USER MOD reduce.3.24.130724 H: found=0, std=0, add=1138, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1135 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 17 THR OG1 : rot -55:sc= 1.24 USER MOD Set 1.2: A 110 HIS : no HD1:sc= -0.769 X(o=0.47,f=0.07) USER MOD Set 2.1: A 31 MET CE :methyl 141:sc= -2.12 (180deg=-5.99!) USER MOD Set 2.2: A 107 CYS SG : rot -21:sc= -4.24! USER MOD Set 3.1: A 36 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 155:sc= 0.435 (180deg=0.206) USER MOD Single : A 2 ASN : amide:sc= 0 X(o=0,f=-0.085) USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 GLN : amide:sc=-0.00991 K(o=-0.0099,f=-1.5) USER MOD Single : A 27 THR OG1 : rot 180:sc= -0.741 USER MOD Single : A 30 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 32 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 38 MET CE :methyl -162:sc= -0.103 (180deg=-0.343) USER MOD Single : A 43 MET CE :methyl -133:sc= -1.05 (180deg=-6.44!) USER MOD Single : A 44 LYS NZ :NH3+ -176:sc= -0.303 (180deg=-0.498) USER MOD Single : A 45 LYS NZ :NH3+ 150:sc= 0.126 (180deg=-0.755) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ -151:sc= -0.0959 (180deg=-0.52) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 THR OG1 : rot 180:sc= 0.41 USER MOD Single : A 53 ASN : amide:sc= -0.533 K(o=-0.53,f=-3.3!) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 GLN : amide:sc= -0.0128 X(o=-0.013,f=-0.012) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0.17 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -0.282 X(o=-0.28,f=-0.0085) USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.151) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 THR OG1 : rot -170:sc= -1.8! USER MOD Single : A 92 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 94 GLN : amide:sc= -0.438 K(o=-0.44,f=-1.3) USER MOD Single : A 100 SER OG : rot -169:sc= 1 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 CYS SG : rot -140:sc= -0.638 USER MOD Single : A 123 THR OG1 : rot 180:sc= -0.0513 USER MOD Single : A 125 TYR OH : rot 98:sc= 1.14 USER MOD Single : A 126 TYR OH : rot 180:sc= -0.742 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.329 0.000 0.000 1.00 0.00 N ATOM 2 CA MET A 1 2.093 -0.001 -1.242 1.00 52.33 C ATOM 3 C MET A 1 2.043 -1.371 -1.910 1.00 64.31 C ATOM 4 O MET A 1 1.838 -2.387 -1.248 1.00 32.42 O ATOM 5 CB MET A 1 3.546 0.396 -0.973 1.00 55.30 C ATOM 6 CG MET A 1 3.763 1.899 -0.909 1.00 51.41 C ATOM 7 SD MET A 1 3.324 2.597 0.695 1.00 43.13 S ATOM 8 CE MET A 1 1.947 3.649 0.241 1.00 22.32 C ATOM 0 H1 MET A 1 1.695 0.740 0.632 1.00 0.00 H new ATOM 0 H2 MET A 1 0.327 0.187 -0.209 1.00 0.00 H new ATOM 0 H3 MET A 1 1.419 -0.927 0.464 1.00 0.00 H new ATOM 0 HA MET A 1 1.644 0.729 -1.916 1.00 52.33 H new ATOM 0 HB2 MET A 1 3.868 -0.050 -0.032 1.00 55.30 H new ATOM 0 HB3 MET A 1 4.179 -0.021 -1.756 1.00 55.30 H new ATOM 0 HG2 MET A 1 4.808 2.121 -1.123 1.00 51.41 H new ATOM 0 HG3 MET A 1 3.169 2.381 -1.685 1.00 51.41 H new ATOM 0 HE1 MET A 1 1.565 4.151 1.129 1.00 22.32 H new ATOM 0 HE2 MET A 1 2.281 4.394 -0.482 1.00 22.32 H new ATOM 0 HE3 MET A 1 1.156 3.043 -0.201 1.00 22.32 H new ATOM 18 N ASN A 2 2.233 -1.391 -3.225 1.00 41.04 N ATOM 19 CA ASN A 2 2.209 -2.637 -3.983 1.00 21.25 C ATOM 20 C ASN A 2 3.608 -3.236 -4.089 1.00 44.12 C ATOM 21 O ASN A 2 3.813 -4.417 -3.806 1.00 53.45 O ATOM 22 CB ASN A 2 1.637 -2.398 -5.381 1.00 53.31 C ATOM 23 CG ASN A 2 0.185 -1.960 -5.345 1.00 21.35 C ATOM 24 OD1 ASN A 2 -0.123 -0.822 -4.992 1.00 10.21 O ATOM 25 ND2 ASN A 2 -0.715 -2.866 -5.710 1.00 1.12 N ATOM 0 H ASN A 2 2.405 -0.558 -3.788 1.00 41.04 H new ATOM 0 HA ASN A 2 1.570 -3.343 -3.453 1.00 21.25 H new ATOM 0 HB2 ASN A 2 2.231 -1.637 -5.888 1.00 53.31 H new ATOM 0 HB3 ASN A 2 1.723 -3.313 -5.967 1.00 53.31 H new ATOM 0 HD21 ASN A 2 -1.707 -2.630 -5.705 1.00 1.12 H new ATOM 0 HD22 ASN A 2 -0.414 -3.798 -5.995 1.00 1.12 H new ATOM 32 N ASP A 3 4.568 -2.413 -4.498 1.00 70.42 