MET A 31 1.263 6.539 -8.910 1.00 0.00 C ATOM 356 C MET A 31 1.548 5.039 -8.940 1.00 0.00 C ATOM 357 O MET A 31 2.591 4.604 -9.424 1.00 0.00 O ATOM 358 CB MET A 31 1.475 7.087 -7.496 1.00 0.00 C ATOM 359 CG MET A 31 2.833 6.751 -6.899 1.00 0.00 C ATOM 360 SD MET A 31 2.721 5.628 -5.491 1.00 0.00 S ATOM 361 CE MET A 31 1.407 6.392 -4.541 1.00 0.00 C ATOM 0 H MET A 31 -0.723 7.127 -8.607 1.00 0.00 H new ATOM 0 HA MET A 31 1.953 7.035 -9.592 1.00 0.00 H new ATOM 0 HB2 MET A 31 1.356 8.170 -7.516 1.00 0.00 H new ATOM 0 HB3 MET A 31 0.695 6.693 -6.844 1.00 0.00 H new ATOM 0 HG2 MET A 31 3.461 6.301 -7.668 1.00 0.00 H new ATOM 0 HG3 MET A 31 3.324 7.672 -6.585 1.00 0.00 H new ATOM 0 HE1 MET A 31 1.540 6.160 -3.484 1.00 0.00 H new ATOM 0 HE2 MET A 31 1.437 7.472 -4.682 1.00 0.00 H new ATOM 0 HE3 MET A 31 0.444 6.008 -4.878 1.00 0.00 H new ATOM 371 N ILE A 32 0.606 4.255 -8.422 1.00 0.00 N ATOM 372 CA ILE A 32 0.751 2.805 -8.391 1.00 0.00 C ATOM 373 C ILE A 32 0.815 2.230 -9.802 1.00 0.00 C ATOM 374 O ILE A 32 1.782 1.560 -10.165 1.00 0.00 O ATOM 375 CB ILE A 32 -0.410 2.135 -7.631 1.00 0.00 C ATOM 376 CG1 ILE A 32 -0.657 2.836 -6.291 1.00 0.00 C ATOM 377 CG2 ILE A 32 -0.118 0.657 -7.413 1.00 0.00 C ATOM 378 CD1 ILE A 32 0.591 3.003 -5.450 1.00 0.00 C ATOM 0 H ILE A 32 -0.265 4.601 -8.019 1.00 0.00 H new ATOM 0 HA ILE A 32 1.685 2.594 -7.869 1.00 0.00 H new ATOM 0 HB ILE A 32 -1.313 2.226 -8.235 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -1.091 3.818 -6.480 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -1.393 2.266 -5.724 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -0.947 0.198 -6.875 1.00 0.00 H new ATOM 0 HG22 ILE A 32 0.006 0.164 -8.377 1.00 0.00 H new ATOM 0 HG23 ILE A 32 0.797 0.549 -6.830 1.00 0.00 H new ATOM 0 HD11 ILE A 32 0.337 3.507 -4.518 1.00 0.00 H new ATOM 0 HD12 ILE A 32 1.015 2.023 -5.229 1.00 0.00 H new ATOM 0 HD13 ILE A 32 1.321 3.599 -5.997 1.00 0.00 H new ATOM 390 N ARG A 33 -0.219 2.497 -10.594 1.00 0.00 N ATOM 391 CA ARG A 33 -0.279 2.010 -11.964 1.00 0.00 C ATOM 392 C ARG A 33 0.967 2.419 -12.741 1.00 0.00 C ATOM 393 O ARG A 33 1.425 1.698 -13.626 1.00 0.00 O ATOM 394 CB ARG A 33 -1.535 2.544 -12.654 1.00 0.00 C ATOM 395 CG ARG A 33 -1.503 4.041 -12.917 1.00 0.00 C ATOM 396 CD ARG A 33 -1.018 4.351 -14.324 1.00 0.00 C ATOM 397 NE ARG A 33 -1.980 3.932 -15.342 1.00 0.00 N ATOM 398 CZ ARG A 33 -3.064 4.633 -15.670 1.00 0.00 C ATOM 399 NH1 ARG A 33 -3.332 5.781 -15.060 1.00 0.00 N ATOM 400 NH2 ARG A 33 -3.883 4.184 -16.611 1.00 0.00 N ATOM 0 H ARG A 33 -1.027 3.049 -10.308 1.00 0.00 H new ATOM 0 HA ARG A 33 -0.322 0.921 -11.942 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -1.668 2.021 -13.601 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -2.403 2.312 -12.037 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -2.500 4.457 -12.775 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -0.849 4.525 -12.191 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -0.836 5.422 -14.417 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -0.066 3.850 -14.497 1.00 0.00 H new ATOM 0 HE ARG A 33 -1.811 3.052 -15.829 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -2.706 6.132 -14.335 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -4.164 6.313 -15.316 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -3.683 3.302 -17.083 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -4.713 4.720 -16.863 1.00 0.00 H new ATOM 414 N GLN A 34 1.519 3.579 -12.395 1.00 0.00 N ATOM 415 CA GLN A 34 2.719 4.082 -13.051 1.00 0.00 C ATOM 416 C GLN A 34 3.957 3.359 -12.530 1.00 0.00 C ATOM 417 O GLN A 34 4.996 3.331 -13.189 1.00 0.00 O ATOM 418 CB GLN A 34 2.858 5.588 -12.820 1.00 0.00 C ATOM 419 CG GLN A 34 4.006 6.218 -13.593 1.00 0.00 C ATOM 420 CD GLN A 34 4.389 7.584 -13.059 1.00 0.00 C ATOM 421 OE1 GLN A 34 5.569 7.913 -12.953 1.00 0.00 O ATOM 422 NE2 GLN A 34 3.388 8.388 -12.718 1.00 0.00 N ATOM 0 H GLN A 34 1.153 4.188 -11.663 1.00 0.00 H new ATOM 0 HA GLN A 34 2.629 3.895 -14.121 1.00 0.00 H new ATOM 0 HB2 GLN A 34 1.927 6.078 -13.104 1.00 0.00 H new ATOM 0 HB3 GLN A 34 3.003 5.772 -11.756 1.00 0.00 H new ATOM 0 HG2 GLN A 34 4.873 5.559 -13.550 1.00 0.00 H new ATOM 0 HG3 GLN A 34 3.726 6.308 -14.643 1.00 0.00 H new ATOM 0 HE21 GLN A 34 2.423 8.074 -12.823 1.00 0.00 H new ATOM 0 HE22 GLN A 34 3.584 9.319 -12.352 1.00 0.00 H new ATOM 431 N LEU A 35 3.838 2.779 -11.339 1.00 0.00 N ATOM 432 CA LEU A 35 4.942 2.061 -10.722 1.00 0.00 C ATOM 433 C LEU A 35 5.024 0.624 -11.235 1.00 0.00 C ATOM 434 O LEU A 35 6.114 0.078 -11.403 1.00 0.00 O ATOM 435 CB LEU A 35 4.776 2.056 -9.202 1.00 0.00 C ATOM 436 CG LEU A 35 5.188 3.351 -8.499 1.00 0.00 C ATOM 437 CD1 LEU A 35 4.698 3.357 -7.060 1.00 0.00 C ATOM 438 CD2 LEU A 35 6.697 3.526 -8.551 1.00 0.00 C ATOM 0 H LEU A 35 2.983 2.794 -10.782 1.00 0.00 H new ATOM 0 HA LEU A 35 5.867 2.572 -10.988 1.00 0.00 H new ATOM 0 HB2 LEU A 35 3.732 1.850 -8.967 1.00 0.00 H new ATOM 0 HB3 LEU A 35 5.363 1.235 -8.791 1.00 0.00 H new ATOM 0 HG LEU A 35 4.726 4.189 -9.021 1.00 0.00 H new ATOM 0 HD11 LEU A 35 5.001 4.286 -6.576 1.00 0.00 H new ATOM 0 HD12 LEU A 35 3.611 3.278 -7.045 1.00 0.00 H new ATOM 0 HD13 LEU A 35 5.131 2.512 -6.525 1.00 0.00 H new ATOM 0 HD21 LEU A 35 6.974 4.452 -8.047 1.00 0.00 H new ATOM 0 HD22 LEU A 35 7.178 2.684 -8.053 1.00 0.00 H new ATOM 0 HD23 LEU A 35 7.023 3.568 -9.590 1.00 0.00 H new ATOM 450 N GLU A 36 3.867 0.013 -11.468 1.00 0.00 N ATOM 451 CA GLU A 36 3.812 -1.365 -11.947 1.00 0.00 C ATOM 452 C GLU A 36 4.089 -1.450 -13.445 1.00 0.00 C ATOM 453 O GLU A 36 4.738 -2.387 -13.910 1.00 0.00 O ATOM 454 CB GLU A 36 2.450 -1.988 -11.630 1.00 0.00 C ATOM 455 CG GLU A 36 1.270 -1.108 -12.009 1.00 0.00 C ATOM 456 CD GLU A 36 0.276 -1.819 -12.906 1.00 0.00 C ATOM 457 OE1 GLU A 36 0.710 -2.635 -13.745 1.00 0.00 O ATOM 458 OE2 GLU A 36 -0.938 -1.558 -12.767 1.00 0.00 O ATOM 0 H GLU A 36 2.955 0.449 -11.333 1.00 0.00 H new ATOM 0 HA GLU A 36 4.591 -1.924 -11.428 1.00 0.00 H new ATOM 0 HB2 GLU A 36 2.365 -2.940 -12.155 1.00 0.00 H new ATOM 0 HB3 GLU A 36 2.400 -2.207 -10.563 1.00 0.00 H new ATOM 0 HG2 GLU A 36 0.763 -0.776 -11.103 1.00 0.00 H new ATOM 0 HG3 GLU A 36 1.636 -0.214 -12.515 1.00 0.00 H new ATOM 465 N GLN A 37 3.589 -0.478 -14.196 1.00 0.00 N ATOM 466 CA GLN A 37 3.780 -0.453 -15.636 1.00 0.00 C ATOM 467 C GLN A 37 5.245 -0.214 -15.995 1.00 0.00 C ATOM 468 O GLN A 37 5.705 -0.613 -17.066 1.00 0.00 O ATOM 469 CB GLN A 37 2.906 0.632 -16.259 1.00 0.00 C ATOM 470 CG GLN A 37 3.261 2.036 -15.801 1.00 0.00 C ATOM 471 CD GLN A 37 3.844 2.883 -16.915 1.00 0.00 C ATOM 472 OE1 GLN A 37 3.116 3.407 -17.759 1.00 0.00 O ATOM 473 NE2 GLN A 37 5.165 3.022 -16.924 1.00 0.00 N ATOM 0 H GLN A 37 3.047 0.304 -13.829 1.00 0.00 H new ATOM 0 HA GLN A 37 3.488 -1.425 -16.034 1.00 0.00 H new ATOM 0 HB2 GLN A 37 2.994 0.580 -17.344 1.00 0.00 H new ATOM 0 HB3 GLN A 37 1.863 0.432 -16.014 1.00 0.00 H new ATOM 0 HG2 GLN A 37 2.368 2.523 -15.409 1.00 0.00 H new ATOM 0 HG3 GLN A 37 3.978 1.977 -14.982 1.00 0.00 H new ATOM 0 HE21 GLN A 37 5.730 2.570 -16.205 1.00 0.00 H new ATOM 0 HE22 GLN A 37 5.614 3.581 -17.650 1.00 0.00 H new ATOM 555 N LEU A 42 6.181 -5.961 -10.778 1.00 0.00 N ATOM 556 CA LEU A 42 5.398 -5.455 -9.657 1.00 0.00 C ATOM 557 C LEU A 42 3.902 -5.622 -9.912 1.00 0.00 C ATOM 558 O LEU A 42 3.359 -5.076 -10.871 1.00 0.00 O ATOM 559 CB LEU A 42 5.721 -3.982 -9.406 1.00 0.00 C ATOM 560 CG LEU A 42 5.100 -3.388 -8.141 1.00 0.00 C ATOM 561 CD1 LEU A 42 6.070 -3.489 -6.973 1.00 0.00 C ATOM 562 CD2 LEU A 42 4.693 -1.941 -8.374 1.00 0.00 C ATOM 0 HA LEU A 42 5.663 -6.036 -8.773 1.00 0.00 H new ATOM 0 HB2 LEU A 42 6.804 -3.868 -9.349 1.00 0.00 H new ATOM 0 HB3 LEU A 42 5.385 -3.401 -10.265 1.00 0.00 H new ATOM 0 HG LEU A 42 4.205 -3.960 -7.896 1.00 0.00 H new ATOM 0 HD11 LEU A 42 5.612 -3.062 -6.081 1.00 0.00 H new ATOM 0 HD12 LEU A 42 6.312 -4.536 -6.790 1.00 0.00 H new ATOM 0 HD13 LEU A 42 6.983 -2.942 -7.210 1.00 0.00 H new ATOM 0 HD21 LEU A 42 4.253 -1.536 -7.463 1.00 0.00 H new ATOM 0 HD22 LEU A 42 5.571 -1.355 -8.645 1.00 0.00 H new ATOM 0 HD23 LEU A 42 3.962 -1.894 -9.182 1.00 0.00 H new ATOM 574 N LYS A 43 3.247 -6.381 -9.041 1.00 0.00 N ATOM 575 CA LYS A 43 1.814 -6.626 -9.155 1.00 0.00 C ATOM 576 C LYS A 43 1.079 -6.123 -7.918 1.00 0.00 C ATOM 577 O LYS A 43 1.004 -6.814 -6.902 1.00 0.00 O ATOM 578 CB LYS A 43 1.546 -8.120 -9.349 1.00 0.00 C ATOM 579 CG LYS A 43 2.369 -8.745 -10.463 1.00 0.00 C ATOM 580 CD LYS A 43 2.030 -8.136 -11.816 1.00 0.00 C ATOM 581 CE LYS A 43 3.283 -7.832 -12.621 1.00 0.00 C ATOM 582 NZ LYS A 43 3.923 -9.071 -13.143 1.00 0.00 N ATOM 0 H LYS A 43 3.688 -6.840 -8.244 1.00 0.00 H new ATOM 0 HA LYS A 43 1.444 -6.081 -10.024 1.00 0.00 H new ATOM 0 HB2 LYS A 43 1.756 -8.643 -8.416 1.00 0.00 H new ATOM 0 HB3 LYS A 43 0.488 -8.266 -9.565 1.00 0.00 H new ATOM 0 HG2 LYS A 43 3.430 -8.605 -10.255 1.00 0.00 H new ATOM 0 HG3 LYS A 43 2.189 -9.820 -10.491 1.00 0.00 H new ATOM 0 HD2 LYS A 43 1.394 -8.822 -12.376 1.00 0.00 H new ATOM 0 HD3 LYS A 43 1.459 -7.219 -11.670 1.00 0.00 H new ATOM 0 HE2 LYS A 43 3.029 -7.176 -13.454 1.00 0.00 H new ATOM 0 HE3 LYS A 43 3.994 -7.292 -11.996 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 4.774 -8.820 -13.686 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 4.189 -9.686 -12.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 3.254 -9.574 -13.761 1.00 0.00 H new ATOM 596 N LEU A 44 0.540 -4.912 -8.009 1.00 0.00 N ATOM 597 CA LEU A 44 -0.184 -4.317 -6.894 1.00 0.00 C ATOM 598 C LEU A 44 -1.689 -4.508 -7.053 1.00 0.00 C ATOM 599 O LEU A 44 -2.170 -4.860 -8.130 1.00 0.00 O ATOM 600 CB LEU A 44 0.147 -2.830 -6.783 1.00 0.00 C ATOM 601 CG LEU A 44 1.291 -2.499 -5.823 1.00 0.00 C ATOM 602 CD1 LEU A 44 2.089 -1.305 -6.328 1.00 0.00 C ATOM 603 CD2 LEU A 44 0.748 -2.233 -4.428 1.00 0.00 C ATOM 0 H LEU A 44 0.591 -4.325 -8.842 1.00 0.00 H new ATOM 0 HA LEU A 44 0.129 -4.821 -5.980 1.00 0.00 H new ATOM 0 HB2 LEU A 44 0.402 -2.454 -7.774 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -0.747 -2.296 -6.459 1.00 0.00 H new ATOM 0 HG LEU A 44 1.962 -3.357 -5.775 1.00 0.00 H new ATOM 0 HD11 LEU A 44 2.898 -1.087 -5.630 1.00 0.00 H new ATOM 0 HD12 LEU A 44 2.507 -1.535 -7.308 1.00 0.00 H new ATOM 0 HD13 LEU A 44 1.434 -0.437 -6.408 1.00 0.00 H new ATOM 0 HD21 LEU A 44 1.573 -1.999 -3.755 1.00 0.00 H new ATOM 0 HD22 LEU A 44 0.056 -1.391 -4.461 1.00 0.00 H new ATOM 0 HD23 LEU A 44 0.225 -3.118 -4.066 1.00 0.00 H new ATOM 615 N CYS A 45 -2.428 -4.273 -5.973 1.00 0.00 N ATOM 616 CA CYS A 45 -3.879 -4.419 -5.995 1.00 0.00 C ATOM 617 C CYS A 45 -4.555 -3.227 -5.331 1.00 0.00 C ATOM 618 O CYS A 45 -3.898 -2.403 -4.694 1.00 0.00 O ATOM 619 CB CYS A 45 -4.291 -5.711 -5.288 1.00 0.00 C ATOM 620 SG CYS A 45 -3.505 -7.211 -5.962 1.00 0.00 S ATOM 0 H CYS A 45 -2.046 -3.981 -5.073 1.00 0.00 H new ATOM 0 HA CYS A 45 -4.200 -4.462 -7.036 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -4.043 -5.628 -4.230 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -5.374 -5.820 -5.355 1.00 0.00 H new ATOM 0 HG CYS A 45 -3.063 -7.946 -4.985 1.00 0.00 H new ATOM 625 N VAL A 46 -5.873 -3.139 -5.479 1.00 0.00 N ATOM 626 CA VAL A 46 -6.635 -2.045 -4.889 1.00 0.00 C ATOM 627 C VAL A 46 -7.952 -2.544 -4.303 1.00 0.00 C ATOM 628 O VAL A 46 -8.268 -3.731 -4.381 1.00 0.00 O ATOM 629 CB VAL A 46 -6.928 -0.938 -5.922 1.00 0.00 C ATOM 630 CG1 VAL A 46 -5.630 -0.368 -6.475 1.00 0.00 C ATOM 631 CG2 VAL A 46 -7.811 -1.465 -7.045 1.00 0.00 C ATOM 0 H VAL A 46 -6.435 -3.811 -6.002 1.00 0.00 H new ATOM 0 HA VAL A 46 -6.021 -1.629 -4.090 1.00 0.00 H new ATOM 0 HB VAL A 46 -7.467 -0.135 -5.420 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -5.856 0.412 -7.202 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -5.042 0.055 -5.660 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -5.061 -1.162 -6.959 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -8.004 -0.666 -7.761 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -7.306 -2.290 -7.548 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -8.756 -1.817 -6.630 1.00 0.00 H new ATOM 641 N SER A 47 -8.716 -1.629 -3.717 1.00 0.00 N ATOM 642 CA SER A 47 -10.000 -1.974 -3.117 1.00 0.00 C ATOM 643 C SER A 47 -11.035 -2.290 -4.194 1.00 0.00 C ATOM 644 O SER A 47 -11.263 -1.490 -5.101 1.00 0.00 O ATOM 645 CB SER A 47 -10.498 -0.830 -2.232 1.00 0.00 C ATOM 646 OG SER A 47 -11.586 -1.245 -1.424 1.00 0.00 O ATOM 0 H SER A 47 -8.469 -0.642 -3.644 1.00 0.00 H new ATOM 0 HA SER A 47 -9.859 -2.863 -2.502 1.00 0.00 H new ATOM 0 HB2 SER A 47 -9.685 -0.476 -1.598 1.00 0.00 H new ATOM 0 HB3 SER A 47 -10.804 0.010 -2.856 1.00 0.00 H new ATOM 0 HG SER A 47 -11.884 -0.496 -0.867 1.00 0.00 H new ATOM 781 N VAL A 57 -8.706 -1.962 -14.683 1.00 0.00 N ATOM 782 CA VAL A 57 -7.529 -1.687 -13.868 1.00 0.00 C ATOM 783 C VAL A 57 -7.196 -2.868 -12.963 1.00 0.00 C ATOM 784 O VAL A 57 -7.958 -3.832 -12.878 1.00 0.00 O ATOM 785 CB VAL A 57 -7.729 -0.430 -12.999 1.00 0.00 C ATOM 786 CG1 VAL A 57 -7.729 0.822 -13.862 1.00 0.00 C ATOM 787 CG2 VAL A 57 -9.016 -0.536 -12.196 1.00 0.00 C ATOM 0 HA VAL A 57 -6.702 -1.517 -14.557 1.00 0.00 H new ATOM 0 HB VAL A 57 -6.897 -0.358 -12.298 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -7.871 1.699 -13.231 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -6.777 0.903 -14.386 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -8.539 0.763 -14.589 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -9.141 0.360 -11.588 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -9.862 -0.634 -12.876 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -8.969 -1.411 -11.547 1.00 0.00 H new ATOM 797 N TRP A 58 -6.054 -2.787 -12.289 1.00 0.00 N ATOM 798 CA TRP A 58 -5.616 -3.845 -11.391 1.00 0.00 C ATOM 799 C TRP A 58 -6.299 -3.720 -10.033 1.00 0.00 C ATOM 800 O TRP A 58 -6.102 -2.739 -9.316 1.00 0.00 O ATOM 801 CB TRP A 58 -4.098 -3.795 -11.221 1.00 0.00 C ATOM 802 CG TRP A 58 -3.448 -5.138 -11.319 1.00 0.00 C ATOM 803 CD1 TRP A 58 -3.812 -6.269 -10.652 1.00 0.00 C ATOM 804 CD2 TRP A 58 -2.322 -5.495 -12.130 1.00 0.00 C ATOM 805 NE1 TRP A 58 -2.981 -7.308 -10.993 1.00 0.00 N ATOM 806 CE2 TRP A 58 -2.059 -6.859 -11.901 1.00 0.00 C ATOM 807 CE3 TRP A 58 -1.512 -4.794 -13.028 1.00 0.00 C ATOM 808 CZ2 TRP A 58 -1.021 -7.533 -12.538 1.00 0.00 C ATOM 809 CZ3 TRP A 58 -0.482 -5.465 -13.658 1.00 0.00 C ATOM 810 CH2 TRP A 58 -0.243 -6.823 -13.411 1.00 0.00 C ATOM 0 H TRP A 58 -5.414 -1.995 -12.349 1.00 0.00 H new ATOM 0 HA TRP A 58 -5.894 -4.804 -11.829 1.00 0.00 H new ATOM 0 HB2 TRP A 58 -3.676 -3.138 -11.981 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -3.862 -3.354 -10.252 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -4.635 -6.338 -9.956 1.00 0.00 H new ATOM 0 HE1 TRP A 58 -3.041 -8.259 -10.629 1.00 0.00 H new ATOM 0 HE3 TRP A 58 -1.688 -3.747 -13.226 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 -0.836 -8.580 -12.350 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 0.150 -4.933 -14.353 1.00 0.00 H new ATOM 0 HH2 TRP A 58 0.571 -7.319 -13.919 1.00 0.00 H new ATOM 821 N SER A 59 -7.101 -4.722 -9.684 1.00 0.00 N ATOM 822 CA SER A 59 -7.812 -4.724 -8.412 1.00 0.00 C ATOM 823 C SER A 59 -7.854 -6.127 -7.816 1.00 0.00 C ATOM 824 O SER A 59 -7.567 -7.110 -8.499 1.00 0.00 O ATOM 825 CB SER A 59 -9.234 -4.192 -8.598 1.00 0.00 C ATOM 826 OG SER A 59 -9.808 -3.825 -7.355 1.00 0.00 O ATOM 0 H SER A 59 -7.274 -5.542 -10.265 1.00 0.00 H new ATOM 0 HA SER A 59 -7.276 -4.072 -7.722 1.00 0.00 H new ATOM 0 HB2 SER A 59 -9.219 -3.329 -9.264 1.00 0.00 H new ATOM 0 HB3 SER A 59 -9.851 -4.953 -9.076 1.00 0.00 H new ATOM 0 HG SER A 59 -10.716 -3.487 -7.501 1.00 0.00 H new ATOM 832 N ILE A 60 -8.212 -6.213 -6.540 1.00 0.00 N ATOM 833 CA ILE A 60 -8.289 -7.497 -5.856 1.00 0.00 C ATOM 834 C ILE A 60 -9.184 -7.416 -4.623 1.00 0.00 C ATOM 835 O ILE A 60 -9.404 -6.337 -4.074 1.00 0.00 O ATOM 836 CB ILE A 60 -6.885 -7.998 -5.441 1.00 0.00 C ATOM 837 CG1 ILE A 60 -6.802 -9.523 -5.585 1.00 0.00 C ATOM 838 CG2 ILE A 60 -6.553 -7.568 -4.013 1.00 0.00 C ATOM 839 CD1 ILE A 60 -5.700 -10.160 -4.762 1.00 0.00 C ATOM 0 H ILE A 60 -8.453 -5.410 -5.959 1.00 0.00 H new ATOM 0 HA ILE A 60 -8.723 -8.206 -6.561 1.00 0.00 H new ATOM 0 HB ILE A 60 -6.148 -7.547 -6.105 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -7.758 -9.958 -5.293 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -6.647 -9.771 -6.635 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -5.561 -7.932 -3.745 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -6.570 -6.480 -3.947 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -7.290 -7.985 -3.327 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -5.707 -11.239 -4.918 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -4.736 -9.755 -5.069 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -5.864 -9.945 -3.706 1.00 0.00 H new ATOM 851 N ALA A 61 -9.681 -8.566 -4.184 1.00 0.00 N ATOM 852 CA ALA A 61 -10.531 -8.629 -3.006 1.00 0.00 C ATOM 853 C ALA A 61 -9.688 -8.524 -1.740 1.00 0.00 C ATOM 854 O ALA A 61 -8.571 -9.038 -1.685 1.00 0.00 O ATOM 855 CB ALA A 61 -11.341 -9.917 -3.007 1.00 0.00 C ATOM 0 H ALA A 61 -9.509 -9.468 -4.628 1.00 0.00 H new ATOM 0 HA ALA A 61 -11.224 -7.788 -3.028 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -11.973 -9.950 -2.119 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -11.967 -9.953 -3.899 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -10.665 -10.772 -3.004 1.00 0.00 H new ATOM 861 N SER A 62 -10.221 -7.849 -0.730 1.00 0.00 N ATOM 862 CA SER A 62 -9.505 -7.671 0.527 1.00 0.00 C ATOM 863 C SER A 62 -9.255 -9.006 1.230 1.00 0.00 C ATOM 864 O SER A 62 -8.436 -9.087 2.144 1.00 0.00 O ATOM 865 CB SER A 62 -10.285 -6.735 1.453 1.00 0.00 C ATOM 866 OG SER A 62 -11.567 -7.260 1.749 1.00 0.00 O ATOM 0 H SER A 62 -11.144 -7.417 -0.756 1.00 0.00 H new ATOM 0 HA SER A 62 -8.537 -7.228 0.293 1.00 0.00 H new ATOM 0 HB2 SER A 62 -9.728 -6.586 2.378 1.00 0.00 H new ATOM 0 HB3 SER A 62 -10.389 -5.757 0.983 1.00 0.00 H new ATOM 0 HG SER A 62 -12.044 -6.644 2.343 1.00 0.00 H new ATOM 872 N GLU A 63 -9.960 -10.049 0.802 1.00 0.00 N ATOM 873 CA GLU A 63 -9.802 -11.368 1.401 1.00 0.00 C ATOM 874 C GLU A 63 -8.651 -12.135 0.749 1.00 0.00 C ATOM 875 O GLU A 63 -8.148 -13.107 1.312 1.00 0.00 O ATOM 876 CB GLU A 63 -11.098 -12.171 1.281 1.00 0.00 C ATOM 877 CG GLU A 63 -11.717 -12.126 -0.107 1.00 0.00 C ATOM 878 CD GLU A 63 -12.452 -13.405 -0.460 1.00 0.00 C ATOM 879 OE1 GLU A 63 -12.040 -14.480 0.026 1.00 0.00 O ATOM 880 OE2 GLU A 63 -13.437 -13.332 -1.223 1.00 0.00 O ATOM 0 H GLU A 63 -10.643 -10.006 0.046 1.00 0.00 H new ATOM 0 HA GLU A 63 -9.568 -11.228 2.456 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -10.898 -13.209 1.547 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -11.820 -11.790 2.004 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -12.409 -11.286 -0.165 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -10.934 -11.946 -0.844 1.00 0.00 H new ATOM 887 N LEU A 64 -8.241 -11.697 -0.438 1.00 0.00 N ATOM 888 CA LEU A 64 -7.160 -12.345 -1.157 1.00 0.00 C ATOM 889 C LEU A 64 -5.817 -11.678 -0.862 1.00 0.00 C ATOM 890 O LEU A 64 -4.782 -12.097 -1.383 1.00 0.00 O ATOM 891 CB LEU A 64 -7.432 -12.312 -2.659 1.00 0.00 C ATOM 892 CG LEU A 64 -8.906 -12.255 -3.054 1.00 0.00 C ATOM 893 CD1 LEU A 64 -9.058 -12.298 -4.567 1.00 0.00 C ATOM 894 CD2 LEU A 64 -9.672 -13.397 -2.408 1.00 0.00 C ATOM 0 H LEU A 64 -8.645 -10.894 -0.919 1.00 0.00 H new ATOM 0 HA LEU A 64 -7.109 -13.380 -0.819 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -6.925 -11.446 -3.084 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -6.985 -13.197 -3.112 1.00 0.00 H new ATOM 0 HG LEU A 64 -9.322 -11.313 -2.696 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -10.116 -12.256 -4.828 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -8.541 -11.446 -5.009 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -8.626 -13.223 -4.950 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -10.721 -13.342 -2.699 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -9.253 -14.348 -2.737 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -9.592 -13.321 -1.324 1.00 0.00 H new ATOM 906 N ILE A 65 -5.834 -10.639 -0.035 1.00 0.00 N ATOM 907 CA ILE A 65 -4.613 -9.925 0.310 1.00 0.00 C ATOM 908 C ILE A 65 -3.703 -10.778 1.189 1.00 0.00 C ATOM 909 O ILE A 65 -2.588 -11.124 0.797 1.00 0.00 O ATOM 910 CB ILE A 65 -4.917 -8.601 1.039 1.00 0.00 C ATOM 911 CG1 ILE A 65 -5.959 -7.793 0.261 1.00 0.00 C ATOM 912 CG2 ILE A 65 -3.641 -7.792 1.224 1.00 0.00 C ATOM 913 CD1 ILE A 65 -6.271 -6.450 0.885 1.00 0.00 C ATOM 0 H ILE A 65 -6.678 -10.274 0.407 1.00 0.00 H new ATOM 0 HA ILE A 65 -4.105 -9.705 -0.629 1.00 0.00 H new ATOM 0 HB ILE A 65 -5.324 -8.831 2.024 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -5.601 -7.637 -0.757 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -6.878 -8.374 0.190 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -3.873 -6.860 1.740 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -2.928 -8.367 1.815 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -3.207 -7.569 0.249 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -7.016 -5.933 0.281 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -6.660 -6.598 1.893 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -5.362 -5.850 0.931 1.00 0.00 H new ATOM 925 N GLU A 66 -4.185 -11.111 2.382 1.00 0.00 N ATOM 926 CA GLU A 66 -3.419 -11.916 3.320 1.00 0.00 C ATOM 927 C GLU A 66 -3.183 -13.328 2.785 1.00 0.00 C ATOM 928 O GLU A 66 -2.333 -14.058 3.296 1.00 0.00 O ATOM 929 CB GLU A 66 -4.142 -11.983 4.664 1.00 0.00 C ATOM 930 CG GLU A 66 -5.629 -12.273 4.545 1.00 0.00 C ATOM 931 CD GLU A 66 -6.237 -12.749 5.849 1.00 0.00 C ATOM 932 OE1 GLU A 66 -5.535 -13.442 6.614 1.00 0.00 O ATOM 933 OE2 GLU A 66 -7.416 -12.427 6.108 1.00 0.00 O ATOM 0 H GLU A 66 -5.106 -10.833 2.721 1.00 0.00 H new ATOM 0 HA GLU A 66 -2.447 -11.440 3.452 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -3.678 -12.755 5.278 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -4.006 -11.036 5.187 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -6.146 -11.372 4.215 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -5.787 -13.030 3.777 1.00 0.00 H new ATOM 940 N LYS A 67 -3.940 -13.713 1.761 1.00 0.00 N ATOM 941 CA LYS A 67 -3.806 -15.042 1.173 1.00 0.00 C ATOM 942 C LYS A 67 -2.943 -15.007 -0.086 1.00 0.00 C ATOM 943 O LYS A 67 -2.199 -15.947 -0.365 1.00 0.00 O ATOM 944 CB LYS A 67 -5.184 -15.617 0.845 1.00 0.00 C ATOM 945 CG LYS A 67 -6.115 -15.689 2.046 1.00 0.00 C ATOM 946 CD LYS A 67 -6.920 -16.977 2.053 1.00 0.00 C ATOM 947 CE LYS A 67 -7.862 -17.054 0.863 1.00 0.00 C ATOM 948 NZ LYS A 67 -8.153 -18.461 0.472 1.00 0.00 N ATOM 0 H LYS A 67 -4.650 -13.126 1.323 1.00 0.00 H new ATOM 0 HA LYS A 67 -3.314 -15.683 1.905 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -5.649 -15.006 0.072 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -5.062 -16.617 0.430 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -5.532 -15.619 2.964 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -6.793 -14.836 2.033 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -6.242 -17.831 2.037 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -7.494 -17.043 2.977 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -8.795 -16.545 1.105 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -7.421 -16.526 0.017 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -8.799 -18.468 -0.343 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -7.266 -18.940 0.216 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -8.597 -18.958 1.270 1.00 0.00 H new ATOM 962 N ARG A 68 -3.053 -13.922 -0.847 1.00 0.00 N ATOM 963 CA ARG A 68 -2.285 -13.775 -2.080 1.00 0.00 C ATOM 964 C ARG A 68 -1.238 -12.673 -1.951 1.00 0.00 C ATOM 965 O ARG A 68 -0.040 -12.922 -2.096 1.00 0.00 O ATOM 966 CB ARG A 68 -3.218 -13.473 -3.255 1.00 0.00 C ATOM 967 CG ARG A 68 -4.464 -14.344 -3.280 1.00 0.00 C ATOM 968 CD ARG A 68 -5.050 -14.433 -4.681 1.00 0.00 C ATOM 969 NE ARG A 68 -5.859 -15.638 -4.857 1.00 0.00 N ATOM 970 CZ ARG A 68 -6.711 -15.817 -5.863 1.00 0.00 C ATOM 971 NH1 ARG A 68 -6.867 -14.875 -6.785 1.00 0.00 N ATOM 972 NH2 ARG A 68 -7.407 -16.941 -5.949 1.00 0.00 N ATOM 0 H ARG A 68 -3.664 -13.134 -0.633 1.00 0.00 H new ATOM 0 HA ARG A 68 -1.768 -14.717 -2.265 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -3.517 -12.426 -3.211 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -2.670 -13.609 -4.188 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -4.218 -15.344 -2.922 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -5.209 -13.936 -2.597 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -5.663 -13.553 -4.875 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -4.243 -14.427 -5.413 1.00 0.00 H new ATOM 0 HE ARG A 68 -5.765 -16.385 -4.169 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -6.332 -14.009 -6.724 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -7.522 -15.018 -7.554 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -7.290 -17.669 -5.244 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -8.060 -17.079 -6.720 1.00 0.00 H new ATOM 986 N CYS A 69 -1.693 -11.453 -1.680 1.00 0.00 N ATOM 987 CA CYS A 69 -0.790 -10.315 -1.537 1.00 0.00 C ATOM 988 C CYS A 69 0.261 -10.586 -0.464 1.00 0.00 C ATOM 989 O CYS A 69 -0.043 -11.143 0.590 1.00 0.00 O ATOM 990 CB CYS A 69 -1.577 -9.050 -1.191 1.00 0.00 C ATOM 991 SG CYS A 69 -2.670 -8.476 -2.511 1.00 0.00 S ATOM 0 H CYS A 69 -2.680 -11.227 -1.555 1.00 0.00 H new ATOM 0 HA CYS A 69 -0.281 -10.166 -2.489 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -2.172 -9.238 -0.297 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -0.874 -8.254 -0.944 1.00 0.00 H new ATOM 0 HG CYS A 69 -3.792 -8.065 -1.998 1.00 0.00 H new ATOM 997 N ARG A 70 1.498 -10.192 -0.744 1.00 0.00 N ATOM 998 CA ARG A 70 2.595 -10.397 0.193 1.00 0.00 C ATOM 999 C ARG A 70 2.767 -9.191 1.113 1.00 0.00 C ATOM 1000 O ARG A 70 3.017 -9.344 2.309 1.00 0.00 O ATOM 1001 CB ARG A 70 3.898 -10.671 -0.567 1.00 0.00 C ATOM 1002 CG ARG A 70 4.420 -12.087 -0.384 1.00 0.00 C ATOM 1003 CD ARG A 70 5.449 -12.162 0.733 1.00 0.00 C ATOM 1004 NE ARG A 70 5.729 -13.540 1.129 1.00 0.00 N ATOM 1005 CZ ARG A 70 6.490 -13.871 2.169 1.00 0.00 C ATOM 1006 NH1 ARG A 70 7.046 -12.929 2.922 1.00 0.00 N ATOM 1007 NH2 ARG A 70 6.695 -15.149 2.459 1.00 0.00 N ATOM 0 H ARG A 70 1.766 -9.729 -1.612 1.00 0.00 H new ATOM 0 HA ARG A 70 2.354 -11.263 0.810 1.00 0.00 H new ATOM 0 HB2 ARG A 70 3.736 -10.486 -1.629 1.00 0.00 H new ATOM 0 HB3 ARG A 70 4.659 -9.966 -0.234 1.00 0.00 H new ATOM 0 HG2 ARG A 70 3.589 -12.756 -0.160 1.00 0.00 H new ATOM 0 HG3 ARG A 70 4.867 -12.434 -1.316 1.00 0.00 H new ATOM 0 HD2 ARG A 70 6.373 -11.684 0.407 1.00 0.00 H new ATOM 0 HD3 ARG A 70 5.088 -11.603 1.596 1.00 0.00 H new ATOM 0 HE ARG A 70 5.317 -14.292 0.576 1.00 0.00 H new ATOM 0 HH11 ARG A 70 6.891 -11.945 2.705 1.00 0.00 H new ATOM 0 HH12 ARG A 70 7.628 -13.190 3.718 1.00 0.00 H new ATOM 0 HH21 ARG A 70 6.269 -15.877 1.885 1.00 0.00 H new ATOM 0 HH22 ARG A 70 7.278 -15.404 3.256 1.00 0.00 H new ATOM 1021 N ARG A 71 2.630 -7.993 0.553 1.00 0.00 N ATOM 1022 CA ARG A 71 2.773 -6.767 1.334 1.00 0.00 C ATOM 1023 C ARG A 71 1.625 -5.799 1.058 1.00 0.00 C ATOM 1024 O ARG A 71 0.860 -5.973 0.111 1.00 0.00 O ATOM 1025 CB ARG A 71 4.117 -6.081 1.042 1.00 0.00 C ATOM 1026 CG ARG A 71 4.827 -6.601 -0.199 1.00 0.00 C ATOM 1027 CD ARG A 71 5.751 -7.761 0.134 1.00 0.00 C ATOM 1028 NE ARG A 71 6.983 -7.311 0.778 1.00 0.00 N ATOM 1029 CZ ARG A 71 7.774 -8.101 1.499 1.00 0.00 C ATOM 1030 NH1 ARG A 71 7.473 -9.383 1.664 1.00 0.00 N ATOM 1031 NH2 ARG A 71 8.873 -7.609 2.056 1.00 0.00 N ATOM 0 H ARG A 71 2.421 -7.844 -0.434 1.00 0.00 H new ATOM 0 HA ARG A 71 2.744 -7.047 2.387 1.00 0.00 H new ATOM 0 HB2 ARG A 71 3.948 -5.010 0.928 1.00 0.00 H new ATOM 0 HB3 ARG A 71 4.773 -6.211 1.903 1.00 0.00 H new ATOM 0 HG2 ARG A 71 4.089 -6.922 -0.934 1.00 0.00 H new ATOM 0 HG3 ARG A 71 5.402 -5.795 -0.655 1.00 0.00 H new ATOM 0 HD2 ARG A 71 5.233 -8.460 0.790 1.00 0.00 H new ATOM 0 HD3 ARG A 71 5.996 -8.303 -0.779 1.00 0.00 H new ATOM 0 HE ARG A 71 7.252 -6.333 0.668 1.00 0.00 H new ATOM 0 HH11 ARG A 71 6.631 -9.768 1.237 1.00 0.00 H new ATOM 0 HH12 ARG A 71 8.084 -9.983 2.218 1.00 0.00 H new ATOM 0 HH21 ARG A 71 9.111 -6.625 1.931 1.00 0.00 H new ATOM 0 HH22 ARG A 71 9.480 -8.215 2.609 1.00 0.00 H new ATOM 1045 N MET A 72 1.507 -4.780 1.902 1.00 0.00 N ATOM 1046 CA MET A 72 0.455 -3.786 1.759 1.00 0.00 C ATOM 1047 C MET A 72 1.036 -2.379 1.692 1.00 0.00 C ATOM 1048 O MET A 72 2.094 -2.100 2.257 1.00 0.00 O ATOM 1049 CB MET A 72 -0.534 -3.890 2.922 1.00 0.00 C ATOM 1050 CG MET A 72 0.030 -4.575 4.158 1.00 0.00 C ATOM 1051 SD MET A 72 -0.071 -6.373 4.065 1.00 0.00 S ATOM 1052 CE MET A 72 -1.825 -6.599 3.779 1.00 0.00 C ATOM 0 H MET A 72 2.130 -4.622 2.694 1.00 0.00 H new ATOM 0 HA MET A 72 -0.071 -3.983 0.825 1.00 0.00 H new ATOM 0 HB2 MET A 72 -0.865 -2.888 3.194 1.00 0.00 H new ATOM 0 HB3 MET A 72 -1.416 -4.437 2.587 1.00 0.00 H new ATOM 0 HG2 MET A 72 1.071 -4.280 4.288 1.00 0.00 H new ATOM 0 HG3 MET A 72 -0.512 -4.230 5.039 1.00 0.00 H new ATOM 0 HE1 MET A 72 -2.086 -7.647 3.927 1.00 0.00 H new ATOM 0 HE2 MET A 72 -2.390 -5.982 4.478 1.00 0.00 H new ATOM 0 HE3 MET A 72 -2.068 -6.306 2.758 1.00 0.00 H new ATOM 1062 N VAL A 73 0.328 -1.495 1.002 1.00 0.00 N ATOM 1063 CA VAL A 73 0.753 -0.111 0.857 1.00 0.00 C ATOM 1064 C VAL A 73 -0.369 0.824 1.285 1.00 0.00 C ATOM 1065 O VAL A 73 -1.283 1.110 0.510 1.00 0.00 O ATOM 1066 CB VAL A 73 1.159 0.205 -0.594 1.00 0.00 C ATOM 1067 CG1 VAL A 73 1.686 1.626 -0.709 1.00 0.00 C ATOM 1068 CG2 VAL A 73 2.195 -0.796 -1.085 1.00 0.00 C ATOM 0 H VAL A 73 -0.550 -1.715 0.531 1.00 0.00 H new ATOM 0 HA VAL A 73 1.624 0.039 1.496 1.00 0.00 H new ATOM 0 HB VAL A 73 0.274 0.122 -1.225 1.00 0.00 H new ATOM 0 HG11 VAL A 73 1.967 1.827 -1.743 1.00 0.00 H new ATOM 0 HG12 VAL A 73 0.911 2.328 -0.400 1.00 0.00 H new ATOM 0 HG13 VAL A 73 2.559 1.744 -0.067 1.00 0.00 H new ATOM 0 HG21 VAL A 73 2.472 -0.559 -2.112 1.00 0.00 H new ATOM 0 HG22 VAL A 73 3.080 -0.745 -0.450 1.00 0.00 H new ATOM 0 HG23 VAL A 73 1.777 -1.802 -1.045 1.00 0.00 H new ATOM 1078 N VAL A 74 -0.307 1.278 2.528 1.00 0.00 N ATOM 1079 CA VAL A 74 -1.330 2.160 3.066 1.00 0.00 C ATOM 1080 C VAL A 74 -1.005 3.624 2.799 1.00 0.00 C ATOM 1081 O VAL A 74 0.158 4.022 2.787 1.00 0.00 O ATOM 1082 CB VAL A 74 -1.511 1.954 4.584 1.00 0.00 C ATOM 1083 CG1 VAL A 74 -2.852 2.503 5.040 1.00 0.00 C ATOM 1084 CG2 VAL A 74 -1.382 0.479 4.946 1.00 0.00 C ATOM 0 H VAL A 74 0.441 1.050 3.182 1.00 0.00 H new ATOM 0 HA VAL A 74 -2.259 1.903 2.556 1.00 0.00 H new ATOM 0 HB VAL A 74 -0.723 2.501 5.101 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -2.962 2.349 6.113 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -2.903 3.569 4.819 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -3.655 1.985 4.515 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -1.513 0.355 6.021 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -2.146 -0.093 4.419 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -0.395 0.118 4.657 1.00 0.00 H new ATOM 1094 N VAL A 75 -2.047 4.420 2.591 1.00 0.00 N ATOM 1095 CA VAL A 75 -1.883 5.843 2.334 1.00 0.00 C ATOM 1096 C VAL A 75 -2.566 6.663 3.426 1.00 0.00 C ATOM 1097 O VAL A 75 -3.766 6.931 3.355 1.00 0.00 O ATOM 1098 CB VAL A 75 -2.457 6.231 0.955 1.00 0.00 C ATOM 1099 CG1 VAL A 75 -2.390 7.736 0.741 1.00 0.00 C ATOM 1100 CG2 VAL A 75 -1.717 5.497 -0.153 1.00 0.00 C ATOM 0 H VAL A 75 -3.016 4.102 2.596 1.00 0.00 H new ATOM 0 HA VAL A 75 -0.815 6.060 2.336 1.00 0.00 H new ATOM 0 HB VAL A 75 -3.506 5.935 0.926 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -2.801 7.983 -0.238 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -2.969 8.240 1.515 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -1.352 8.065 0.793 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -2.134 5.781 -1.119 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -0.660 5.761 -0.122 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -1.826 4.422 -0.013 1.00 0.00 H new ATOM 1110 N VAL A 76 -1.798 7.045 4.441 1.00 0.00 N ATOM 1111 CA VAL A 76 -2.332 7.819 5.557 1.00 0.00 C ATOM 1112 C VAL A 76 -2.399 9.307 5.235 1.00 0.00 C ATOM 1113 O VAL A 76 -1.412 10.029 5.370 1.00 0.00 O ATOM 1114 CB VAL A 76 -1.494 7.615 6.833 1.00 0.00 C ATOM 1115 CG1 VAL A 76 -0.056 8.059 6.612 1.00 0.00 C ATOM 1116 CG2 VAL A 76 -2.118 8.357 8.007 1.00 0.00 C ATOM 0 H VAL A 76 -0.803 6.831 4.514 1.00 0.00 H new ATOM 0 HA VAL A 76 -3.344 7.453 5.729 1.00 0.00 H new ATOM 0 HB VAL A 76 -1.484 6.551 7.070 1.00 0.00 H new ATOM 0 HG11 VAL A 76 0.517 7.906 7.527 1.00 0.00 H new ATOM 0 HG12 VAL A 76 0.385 7.474 5.805 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -0.038 9.116 6.346 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -1.512 8.201 8.900 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -2.164 9.422 7.781 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -3.125 7.979 8.182 1.00 0.00 H new ATOM 1126 N SER A 77 -3.574 9.761 4.822 1.00 0.00 N ATOM 1127 CA SER A 77 -3.776 11.166 4.495 1.00 0.00 C ATOM 1128 C SER A 77 -5.008 11.716 5.206 1.00 0.00 C ATOM 1129 O SER A 77 -5.950 10.980 5.490 1.00 0.00 O ATOM 1130 CB SER A 77 -3.924 11.341 2.982 1.00 0.00 C ATOM 1131 OG SER A 77 -3.953 12.714 2.628 1.00 0.00 O ATOM 0 H SER A 77 -4.402 9.177 4.705 1.00 0.00 H new ATOM 0 HA SER A 77 -2.903 11.724 4.835 1.00 0.00 H new ATOM 0 HB2 SER A 77 -3.096 10.848 2.473 1.00 0.00 H new ATOM 0 HB3 SER A 77 -4.840 10.856 2.644 1.00 0.00 H new ATOM 0 HG SER A 77 -4.046 12.799 1.656 1.00 0.00 H new ATOM 1137 N ASP A 78 -4.989 13.017 5.491 1.00 0.00 N ATOM 1138 CA ASP A 78 -6.102 13.688 6.168 1.00 0.00 C ATOM 1139 C ASP A 78 -7.458 13.177 5.680 1.00 0.00 C ATOM 1140 O ASP A 78 -8.298 12.746 6.470 1.00 0.00 O ATOM 1141 CB ASP A 78 -6.014 15.197 5.926 1.00 0.00 C ATOM 1142 CG ASP A 78 -5.818 15.981 7.205 1.00 0.00 C ATOM 1143 OD1 ASP A 78 -4.903 15.632 7.974 1.00 0.00 O ATOM 1144 OD2 ASP A 78 -6.578 16.944 7.435 1.00 0.00 O ATOM 0 H ASP A 78 -4.209 13.633 5.262 1.00 0.00 H new ATOM 0 HA ASP A 78 -6.023 13.468 7.233 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -5.187 15.405 5.247 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -6.925 15.536 5.432 1.00 0.00 H new ATOM 1149 N ASP A 79 -7.661 13.259 4.373 1.00 0.00 N ATOM 1150 CA ASP A 79 -8.909 12.839 3.743 1.00 0.00 C ATOM 1151 C ASP A 79 -9.194 11.349 3.932 1.00 0.00 C ATOM 1152 O ASP A 79 -10.316 10.896 3.704 1.00 0.00 O ATOM 1153 CB ASP A 79 -8.861 13.164 2.252 1.00 0.00 C ATOM 1154 CG ASP A 79 -8.685 14.645 1.985 1.00 0.00 C ATOM 1155 OD1 ASP A 79 -7.543 15.137 2.104 1.00 0.00 O ATOM 1156 OD2 ASP A 79 -9.687 15.313 1.658 1.00 0.00 O ATOM 0 H ASP A 79 -6.967 13.618 3.718 1.00 0.00 H new ATOM 0 HA ASP A 79 -9.717 13.386 4.229 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -8.040 12.615 1.790 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -9.781 12.820 1.779 1.00 0.00 H new ATOM 1161 N TYR A 80 -8.187 10.588 4.341 1.00 0.00 N ATOM 1162 CA TYR A 80 -8.355 9.154 4.545 1.00 0.00 C ATOM 1163 C TYR A 80 -8.742 8.851 5.985 1.00 0.00 C ATOM 1164 O TYR A 80 -9.423 7.864 6.262 1.00 0.00 O ATOM 1165 CB TYR A 80 -7.065 8.413 4.181 1.00 0.00 C ATOM 1166 CG TYR A 80 -7.092 6.935 4.503 1.00 0.00 C ATOM 1167 CD1 TYR A 80 -8.159 6.138 4.112 1.00 0.00 C ATOM 1168 CD2 TYR A 80 -6.049 6.337 5.200 1.00 0.00 C ATOM 1169 CE1 TYR A 80 -8.188 4.788 4.405 1.00 0.00 C ATOM 1170 CE2 TYR A 80 -6.070 4.987 5.495 1.00 0.00 C ATOM 1171 CZ TYR A 80 -7.141 4.217 5.096 1.00 0.00 C ATOM 1172 OH TYR A 80 -7.165 2.874 5.388 1.00 0.00 O ATOM 0 H TYR A 80 -7.249 10.937 4.537 1.00 0.00 H new ATOM 0 HA TYR A 80 -9.159 8.810 3.894 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -6.874 8.539 3.115 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -6.231 8.874 4.710 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -8.981 6.581 3.569 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -5.208 6.937 5.516 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -9.027 4.183 4.094 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -5.251 4.537 6.036 1.00 0.00 H new ATOM 0 HH TYR A 80 -7.989 2.477 5.036 1.00 0.00 H new ATOM 1182 N LEU A 81 -8.303 9.704 6.899 1.00 0.00 N ATOM 1183 CA LEU A 81 -8.596 9.531 8.307 1.00 0.00 C ATOM 1184 C LEU A 81 -10.004 10.010 8.631 1.00 0.00 C ATOM 1185 O LEU A 81 -10.711 9.399 9.432 1.00 0.00 O ATOM 1186 CB LEU A 81 -7.583 10.302 9.140 1.00 0.00 C ATOM 1187 CG LEU A 81 -6.143 9.810 9.038 1.00 0.00 C ATOM 1188 CD1 LEU A 81 -5.155 10.919 9.363 1.00 0.00 C ATOM 1189 CD2 LEU A 81 -5.932 8.644 9.972 1.00 0.00 C ATOM 0 H LEU A 81 -7.739 10.527 6.685 1.00 0.00 H new ATOM 0 HA LEU A 81 -8.532 8.469 8.546 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -7.613 11.350 8.840 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.890 10.260 10.185 1.00 0.00 H new ATOM 0 HG LEU A 81 -5.967 9.491 8.011 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -4.138 10.536 9.281 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -5.290 11.743 8.662 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -5.328 11.274 10.379 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -4.902 8.297 9.894 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -6.133 8.957 10.996 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -6.609 7.834 9.701 1.00 0.00 H new ATOM 1201 N GLN A 82 -10.404 11.110 8.002 1.00 0.00 N ATOM 1202 CA GLN A 82 -11.725 11.675 8.219 1.00 0.00 C ATOM 1203 C GLN A 82 -12.817 10.650 7.924 1.00 0.00 C ATOM 1204 O GLN A 82 -13.946 10.777 8.398 1.00 0.00 O ATOM 1205 CB GLN A 82 -11.915 12.909 7.340 1.00 0.00 C ATOM 1206 CG GLN A 82 -11.523 12.687 5.890 1.00 0.00 C ATOM 