N ATOM 33 CA ASP A 3 5.949 -2.860 -4.641 1.00 32.43 C ATOM 34 C ASP A 3 6.664 -2.852 -3.294 1.00 24.35 C ATOM 35 O ASP A 3 7.233 -1.838 -2.888 1.00 14.12 O ATOM 36 CB ASP A 3 6.696 -1.969 -5.634 1.00 73.55 C ATOM 37 CG ASP A 3 5.812 -1.508 -6.776 1.00 73.24 C ATOM 38 OD1 ASP A 3 5.154 -0.457 -6.630 1.00 4.31 O ATOM 39 OD2 ASP A 3 5.776 -2.199 -7.816 1.00 64.14 O ATOM 0 H ASP A 3 4.415 -1.433 -4.736 1.00 70.42 H new ATOM 0 HA ASP A 3 5.937 -3.882 -5.020 1.00 32.43 H new ATOM 0 HB2 ASP A 3 7.092 -1.099 -5.110 1.00 73.55 H new ATOM 0 HB3 ASP A 3 7.550 -2.514 -6.036 1.00 73.55 H new ATOM 44 N ILE A 4 6.632 -3.988 -2.605 1.00 74.20 N ATOM 45 CA ILE A 4 7.277 -4.111 -1.304 1.00 30.21 C ATOM 46 C ILE A 4 8.369 -5.175 -1.330 1.00 72.43 C ATOM 47 O ILE A 4 8.324 -6.105 -2.136 1.00 44.13 O ATOM 48 CB ILE A 4 6.260 -4.462 -0.202 1.00 30.31 C ATOM 49 CG1 ILE A 4 5.138 -5.332 -0.772 1.00 33.32 C ATOM 50 CG2 ILE A 4 5.692 -3.194 0.418 1.00 71.40 C ATOM 51 CD1 ILE A 4 5.622 -6.647 -1.342 1.00 24.15 C ATOM 0 H ILE A 4 6.166 -4.836 -2.927 1.00 74.20 H new ATOM 0 HA ILE A 4 7.723 -3.142 -1.080 1.00 30.21 H new ATOM 0 HB ILE A 4 6.771 -5.026 0.578 1.00 30.31 H new ATOM 0 HG12 ILE A 4 4.410 -5.532 0.014 1.00 33.32 H new ATOM 0 HG13 ILE A 4 4.619 -4.776 -1.553 1.00 33.32 H new ATOM 0 HG21 ILE A 4 4.975 -3.459 1.195 1.00 71.40 H new ATOM 0 HG22 ILE A 4 6.501 -2.609 0.855 1.00 71.40 H new ATOM 0 HG23 ILE A 4 5.193 -2.605 -0.351 1.00 71.40 H new ATOM 0 HD11 ILE A 4 4.773 -7.211 -1.728 1.00 24.15 H new ATOM 0 HD12 ILE A 4 6.328 -6.455 -2.150 1.00 24.15 H new ATOM 0 HD13 ILE A 4 6.115 -7.223 -0.559 1.00 24.15 H new ATOM 63 N ARG A 5 9.347 -5.034 -0.442 1.00 43.42 N ATOM 64 CA ARG A 5 10.451 -5.983 -0.363 1.00 33.21 C ATOM 65 C ARG A 5 9.931 -7.405 -0.173 1.00 65.42 C ATOM 66 O ARG A 5 8.793 -7.610 0.250 1.00 41.35 O ATOM 67 CB ARG A 5 11.388 -5.613 0.788 1.00 62.31 C ATOM 68 CG ARG A 5 12.399 -4.537 0.428 1.00 1.10 C ATOM 69 CD ARG A 5 11.713 -3.237 0.037 1.00 4.04 C ATOM 70 NE ARG A 5 12.604 -2.087 0.169 1.00 22.23 N ATOM 71 CZ ARG A 5 12.196 -0.827 0.077 1.00 15.44 C ATOM 72 NH1 ARG A 5 10.917 -0.555 -0.145 1.00 70.33 N ATOM 73 NH2 ARG A 5 13.067 0.166 0.209 1.00 75.22 N ATOM 0 H ARG A 5 9.398 -4.271 0.233 1.00 43.42 H new ATOM 0 HA ARG A 5 11.004 -5.938 -1.301 1.00 33.21 H new ATOM 0 HB2 ARG A 5 10.793 -5.271 1.635 1.00 62.31 H new ATOM 0 HB3 ARG A 5 11.921 -6.506 1.113 1.00 62.31 H new ATOM 0 HG2 ARG A 5 13.061 -4.360 1.276 1.00 1.10 H new ATOM 0 HG3 ARG A 5 13.022 -4.883 -0.396 1.00 1.10 H new ATOM 0 HD2 ARG A 5 11.362 -3.308 -0.993 1.00 4.04 H new ATOM 0 HD3 ARG A 5 10.834 -3.088 0.664 1.00 4.04 H new ATOM 0 HE ARG A 5 13.594 -2.262 0.341 1.00 22.23 H new ATOM 0 HH11 ARG A 5 10.244 -1.315 -0.245 1.00 70.33 H new ATOM 0 HH12 ARG A 5 10.606 0.414 -0.215 1.00 70.33 H new ATOM 0 HH21 ARG A 5 14.051 -0.039 0.381 1.00 75.22 H new ATOM 0 HH22 ARG A 5 12.752 1.134 0.138 1.00 75.22 H new ATOM 87 N ILE A 6 10.773 -8.384 -0.489 1.00 0.01 N ATOM 88 CA ILE A 6 10.399 -9.786 -0.353 1.00 20.14 C ATOM 89 C ILE A 6 11.281 -10.493 0.671 1.00 35.14 C ATOM 90 O ILE A 6 10.878 -11.491 1.269 1.00 21.15 O ATOM 91 CB ILE A 6 10.498 -10.529 -1.698 1.00 41.42 C ATOM 92 CG1 ILE A 6 11.723 -10.050 -2.481 1.00 14.21 C ATOM 93 CG2 ILE A 6 9.229 -10.323 -2.512 1.00 10.55 C ATOM 94 CD1 ILE A 6 11.445 -8.854 -3.364 1.00 41.33 C ATOM 0 H ILE A 6 11.718 -8.232 -0.841 1.00 0.01 H new ATOM 0 HA ILE A 6 9.364 -9.804 -0.013 1.00 20.14 H new ATOM 0 HB ILE A 6 10.610 -11.595 -1.500 1.00 41.42 H new ATOM 0 HG12 ILE A 6 12.517 -9.796 -1.779 1.00 14.21 H new ATOM 0 HG13 ILE A 6 12.093 -10.869 -3.098 1.00 14.21 H new ATOM 0 HG21 ILE A 6 9.314 -10.854 -3.460 1.00 10.55 H new ATOM 0 HG22 ILE A 6 8.374 -10.708 -1.956 1.00 10.55 H new ATOM 0 HG23 ILE A 6 9.088 -9.259 -2.704 1.00 10.55 H new ATOM 0 HD11 ILE A 6 12.357 -8.569 -3.889 1.00 41.33 H new ATOM 0 HD12 ILE A 6 10.673 -9.109 -4.090 1.00 41.33 H new ATOM 0 HD13 ILE A 6 11.104 -8.020 -2.750 1.00 41.33 H new ATOM 106 N VAL A 7 12.485 -9.968 0.870 1.00 3.12 N ATOM 107 CA VAL A 7 13.424 -10.546 1.824 1.00 33.54 C ATOM 108 C VAL A 7 14.376 -9.488 2.370 1.00 71.05 C ATOM 109 O VAL A 7 15.282 -9.019 1.681 1.00 65.20 O ATOM 110 CB VAL A 7 14.246 -11.681 1.185 1.00 3.01 C ATOM 111 CG1 VAL A 7 13.358 -12.877 0.877 1.00 10.31 C ATOM 112 CG2 VAL A 7 14.946 -11.188 -0.073 1.00 13.14 C ATOM 0 H VAL A 7 12.834 -9.142 0.383 1.00 3.12 H new ATOM 0 HA VAL A 7 12.832 -10.953 2.643 1.00 33.54 H new ATOM 0 HB VAL A 7 15.008 -11.999 1.897 1.00 3.01 H new ATOM 0 HG11 VAL A 7 13.957 -13.668 0.426 1.00 10.31 H new ATOM 0 HG12 VAL A 7 12.908 -13.243 1.800 1.00 10.31 H new ATOM 0 HG13 VAL A 7 12.572 -12.578 0.184 1.00 10.31 H new ATOM 0 HG21 VAL A 7 15.522 -12.003 -0.512 1.00 13.14 H new ATOM 0 HG22 VAL A 7 14.203 -10.842 -0.791 1.00 13.14 H new ATOM 0 HG23 VAL A 7 15.615 -10.366 0.181 1.00 13.14 H new ATOM 122 N PRO A 8 14.168 -9.101 3.637 1.00 72.31 N ATOM 123 CA PRO A 8 14.998 -8.094 4.304 1.00 64.32 C ATOM 124 C PRO A 8 16.409 -8.601 4.587 1.00 55.13 C ATOM 125 O PRO A 8 16.773 -9.705 4.183 1.00 1.12 O ATOM 126 CB PRO A 8 14.252 -7.830 5.614 1.00 22.20 C ATOM 127 CG PRO A 8 13.481 -9.079 5.869 1.00 24.24 C ATOM 128 CD PRO A 8 13.106 -9.618 4.517 1.00 51.14 C ATOM 0 HA PRO A 8 15.133 -7.205 3.688 1.00 64.32 H new ATOM 0 HB2 PRO A 8 14.945 -7.619 6.429 1.00 22.20 H new ATOM 0 HB3 PRO A 8 13.591 -6.968 5.526 1.00 22.20 H new ATOM 0 HG2 PRO A 8 14.080 -9.801 6.424 1.00 24.24 H new ATOM 0 HG3 PRO A 8 12.593 -8.874 6.467 1.00 24.24 H new ATOM 0 HD2 PRO A 8 13.076 -10.708 4.513 1.00 51.14 H new ATOM 0 HD3 PRO A 8 12.121 -9.271 4.205 1.00 51.14 H new ATOM 136 N GLN A 9 17.196 -7.787 5.282 1.00 23.23 N ATOM 137 CA GLN A 9 18.567 -8.154 5.618 1.00 32.33 C ATOM 138 C GLN A 9 18.615 -8.944 6.922 1.00 33.21 C ATOM 139 O GLN A 9 17.671 -8.914 7.712 1.00 12.23 O ATOM 140 CB GLN A 9 19.439 -6.903 5.734 1.00 14.31 C ATOM 141 CG GLN A 9 19.038 -5.986 6.879 1.00 24.31 C ATOM 142 CD GLN A 9 20.074 -4.914 7.158 1.00 75.42 C ATOM 143 OE1 GLN A 9 20.161 -3.918 6.440 1.00 53.31 O ATOM 144 NE2 GLN A 9 20.865 -5.114 8.205 1.00 44.41 N ATOM 0 H GLN A 9 16.909 -6.870 5.623 1.00 23.23 H new ATOM 0 HA GLN A 9 18.954 -8.785 4.817 1.00 32.33 H new ATOM 0 HB2 GLN A 9 20.478 -7.205 5.868 1.00 14.31 H new ATOM 0 HB3 GLN A 9 19.387 -6.346 4.798 1.00 14.31 H new ATOM 0 HG2 GLN A 9 18.085 -5.512 6.644 1.00 24.31 H new ATOM 0 HG3 GLN A 9 18.885 -6.581 7.779 1.00 24.31 H new ATOM 0 HE21 GLN A 9 20.757 -5.955 8.773 1.00 44.41 H new ATOM 0 HE22 GLN A 9 21.581 -4.427 8.442 1.00 44.41 H new ATOM 153 N ILE A 10 19.719 -9.650 7.140 1.00 71.41 N ATOM 154 CA ILE A 10 19.889 -10.448 8.348 1.00 3.53 C ATOM 155 C ILE A 10 21.028 -9.907 9.207 1.00 35.33 C ATOM 156 O ILE A 10 22.080 -9.525 8.695 1.00 41.20 O ATOM 157 CB ILE A 10 20.170 -11.924 8.014 1.00 62.35 C ATOM 158 CG1 ILE A 10 21.176 -12.027 6.865 1.00 72.21 C ATOM 159 CG2 ILE A 10 18.877 -12.642 7.658 1.00 33.11 C ATOM 160 CD1 ILE A 10 21.627 -13.443 6.582 1.00 3.11 C ATOM 0 H ILE A 10 20.509 -9.686 6.496 1.00 71.41 H new ATOM 0 HA ILE A 10 18.954 -10.382 8.904 1.00 3.53 H new ATOM 0 HB ILE A 10 20.600 -12.404 8.893 1.00 62.35 H new ATOM 0 HG12 ILE A 10 20.729 -11.610 5.963 1.00 72.21 H new ATOM 0 HG13 ILE A 10 22.048 -11.417 7.100 1.00 72.21 H new ATOM 0 HG21 ILE A 10 19.092 -13.685 7.424 1.00 33.11 H new ATOM 0 HG22 ILE A 10 18.190 -12.594 8.503 1.00 33.11 H new ATOM 0 HG23 ILE A 10 18.421 -12.163 6.792 1.00 33.11 H new ATOM 0 HD11 ILE A 10 22.339 -13.440 5.756 1.00 3.11 H new ATOM 0 HD12 ILE A 10 22.104 -13.857 7.470 1.00 3.11 H new ATOM 0 HD13 ILE A 10 20.764 -14.053 6.315 1.00 3.11 H new ATOM 172 N THR A 11 20.810 -9.880 10.519 1.00 45.13 N ATOM 173 CA THR A 11 21.818 -9.387 11.450 1.00 74.41 C ATOM 174 C THR A 11 22.340 -10.510 12.339 1.00 65.24 C ATOM 175 O THR A 11 22.076 -11.686 12.089 1.00 21.51 O ATOM 176 CB THR A 11 21.257 -8.262 12.340 1.00 23.21 C ATOM 177 OG1 THR A 11 19.993 -7.820 11.833 1.00 44.41 O ATOM 178 CG2 THR A 11 22.224 -7.089 12.402 1.00 53.02 C ATOM 0 H THR A 11 19.945 -10.193 10.960 1.00 45.13 H new ATOM 0 HA THR A 11 22.637 -8.991 10.850 1.00 74.41 H new ATOM 0 HB THR A 11 21.125 -8.657 13.347 1.00 23.21 H new ATOM 0 HG1 THR A 11 19.642 -7.106 12.405 1.00 44.41 H new ATOM 0 HG21 THR A 11 21.807 -6.307 13.036 1.00 53.02 H new ATOM 0 HG22 THR A 11 23.175 -7.423 12.816 1.00 53.02 H new ATOM 0 HG23 THR A 11 22.384 -6.696 11.398 1.00 53.02 H new ATOM 186 N ASP A 12 23.083 -10.140 13.376 1.00 33.03 N ATOM 187 CA ASP A 12 23.641 -11.117 14.304 1.00 45.31 C ATOM 188 C ASP A 12 22.539 -11.968 14.926 1.00 60.01 C ATOM 189 O ASP A 12 22.791 -13.074 15.403 1.00 0.35 O ATOM 190 CB ASP A 12 24.439 -10.411 15.402 1.00 71.02 C ATOM 191 CG ASP A 12 25.566 -11.269 15.941 1.00 64.20 C ATOM 192 OD1 ASP A 12 25.563 -12.489 15.673 1.00 3.25 O ATOM 193 OD2 ASP A 12 26.452 -10.721 16.631 1.00 35.33 O ATOM 0 H ASP A 12 23.313 -9.171 13.595 1.00 33.03 H new ATOM 0 HA ASP A 12 24.308 -11.773 13.745 1.00 45.31 H new ATOM 0 HB2 ASP A 12 24.850 -9.482 15.008 1.00 71.02 H new ATOM 0 HB3 ASP A 12 23.769 -10.142 16.218 1.00 71.02 H new ATOM 198 N GLU A 13 21.317 -11.444 14.917 1.00 3.11 N ATOM 199 CA GLU A 13 20.177 -12.156 15.482 1.00 3.15 C ATOM 200 C GLU A 13 19.785 -13.340 14.603 1.00 13.23 C ATOM 201 O GLU A 13 19.276 -14.347 15.093 1.00 21.42 O ATOM 202 CB GLU A 13 18.986 -11.210 15.644 1.00 11.53 C ATOM 203 CG GLU A 13 19.330 -9.915 16.361 1.00 41.42 C ATOM 204 CD GLU A 13 18.101 -9.181 16.862 1.00 45.41 C ATOM 205 OE1 GLU A 13 17.187 -9.848 17.390 1.00 41.31 O ATOM 206 OE2 GLU A 13 18.054 -7.940 16.726 1.00 71.41 O ATOM 0 H GLU A 13 21.092 -10.530 14.525 1.00 3.11 H new ATOM 0 HA GLU A 13 20.467 -12.534 16.462 1.00 3.15 H new ATOM 0 HB2 GLU A 13 18.584 -10.974 14.659 1.00 11.53 H new ATOM 0 HB3 GLU A 13 18.198 -11.723 16.196 1.00 11.53 H new ATOM 0 HG2 GLU A 13 19.986 -10.134 17.203 1.00 41.42 H new ATOM 0 HG3 GLU A 13 19.886 -9.266 15.684 1.00 41.42 H new ATOM 213 N GLU A 14 20.025 -13.209 13.302 1.00 14.53 N ATOM 214 CA GLU A 14 19.695 -14.267 12.355 1.00 53.31 C ATOM 215 C GLU A 14 20.911 -15.145 12.075 1.00 32.01 C ATOM 216 O GLU A 14 20.794 -16.364 11.951 1.00 65.45 O ATOM 217 CB GLU A 14 19.174 -13.667 11.047 1.00 15.23 C ATOM 218 CG GLU A 14 17.936 -12.803 11.225 1.00 42.14 C ATOM 219 CD GLU A 14 16.765 -13.573 11.802 1.00 75.44 C ATOM 220 OE1 GLU A 14 16.123 -14.331 11.044 1.00 21.51 O ATOM 221 OE2 GLU A 14 16.489 -13.418 13.009 1.00 32.45 O ATOM 0 H GLU A 14 20.446 -12.381 12.880 1.00 14.53 H new ATOM 0 HA GLU A 14 18.915 -14.886 12.799 1.00 53.31 H new ATOM 0 HB2 GLU A 14 19.963 -13.068 10.592 1.00 15.23 H new ATOM 0 HB3 GLU A 14 18.946 -14.475 10.352 1.00 15.23 H new ATOM 0 HG2 GLU A 14 18.174 -11.965 11.881 1.00 42.14 H new ATOM 0 HG3 GLU A 14 17.650 -12.382 10.261 1.00 42.14 H new ATOM 228 N PHE A 15 22.077 -14.516 11.977 1.00 64.20 N ATOM 229 CA PHE A 15 23.315 -15.239 11.710 1.00 25.13 C ATOM 230 C PHE A 15 23.647 -16.191 12.856 1.00 3.42 C ATOM 231 O PHE A 15 24.094 -17.316 12.635 1.00 71.34 O ATOM 232 CB PHE A 15 24.469 -14.257 11.498 1.00 40.40 C ATOM 233 CG PHE A 15 25.819 -14.844 11.794 1.00 22.15 C ATOM 234 CD1 PHE A 15 26.486 -15.598 10.842 1.00 75.21 C ATOM 235 CD2 PHE A 15 26.422 -14.642 13.025 1.00 22.04 C ATOM 236 CE1 PHE A 15 27.728 -16.141 11.113 1.00 54.55 C ATOM 237 CE2 PHE A 15 27.664 -15.182 13.302 1.00 45.44 C ATOM 238 CZ PHE A 15 28.318 -15.931 12.343 1.00 3.04 C ATOM 0 H PHE A 15 22.191 -13.507 12.078 1.00 64.20 H new ATOM 0 HA PHE A 15 23.175 -15.826 10.802 1.00 25.13 H new ATOM 0 HB2 PHE A 15 24.452 -13.907 10.466 1.00 40.40 H new ATOM 0 HB3 PHE A 15 24.314 -13.385 12.133 1.00 40.40 H new ATOM 0 HD1 PHE A 15 26.030 -15.763 9.877 1.00 75.21 H new ATOM 0 HD2 PHE A 15 25.916 -14.056 13.777 1.00 22.04 H new ATOM 0 HE1 PHE A 15 28.236 -16.729 