1207 CD GLN A 82 -12.075 13.755 4.967 1.00 0.00 C ATOM 1208 OE1 GLN A 82 -11.418 14.761 4.698 1.00 0.00 O ATOM 1209 NE2 GLN A 82 -13.291 13.543 4.477 1.00 0.00 N ATOM 0 H GLN A 82 -9.829 11.627 7.337 1.00 0.00 H new ATOM 0 HA GLN A 82 -11.804 11.963 9.267 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -12.959 13.218 7.382 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -11.323 13.729 7.746 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -10.436 12.669 5.810 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -11.883 11.710 5.566 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -13.801 12.695 4.726 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -13.715 14.228 3.852 1.00 0.00 H new ATOM 1218 N SER A 83 -12.474 9.633 7.137 1.00 0.00 N ATOM 1219 CA SER A 83 -13.427 8.590 6.781 1.00 0.00 C ATOM 1220 C SER A 83 -13.296 7.390 7.712 1.00 0.00 C ATOM 1221 O SER A 83 -12.211 7.095 8.213 1.00 0.00 O ATOM 1222 CB SER A 83 -13.213 8.150 5.331 1.00 0.00 C ATOM 1223 OG SER A 83 -14.105 7.107 4.978 1.00 0.00 O ATOM 0 H SER A 83 -11.544 9.511 6.735 1.00 0.00 H new ATOM 0 HA SER A 83 -14.432 9.000 6.887 1.00 0.00 H new ATOM 0 HB2 SER A 83 -13.360 9.000 4.664 1.00 0.00 H new ATOM 0 HB3 SER A 83 -12.185 7.814 5.197 1.00 0.00 H new ATOM 0 HG SER A 83 -14.420 7.243 4.060 1.00 0.00 H new ATOM 1229 N LYS A 84 -14.409 6.699 7.939 1.00 0.00 N ATOM 1230 CA LYS A 84 -14.423 5.532 8.805 1.00 0.00 C ATOM 1231 C LYS A 84 -13.703 4.360 8.146 1.00 0.00 C ATOM 1232 O LYS A 84 -13.277 3.422 8.821 1.00 0.00 O ATOM 1233 CB LYS A 84 -15.864 5.139 9.129 1.00 0.00 C ATOM 1234 CG LYS A 84 -16.452 5.884 10.316 1.00 0.00 C ATOM 1235 CD LYS A 84 -16.584 7.377 10.048 1.00 0.00 C ATOM 1236 CE LYS A 84 -15.887 8.200 11.121 1.00 0.00 C ATOM 1237 NZ LYS A 84 -16.658 8.216 12.395 1.00 0.00 N ATOM 0 H LYS A 84 -15.315 6.931 7.532 1.00 0.00 H new ATOM 0 HA LYS A 84 -13.901 5.784 9.728 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -16.486 5.322 8.253 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -15.902 4.068 9.329 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -17.432 5.471 10.553 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -15.820 5.728 11.190 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -16.157 7.612 9.073 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -17.639 7.649 10.008 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -14.893 7.792 11.303 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -15.752 9.221 10.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -16.150 8.787 13.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -17.598 8.629 12.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -16.765 7.244 12.748 1.00 0.00 H new ATOM 1251 N GLU A 85 -13.567 4.421 6.824 1.00 0.00 N ATOM 1252 CA GLU A 85 -12.898 3.366 6.075 1.00 0.00 C ATOM 1253 C GLU A 85 -11.491 3.136 6.612 1.00 0.00 C ATOM 1254 O GLU A 85 -10.979 2.016 6.585 1.00 0.00 O ATOM 1255 CB GLU A 85 -12.840 3.722 4.589 1.00 0.00 C ATOM 1256 CG GLU A 85 -14.195 4.062 3.991 1.00 0.00 C ATOM 1257 CD GLU A 85 -14.389 3.464 2.611 1.00 0.00 C ATOM 1258 OE1 GLU A 85 -14.798 2.288 2.524 1.00 0.00 O ATOM 1259 OE2 GLU A 85 -14.131 4.175 1.616 1.00 0.00 O ATOM 0 H GLU A 85 -13.912 5.191 6.251 1.00 0.00 H new ATOM 0 HA GLU A 85 -13.471 2.446 6.195 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -12.169 4.570 4.453 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -12.410 2.884 4.040 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -14.982 3.701 4.654 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -14.301 5.145 3.932 1.00 0.00 H new ATOM 1266 N CYS A 86 -10.875 4.203 7.109 1.00 0.00 N ATOM 1267 CA CYS A 86 -9.532 4.117 7.661 1.00 0.00 C ATOM 1268 C CYS A 86 -9.577 3.560 9.078 1.00 0.00 C ATOM 1269 O CYS A 86 -8.661 2.860 9.510 1.00 0.00 O ATOM 1270 CB CYS A 86 -8.861 5.493 7.654 1.00 0.00 C ATOM 1271 SG CYS A 86 -7.218 5.524 8.412 1.00 0.00 S ATOM 0 H CYS A 86 -11.286 5.136 7.140 1.00 0.00 H new ATOM 0 HA CYS A 86 -8.945 3.442 7.038 1.00 0.00 H new ATOM 0 HB2 CYS A 86 -8.780 5.839 6.624 1.00 0.00 H new ATOM 0 HB3 CYS A 86 -9.504 6.200 8.178 1.00 0.00 H new ATOM 0 HG CYS A 86 -6.323 5.219 7.520 1.00 0.00 H new ATOM 1277 N ASP A 87 -10.654 3.865 9.797 1.00 0.00 N ATOM 1278 CA ASP A 87 -10.817 3.382 11.161 1.00 0.00 C ATOM 1279 C ASP A 87 -10.836 1.860 11.180 1.00 0.00 C ATOM 1280 O ASP A 87 -10.269 1.229 12.071 1.00 0.00 O ATOM 1281 CB ASP A 87 -12.105 3.935 11.777 1.00 0.00 C ATOM 1282 CG ASP A 87 -11.953 4.249 13.251 1.00 0.00 C ATOM 1283 OD1 ASP A 87 -11.045 5.031 13.602 1.00 0.00 O ATOM 1284 OD2 ASP A 87 -12.744 3.713 14.058 1.00 0.00 O ATOM 0 H ASP A 87 -11.423 4.442 9.457 1.00 0.00 H new ATOM 0 HA ASP A 87 -9.973 3.731 11.755 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -12.400 4.839 11.244 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -12.908 3.210 11.644 1.00 0.00 H new ATOM 1289 N PHE A 88 -11.478 1.278 10.174 1.00 0.00 N ATOM 1290 CA PHE A 88 -11.555 -0.170 10.054 1.00 0.00 C ATOM 1291 C PHE A 88 -10.220 -0.709 9.558 1.00 0.00 C ATOM 1292 O PHE A 88 -9.726 -1.729 10.043 1.00 0.00 O ATOM 1293 CB PHE A 88 -12.676 -0.570 9.095 1.00 0.00 C ATOM 1294 CG PHE A 88 -12.986 -2.039 9.110 1.00 0.00 C ATOM 1295 CD1 PHE A 88 -13.593 -2.621 10.212 1.00 0.00 C ATOM 1296 CD2 PHE A 88 -12.670 -2.839 8.024 1.00 0.00 C ATOM 1297 CE1 PHE A 88 -13.878 -3.973 10.230 1.00 0.00 C ATOM 1298 CE2 PHE A 88 -12.954 -4.192 8.036 1.00 0.00 C ATOM 1299 CZ PHE A 88 -13.559 -4.759 9.140 1.00 0.00 C ATOM 0 H PHE A 88 -11.953 1.789 9.430 1.00 0.00 H new ATOM 0 HA PHE A 88 -11.776 -0.597 11.033 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -13.578 -0.014 9.352 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -12.398 -0.276 8.083 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -13.846 -2.011 11.066 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -12.196 -2.401 7.158 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -14.350 -4.415 11.095 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -12.703 -4.805 7.183 1.00 0.00 H new ATOM 0 HZ PHE A 88 -13.782 -5.816 9.151 1.00 0.00 H new ATOM 1309 N GLN A 89 -9.635 0.004 8.603 1.00 0.00 N ATOM 1310 CA GLN A 89 -8.345 -0.377 8.047 1.00 0.00 C ATOM 1311 C GLN A 89 -7.284 -0.337 9.138 1.00 0.00 C ATOM 1312 O GLN A 89 -6.351 -1.137 9.140 1.00 0.00 O ATOM 1313 CB GLN A 89 -7.962 0.561 6.901 1.00 0.00 C ATOM 1314 CG GLN A 89 -7.120 -0.103 5.825 1.00 0.00 C ATOM 1315 CD GLN A 89 -5.655 -0.199 6.206 1.00 0.00 C ATOM 1316 OE1 GLN A 89 -5.063 -1.278 6.174 1.00 0.00 O ATOM 1317 NE2 GLN A 89 -5.062 0.933 6.566 1.00 0.00 N ATOM 0 H GLN A 89 -10.035 0.850 8.198 1.00 0.00 H new ATOM 0 HA GLN A 89 -8.414 -1.391 7.654 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -8.871 0.956 6.447 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -7.413 1.411 7.307 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -7.507 -1.103 5.632 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -7.214 0.460 4.897 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -5.592 1.805 6.578 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -4.077 0.931 6.830 1.00 0.00 H new ATOM 1326 N THR A 90 -7.448 0.596 10.071 1.00 0.00 N ATOM 1327 CA THR A 90 -6.524 0.743 11.185 1.00 0.00 C ATOM 1328 C THR A 90 -6.564 -0.479 12.074 1.00 0.00 C ATOM 1329 O THR A 90 -5.582 -1.199 12.173 1.00 0.00 O ATOM 1330 CB THR A 90 -6.863 1.996 11.993 1.00 0.00 C ATOM 1331 OG1 THR A 90 -6.874 3.142 11.162 1.00 0.00 O ATOM 1332 CG2 THR A 90 -5.892 2.260 13.119 1.00 0.00 C ATOM 0 H THR A 90 -8.218 1.265 10.075 1.00 0.00 H new ATOM 0 HA THR A 90 -5.515 0.846 10.784 1.00 0.00 H new ATOM 0 HB THR A 90 -7.849 1.806 12.418 1.00 0.00 H new ATOM 0 HG1 THR A 90 -7.768 3.258 10.777 1.00 0.00 H new ATOM 0 HG21 THR A 90 -6.190 3.163 13.652 1.00 0.00 H new ATOM 0 HG22 THR A 90 -5.894 1.415 13.807 1.00 0.00 H new ATOM 0 HG23 THR A 90 -4.890 2.393 12.712 1.00 0.00 H new ATOM 1340 N LYS A 91 -7.698 -0.716 12.715 1.00 0.00 N ATOM 1341 CA LYS A 91 -7.834 -1.868 13.601 1.00 0.00 C ATOM 1342 C LYS A 91 -7.339 -3.143 12.931 1.00 0.00 C ATOM 1343 O LYS A 91 -6.878 -4.066 13.602 1.00 0.00 O ATOM 1344 CB LYS A 91 -9.286 -2.033 14.052 1.00 0.00 C ATOM 1345 CG LYS A 91 -9.620 -1.262 15.319 1.00 0.00 C ATOM 1346 CD LYS A 91 -9.533 0.239 15.097 1.00 0.00 C ATOM 1347 CE LYS A 91 -9.445 0.993 16.413 1.00 0.00 C ATOM 1348 NZ LYS A 91 -8.825 2.336 16.243 1.00 0.00 N ATOM 0 H LYS A 91 -8.532 -0.134 12.642 1.00 0.00 H new ATOM 0 HA LYS A 91 -7.214 -1.686 14.479 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -9.947 -1.702 13.250 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -9.489 -3.091 14.216 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -10.624 -1.524 15.651 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -8.935 -1.553 16.115 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -8.659 0.467 14.487 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -10.407 0.577 14.541 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -10.444 1.105 16.835 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -8.861 0.411 17.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -8.783 2.818 17.164 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -7.862 2.229 15.864 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -9.396 2.901 15.582 1.00 0.00 H new ATOM 1362 N PHE A 92 -7.423 -3.186 11.610 1.00 0.00 N ATOM 1363 CA PHE A 92 -6.964 -4.349 10.867 1.00 0.00 C ATOM 1364 C PHE A 92 -5.508 -4.179 10.450 1.00 0.00 C ATOM 1365 O PHE A 92 -4.798 -5.159 10.221 1.00 0.00 O ATOM 1366 CB PHE A 92 -7.842 -4.576 9.635 1.00 0.00 C ATOM 1367 CG PHE A 92 -7.571 -5.879 8.937 1.00 0.00 C ATOM 1368 CD1 PHE A 92 -8.168 -7.050 9.371 1.00 0.00 C ATOM 1369 CD2 PHE A 92 -6.719 -5.929 7.845 1.00 0.00 C ATOM 1370 CE1 PHE A 92 -7.920 -8.250 8.730 1.00 0.00 C ATOM 1371 CE2 PHE A 92 -6.468 -7.125 7.200 1.00 0.00 C ATOM 1372 CZ PHE A 92 -7.069 -8.287 7.642 1.00 0.00 C ATOM 0 H PHE A 92 -7.802 -2.434 11.034 1.00 0.00 H new ATOM 0 HA PHE A 92 -7.039 -5.221 11.517 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -8.890 -4.545 9.935 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -7.687 -3.757 8.932 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -8.835 -7.026 10.220 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -6.246 -5.023 7.494 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -8.391 -9.157 9.079 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -5.802 -7.151 6.350 1.00 0.00 H new ATOM 0 HZ PHE A 92 -6.874 -9.222 7.139 1.00 0.00 H new ATOM 1382 N ALA A 93 -5.067 -2.928 10.354 1.00 0.00 N ATOM 1383 CA ALA A 93 -3.696 -2.625 9.965 1.00 0.00 C ATOM 1384 C ALA A 93 -2.783 -2.504 11.181 1.00 0.00 C ATOM 1385 O ALA A 93 -1.579 -2.748 11.093 1.00 0.00 O ATOM 1386 CB ALA A 93 -3.652 -1.345 9.148 1.00 0.00 C ATOM 0 H ALA A 93 -5.642 -2.107 10.541 1.00 0.00 H new ATOM 0 HA ALA A 93 -3.333 -3.452 9.355 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -2.622 -1.130 8.864 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -4.259 -1.465 8.250 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -4.044 -0.520 9.743 1.00 0.00 H new ATOM 1392 N LEU A 94 -3.360 -2.124 12.317 1.00 0.00 N ATOM 1393 CA LEU A 94 -2.601 -1.969 13.544 1.00 0.00 C ATOM 1394 C LEU A 94 -2.454 -3.305 14.241 1.00 0.00 C ATOM 1395 O LEU A 94 -1.368 -3.701 14.660 1.00 0.00 O ATOM 1396 CB LEU A 94 -3.306 -0.972 14.459 1.00 0.00 C ATOM 1397 CG LEU A 94 -4.783 -1.249 14.762 1.00 0.00 C ATOM 1398 CD1 LEU A 94 -4.928 -2.211 15.917 1.00 0.00 C ATOM 1399 CD2 LEU A 94 -5.516 0.052 15.066 1.00 0.00 C ATOM 0 H LEU A 94 -4.355 -1.918 12.409 1.00 0.00 H new ATOM 0 HA LEU A 94 -1.607 -1.593 13.304 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -2.765 -0.935 15.404 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -3.230 0.018 14.009 1.00 0.00 H new ATOM 0 HG LEU A 94 -5.228 -1.707 13.879 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -5.986 -2.390 16.111 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -4.440 -3.154 15.669 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -4.463 -1.785 16.806 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -6.563 -0.162 15.279 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -5.060 0.533 15.932 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -5.449 0.717 14.205 1.00 0.00 H new ATOM 1411 N SER A 95 -3.574 -3.986 14.346 1.00 0.00 N ATOM 1412 CA SER A 95 -3.627 -5.300 14.980 1.00 0.00 C ATOM 1413 C SER A 95 -3.940 -6.377 13.948 1.00 0.00 C ATOM 1414 O SER A 95 -4.921 -7.109 14.070 1.00 0.00 O ATOM 1415 CB SER A 95 -4.677 -5.319 16.094 1.00 0.00 C ATOM 1416 OG SER A 95 -5.987 -5.215 15.568 1.00 0.00 O ATOM 0 H SER A 95 -4.473 -3.653 13.999 1.00 0.00 H new ATOM 0 HA SER A 95 -2.651 -5.507 15.418 1.00 0.00 H new ATOM 0 HB2 SER A 95 -4.585 -6.241 16.667 1.00 0.00 H new ATOM 0 HB3 SER A 95 -4.493 -4.495 16.784 1.00 0.00 H new ATOM 0 HG SER A 95 -5.994 -4.566 14.834 1.00 0.00 H new ATOM 1422 N LEU A 96 -3.093 -6.461 12.928 1.00 0.00 N ATOM 1423 CA LEU A 96 -3.272 -7.447 11.864 1.00 0.00 C ATOM 1424 C LEU A 96 -2.750 -8.814 12.299 1.00 0.00 C ATOM 1425 O LEU A 96 -3.523 -9.689 12.692 1.00 0.00 O ATOM 1426 CB LEU A 96 -2.573 -7.008 10.564 1.00 0.00 C ATOM 1427 CG LEU A 96 -1.786 -5.696 10.631 1.00 0.00 C ATOM 1428 CD1 LEU A 96 -0.426 -5.914 11.275 1.00 0.00 C ATOM 1429 CD2 LEU A 96 -1.626 -5.111 9.238 1.00 0.00 C ATOM 0 H LEU A 96 -2.277 -5.860 12.814 1.00 0.00 H new ATOM 0 HA LEU A 96 -4.342 -7.522 11.668 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -1.892 -7.801 10.256 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -3.328 -6.916 9.783 1.00 0.00 H new ATOM 0 HG LEU A 96 -2.343 -4.990 11.247 1.00 0.00 H new ATOM 0 HD11 LEU A 96 0.115 -4.968 11.312 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -0.560 -6.295 12.287 1.00 0.00 H new ATOM 0 HD13 LEU A 96 0.143 -6.635 10.688 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -1.065 -4.178 9.297 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -1.089 -5.818 8.606 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -2.609 -4.916 8.810 1.00 0.00 H new ATOM 1441 N SER A 97 -1.436 -8.989 12.224 1.00 0.00 N ATOM 1442 CA SER A 97 -0.806 -10.245 12.606 1.00 0.00 C ATOM 1443 C SER A 97 0.314 -10.009 13.617 1.00 0.00 C ATOM 1444 O SER A 97 0.729 -8.872 13.842 1.00 0.00 O ATOM 1445 CB SER A 97 -0.253 -10.959 11.370 1.00 0.00 C ATOM 1446 OG SER A 97 -1.096 -12.029 10.978 1.00 0.00 O ATOM 0 H SER A 97 -0.785 -8.273 11.901 1.00 0.00 H new ATOM 0 HA SER A 97 -1.563 -10.875 13.072 1.00 0.00 H new ATOM 0 HB2 SER A 97 -0.156 -10.249 10.549 1.00 0.00 H new ATOM 0 HB3 SER A 97 0.746 -11.339 11.582 1.00 0.00 H new ATOM 0 HG SER A 97 -0.721 -12.467 10.186 1.00 0.00 H new ATOM 1452 N PRO A 98 0.818 -11.087 14.243 1.00 0.00 N ATOM 1453 CA PRO A 98 1.892 -10.994 15.235 1.00 0.00 C ATOM 1454 C PRO A 98 3.254 -10.729 14.600 1.00 0.00 C ATOM 1455 O PRO A 98 4.070 -11.638 14.455 1.00 0.00 O ATOM 1456 CB PRO A 98 1.871 -12.372 15.898 1.00 0.00 C ATOM 1457 CG PRO A 98 1.355 -13.287 14.843 1.00 0.00 C ATOM 1458 CD PRO A 98 0.377 -12.480 14.033 1.00 0.00 C ATOM 0 HA PRO A 98 1.739 -10.165 15.926 1.00 0.00 H new ATOM 0 HB2 PRO A 98 2.867 -12.669 16.228 1.00 0.00 H new ATOM 0 HB3 PRO A 98 1.228 -12.379 16.778 1.00 0.00 H new ATOM 0 HG2 PRO A 98 2.167 -13.658 14.217 1.00 0.00 H new ATOM 0 HG3 PRO A 98 0.870 -14.158 15.285 1.00 0.00 H new ATOM 0 HD2 PRO A 98 0.406 -12.755 12.979 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -0.647 -12.632 14.374 1.00 0.00 H new ATOM 1466 N GLY A 99 3.492 -9.476 14.227 1.00 0.00 N ATOM 1467 CA GLY A 99 4.759 -9.114 13.615 1.00 0.00 C ATOM 1468 C GLY A 99 4.600 -8.614 12.193 1.00 0.00 C ATOM 1469 O GLY A 99 5.398 -8.950 11.318 1.00 0.00 O ATOM 0 H GLY A 99 2.832 -8.706 14.337 1.00 0.00 H new ATOM 0 HA2 GLY A 99 5.240 -8.342 14.215 1.00 0.00 H new ATOM 0 HA3 GLY A 99 5.421 -9.980 13.619 1.00 0.00 H new ATOM 1473 N ALA A 100 3.570 -7.808 11.962 1.00 0.00 N ATOM 1474 CA ALA A 100 3.312 -7.260 10.634 1.00 0.00 C ATOM 1475 C ALA A 100 2.731 -5.854 10.724 1.00 0.00 C ATOM 1476 O ALA A 100 1.908 -5.457 9.900 1.00 0.00 O ATOM 1477 CB ALA A 100 2.372 -8.173 9.862 1.00 0.00 C ATOM 0 H ALA A 100 2.900 -7.519 12.675 1.00 0.00 H new ATOM 0 HA ALA A 100 4.261 -7.199 10.102 1.00 0.00 H new ATOM 0 HB1 ALA A 100 2.188 -7.753 8.873 1.00 0.00 H new ATOM 0 HB2 ALA A 100 2.826 -9.159 9.759 1.00 0.00 H new ATOM 0 HB3 ALA A 100 1.428 -8.262 10.400 1.00 0.00 H new ATOM 1483 N HIS A 101 3.166 -5.102 11.729 1.00 0.00 N ATOM 1484 CA HIS A 101 2.692 -3.736 11.925 1.00 0.00 C ATOM 1485 C HIS A 101 3.416 -2.775 10.991 1.00 0.00 C ATOM 1486 O HIS A 101 2.848 -1.780 10.542 1.00 0.00 O ATOM 1487 CB HIS A 101 2.895 -3.307 13.379 1.00 0.00 C ATOM 1488 CG HIS A 101 2.218 -4.201 14.369 1.00 0.00 C ATOM 1489 ND1 HIS A 101 1.241 -3.760 15.237 1.00 0.00 N ATOM 1490 CD2 HIS A 101 2.379 -5.521 14.627 1.00 0.00 C ATOM 1491 CE1 HIS A 101 0.832 -4.768 15.987 1.00 0.00 C ATOM 1492 NE2 HIS A 101 1.507 -5.847 15.636 1.00 0.00 N ATOM 0 H HIS A 101 3.847 -5.415 12.421 1.00 0.00 H new ATOM 0 HA HIS A 101 1.627 -3.708 11.693 1.00 0.00 H new ATOM 0 HB2 HIS A 101 3.963 -3.282 13.596 1.00 0.00 H new ATOM 0 HB3 HIS A 101 2.521 -2.291 13.505 1.00 0.00 H new ATOM 0 HD2 HIS A 101 3.065 -6.192 14.131 1.00 0.00 H new ATOM 0 HE1 HIS A 101 0.075 -4.718 16.756 1.00 0.00 H new ATOM 0 HE2 HIS A 101 1.398 -6.774 16.048 1.00 0.00 H new ATOM 1501 N GLN A 102 4.675 -3.082 10.700 1.00 0.00 N ATOM 1502 CA GLN A 102 5.482 -2.251 9.818 1.00 0.00 C ATOM 1503 C GLN A 102 6.497 -3.098 9.060 1.00 0.00 C ATOM 1504 O GLN A 102 7.596 -2.639 8.744 1.00 0.00 O ATOM 1505 CB GLN A 102 6.201 -1.164 10.620 1.00 0.00 C ATOM 1506 CG GLN A 102 7.112 -1.712 11.707 1.00 0.00 C ATOM 1507 CD GLN A 102 7.723 -0.619 12.561 1.00 0.00 C ATOM 1508 OE1 GLN A 102 7.483 -0.551 13.766 1.00 0.00 O ATOM 1509 NE2 GLN A 102 8.517 0.244 11.939 1.00 0.00 N ATOM 0 H GLN A 102 5.159 -3.903 11.064 1.00 0.00 H new ATOM 0 HA GLN A 102 4.818 -1.776 9.096 1.00 0.00 H new ATOM 0 HB2 GLN A 102 6.791 -0.551 9.938 1.00 0.00 H new ATOM 0 HB3 GLN A 102 5.458 -0.509 11.076 1.00 0.00 H new ATOM 0 HG2 GLN A 102 6.544 -2.391 12.344 1.00 0.00 H new ATOM 0 HG3 GLN A 102 7.909 -2.297 11.248 1.00 0.00 H new ATOM 0 HE21 GLN A 102 8.688 0.150 10.938 1.00 0.00 H new ATOM 0 HE22 GLN A 102 8.956 1.002 12.462 1.00 0.00 H new ATOM 1518 N LYS A 103 6.123 -4.340 8.774 1.00 0.00 N ATOM 1519 CA LYS A 103 6.997 -5.259 8.055 1.00 0.00 C ATOM 1520 C LYS A 103 6.497 -5.489 6.634 1.00 0.00 C ATOM 1521 O LYS A 103 7.283 -5.750 5.723 1.00 0.00 O ATOM 1522 CB LYS A 103 7.083 -6.596 8.797 1.00 0.00 C ATOM 1523 CG LYS A 103 8.264 -6.688 9.747 1.00 0.00 C ATOM 1524 CD LYS A 103 7.909 -6.168 11.130 1.00 0.00 C ATOM 1525 CE LYS A 103 8.969 -6.544 12.154 1.00 0.00 C ATOM 1526 NZ LYS A 103 10.327 -6.099 11.739 1.00 0.00 N ATOM 0 H LYS A 103 5.218 -4.734 9.030 1.00 0.00 H new ATOM 0 HA LYS A 103 7.989 -4.811 8.004 1.00 0.00 H new ATOM 0 HB2 LYS A 103 6.162 -6.750 9.359 1.00 0.00 H new ATOM 0 HB3 LYS A 103 7.150 -7.403 8.068 1.00 0.00 H new ATOM 0 HG2 LYS A 103 8.593 -7.725 9.820 1.00 0.00 H new ATOM 0 HG3 LYS A 103 9.100 -6.116 9.346 1.00 0.00 H new ATOM 0 HD2 LYS A 103 7.802 -5.084 11.096 1.00 0.00 H new ATOM 0 HD3 LYS A 103 6.945 -6.574 11.436 1.00 0.00 H new ATOM 0 HE2 LYS A 103 8.719 -6.096 13.116 1.00 0.00 H new ATOM 0 HE3 LYS A 103 8.969 -7.625 12.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 10.978 -6.173 12.546 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 10.668 -6.702 10.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 10.285 -5.111 11.417 1.00 0.00 H new ATOM 1540 N ARG A 104 5.183 -5.393 6.451 1.00 0.00 N ATOM 1541 CA ARG A 104 4.578 -5.597 5.138 1.00 0.00 C ATOM 1542 C ARG A 104 3.743 -4.389 4.716 1.00 0.00 C ATOM 1543 O ARG A 104 3.585 -4.120 3.526 1.00 0.00 O ATOM 1544 CB ARG A 104 3.710 -6.859 5.140 1.00 0.00 C ATOM 1545 CG ARG A 104 2.866 -7.026 6.394 1.00 0.00 C ATOM 1546 CD ARG A 104 2.457 -8.476 6.599 1.00 0.00 C ATOM 1547 NE ARG A 104 3.602 -9.326 6.921 1.00 0.00 N ATOM 1548 CZ ARG A 104 3.497 -10.528 7.483 1.00 0.00 C ATOM 1549 NH1 ARG A 104 2.304 -11.025 7.786 1.00 0.00 N ATOM 1550 NH2 ARG A 104 4.588 -11.234 7.741 1.00 0.00 N ATOM 0 H ARG A 104 4.518 -5.176 7.193 1.00 0.00 H new ATOM 0 HA ARG A 104 5.386 -5.720 4.416 1.00 0.00 H new ATOM 0 HB2 ARG A 104 3.052 -6.836 4.272 1.00 0.00 H new ATOM 0 HB3 ARG A 104 4.354 -7.731 5.029 1.00 0.00 H new ATOM 0 HG2 ARG A 104 3.428 -6.679 7.261 1.00 0.00 H new ATOM 0 HG3 ARG A 104 1.975 -6.402 6.321 1.00 0.00 H new ATOM 0 HD2 ARG A 104 1.723 -8.536 7.403 1.00 0.00 H new ATOM 0 HD3 ARG A 104 1.972 -8.847 5.696 1.00 0.00 H new ATOM 0 HE ARG A 104 4.535 -8.978 6.702 1.00 0.00 H new ATOM 0 HH11 ARG A 104 1.461 -10.485 7.588 1.00 0.00 H new ATOM 0 HH12 ARG A 104 2.230 -11.947 8.217 1.00 0.00 H new ATOM 0 HH21 ARG A 104 5.507 -10.856 7.509 1.00 0.00 H new ATOM 0 HH22 ARG A 104 4.509 -12.155 8.172 1.00 0.00 H new ATOM 1564 N LEU A 105 3.208 -3.667 5.695 1.00 0.00 N ATOM 1565 CA LEU A 105 2.389 -2.499 5.427 1.00 0.00 C ATOM 1566 C LEU A 105 3.206 -1.218 5.566 1.00 0.00 C ATOM 1567 O LEU A 105 3.896 -1.018 6.565 1.00 0.00 O ATOM 1568 CB LEU A 105 1.219 -2.472 6.405 1.00 0.00 C ATOM 1569 CG LEU A 105 1.604 -2.222 7.864 1.00 0.00 C ATOM 1570 CD1 LEU A 105 1.563 -0.735 8.182 1.00 0.00 C ATOM 1571 CD2 LEU A 105 0.682 -2.992 8.799 1.00 0.00 C ATOM 0 H LEU A 105 3.330 -3.875 6.686 1.00 0.00 H new ATOM 0 HA LEU A 105 2.018 -2.558 4.404 1.00 0.00 H new ATOM 0 HB2 LEU A 105 0.520 -1.697 6.091 1.00 0.00 H new ATOM 0 HB3 LEU A 105 0.690 -3.423 6.342 1.00 0.00 H new ATOM 0 HG LEU A 105 2.623 -2.577 8.015 1.00 0.00 H new ATOM 0 HD11 LEU A 105 1.840 -0.578 9.224 1.00 0.00 H new ATOM 0 HD12 LEU A 105 2.264 -0.205 7.537 1.00 0.00 H new ATOM 0 HD13 LEU A 105 0.556 -0.354 8.013 1.00 0.00 H new ATOM 0 HD21 LEU A 105 0.971 -2.802 9.833 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -0.347 -2.667 8.644 1.00 0.00 H new ATOM 0 HD23 LEU A 105 0.761 -4.059 8.590 1.00 0.00 H new ATOM 1583 N ILE A 106 3.121 -0.354 4.561 1.00 0.00 N ATOM 1584 CA ILE A 106 3.855 0.907 4.583 1.00 0.00 C ATOM 1585 C ILE A 106 2.938 2.094 4.290 1.00 0.00 C ATOM 1586 O ILE A 106 2.336 2.173 3.218 1.00 0.00 O ATOM 1587 CB ILE A 106 5.015 0.915 3.565 1.00 0.00 C ATOM 1588 CG1 ILE A 106 4.599 0.224 2.260 1.00 0.00 C ATOM 1589 CG2 ILE A 106 6.252 0.257 4.166 1.00 0.00 C ATOM 1590 CD1 ILE A 106 4.796 -1.279 2.264 1.00 0.00 C ATOM 0 H ILE A 106 2.555 -0.501 3.725 1.00 0.00 H new ATOM 0 HA ILE A 106 4.263 1.003 5.589 1.00 0.00 H new ATOM 0 HB ILE A 106 5.262 1.950 3.328 1.00 0.00 H new ATOM 0 HG12 ILE A 106 3.549 0.441 2.066 1.00 0.00 H new ATOM 0 HG13 ILE A 106 5.171 0.652 1.437 1.00 0.00 H new ATOM 0 HG21 ILE A 106 7.062 0.270 3.436 1.00 0.00 H new ATOM 0 HG22 ILE A 106 6.558 0.804 5.058 1.00 0.00 H new ATOM 0 HG23 ILE A 106 6.022 -0.774 4.434 1.00 0.00 H new ATOM 0 HD11 ILE A 106 4.478 -1.690 1.306 1.00 0.00 H new ATOM 0 HD12 ILE A 106 5.850 -1.507 2.425 1.00 0.00 H new ATOM 0 HD13 ILE A 106 4.202 -1.722 3.064 1.00 0.00 H new ATOM 1602 N PRO A 107 2.818 3.039 5.243 1.00 0.00 N ATOM 1603 CA PRO A 107 1.974 4.229 5.078 1.00 0.00 C ATOM 1604 C PRO A 107 2.574 5.236 4.099 1.00 0.00 C ATOM 1605 O PRO A 107 3.793 5.331 3.962 1.00 0.00 O ATOM 1606 CB PRO A 107 1.930 4.825 6.486 1.00 0.00 C ATOM 1607 CG PRO A 107 3.211 4.393 7.106 1.00 0.00 C ATOM 1608 CD PRO A 107 3.489 3.022 6.556 1.00 0.00 C ATOM 0 HA PRO A 107 0.995 3.980 4.669 1.00 0.00 H new ATOM 0 HB2 PRO A 107 1.849 5.912 6.456 1.00 0.00 H new ATOM 0 HB3 PRO A 107 1.072 4.457 7.048 1.00 0.00 H new ATOM 0 HG2 PRO A 107 4.017 5.084 6.860 1.00 0.00 H new ATOM 0 HG3 PRO A 107 3.131 4.370 8.193 1.00 0.00 H new ATOM 0 HD2 PRO A 107 4.559 2.837 6.458 1.00 0.00 H new ATOM 0 HD3 PRO A 107 3.088 2.241 7.202 1.00 0.00 H new ATOM 1616 N ILE A 108 1.707 5.983 3.423 1.00 0.00 N ATOM 1617 CA ILE A 108 2.145 6.985 2.458 1.00 0.00 C ATOM 1618 C ILE A 108 1.146 8.138 2.390 1.00 0.00 C ATOM 1619 O ILE A 108 -0.007 7.995 2.799 1.00 0.00 O ATOM 1620 CB ILE A 108 2.327 6.359 1.055 1.00 0.00 C ATOM 1621 CG1 ILE A 108 3.531 5.415 1.051 1.00 0.00 C ATOM 1622 CG2 ILE A 108 2.500 7.433 -0.012 1.00 0.00 C ATOM 1623 CD1 ILE A 108 3.178 3.983 1.385 1.00 0.00 C ATOM 0 H ILE A 108 0.695 5.913 3.526 1.00 0.00 H new ATOM 0 HA ILE A 108 3.108 7.372 2.791 1.00 0.00 H new ATOM 0 HB ILE A 108 1.426 5.792 0.820 1.00 0.00 H new ATOM 0 HG12 ILE A 108 4.002 5.445 0.069 1.00 0.00 H new ATOM 0 HG13 ILE A 108 4.268 5.776 1.769 1.00 0.00 H new ATOM 0 HG21 ILE A 108 2.626 6.961 -0.986 1.00 0.00 H new ATOM 0 HG22 ILE A 108 1.618 8.073 -0.030 1.00 0.00 H new ATOM 0 HG23 ILE A 108 3.380 8.034 0.216 1.00 0.00 H new ATOM 0 HD11 ILE A 108 4.080 3.371 1.363 1.00 0.00 H new ATOM 0 HD12 ILE A 108 2.734 3.940 2.380 1.00 0.00 H new ATOM 0 HD13 ILE A 108 2.465 3.604 0.653 1.00 0.00 H new ATOM 1635 N LYS A 109 1.588 9.282 1.878 1.00 0.00 N ATOM 1636 CA LYS A 109 0.720 10.449 1.767 1.00 0.00 C ATOM 1637 C LYS A 109 1.372 11.550 0.939 1.00 0.00 C ATOM 1638 O LYS A 109 2.595 11.687 0.918 1.00 0.00 O ATOM 1639 CB LYS A 109 0.368 10.978 3.159 1.00 0.00 C ATOM 1640 CG LYS A 109 1.547 11.581 3.906 1.00 0.00 C ATOM 1641 CD LYS A 109 2.367 10.515 4.612 1.00 0.00 C ATOM 1642 CE LYS A 109 1.986 10.403 6.081 1.00 0.00 C ATOM 1643 NZ LYS A 109 2.741 11.367 6.925 1.00 0.00 N ATOM 0 H LYS A 109 2.538 9.426 1.535 1.00 0.00 H new ATOM 0 HA LYS A 109 -0.193 10.140 1.257 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -0.413 11.732 3.063 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -0.047 10.163 3.752 1.00 0.00 H new ATOM 0 HG2 LYS A 109 2.182 12.125 3.206 1.00 0.00 H new ATOM 0 HG3 LYS A 109 1.184 12.304 4.636 1.00 0.00 H new ATOM 0 HD2 LYS A 109 2.216 9.553 4.121 1.00 0.00 H new ATOM 0 HD3 LYS A 109 3.427 10.754 4.527 1.00 0.00 H new ATOM 0 HE2 LYS A 109 0.917 10.582 6.193 1.00 0.00 H new ATOM 0 HE3 LYS A 109 2.177 9.388 6.429 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 2.794 11.008 7.