10.363 1.00 54.55 H new ATOM 0 HE2 PHE A 15 28.122 -15.019 14.266 1.00 45.44 H new ATOM 0 HZ PHE A 15 29.290 -16.352 12.555 1.00 3.04 H new ATOM 248 N LYS A 16 23.426 -15.730 14.083 1.00 44.33 N ATOM 249 CA LYS A 16 23.700 -16.538 15.265 1.00 4.41 C ATOM 250 C LYS A 16 22.909 -17.841 15.229 1.00 62.24 C ATOM 251 O LYS A 16 23.255 -18.809 15.907 1.00 61.32 O ATOM 252 CB LYS A 16 23.356 -15.755 16.534 1.00 14.21 C ATOM 253 CG LYS A 16 21.864 -15.547 16.734 1.00 23.34 C ATOM 254 CD LYS A 16 21.555 -15.034 18.131 1.00 44.12 C ATOM 255 CE LYS A 16 20.057 -14.965 18.380 1.00 14.13 C ATOM 256 NZ LYS A 16 19.483 -16.304 18.689 1.00 25.14 N ATOM 0 H LYS A 16 23.058 -14.800 14.284 1.00 44.33 H new ATOM 0 HA LYS A 16 24.763 -16.779 15.271 1.00 4.41 H new ATOM 0 HB2 LYS A 16 23.760 -16.283 17.398 1.00 14.21 H new ATOM 0 HB3 LYS A 16 23.848 -14.783 16.496 1.00 14.21 H new ATOM 0 HG2 LYS A 16 21.492 -14.838 15.994 1.00 23.34 H new ATOM 0 HG3 LYS A 16 21.339 -16.487 16.566 1.00 23.34 H new ATOM 0 HD2 LYS A 16 22.018 -15.687 18.870 1.00 44.12 H new ATOM 0 HD3 LYS A 16 21.993 -14.044 18.261 1.00 44.12 H new ATOM 0 HE2 LYS A 16 19.858 -14.285 19.208 1.00 14.13 H new ATOM 0 HE3 LYS A 16 19.562 -14.552 17.501 1.00 14.13 H new ATOM 0 HZ1 LYS A 16 18.460 -16.214 18.852 1.00 25.14 H new ATOM 0 HZ2 LYS A 16 19.651 -16.947 17.889 1.00 25.14 H new ATOM 0 HZ3 LYS A 16 19.937 -16.688 19.542 1.00 25.14 H new ATOM 270 N THR A 17 21.846 -17.861 14.431 1.00 15.32 N ATOM 271 CA THR A 17 21.006 -19.045 14.306 1.00 32.20 C ATOM 272 C THR A 17 21.663 -20.094 13.416 1.00 3.22 C ATOM 273 O THR A 17 21.215 -21.239 13.356 1.00 61.15 O ATOM 274 CB THR A 17 19.621 -18.694 13.729 1.00 4.02 C ATOM 275 OG1 THR A 17 19.688 -18.630 12.300 1.00 0.53 O ATOM 276 CG2 THR A 17 19.127 -17.365 14.279 1.00 3.44 C ATOM 0 H THR A 17 21.547 -17.070 13.861 1.00 15.32 H new ATOM 0 HA THR A 17 20.881 -19.450 15.310 1.00 32.20 H new ATOM 0 HB THR A 17 18.920 -19.474 14.025 1.00 4.02 H new ATOM 0 HG1 THR A 17 20.385 -17.995 12.033 1.00 0.53 H new ATOM 0 HG21 THR A 17 18.148 -17.138 13.858 1.00 3.44 H new ATOM 0 HG22 THR A 17 19.049 -17.427 15.364 1.00 3.44 H new ATOM 0 HG23 THR A 17 19.829 -16.576 14.010 1.00 3.44 H new ATOM 284 N ILE A 18 22.728 -19.696 12.728 1.00 10.41 N ATOM 285 CA ILE A 18 23.448 -20.603 11.843 1.00 51.41 C ATOM 286 C ILE A 18 24.862 -20.860 12.352 1.00 62.13 C ATOM 287 O ILE A 18 25.728 -19.985 12.322 1.00 21.40 O ATOM 288 CB ILE A 18 23.524 -20.047 10.408 1.00 34.24 C ATOM 289 CG1 ILE A 18 22.124 -19.697 9.899 1.00 11.13 C ATOM 290 CG2 ILE A 18 24.192 -21.055 9.485 1.00 3.41 C ATOM 291 CD1 ILE A 18 21.972 -18.246 9.500 1.00 51.11 C ATOM 0 H ILE A 18 23.111 -18.751 12.767 1.00 10.41 H new ATOM 0 HA ILE A 18 22.892 -21.541 11.832 1.00 51.41 H new ATOM 0 HB ILE A 18 24.125 -19.138 10.417 1.00 34.24 H new ATOM 0 HG12 ILE A 18 21.890 -20.328 9.041 1.00 11.13 H new ATOM 0 HG13 ILE A 18 21.395 -19.930 10.675 1.00 11.13 H new ATOM 0 HG21 ILE A 18 24.239 -20.648 8.475 1.00 3.41 H new ATOM 0 HG22 ILE A 18 25.202 -21.260 9.840 1.00 3.41 H new ATOM 0 HG23 ILE A 18 23.615 -21.980 9.478 1.00 3.41 H new ATOM 0 HD11 ILE A 18 20.955 -18.070 9.149 1.00 51.11 H new ATOM 0 HD12 ILE A 18 22.175 -17.609 10.361 1.00 51.11 H new ATOM 0 HD13 ILE A 18 22.677 -18.012 8.702 1.00 51.11 H new ATOM 303 N PRO A 19 25.105 -22.090 12.829 1.00 54.01 N ATOM 304 CA PRO A 19 26.414 -22.493 13.351 1.00 13.42 C ATOM 305 C PRO A 19 27.466 -22.605 12.254 1.00 43.54 C ATOM 306 O PRO A 19 27.138 -22.690 11.070 1.00 12.01 O ATOM 307 CB PRO A 19 26.141 -23.865 13.973 1.00 40.35 C ATOM 308 CG PRO A 19 24.955 -24.385 13.236 1.00 1.02 C ATOM 309 CD PRO A 19 24.119 -23.182 12.895 1.00 64.43 C ATOM 0 HA PRO A 19 26.814 -21.763 14.055 1.00 13.42 H new ATOM 0 HB2 PRO A 19 26.999 -24.528 13.861 1.00 40.35 H new ATOM 0 HB3 PRO A 19 25.939 -23.783 15.041 1.00 40.35 H new ATOM 0 HG2 PRO A 19 25.258 -24.918 12.335 1.00 1.02 H new ATOM 0 HG3 PRO A 19 