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 3.702 11.482 6.545 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 2.255 12.286 6.921 1.00 0.00 H new ATOM 1657 N TYR A 110 0.542 12.339 0.263 1.00 0.00 N ATOM 1658 CA TYR A 110 1.031 13.435 -0.562 1.00 0.00 C ATOM 1659 C TYR A 110 1.653 14.525 0.307 1.00 0.00 C ATOM 1660 O TYR A 110 2.541 15.256 -0.135 1.00 0.00 O ATOM 1661 CB TYR A 110 -0.111 14.019 -1.399 1.00 0.00 C ATOM 1662 CG TYR A 110 0.290 15.215 -2.233 1.00 0.00 C ATOM 1663 CD1 TYR A 110 1.006 15.057 -3.413 1.00 0.00 C ATOM 1664 CD2 TYR A 110 -0.049 16.503 -1.839 1.00 0.00 C ATOM 1665 CE1 TYR A 110 1.374 16.148 -4.178 1.00 0.00 C ATOM 1666 CE2 TYR A 110 0.315 17.599 -2.597 1.00 0.00 C ATOM 1667 CZ TYR A 110 1.026 17.418 -3.765 1.00 0.00 C ATOM 1668 OH TYR A 110 1.389 18.507 -4.523 1.00 0.00 O ATOM 0 H TYR A 110 -0.473 12.238 0.271 1.00 0.00 H new ATOM 0 HA TYR A 110 1.797 13.045 -1.232 1.00 0.00 H new ATOM 0 HB2 TYR A 110 -0.499 13.242 -2.058 1.00 0.00 H new ATOM 0 HB3 TYR A 110 -0.925 14.309 -0.734 1.00 0.00 H new ATOM 0 HD1 TYR A 110 1.280 14.064 -3.738 1.00 0.00 H new ATOM 0 HD2 TYR A 110 -0.606 16.650 -0.925 1.00 0.00 H new ATOM 0 HE1 TYR A 110 1.930 16.007 -5.093 1.00 0.00 H new ATOM 0 HE2 TYR A 110 0.044 18.594 -2.276 1.00 0.00 H new ATOM 0 HH TYR A 110 1.066 19.327 -4.094 1.00 0.00 H new ATOM 1678 N LYS A 111 1.179 14.629 1.545 1.00 0.00 N ATOM 1679 CA LYS A 111 1.687 15.627 2.478 1.00 0.00 C ATOM 1680 C LYS A 111 1.233 15.321 3.902 1.00 0.00 C ATOM 1681 O LYS A 111 0.539 14.333 4.144 1.00 0.00 O ATOM 1682 CB LYS A 111 1.227 17.030 2.068 1.00 0.00 C ATOM 1683 CG LYS A 111 -0.198 17.081 1.543 1.00 0.00 C ATOM 1684 CD LYS A 111 -1.177 17.500 2.628 1.00 0.00 C ATOM 1685 CE LYS A 111 -1.170 19.007 2.831 1.00 0.00 C ATOM 1686 NZ LYS A 111 -2.332 19.664 2.172 1.00 0.00 N ATOM 0 H LYS A 111 0.443 14.033 1.925 1.00 0.00 H new ATOM 0 HA LYS A 111 2.776 15.592 2.448 1.00 0.00 H new ATOM 0 HB2 LYS A 111 1.311 17.695 2.927 1.00 0.00 H new ATOM 0 HB3 LYS A 111 1.900 17.413 1.301 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -0.255 17.781 0.710 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -0.480 16.102 1.156 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -2.181 17.172 2.360 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -0.919 17.004 3.564 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -1.185 19.229 3.898 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -0.245 19.422 2.432 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -2.289 20.690 2.335 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -2.304 19.474 1.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -3.216 19.287 2.570 1.00 0.00 H new ATOM 1700 N ALA A 112 1.637 16.169 4.843 1.00 0.00 N ATOM 1701 CA ALA A 112 1.282 15.984 6.245 1.00 0.00 C ATOM 1702 C ALA A 112 -0.216 16.158 6.481 1.00 0.00 C ATOM 1703 O ALA A 112 -0.882 16.929 5.789 1.00 0.00 O ATOM 1704 CB ALA A 112 2.067 16.952 7.115 1.00 0.00 C ATOM 0 H ALA A 112 2.211 16.992 4.659 1.00 0.00 H new ATOM 0 HA ALA A 112 1.540 14.961 6.518 1.00 0.00 H new ATOM 0 HB1 ALA A 112 1.794 16.805 8.160 1.00 0.00 H new ATOM 0 HB2 ALA A 112 3.134 16.770 6.990 1.00 0.00 H new ATOM 0 HB3 ALA A 112 1.836 17.976 6.820 1.00 0.00 H new ATOM 1710 N MET A 113 -0.734 15.438 7.471 1.00 0.00 N ATOM 1711 CA MET A 113 -2.147 15.497 7.821 1.00 0.00 C ATOM 1712 C MET A 113 -2.424 16.664 8.763 1.00 0.00 C ATOM 1713 O MET A 113 -1.829 16.765 9.835 1.00 0.00 O ATOM 1714 CB MET A 113 -2.572 14.183 8.481 1.00 0.00 C ATOM 1715 CG MET A 113 -2.571 12.998 7.529 1.00 0.00 C ATOM 1716 SD MET A 113 -1.461 11.681 8.063 1.00 0.00 S ATOM 1717 CE MET A 113 -1.935 11.519 9.781 1.00 0.00 C ATOM 0 H MET A 113 -0.188 14.800 8.050 1.00 0.00 H new ATOM 0 HA MET A 113 -2.723 15.648 6.908 1.00 0.00 H new ATOM 0 HB2 MET A 113 -1.902 13.970 9.314 1.00 0.00 H new ATOM 0 HB3 MET A 113 -3.572 14.302 8.899 1.00 0.00 H new ATOM 0 HG2 MET A 113 -3.583 12.603 7.445 1.00 0.00 H new ATOM 0 HG3 MET A 113 -2.277 13.335 6.535 1.00 0.00 H new ATOM 0 HE1 MET A 113 -1.179 11.985 10.413 1.00 0.00 H new ATOM 0 HE2 MET A 113 -2.895 12.010 9.942 1.00 0.00 H new ATOM 0 HE3 MET A 113 -2.021 10.463 10.037 1.00 0.00 H new ATOM 1727 N LYS A 114 -3.338 17.538 8.356 1.00 0.00 N ATOM 1728 CA LYS A 114 -3.707 18.695 9.163 1.00 0.00 C ATOM 1729 C LYS A 114 -4.246 18.262 10.523 1.00 0.00 C ATOM 1730 O LYS A 114 -4.310 19.064 11.456 1.00 0.00 O ATOM 1731 CB LYS A 114 -4.753 19.540 8.433 1.00 0.00 C ATOM 1732 CG LYS A 114 -4.158 20.680 7.622 1.00 0.00 C ATOM 1733 CD LYS A 114 -4.140 20.359 6.137 1.00 0.00 C ATOM 1734 CE LYS A 114 -2.867 19.628 5.739 1.00 0.00 C ATOM 1735 NZ LYS A 114 -1.677 20.523 5.781 1.00 0.00 N ATOM 0 H LYS A 114 -3.838 17.467 7.470 1.00 0.00 H new ATOM 0 HA LYS A 114 -2.811 19.295 9.322 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -5.329 18.896 7.769 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -5.450 19.950 9.163 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -4.736 21.588 7.792 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -3.143 20.880 7.964 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -5.006 19.747 5.886 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -4.225 21.282 5.563 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -2.709 18.783 6.409 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -2.981 19.222 4.734 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -0.833 19.967 6.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -1.542 20.964 4.849 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -1.824 21.263 6.496 1.00 0.00 H new ATOM 1749 N LYS A 115 -4.628 16.990 10.639 1.00 0.00 N ATOM 1750 CA LYS A 115 -5.153 16.466 11.894 1.00 0.00 C ATOM 1751 C LYS A 115 -4.171 15.475 12.524 1.00 0.00 C ATOM 1752 O LYS A 115 -2.977 15.511 12.226 1.00 0.00 O ATOM 1753 CB LYS A 115 -6.544 15.848 11.699 1.00 0.00 C ATOM 1754 CG LYS A 115 -6.770 15.237 10.335 1.00 0.00 C ATOM 1755 CD LYS A 115 -6.241 13.823 10.282 1.00 0.00 C ATOM 1756 CE LYS A 115 -7.166 12.871 11.019 1.00 0.00 C ATOM 1757 NZ LYS A 115 -6.833 12.757 12.465 1.00 0.00 N ATOM 0 H LYS A 115 -4.583 16.308 9.881 1.00 0.00 H new ATOM 0 HA LYS A 115 -5.268 17.298 12.589 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -6.697 15.080 12.457 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -7.297 16.618 11.868 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -7.835 15.240 10.103 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -6.277 15.843 9.575 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -6.139 13.507 9.244 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -5.246 13.786 10.725 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -8.195 13.214 10.913 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -7.110 11.885 10.558 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -7.197 11.856 12.835 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -5.801 12.790 12.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -7.268 13.546 12.985 1.00 0.00 H new ATOM 1771 N GLU A 116 -4.661 14.614 13.410 1.00 0.00 N ATOM 1772 CA GLU A 116 -3.806 13.651 14.088 1.00 0.00 C ATOM 1773 C GLU A 116 -3.551 12.416 13.234 1.00 0.00 C ATOM 1774 O GLU A 116 -4.135 12.249 12.164 1.00 0.00 O ATOM 1775 CB GLU A 116 -4.440 13.237 15.414 1.00 0.00 C ATOM 1776 CG GLU A 116 -4.365 14.309 16.488 1.00 0.00 C ATOM 1777 CD GLU A 116 -5.170 13.956 17.722 1.00 0.00 C ATOM 1778 OE1 GLU A 116 -4.792 12.992 18.422 1.00 0.00 O ATOM 1779 OE2 GLU A 116 -6.180 14.640 17.989 1.00 0.00 O ATOM 0 H GLU A 116 -5.645 14.565 13.674 1.00 0.00 H new ATOM 0 HA GLU A 116 -2.846 14.134 14.270 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -5.485 12.980 15.242 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -3.946 12.336 15.777 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -3.323 14.463 16.770 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -4.728 15.253 16.080 1.00 0.00 H new ATOM 1786 N PHE A 117 -2.674 11.554 13.730 1.00 0.00 N ATOM 1787 CA PHE A 117 -2.325 10.319 13.039 1.00 0.00 C ATOM 1788 C PHE A 117 -2.883 9.112 13.787 1.00 0.00 C ATOM 1789 O PHE A 117 -2.946 9.105 15.017 1.00 0.00 O ATOM 1790 CB PHE A 117 -0.803 10.188 12.897 1.00 0.00 C ATOM 1791 CG PHE A 117 -0.022 10.954 13.928 1.00 0.00 C ATOM 1792 CD1 PHE A 117 0.167 12.321 13.800 1.00 0.00 C ATOM 1793 CD2 PHE A 117 0.526 10.306 15.024 1.00 0.00 C ATOM 1794 CE1 PHE A 117 0.886 13.027 14.745 1.00 0.00 C ATOM 1795 CE2 PHE A 117 1.246 11.007 15.973 1.00 0.00 C ATOM 1796 CZ PHE A 117 1.427 12.370 15.833 1.00 0.00 C ATOM 0 H PHE A 117 -2.187 11.689 14.616 1.00 0.00 H new ATOM 0 HA PHE A 117 -2.767 10.352 12.043 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -0.532 9.134 12.961 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -0.510 10.533 11.905 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -0.253 12.841 12.951 1.00 0.00 H new ATOM 0 HD2 PHE A 117 0.389 9.241 15.138 1.00 0.00 H new ATOM 0 HE1 PHE A 117 1.025 14.092 14.633 1.00 0.00 H new ATOM 0 HE2 PHE A 117 1.667 10.490 16.823 1.00 0.00 H new ATOM 0 HZ PHE A 117 1.990 12.920 16.572 1.00 0.00 H new ATOM 1806 N PRO A 118 -3.295 8.067 13.050 1.00 0.00 N ATOM 1807 CA PRO A 118 -3.846 6.852 13.644 1.00 0.00 C ATOM 1808 C PRO A 118 -2.765 5.915 14.155 1.00 0.00 C ATOM 1809 O PRO A 118 -1.636 5.945 13.667 1.00 0.00 O ATOM 1810 CB PRO A 118 -4.597 6.214 12.478 1.00 0.00 C ATOM 1811 CG PRO A 118 -3.837 6.634 11.270 1.00 0.00 C ATOM 1812 CD PRO A 118 -3.254 7.990 11.578 1.00 0.00 C ATOM 0 HA PRO A 118 -4.468 7.063 14.514 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -4.626 5.128 12.571 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -5.630 6.558 12.436 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -3.049 5.917 11.039 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -4.490 6.682 10.399 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -2.235 8.082 11.201 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -3.837 8.789 11.120 1.00 0.00 H new ATOM 1820 N SER A 119 -3.118 5.065 15.122 1.00 0.00 N ATOM 1821 CA SER A 119 -2.169 4.094 15.661 1.00 0.00 C ATOM 1822 C SER A 119 -1.858 3.101 14.559 1.00 0.00 C ATOM 1823 O SER A 119 -2.281 1.946 14.592 1.00 0.00 O ATOM 1824 CB SER A 119 -2.754 3.377 16.880 1.00 0.00 C ATOM 1825 OG SER A 119 -3.713 4.188 17.538 1.00 0.00 O ATOM 0 H SER A 119 -4.046 5.031 15.543 1.00 0.00 H new ATOM 0 HA SER A 119 -1.261 4.598 15.990 1.00 0.00 H new ATOM 0 HB2 SER A 119 -3.218 2.441 16.568 1.00 0.00 H new ATOM 0 HB3 SER A 119 -1.953 3.120 17.574 1.00 0.00 H new ATOM 0 HG SER A 119 -4.073 3.706 18.312 1.00 0.00 H new ATOM 1831 N ILE A 120 -1.169 3.602 13.547 1.00 0.00 N ATOM 1832 CA ILE A 120 -0.844 2.832 12.370 1.00 0.00 C ATOM 1833 C ILE A 120 0.482 3.302 11.779 1.00 0.00 C ATOM 1834 O ILE A 120 1.348 2.498 11.436 1.00 0.00 O ATOM 1835 CB ILE A 120 -1.984 3.016 11.342 1.00 0.00 C ATOM 1836 CG1 ILE A 120 -3.162 2.114 11.700 1.00 0.00 C ATOM 1837 CG2 ILE A 120 -1.519 2.755 9.926 1.00 0.00 C ATOM 1838 CD1 ILE A 120 -2.874 0.646 11.508 1.00 0.00 C ATOM 0 H ILE A 120 -0.820 4.560 13.524 1.00 0.00 H new ATOM 0 HA ILE A 120 -0.741 1.778 12.630 1.00 0.00 H new ATOM 0 HB ILE A 120 -2.306 4.057 11.385 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -3.441 2.289 12.739 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -4.021 2.391 11.089 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -2.352 2.896 9.238 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -0.718 3.449 9.672 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -1.152 1.732 9.846 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -3.754 0.064 11.781 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -2.624 0.458 10.464 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -2.035 0.354 12.140 1.00 0.00 H new ATOM 1850 N LEU A 121 0.622 4.618 11.674 1.00 0.00 N ATOM 1851 CA LEU A 121 1.833 5.226 11.136 1.00 0.00 C ATOM 