24.393 -25.090 13.849 1.00 1.02 H new ATOM 0 HD2 PRO A 19 23.598 -23.311 11.947 1.00 64.43 H new ATOM 0 HD3 PRO A 19 23.359 -22.992 13.653 1.00 64.43 H new ATOM 317 N LYS A 20 28.734 -22.604 12.653 1.00 35.03 N ATOM 318 CA LYS A 20 29.836 -22.707 11.704 1.00 34.33 C ATOM 319 C LYS A 20 29.724 -23.984 10.877 1.00 32.24 C ATOM 320 O LYS A 20 30.312 -24.092 9.801 1.00 10.21 O ATOM 321 CB LYS A 20 31.176 -22.681 12.443 1.00 72.03 C ATOM 322 CG LYS A 20 31.486 -21.344 13.093 1.00 41.35 C ATOM 323 CD LYS A 20 32.301 -20.452 12.171 1.00 1.21 C ATOM 324 CE LYS A 20 33.788 -20.753 12.275 1.00 23.54 C ATOM 325 NZ LYS A 20 34.413 -20.068 13.441 1.00 72.42 N ATOM 0 H LYS A 20 29.024 -22.533 13.628 1.00 35.03 H new ATOM 0 HA LYS A 20 29.783 -21.852 11.029 1.00 34.33 H new ATOM 0 HB2 LYS A 20 31.174 -23.456 13.209 1.00 72.03 H new ATOM 0 HB3 LYS A 20 31.973 -22.928 11.742 1.00 72.03 H new ATOM 0 HG2 LYS A 20 30.555 -20.842 13.357 1.00 41.35 H new ATOM 0 HG3 LYS A 20 32.034 -21.508 14.021 1.00 41.35 H new ATOM 0 HD2 LYS A 20 31.971 -20.593 11.142 1.00 1.21 H new ATOM 0 HD3 LYS A 20 32.122 -19.407 12.423 1.00 1.21 H new ATOM 0 HE2 LYS A 20 33.935 -21.829 12.365 1.00 23.54 H new ATOM 0 HE3 LYS A 20 34.287 -20.438 11.359 1.00 23.54 H new ATOM 0 HZ1 LYS A 20 35.426 -20.299 13.477 1.00 72.42 H new ATOM 0 HZ2 LYS A 20 34.295 -19.039 13.343 1.00 72.42 H new ATOM 0 HZ3 LYS A 20 33.954 -20.387 14.318 1.00 72.42 H new ATOM 339 N TYR A 21 28.965 -24.948 11.386 1.00 31.33 N ATOM 340 CA TYR A 21 28.777 -26.218 10.695 1.00 72.31 C ATOM 341 C TYR A 21 28.115 -26.006 9.337 1.00 63.34 C ATOM 342 O TYR A 21 28.187 -26.866 8.459 1.00 33.22 O ATOM 343 CB TYR A 21 27.929 -27.165 11.546 1.00 72.35 C ATOM 344 CG TYR A 21 28.397 -27.275 12.979 1.00 61.30 C ATOM 345 CD1 TYR A 21 29.745 -27.429 13.280 1.00 10.10 C ATOM 346 CD2 TYR A 21 27.492 -27.226 14.032 1.00 23.50 C ATOM 347 CE1 TYR A 21 30.178 -27.531 14.588 1.00 14.51 C ATOM 348 CE2 TYR A 21 27.916 -27.326 15.343 1.00 10.31 C ATOM 349 CZ TYR A 21 29.259 -27.478 15.616 1.00 4.20 C ATOM 350 OH TYR A 21 29.685 -27.578 16.921 1.00 64.54 O ATOM 0 H TYR A 21 28.470 -24.874 12.275 1.00 31.33 H new ATOM 0 HA TYR A 21 29.758 -26.665 10.535 1.00 72.31 H new ATOM 0 HB2 TYR A 21 26.895 -26.821 11.536 1.00 72.35 H new ATOM 0 HB3 TYR A 21 27.940 -28.156 11.092 1.00 72.35 H new ATOM 0 HD1 TYR A 21 30.467 -27.470 12.477 1.00 10.10 H new ATOM 0 HD2 TYR A 21 26.439 -27.108 13.822 1.00 23.50 H new ATOM 0 HE1 TYR A 21 31.229 -27.651 14.805 1.00 14.51 H new ATOM 0 HE2 TYR A 21 27.199 -27.285 16.150 1.00 10.31 H new ATOM 0 HH TYR A 21 28.913 -27.521 17.522 1.00 64.54 H new ATOM 360 N GLN A 22 27.472 -24.855 9.172 1.00 4.31 N ATOM 361 CA GLN A 22 26.798 -24.529 7.921 1.00 12.12 C ATOM 362 C GLN A 22 27.489 -23.366 7.217 1.00 71.12 C ATOM 363 O GLN A 22 27.540 -23.313 5.987 1.00 14.02 O ATOM 364 CB GLN A 22 25.331 -24.183 8.183 1.00 1.34 C ATOM 365 CG GLN A 22 24.582 -25.254 8.960 1.00 45.02 C ATOM 366 CD GLN A 22 24.011 -26.333 8.062 1.00 73.31 C ATOM 367 OE1 GLN A 22 24.378 -26.443 6.892 1.00 45.11 O ATOM 368 NE2 GLN A 22 23.105 -27.138 8.606 1.00 64.20 N ATOM 0 H GLN A 22 27.403 -24.133 9.889 1.00 4.31 H new ATOM 0 HA GLN A 22 26.848 -25.403 7.272 1.00 12.12 H new ATOM 0 HB2 GLN A 22 25.281 -23.244 8.734 1.00 1.34 H new ATOM 0 HB3 GLN A 22 24.829 -24.020 7.229 1.00 1.34 H new ATOM 0 HG2 GLN A 22 25.256 -25.709 9.686 1.00 45.02 H new ATOM 0 HG3 GLN A 22 23.773 -24.790 9.524 1.00 45.02 H new ATOM 0 HE21 GLN A 22 22.830 -27.011 9.580 1.00 64.20 H new ATOM 0 HE22 GLN A 22 22.685 -27.883 8.050 1.00 64.20 H new ATOM 377 N LEU A 23 28.020 -22.436 8.003 1.00 73.11 N ATOM 378 CA LEU A 23 28.708 -21.273 7.455 1.00 43.24 C ATOM 379 C LEU A 23 30.092 -21.653 6.937 1.00 51.21 C ATOM 380 O LEU A 23 30.442 -21.356 5.796 1.00 41.43 O ATOM 381 CB LEU A 23 28.832 -20.180 8.518 1.00 34.31 C ATOM 382 CG LEU A 23 27.602 -19.961 9.401 1.00 64.21 C ATOM 383 CD1 LEU A 23 27.997 -19.292 