1852 C LEU A 121 2.471 6.157 12.165 1.00 0.00 C ATOM 1853 O LEU A 121 3.097 7.156 11.809 1.00 0.00 O ATOM 1854 CB LEU A 121 1.529 5.993 9.838 1.00 0.00 C ATOM 1855 CG LEU A 121 0.296 6.915 9.854 1.00 0.00 C ATOM 1856 CD1 LEU A 121 -0.989 6.117 9.681 1.00 0.00 C ATOM 1857 CD2 LEU A 121 0.239 7.747 11.126 1.00 0.00 C ATOM 0 H LEU A 121 -0.093 5.288 11.956 1.00 0.00 H new ATOM 0 HA LEU A 121 2.538 4.427 10.906 1.00 0.00 H new ATOM 0 HB2 LEU A 121 2.402 6.596 9.586 1.00 0.00 H new ATOM 0 HB3 LEU A 121 1.401 5.267 9.035 1.00 0.00 H new ATOM 0 HG LEU A 121 0.392 7.598 9.010 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -1.843 6.794 9.696 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -0.963 5.587 8.729 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -1.082 5.397 10.494 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -0.644 8.386 11.104 1.00 0.00 H new ATOM 0 HD22 LEU A 121 0.187 7.086 11.991 1.00 0.00 H new ATOM 0 HD23 LEU A 121 1.133 8.366 11.196 1.00 0.00 H new ATOM 1869 N ARG A 122 2.299 5.820 13.442 1.00 0.00 N ATOM 1870 CA ARG A 122 2.842 6.617 14.542 1.00 0.00 C ATOM 1871 C ARG A 122 4.253 7.119 14.247 1.00 0.00 C ATOM 1872 O ARG A 122 4.566 8.286 14.483 1.00 0.00 O ATOM 1873 CB ARG A 122 2.843 5.799 15.835 1.00 0.00 C ATOM 1874 CG ARG A 122 3.388 4.390 15.667 1.00 0.00 C ATOM 1875 CD ARG A 122 2.959 3.488 16.814 1.00 0.00 C ATOM 1876 NE ARG A 122 3.514 2.143 16.690 1.00 0.00 N ATOM 1877 CZ ARG A 122 3.195 1.132 17.494 1.00 0.00 C ATOM 1878 NH1 ARG A 122 2.326 1.309 18.482 1.00 0.00 N ATOM 1879 NH2 ARG A 122 3.744 -0.060 17.311 1.00 0.00 N ATOM 0 H ARG A 122 1.783 4.993 13.743 1.00 0.00 H new ATOM 0 HA ARG A 122 2.198 7.489 14.658 1.00 0.00 H new ATOM 0 HB2 ARG A 122 3.437 6.322 16.585 1.00 0.00 H new ATOM 0 HB3 ARG A 122 1.824 5.742 16.219 1.00 0.00 H new ATOM 0 HG2 ARG A 122 3.037 3.973 14.723 1.00 0.00 H new ATOM 0 HG3 ARG A 122 4.476 4.423 15.616 1.00 0.00 H new ATOM 0 HD2 ARG A 122 3.279 3.926 17.759 1.00 0.00 H new ATOM 0 HD3 ARG A 122 1.871 3.430 16.842 1.00 0.00 H new ATOM 0 HE ARG A 122 4.186 1.968 15.943 1.00 0.00 H new ATOM 0 HH11 ARG A 122 1.899 2.224 18.628 1.00 0.00 H new ATOM 0 HH12 ARG A 122 2.085 0.530 19.095 1.00 0.00 H new ATOM 0 HH21 ARG A 122 4.412 -0.203 16.553 1.00 0.00 H new ATOM 0 HH22 ARG A 122 3.499 -0.834 17.928 1.00 0.00 H new ATOM 1893 N PHE A 123 5.100 6.238 13.736 1.00 0.00 N ATOM 1894 CA PHE A 123 6.476 6.602 13.415 1.00 0.00 C ATOM 1895 C PHE A 123 7.144 5.533 12.561 1.00 0.00 C ATOM 1896 O PHE A 123 8.359 5.339 12.625 1.00 0.00 O ATOM 1897 CB PHE A 123 7.277 6.815 14.701 1.00 0.00 C ATOM 1898 CG PHE A 123 8.558 7.572 14.495 1.00 0.00 C ATOM 1899 CD1 PHE A 123 8.569 8.761 13.783 1.00 0.00 C ATOM 1900 CD2 PHE A 123 9.753 7.095 15.013 1.00 0.00 C ATOM 1901 CE1 PHE A 123 9.747 9.461 13.592 1.00 0.00 C ATOM 1902 CE2 PHE A 123 10.932 7.789 14.826 1.00 0.00 C ATOM 1903 CZ PHE A 123 10.929 8.974 14.114 1.00 0.00 C ATOM 0 H PHE A 123 4.861 5.267 13.534 1.00 0.00 H new ATOM 0 HA PHE A 123 6.454 7.530 12.844 1.00 0.00 H new ATOM 0 HB2 PHE A 123 6.658 7.353 15.419 1.00 0.00 H new ATOM 0 HB3 PHE A 123 7.505 5.844 15.141 1.00 0.00 H new ATOM 0 HD1 PHE A 123 7.647 9.146 13.372 1.00 0.00 H new ATOM 0 HD2 PHE A 123 9.761 6.169 15.569 1.00 0.00 H new ATOM 0 HE1 PHE A 123 9.742 10.387 13.036 1.00 0.00 H new ATOM 0 HE2 PHE A 123 11.855 7.407 15.235 1.00 0.00 H new ATOM 0 HZ PHE A 123 11.850 9.518 13.966 1.00 0.00 H new ATOM 1913 N ILE A 124 6.346 4.835 11.762 1.00 0.00 N ATOM 1914 CA ILE A 124 6.850 3.787 10.899 1.00 0.00 C ATOM 1915 C ILE A 124 7.306 4.353 9.554 1.00 0.00 C ATOM 1916 O ILE A 124 7.269 5.565 9.338 1.00 0.00 O ATOM 1917 CB ILE A 124 5.773 2.710 10.681 1.00 0.00 C ATOM 1918 CG1 ILE A 124 4.661 3.229 9.761 1.00 0.00 C ATOM 1919 CG2 ILE A 124 5.195 2.267 12.020 1.00 0.00 C ATOM 1920 CD1 ILE A 124 3.498 2.269 9.612 1.00 0.00 C ATOM 0 H ILE A 124 5.339 4.982 11.698 1.00 0.00 H new ATOM 0 HA ILE A 124 7.712 3.334 11.388 1.00 0.00 H new ATOM 0 HB ILE A 124 6.238 1.851 10.198 1.00 0.00 H new ATOM 0 HG12 ILE A 124 4.291 4.177 10.152 1.00 0.00 H new ATOM 0 HG13 ILE A 124 5.081 3.433 8.776 1.00 0.00 H new ATOM 0 HG21 ILE A 124 4.434 1.505 11.853 1.00 0.00 H new ATOM 0 HG22 ILE A 124 5.990 1.856 12.642 1.00 0.00 H new ATOM 0 HG23 ILE A 124 4.747 3.123 12.524 1.00 0.00 H new ATOM 0 HD11 ILE A 124 2.751 2.703 8.948 1.00 0.00 H new ATOM 0 HD12 ILE A 124 3.854 1.328 9.192 1.00 0.00 H new ATOM 0 HD13 ILE A 124 3.051 2.084 10.589 1.00 0.00 H new ATOM 1932 N THR A 125 7.735 3.473 8.654 1.00 0.00 N ATOM 1933 CA THR A 125 8.198 3.894 7.334 1.00 0.00 C ATOM 1934 C THR A 125 7.120 4.692 6.606 1.00 0.00 C ATOM 1935 O THR A 125 6.200 4.122 6.023 1.00 0.00 O ATOM 1936 CB THR A 125 8.597 2.675 6.497 1.00 0.00 C ATOM 1937 OG1 THR A 125 9.708 2.013 7.074 1.00 0.00 O ATOM 1938 CG2 THR A 125 8.960 3.019 5.068 1.00 0.00 C ATOM 0 H THR A 125 7.772 2.466 8.813 1.00 0.00 H new ATOM 0 HA THR A 125 9.069 4.535 7.471 1.00 0.00 H new ATOM 0 HB THR A 125 7.716 2.034 6.485 1.00 0.00 H new ATOM 0 HG1 THR A 125 9.947 1.236 6.526 1.00 0.00 H new ATOM 0 HG21 THR A 125 9.232 2.109 4.533 1.00 0.00 H new ATOM 0 HG22 THR A 125 8.106 3.486 4.578 1.00 0.00 H new ATOM 0 HG23 THR A 125 9.804 3.709 5.063 1.00 0.00 H new ATOM 1946 N VAL A 126 7.240 6.014 6.640 1.00 0.00 N ATOM 1947 CA VAL A 126 6.275 6.883 5.986 1.00 0.00 C ATOM 1948 C VAL A 126 6.878 7.563 4.759 1.00 0.00 C ATOM 1949 O VAL A 126 8.007 8.051 4.799 1.00 0.00 O ATOM 1950 CB VAL A 126 5.747 7.957 6.955 1.00 0.00 C ATOM 1951 CG1 VAL A 126 6.866 8.892 7.389 1.00 0.00 C ATOM 1952 CG2 VAL A 126 4.605 8.737 6.318 1.00 0.00 C ATOM 0 H VAL A 126 7.997 6.506 7.114 1.00 0.00 H new ATOM 0 HA VAL A 126 5.446 6.251 5.667 1.00 0.00 H new ATOM 0 HB VAL A 126 5.364 7.456 7.844 1.00 0.00 H new ATOM 0 HG11 VAL A 126 6.469 9.642 8.073 1.00 0.00 H new ATOM 0 HG12 VAL A 126 7.645 8.319 7.892 1.00 0.00 H new ATOM 0 HG13 VAL A 126 7.287 9.386 6.514 1.00 0.00 H new ATOM 0 HG21 VAL A 126 4.245 9.491 7.018 1.00 0.00 H new ATOM 0 HG22 VAL A 126 4.959 9.224 5.410 1.00 0.00 H new ATOM 0 HG23 VAL A 126 3.792 8.055 6.070 1.00 0.00 H new ATOM 1962 N CYS A 127 6.114 7.590 3.671 1.00 0.00 N ATOM 1963 CA CYS A 127 6.569 8.208 2.431 1.00 0.00 C ATOM 1964 C CYS A 127 5.795 9.492 2.147 1.00 0.00 C ATOM 1965 O CYS A 127 4.719 9.461 1.548 1.00 0.00 O ATOM 1966 CB CYS A 127 6.409 7.233 1.263 1.00 0.00 C ATOM 1967 SG CYS A 127 7.535 7.543 -0.117 1.00 0.00 S ATOM 0 H CYS A 127 5.177 7.191 3.623 1.00 0.00 H new ATOM 0 HA CYS A 127 7.624 8.459 2.544 1.00 0.00 H new ATOM 0 HB2 CYS A 127 6.568 6.218 1.627 1.00 0.00 H new ATOM 0 HB3 CYS A 127 5.383 7.284 0.899 1.00 0.00 H new ATOM 0 HG CYS A 127 7.325 6.666 -1.054 1.00 0.00 H new ATOM 1973 N ASP A 128 6.348 10.619 2.581 1.00 0.00 N ATOM 1974 CA ASP A 128 5.713 11.916 2.376 1.00 0.00 C ATOM 1975 C ASP A 128 6.569 12.801 1.479 1.00 0.00 C ATOM 1976 O ASP A 128 7.784 12.888 1.654 1.00 0.00 O ATOM 1977 CB ASP A 128 5.466 12.614 3.717 1.00 0.00 C ATOM 1978 CG ASP A 128 6.432 12.171 4.801 1.00 0.00 C ATOM 1979 OD1 ASP A 128 7.615 11.929 4.481 1.00 0.00 O ATOM 1980 OD2 ASP A 128 6.005 12.069 5.971 1.00 0.00 O ATOM 0 H ASP A 128 7.237 10.661 3.079 1.00 0.00 H new ATOM 0 HA ASP A 128 4.754 11.747 1.886 1.00 0.00 H new ATOM 0 HB2 ASP A 128 5.551 13.692 3.581 1.00 0.00 H new ATOM 0 HB3 ASP A 128 4.445 12.413 4.043 1.00 0.00 H new ATOM 1985 N TYR A 129 5.928 13.461 0.519 1.00 0.00 N ATOM 1986 CA TYR A 129 6.639 14.340 -0.396 1.00 0.00 C ATOM 1987 C TYR A 129 6.983 15.657 0.287 1.00 0.00 C ATOM 1988 O TYR A 129 6.247 16.639 0.180 1.00 0.00 O ATOM 1989 CB TYR A 129 5.809 14.597 -1.657 1.00 0.00 C ATOM 1990 CG TYR A 129 5.131 13.358 -2.197 1.00 0.00 C ATOM 1991 CD1 TYR A 129 5.810 12.148 -2.272 1.00 0.00 C ATOM 1992 CD2 TYR A 129 3.812 13.398 -2.633 1.00 0.00 C ATOM 1993 CE1 TYR A 129 5.195 11.014 -2.766 1.00 0.00 C ATOM 1994 CE2 TYR A 129 3.190 12.267 -3.128 1.00 0.00 C ATOM 1995 CZ TYR A 129 3.886 11.078 -3.192 1.00 0.00 C ATOM 1996 OH TYR A 129 3.270 9.949 -3.684 1.00 0.00 O ATOM 0 H TYR A 129 4.923 13.403 0.357 1.00 0.00 H new ATOM 0 HA TYR A 129 7.566 13.847 -0.689 1.00 0.00 H new ATOM 0 HB2 TYR A 129 5.051 15.349 -1.436 1.00 0.00 H new ATOM 0 HB3 TYR A 129 6.456 15.013 -2.429 1.00 0.00 H new ATOM 0 HD1 TYR A 129 6.836 12.093 -1.938 1.00 0.00 H new ATOM 0 HD2 TYR A 129 3.264 14.327 -2.584 1.00 0.00 H new ATOM 0 HE1 TYR A 129 5.738 10.082 -2.818 1.00 0.00 H new ATOM 0 HE2 TYR A 129 2.164 12.314 -3.463 1.00 0.00 H new ATOM 0 HH TYR A 129 3.899 9.453 -4.248 1.00 0.00 H new ATOM 2006 N THR A 130 8.110 15.665 0.985 1.00 0.00 N ATOM 2007 CA THR A 130 8.572 16.856 1.691 1.00 0.00 C ATOM 2008 C THR A 130 9.468 17.685 0.781 1.00 0.00 C ATOM 2009 O THR A 130 9.330 18.904 0.690 1.00 0.00 O ATOM 2010 CB THR A 130 9.330 16.465 2.961 1.00 0.00 C ATOM 2011 OG1 THR A 130 10.562 15.847 2.638 1.00 0.00 O ATOM 2012 CG2 THR A 130 8.557 15.514 3.848 1.00 0.00 C ATOM 0 H THR A 130 8.725 14.857 1.079 1.00 0.00 H new ATOM 0 HA THR A 130 7.705 17.452 1.975 1.00 0.00 H new ATOM 0 HB THR A 130 9.487 17.397 3.504 1.00 0.00 H new ATOM 0 HG1 THR A 130 11.033 15.606 3.463 1.00 0.00 H new ATOM 0 HG21 THR A 130 9.150 15.277 4.731 1.00 0.00 H new ATOM 0 HG22 THR A 130 7.621 15.982 4.154 1.00 0.00 H new ATOM 0 HG23 THR A 130 8.342 14.598 3.298 1.00 0.00 H new ATOM 2020 N ASN A 131 10.369 16.999 0.092 1.00 0.00 N ATOM 2021 CA ASN A 131 11.283 17.643 -0.839 1.00 0.00 C ATOM 2022 C ASN A 131 11.129 17.010 -2.218 1.00 0.00 C ATOM 2023 O ASN A 131 12.097 16.515 -2.797 1.00 0.00 O ATOM 2024 CB ASN A 131 12.726 17.512 -0.350 1.00 0.00 C ATOM 2025 CG ASN A 131 13.157 18.689 0.503 1.00 0.00 C ATOM 2026 OD1 ASN A 131 13.196 19.827 0.036 1.00 0.00 O ATOM 2027 ND2 ASN A 131 13.483 18.421 1.763 1.00 0.00 N ATOM 0 H ASN A 131 10.486 15.988 0.162 1.00 0.00 H new ATOM 0 HA ASN A 131 11.042 18.704 -0.901 1.00 0.00 H new ATOM 0 HB2 ASN A 131 12.829 16.592 0.226 1.00 0.00 H new ATOM 0 HB3 ASN A 131 13.391 17.427 -1.209 1.00 0.00 H new ATOM 0 HD21 ASN A 131 13.780 19.174 2.384 1.00 0.00 H new ATOM 0 HD22 ASN A 131 13.436 17.463 2.109 1.00 0.00 H new ATOM 2034 N PRO A 132 9.892 17.007 -2.755 1.00 0.00 N ATOM 2035 CA PRO A 132 9.588 16.422 -4.057 1.00 0.00 C ATOM 2036 C PRO A 132 10.682 16.667 -5.089 1.00 0.00 C ATOM 2037 O PRO A 132 10.919 15.845 -5.973 1.00 0.00 O ATOM 2038 CB PRO A 132 8.307 17.143 -4.468 1.00 0.00 C ATOM 2039 CG PRO A 132 7.627 17.506 -3.190 1.00 0.00 C ATOM 2040 CD PRO A 132 8.686 17.564 -2.114 1.00 0.00 C ATOM 0 HA PRO A 132 9.497 15.337 -4.000 1.00 0.00 H new ATOM 0 HB2 PRO A 132 8.529 18.031 -5.060 1.00 0.00 H new ATOM 0 HB3 PRO A 132 7.674 16.501 -5.081 1.00 0.00 H new ATOM 0 HG2 PRO A 132 7.122 18.468 -3.284 1.00 0.00 H new ATOM 0 HG3 PRO A 132 6.864 16.769 -2.938 1.00 0.00 H new ATOM 0 HD2 PRO A 132 8.853 18.587 -1.775 1.00 0.00 H new ATOM 0 HD3 PRO A 132 8.396 16.982 -1.239 1.00 0.00 H new ATOM 2048 N CYS A 133 11.338 17.811 -4.968 1.00 0.00 N ATOM 2049 CA CYS A 133 12.409 18.189 -5.886 1.00 0.00 C ATOM 2050 C CYS A 133 13.464 17.093 -5.991 1.00 0.00 C ATOM 2051 O CYS A 133 13.932 16.770 -7.082 1.00 0.00 O ATOM 2052 CB CYS A 133 13.057 19.498 -5.430 1.00 0.00 C ATOM 2053 SG CYS A 133 12.496 20.955 -6.342 1.00 0.00 S ATOM 0 H CYS A 133 11.148 18.499 -4.240 1.00 0.00 H new ATOM 0 HA CYS A 133 11.969 18.330 -6.873 1.00 0.00 H new ATOM 0 HB2 CYS A 133 12.850 19.644 -4.370 1.00 0.00 H new ATOM 0 HB3 CYS A 133 14.139 19.411 -5.534 1.00 0.00 H new ATOM 0 HG CYS A 133 13.098 22.012 -5.883 1.00 0.00 H new ATOM 2059 N THR A 134 13.834 16.528 -4.849 1.00 0.00 N ATOM 2060 CA THR A 134 14.839 15.470 -4.811 1.00 0.00 C ATOM 2061 C THR A 134 14.220 14.139 -4.398 1.00 0.00 C ATOM 2062 O THR A 134 14.711 13.074 -4.772 1.00 0.00 O ATOM 2063 CB THR A 134 15.964 15.844 -3.845 1.00 0.00 C ATOM 2064 OG1 THR A 134 15.524 15.756 -2.502 1.00 0.00 O ATOM 2065 CG2 THR A 134 16.499 17.243 -4.063 1.00 0.00 C ATOM 0 H THR A 134 13.455 16.783 -3.937 1.00 0.00 H new ATOM 0 HA THR A 134 15.250 15.360 -5.815 1.00 0.00 H new ATOM 0 HB THR A 134 16.764 15.131 -4.044 1.00 0.00 H new ATOM 0 HG1 THR A 134 16.259 15.998 -1.900 1.00 0.00 H new ATOM 0 HG21 THR A 134 17.294 17.444 -3.345 1.00 0.00 H new ATOM 0 HG22 THR A 134 16.894 17.328 -5.075 1.00 0.00 H new ATOM 0 HG23 THR A 134 15.695 17.966 -3.926 1.00 0.00 H new ATOM 2073 N LYS A 135 13.139 14.204 -3.626 1.00 0.00 N ATOM 2074 CA LYS A 135 12.454 13.002 -3.166 1.00 0.00 C ATOM 2075 C LYS A 135 11.656 12.348 -4.297 1.00 0.00 C ATOM 2076 O LYS A 135 11.089 11.271 -4.119 1.00 0.00 O ATOM 2077 CB LYS A 135 11.527 13.338 -1.996 1.00 0.00 C ATOM 2078 CG LYS A 135 11.680 12.396 -0.811 1.00 0.00 C ATOM 2079 CD LYS A 135 11.923 13.160 0.482 1.00 0.00 C ATOM 2080 CE LYS A 135 13.398 13.179 0.851 1.00 0.00 C ATOM 2081 NZ LYS A 135 14.025 14.499 0.569 1.00 0.00 N ATOM 0 H LYS A 135 12.719 15.077 -3.306 1.00 0.00 H new ATOM 0 HA LYS A 135 13.211 12.292 -2.833 1.00 0.00 H new ATOM 0 HB2 LYS A 135 11.725 14.358 -1.667 1.00 0.00 H new ATOM 0 HB3 LYS A 135 10.494 13.310 -2.342 1.00 0.00 H new ATOM 0 HG2 LYS A 135 10.782 11.787 -0.711 1.00 0.00 H new ATOM 0 HG3 LYS A 135 12.510 11.713 -0.993 1.00 0.00 H new ATOM 0 HD2 LYS A 135 11.561 14.182 0.375 1.00 0.00 H new ATOM 0 HD3 LYS A 135 11.351 12.702 1.289 1.00 0.00 H new ATOM 0 HE2 LYS A 135 13.510 12.943 1.909 1.00 0.00 H new ATOM 0 HE3 LYS A 135 13.921 12.402 0.294 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 15.060 14.403 0.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 13.726 14.832 -0.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 13.727 15.186 1.291 1.00 0.00 H new ATOM 2095 N SER A 136 11.613 13.005 -5.457 1.00 0.00 N ATOM 2096 CA SER A 136 10.879 12.483 -6.609 1.00 0.00 C ATOM 2097 C SER A 136 11.228 11.020 -6.881 1.00 0.00 C ATOM 2098 O SER A 136 10.432 10.284 -7.464 1.00 0.00 O ATOM 2099 CB SER A 136 11.174 13.329 -7.849 1.00 0.00 C ATOM 2100 OG SER A 136 12.362 12.899 -8.492 1.00 0.00 O ATOM 0 H SER A 136 12.077 13.898 -5.623 1.00 0.00 H new ATOM 0 HA SER A 136 9.815 12.537 -6.378 1.00 0.00 H new ATOM 0 HB2 SER A 136 10.337 13.264 -8.544 1.00 0.00 H new ATOM 0 HB3 SER A 136 11.271 14.376 -7.563 1.00 0.00 H new ATOM 0 HG SER A 136 12.526 13.455 -9.282 1.00 0.00 H new ATOM 2106 N TRP A 137 12.418 10.605 -6.460 1.00 0.00 N ATOM 2107 CA TRP A 137 12.862 9.228 -6.665 1.00 0.00 C ATOM 2108 C TRP A 137 12.126 8.254 -5.743 1.00 0.00 C ATOM 2109 O TRP A 137 12.331 7.044 -5.823 1.00 0.00 O ATOM 2110 CB TRP A 137 14.373 9.109 -6.445 1.00 0.00 C ATOM 2111 CG TRP A 137 14.865 9.836 -5.230 1.00 0.00 C ATOM 2112 CD1 TRP A 137 14.172 10.073 -4.077 1.00 0.00 C ATOM 2113 CD2 TRP A 137 16.159 10.424 -5.048 1.00 0.00 C ATOM 2114 NE1 TRP A 137 14.956 10.771 -3.190 1.00 0.00 N ATOM 2115 CE2 TRP A 137 16.180 10.998 -3.763 1.00 0.00 C ATOM 2116 CE3 TRP A 137 17.302 10.519 -5.847 1.00 0.00 C ATOM 2117 CZ2 TRP A 137 17.299 11.655 -3.260 1.00 0.00 C ATOM 2118 CZ3 TRP A 137 18.412 11.173 -5.347 1.00 0.00 C ATOM 2119 CH2 TRP A 137 18.403 11.734 -4.064 1.00 0.00 C ATOM 0 H TRP A 137 13.091 11.199 -5.976 1.00 0.00 H new ATOM 0 HA TRP A 137 12.628 8.963 -7.696 1.00 0.00 H new ATOM 0 HB2 TRP A 137 14.636 8.055 -6.358 1.00 0.00 H new ATOM 0 HB3 TRP A 137 14.890 9.496 -7.323 1.00 0.00 H new ATOM 0 HD1 TRP A 137 13.156 9.758 -3.890 1.00 0.00 H new ATOM 0 HE1 TRP A 137 14.673 11.071 -2.257 1.00 0.00 H new ATOM 0 HE3 TRP A 137 17.317 10.089 -6.838 1.00 0.00 H new ATOM 0 HZ2 TRP A 137 17.296 12.087 -2.270 1.00 0.00 H new ATOM 0 HZ3 TRP A 137 19.301 11.253 -5.956 1.00 0.00 H new ATOM 0 HH2 TRP A 137 19.286 12.240 -3.702 1.00 0.00 H new ATOM 2130 N PHE A 138 11.267 8.782 -4.869 1.00 0.00 N ATOM 2131 CA PHE A 138 10.509 7.948 -3.943 1.00 0.00 C ATOM 2132 C PHE A 138 9.835 6.785 -4.670 1.00 0.00 C ATOM 2133 O PHE A 138 9.598 5.728 -4.085 1.00 0.00 O ATOM 2134 CB PHE A 138 9.465 8.797 -3.209 1.00 0.00 C ATOM 2135 CG PHE A 138 8.261 9.144 -4.043 1.00 0.00 C ATOM 2136 CD1 PHE A 138 7.255 8.213 -4.255 1.00 0.00 C ATOM 2137 CD2 PHE A 138 8.133 10.402 -4.612 1.00 0.00 C ATOM 2138 CE1 PHE A 138 6.148 8.530 -5.018 1.00 0.00 C ATOM 2139 CE2 PHE A 138 7.028 10.724 -5.376 1.00 0.00 C ATOM 2140 CZ PHE A 138 6.034 9.786 -5.579 1.00 0.00 C ATOM 0 H PHE A 138 11.081 9.781 -4.785 1.00 0.00 H new ATOM 0 HA PHE A 138 11.203 7.528 -3.215 1.00 0.00 H new ATOM 0 HB2 PHE A 138 9.135 8.260 -2.320 1.00 0.00 H new ATOM 0 HB3 PHE A 138 9.936 9.719 -2.868 1.00 0.00 H new ATOM 0 HD1 PHE A 138 7.338 7.229 -3.818 1.00 0.00 H new ATOM 0 HD2 PHE A 138 8.907 11.139 -4.456 1.00 0.00 H new ATOM 0 HE1 PHE A 138 5.372 7.795 -5.176 1.00 0.00 H new ATOM 0 HE2 PHE A 138 6.941 11.707 -5.814 1.00 0.00 H new ATOM 0 HZ PHE A 138 5.169 10.035 -6.176 1.00 0.00 H new ATOM 2150 N TRP A 139 9.531 6.989 -5.950 1.00 0.00 N ATOM 2151 CA TRP A 139 8.885 5.962 -6.760 1.00 0.00 C ATOM 2152 C TRP A 139 9.679 4.659 -6.725 1.00 0.00 C ATOM 2153 O TRP A 139 9.113 3.582 -6.533 1.00 0.00 O ATOM 2154 CB TRP A 139 8.740 6.445 -8.204 1.00 0.00 C ATOM 2155 CG TRP A 139 7.570 7.358 -8.407 1.00 0.00 C ATOM 2156 CD1 TRP A 139 6.291 7.160 -7.973 1.00 0.00 C ATOM 2157 CD2 TRP A 139 7.571 8.614 -9.095 1.00 0.00 C ATOM 2158 NE1 TRP A 139 5.496 8.216 -8.350 1.00 0.00 N ATOM 2159 CE2 TRP A 139 6.259 9.122 -9.041 1.00 0.00 C ATOM 2160 CE3 TRP A 139 8.554 9.359 -9.753 1.00 0.00 C ATOM 2161 CZ2 TRP A 139 5.906 10.338 -9.618 1.00 0.00 C ATOM 2162 CZ3 TRP A 139 8.203 10.566 -10.325 1.00 0.00 C ATOM 2163 CH2 TRP A 139 6.890 11.047 -10.254 1.00 0.00 C ATOM 0 H TRP A 139 9.723 7.858 -6.448 1.00 0.00 H new ATOM 0 HA TRP A 139 7.896 5.773 -6.343 1.00 0.00 H new ATOM 0 HB2 TRP A 139 9.652 6.963 -8.500 1.00 0.00 H new ATOM 0 HB3 TRP A 139 8.636 5.581 -8.860 1.00 0.00 H new ATOM 0 HD1 TRP A 139 5.953 6.299 -7.415 1.00 0.00 H new ATOM 0 HE1 TRP A 139 4.501 8.310 -8.149 1.00 0.00 H new ATOM 0 HE3 TRP A 139 9.570 8.997 -9.813 1.00 0.00 H new ATOM 0 HZ2 TRP A 139 4.893 10.709 -9.566 1.00 0.00 H new ATOM 0 HZ3 TRP A 139 8.955 11.149 -10.836 1.00 0.00 H new ATOM 0 HH2 TRP A 139 6.648 11.996 -10.710 1.00 0.00 H new ATOM 2174 N THR A 140 10.990 4.766 -6.907 1.00 0.00 N ATOM 2175 CA THR A 140 11.860 3.595 -6.895 1.00 0.00 C ATOM 2176 C THR A 140 11.912 2.977 -5.503 1.00 0.00 C ATOM 2177 O THR A 140 12.063 1.763 -5.358 1.00 0.00 O ATOM 2178 CB THR A 140 13.271 3.979 -7.349 1.00 0.00 C ATOM 2179 OG1 THR A 140 13.219 4.810 -8.494 1.00 0.00 O ATOM 2180 CG2 THR A 140 14.137 2.785 -7.686 1.00 0.00 C ATOM 0 H THR A 140 11.474 5.650 -7.064 1.00 0.00 H new ATOM 0 HA THR A 140 11.452 2.858 -7.587 1.00 0.00 H new ATOM 0 HB THR A 140 13.716 4.501 -6.502 1.00 0.00 H new ATOM 0 HG1 THR A 140 14.130 5.046 -8.768 1.00 0.00 H new ATOM 0 HG21 THR A 140 15.123 3.128 -8.000 1.00 0.00 H new ATOM 0 HG22 THR A 140 14.237 2.149 -6.807 1.00 0.00 H new ATOM 0 HG23 THR A 140 13.676 2.217 -8.494 1.00 0.00 H new ATOM 2188 N ARG A 141 11.781 3.816 -4.482 1.00 0.00 N ATOM 2189 CA ARG A 141 11.808 3.348 -3.102 1.00 0.00 C ATOM 2190 C ARG A 141 10.662 2.374 -2.846 1.00 0.00 C ATOM 2191 O ARG A 141 10.873 1.276 -2.330 1.00 0.00 O ATOM 2192 CB ARG A 141 11.720 4.533 -2.137 1.00 0.00 C ATOM 2193 CG ARG A 141 13.047 4.889 -1.489 1.00 0.00 C ATOM 2194 CD ARG A 141 12.872 5.929 -0.394 1.00 0.00 C ATOM 2195 NE ARG A 141 12.502 5.324 0.881 1.00 0.00 N ATOM 2196 CZ ARG A 141 12.161 6.022 1.962 1.00 0.00 C ATOM 2197 NH1 ARG A 141 12.139 7.348 1.925 1.00 0.00 N ATOM 2198 NH2 ARG A 141 11.837 5.393 3.083 1.00 0.00 N ATOM 0 H ARG A 141 11.655 4.823 -4.584 1.00 0.00 H new ATOM 0 HA ARG A 141 12.751 2.827 -2.933 1.00 0.00 H new ATOM 0 HB2 ARG A 141 11.343 5.402 -2.676 1.00 0.00 H new ATOM 0 HB3 ARG A 141 10.994 4.303 -1.357 1.00 0.00 H new ATOM 0 HG2 ARG A 141 13.501 3.991 -1.070 1.00 0.00 H new ATOM 0 HG3 ARG A 141 13.733 5.269 -2.247 1.00 0.00 H new ATOM 0 HD2 ARG A 141 13.800 6.489 -0.274 1.00 0.00 H new ATOM 0 HD3 ARG A 141 12.105 6.644 -0.692 1.00 0.00 H new ATOM 0 HE ARG A 141 12.505 4.306 0.948 1.00 0.00 H new ATOM 0 HH11 ARG A 141 12.384 7.838 1.065 1.00 0.00 H new ATOM 0 HH12 ARG A 141 11.877 7.877 2.757 1.00 0.00 H new ATOM 0 HH21 ARG A 141 11.849 4.374 3.118 1.00 0.00 H new ATOM 0 HH22 ARG A 141 11.576 5.928 3.911 1.00 0.00 H new ATOM 2212 N LEU A 142 9.452 2.783 -3.212 1.00 0.00 N ATOM 2213 CA LEU A 142 8.274 1.945 -3.026 1.00 0.00 C ATOM 2214 C LEU A 142 8.247 0.818 -4.051 1.00 0.00 C ATOM 2215 O LEU A 142 7.818 -0.297 -3.752 1.00 0.00 O ATOM 2216 CB LEU A 142 7.000 2.785 -3.139 1.00 0.00 C ATOM 2217 CG LEU A 142 5.769 2.189 -2.455 1.00 0.00 C ATOM 2218 CD1 LEU A 142 5.954 2.169 -0.946 1.00 0.00 C ATOM 2219 CD2 LEU A 142 4.520 2.972 -2.831 1.00 0.00 C ATOM 0 H LEU A 142 9.262 3.690 -3.639 1.00 0.00 H new ATOM 0 HA LEU A 142 8.322 1.507 -2.029 1.00 0.00 H new ATOM 0 HB2 LEU A 142 7.193 3.769 -2.712 1.00 0.00 H new ATOM 0 HB3 LEU A 142 6.774 2.934 -4.195 1.00 0.00 H new ATOM 0 HG LEU A 142 5.647 1.162 -2.799 1.00 0.00 H new ATOM 0 HD11 LEU A 142 5.068 1.742 -0.476 1.00 0.00 H new ATOM 0 HD12 LEU A 142 6.825 1.565 -0.694 1.00 0.00 H new ATOM 0 HD13 LEU A 142 6.101 3.187 -0.584 1.00 0.00 H new ATOM 0 HD21 LEU A 142 3.653 2.534 -2.336 1.00 0.00 H new ATOM 0 HD22 LEU A 142 4.632 4.009 -2.516 1.00 0.00 H new ATOM 0 HD23 LEU A 142 4.378 2.934 -3.911 1.00 0.00 H new ATOM 2231 N ALA A 143 8.710 1.116 -5.259 1.00 0.00 N ATOM 2232 CA ALA A 143 8.745 0.127 -6.331 1.00 0.00 C ATOM 2233 C ALA A 143 9.768 -0.963 -6.032 1.00 0.00 C ATOM 2234 O ALA A 143 9.575 -2.125 -6.385 1.00 0.00 O ATOM 2235 CB ALA A 143 9.058 0.800 -7.659 1.00 0.00 C ATOM 0 H ALA A 143 9.067 2.035 -5.521 1.00 0.00 H new ATOM 0 HA ALA A 143 7.762 -0.340 -6.398 1.00 0.00 H new ATOM 0 HB1 ALA A 143 9.081 0.051 -8.450 1.00 0.00 H new ATOM 0 HB2 ALA A 143 8.289 1.540 -7.882 1.00 0.00 H new ATOM 0 HB3 ALA A 143 10.028 1.293 -7.597 1.00 0.00 H new ATOM 2241 N LYS A 144 10.858 -0.574 -5.382 1.00 0.00 N ATOM 2242 CA LYS A 144 11.920 -1.511 -5.032 1.00 0.00 C ATOM 2243 C LYS A 144 11.731 -2.065 -3.618 1.00 0.00 C ATOM 2244 O LYS A 144 12.425 -2.998 -3.214 1.00 0.00 O ATOM 2245 CB LYS A 144 13.281 -0.825 -5.148 1.00 0.00 C ATOM 2246 CG LYS A 144 14.457 -1.747 -4.863 1.00 0.00 C ATOM 2247 CD LYS A 144 15.268 -1.271 -3.665 1.00 0.00 C ATOM 2248 CE LYS A 144 15.126 -2.217 -2.483 1.00 0.00 C ATOM 2249 NZ LYS A 144 16.128 -1.931 -1.419 1.00 0.00 N ATOM 0 H LYS A 144 11.031 0.387 -5.086 1.00 0.00 H new ATOM 0 HA LYS A 144 11.875 -2.347 -5.730 1.00 0.00 H new ATOM 0 HB2 LYS A 144 13.387 -0.415 -6.153 1.00 0.00 H new ATOM 0 HB3 LYS A 144 13.314 0.016 -4.456 1.00 0.00 H new ATOM 0 HG2 LYS A 144 14.091 -2.757 -4.677 1.00 0.00 H new ATOM 0 HG3 LYS A 144 15.101 -1.798 -5.741 1.00 0.00 H new ATOM 0 HD2 LYS A 144 16.319 -1.192 -3.944 1.00 0.00 H new ATOM 0 HD3 LYS A 144 14.939 -0.273 -3.375 1.00 0.00 H new ATOM 0 HE2 LYS A 144 14.122 -2.131 -2.068 1.00 0.00 H new ATOM 0 HE3 LYS A 144 15.243 -3.245 -2.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 15.998 -2.597 -0.631 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 17.087 -2.037 -1.807 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 16.000 -0.958 -1.074 1.00 0.00 H new ATOM 2263 N ALA A 145 10.793 -1.488 -2.871 1.00 0.00 N ATOM 2264 CA ALA A 145 10.520 -1.927 -1.508 1.00 0.00 C ATOM 2265 C ALA A 145 9.379 -2.939 -1.470 1.00 0.00 C ATOM 2266 O ALA A 145 9.269 -3.729 -0.532 1.00 0.00 O ATOM 2267 CB ALA A 145 10.195 -0.735 -0.622 1.00 0.00 C ATOM 0 H ALA A 145 10.209 -0.714 -3.189 1.00 0.00 H new ATOM 0 HA ALA A 145 11.417 -2.416 -1.129 1.00 0.00 H new ATOM 0 HB1 ALA A 145 9.994 -1.080 0.392 1.00 0.00 H new ATOM 0 HB2 ALA A 145 11.042 -0.049 -0.611 1.00 0.00 H new ATOM 0 HB3 ALA A 145 9.316 -0.221 -1.012 1.00 0.00 H new ATOM 2273 N LEU A 146 8.528 -2.904 -2.489 1.00 0.00 N ATOM 2274 CA LEU A 146 7.393 -3.810 -2.568 1.00 0.00 C ATOM 2275 C LEU A 146 7.722 -5.052 -3.396 1.00 0.00 C ATOM 2276 O LEU A 146 6.868 -5.916 -3.589 1.00 0.00 O ATOM 2277 CB LEU A 146 6.196 -3.083 -3.178 1.00 0.00 C ATOM 2278 CG LEU A 146 5.452 -2.143 -2.228 1.00 0.00 C ATOM 2279 CD1 LEU A 146 4.529 -1.218 -3.009 1.00 0.00 C ATOM 2280 CD2 LEU A 146 4.667 -2.936 -1.193 1.00 0.00 C ATOM 0 H LEU A 146 8.605 -2.256 -3.273 1.00 0.00 H new ATOM 0 HA LEU A 146 7.151 -4.137 -1.557 1.00 0.00 H new ATOM 0 HB2 LEU A 146 6.540 -2.507 -4.037 1.00 0.00 H new ATOM 0 HB3 LEU A 146 5.492 -3.826 -3.553 1.00 0.00 H new ATOM 0 HG LEU A 146 6.187 -1.533 -1.703 1.00 0.00 H new ATOM 0 HD11 LEU A 146 4.007 -0.556 -2.318 1.00 0.00 H new ATOM 0 HD12 LEU A 146 5.117 -0.623 -3.708 1.00 0.00 H new ATOM 0 HD13 LEU A 146 3.801 -1.812 -3.561 1.00 0.00 H new ATOM 0 HD21 LEU A 146 4.145 -2.249 -0.527 1.00 0.00 H new ATOM 0 HD22 LEU A 146 3.941 -3.574 -1.697 1.00 0.00 H new ATOM 0 HD23 LEU A 146 5.352 -3.554 -0.612 1.00 0.00 H new ATOM 2292 N SER A 147 8.957 -5.139 -3.892 1.00 0.00 N ATOM 2293 CA SER A 147 9.365 -6.280 -4.702 1.00 0.00 C ATOM 2294 C SER A 147 10.565 -7.005 -4.100 1.00 0.00 C ATOM 2295 O SER A 147 11.259 -7.749 -4.792 1.00 0.00 O ATOM 2296 CB SER A 147 9.688 -5.829 -6.128 1.00 0.00 C ATOM 2297 OG SER A 147 8.566 -5.985 -6.978 1.00 0.00 O ATOM 0 H SER A 147 9.684 -4.438 -3.747 1.00 0.00 H new ATOM 0 HA SER A 147 8.530 -6.981 -4.723 1.00 0.00 H new ATOM 0 HB2 SER A 147 10.000 -4.785 -6.121 1.00 0.00 H new ATOM 0 HB3 SER A 147 10.525 -6.409 -6.516 1.00 0.00 H new ATOM 0 HG SER A 147 7.926 -6.602 -6.566 1.00 0.00 H new