10.708 1.00 33.04 C ATOM 384 CD2 LEU A 23 26.560 -19.130 8.667 1.00 2.13 C ATOM 0 H LEU A 23 27.987 -22.465 9.022 1.00 73.11 H new ATOM 0 HA LEU A 23 28.119 -20.894 6.620 1.00 43.24 H new ATOM 0 HB2 LEU A 23 29.678 -20.421 9.161 1.00 34.31 H new ATOM 0 HB3 LEU A 23 29.068 -19.240 8.019 1.00 34.31 H new ATOM 0 HG LEU A 23 27.165 -20.933 9.631 1.00 64.21 H new ATOM 0 HD11 LEU A 23 27.110 -19.144 11.324 1.00 33.04 H new ATOM 0 HD12 LEU A 23 28.707 -19.925 11.241 1.00 33.04 H new ATOM 0 HD13 LEU A 23 28.458 -18.327 10.498 1.00 33.04 H new ATOM 0 HD21 LEU A 23 25.692 -18.984 9.310 1.00 2.13 H new ATOM 0 HD22 LEU A 23 26.985 -18.161 8.406 1.00 2.13 H new ATOM 0 HD23 LEU A 23 26.255 -19.649 7.758 1.00 2.13 H new ATOM 396 N GLY A 24 30.874 -22.314 7.784 1.00 23.35 N ATOM 397 CA GLY A 24 32.210 -22.726 7.394 1.00 72.32 C ATOM 398 C GLY A 24 33.151 -21.551 7.218 1.00 72.14 C ATOM 399 O GLY A 24 33.828 -21.142 8.161 1.00 32.53 O ATOM 0 H GLY A 24 30.606 -22.572 8.734 1.00 23.35 H new ATOM 0 HA2 GLY A 24 32.614 -23.401 8.149 1.00 72.32 H new ATOM 0 HA3 GLY A 24 32.156 -23.287 6.461 1.00 72.32 H new ATOM 403 N ARG A 25 33.195 -21.007 6.006 1.00 63.21 N ATOM 404 CA ARG A 25 34.063 -19.874 5.709 1.00 52.25 C ATOM 405 C ARG A 25 33.241 -18.636 5.361 1.00 74.45 C ATOM 406 O ARG A 25 33.727 -17.722 4.694 1.00 52.03 O ATOM 407 CB ARG A 25 35.005 -20.215 4.553 1.00 50.15 C ATOM 408 CG ARG A 25 35.967 -21.349 4.865 1.00 22.14 C ATOM 409 CD ARG A 25 37.332 -21.110 4.239 1.00 22.32 C ATOM 410 NE ARG A 25 38.376 -21.905 4.882 1.00 53.14 N ATOM 411 CZ ARG A 25 39.638 -21.933 4.468 1.00 74.13 C ATOM 412 NH1 ARG A 25 40.011 -21.214 3.418 1.00 73.31 N ATOM 413 NH2 ARG A 25 40.529 -22.681 5.105 1.00 65.13 N ATOM 0 H ARG A 25 32.640 -21.332 5.214 1.00 63.21 H new ATOM 0 HA ARG A 25 34.654 -19.658 6.599 1.00 52.25 H new ATOM 0 HB2 ARG A 25 34.411 -20.484 3.679 1.00 50.15 H new ATOM 0 HB3 ARG A 25 35.578 -19.326 4.288 1.00 50.15 H new ATOM 0 HG2 ARG A 25 36.074 -21.450 5.945 1.00 22.14 H new ATOM 0 HG3 ARG A 25 35.556 -22.288 4.496 1.00 22.14 H new ATOM 0 HD2 ARG A 25 37.292 -21.355 3.178 1.00 22.32 H new ATOM 0 HD3 ARG A 25 37.585 -20.052 4.313 1.00 22.32 H new ATOM 0 HE ARG A 25 38.122 -22.469 5.693 1.00 53.14 H new ATOM 0 HH11 ARG A 25 39.328 -20.638 2.926 1.00 73.31 H new ATOM 0 HH12 ARG A 25 40.981 -21.237 3.102 1.00 73.31 H new ATOM 0 HH21 ARG A 25 40.245 -23.235 5.913 1.00 65.13 H new ATOM 0 HH22 ARG A 25 41.498 -22.702 4.787 1.00 65.13 H new ATOM 427 N LEU A 26 31.993 -18.615 5.816 1.00 52.43 N ATOM 428 CA LEU A 26 31.102 -17.490 5.552 1.00 11.34 C ATOM 429 C LEU A 26 31.065 -16.535 6.741 1.00 1.51 C ATOM 430 O LEU A 26 31.672 -16.795 7.780 1.00 3.24 O ATOM 431 CB LEU A 26 29.691 -17.993 5.244 1.00 54.31 C ATOM 432 CG LEU A 26 29.335 -18.128 3.763 1.00 41.11 C ATOM 433 CD1 LEU A 26 28.622 -19.446 3.503 1.00 3.02 C ATOM 434 CD2 LEU A 26 28.475 -16.956 3.312 1.00 71.41 C ATOM 0 H LEU A 26 31.575 -19.363 6.369 1.00 52.43 H new ATOM 0 HA LEU A 26 31.485 -16.950 4.687 1.00 11.34 H new ATOM 0 HB2 LEU A 26 29.562 -18.966 5.718 1.00 54.31 H new ATOM 0 HB3 LEU A 26 28.976 -17.315 5.709 1.00 54.31 H new ATOM 0 HG LEU A 26 30.259 -18.118 3.185 1.00 41.11 H new ATOM 0 HD11 LEU A 26 28.377 -19.524 2.444 1.00 3.02 H new ATOM 0 HD12 LEU A 26 29.272 -20.274 3.787 1.00 3.02 H new ATOM 0 HD13 LEU A 26 27.706 -19.486 4.092 1.00 3.02 H new ATOM 0 HD21 LEU A 26 28.231 -17.069 2.256 1.00 71.41 H new ATOM 0 HD22 LEU A 26 27.555 -16.934 3.896 1.00 71.41 H new ATOM 0 HD23 LEU A 26 29.022 -16.025 3.461 1.00 71.41 H new ATOM 446 N THR A 27 30.347 -15.427 6.582 1.00 34.30 N ATOM 447 CA THR A 27 30.229 -14.434 7.642 1.00 41.44 C ATOM 448 C THR A 27 28.991 -13.566 7.447 1.00 43.54 C ATOM 449 O THR A 27 28.424 -13.511 6.354 1.00 22.35 O ATOM 450 CB THR A 27 31.473 -13.527 7.702 1.00 23.44 C ATOM 451 OG1 THR A 27 31.989 -13.314 6.384 1.00 61.33 O ATOM 452 CG2 THR A 27 32.551 -14.146 8.580 1.00 31.01 C ATOM 0 H THR A 27 29.838 -15.195 5.729 1.00 34.30 H new ATOM 0 HA THR A 27 30.141 -14.982 8.580 1.00 41.44 H new ATOM 0 HB THR A 27 31.178 -12.571 8.134 1.00 23.44 H new ATOM 0 HG1 THR A 27 32.778 -12.735 6.431 1.00 61.33 H new ATOM 0 HG21 THR A 27 33.420 -13.488 8.608 1.00 31.01 H new ATOM 0 HG22 THR A 27 32.165 -14.280 9.590 1.00 31.01 H new ATOM 0 HG23 THR A 27 32.842 -15.114 8.172 1.00 31.01 H new ATOM 460 N LEU A 28 28.577 -12.887 8.511 1.00 52.03 N ATOM 461 CA LEU A 28 27.405 -12.020 8.456 1.00 2.53 C ATOM 462 C LEU A 28 27.492 -11.061 7.273 1.00 73.12 C ATOM 463 O LEU A 28 26.508 -10.841 6.568 1.00 54.41 O ATOM 464 CB LEU A 28 27.271 -11.229 9.759 1.00 53.32 C ATOM 465 CG LEU A 28 25.882 -11.220 10.398 1.00 12.32 C ATOM 466 CD1 LEU A 28 25.992 -11.229 11.915 1.00 63.21 C ATOM 467 CD2 LEU A 28 25.086 -10.011 9.927 1.00 33.32 C ATOM 0 H LEU A 28 29.035 -12.920 9.422 1.00 52.03 H new ATOM 0 HA LEU A 28 26.524 -12.649 8.326 1.00 2.53 H new ATOM 0 HB2 LEU A 28 27.979 -11.635 10.482 1.00 53.32 H new ATOM 0 HB3 LEU A 28 27.567 -10.198 9.567 1.00 53.32 H new ATOM 0 HG LEU A 28 25.354 -12.122 10.087 1.00 12.32 H new ATOM 0 HD11 LEU A 28 24.994 -11.222 12.352 1.00 63.21 H new ATOM 0 HD12 LEU A 28 26.523 -12.125 12.236 1.00 63.21 H new ATOM 0 HD13 LEU A 28 26.539 -10.346 12.245 1.00 63.21 H new ATOM 0 HD21 LEU A 28 24.100 -10.021 10.392 1.00 33.32 H new ATOM 0 HD22 LEU A 28 25.611 -9.098 10.208 1.00 33.32 H new ATOM 0 HD23 LEU A 28 24.976 -10.047 8.843 1.00 33.32 H new ATOM 479 N GLU A 29 28.676 -10.496 7.060 1.00 24.55 N ATOM 480 CA GLU A 29 28.891 -9.563 5.961 1.00 52.00 C ATOM 481 C GLU A 29 28.589 -10.224 4.619 1.00 31.12 C ATOM 482 O GLU A 29 27.979 -9.617 3.739 1.00 3.14 O ATOM 483 CB GLU A 29 30.331 -9.046 5.975 1.00 71.22 C ATOM 484 CG GLU A 29 30.654 -8.113 4.820 1.00 60.42 C ATOM 485 CD GLU A 29 30.928 -6.694 5.276 1.00 44.52 C ATOM 486 OE1 GLU A 29 32.008 -6.454 5.856 1.00 70.22 O ATOM 487 OE2 GLU A 29 30.063 -5.821 5.052 1.00 72.51 O ATOM 0 H GLU A 29 29.501 -10.668 7.634 1.00 24.55 H new ATOM 0 HA GLU A 29 28.210 -8.722 6.094 1.00 52.00 H new ATOM 0 HB2 GLU A 29 30.511 -8.523 6.914 1.00 71.22 H new ATOM 0 HB3 GLU A 29 31.013 -9.895 5.947 1.00 71.22 H new ATOM 0 HG2 GLU A 29 31.524 -8.493 4.284 1.00 60.42 H new ATOM 0 HG3 GLU A 29 29.822 -8.110 4.116 1.00 60.42 H new ATOM 494 N MET A 30 29.021 -11.472 4.471 1.00 60.23 N ATOM 495 CA MET A 30 28.797 -12.216 3.237 1.00 73.42 C ATOM 496 C MET A 30 27.306 -12.423 2.990 1.00 53.32 C ATOM 497 O MET A 30 26.829 -12.283 1.864 1.00 73.31 O ATOM 498 CB MET A 30 29.508 -13.570 3.296 1.00 52.31 C ATOM 499 CG MET A 30 31.022 -13.465 3.210 1.00 52.02 C ATOM 500 SD MET A 30 31.798 -15.013 2.707 1.00 54.13 S ATOM 501 CE MET A 30 33.498 -14.489 2.503 1.00 41.31 C ATOM 0 H MET A 30 29.528 -11.989 5.190 1.00 60.23 H new ATOM 0 HA MET A 30 29.207 -11.634 2.412 1.00 73.42 H new ATOM 0 HB2 MET A 30 29.239 -14.072 4.225 1.00 52.31 H new ATOM 0 HB3 MET A 30 29.148 -14.196 2.479 1.00 52.31 H new ATOM 0 HG2 MET A 30 31.288 -12.682 2.500 1.00 52.02 H new ATOM 0 HG3 MET A 30 31.417 -13.163 4.180 1.00 52.02 H new ATOM 0 HE1 MET A 30 34.106 -15.339 2.192 1.00 41.31 H new ATOM 0 HE2 MET A 30 33.550 -13.709 1.744 1.00 41.31 H new ATOM 0 HE3 MET A 30 33.875 -14.100 3.449 1.00 41.31 H new ATOM 511 N MET A 31 26.575 -12.756 4.049 1.00 4.40 N ATOM 512 CA MET A 31 25.138 -12.980 3.946 1.00 61.01 C ATOM 513 C MET A 31 24.391 -11.659 3.797 1.00 12.43 C ATOM 514 O MET A 31 23.406 -11.571 3.065 1.00 11.14 O ATOM 515 CB MET A 31 24.628 -13.732 5.177 1.00 61.13 C ATOM 516 CG MET A 31 25.382 -15.022 5.456 1.00 73.41 C ATOM 517 SD MET A 31 25.933 -15.148 7.168 1.00 31.20 S ATOM 518 CE MET A 31 24.366 -15.086 8.034 1.00 60.54 C ATOM 0 H MET A 31 26.954 -12.877 4.988 1.00 4.40 H new ATOM 0 HA MET A 31 24.952 -13.584 3.058 1.00 61.01 H new ATOM 0 HB2 MET A 31 24.704 -13.081 6.048 1.00 61.13 H new ATOM 0 HB3 MET A 31 23.571 -13.961 5.041 1.00 61.13 H new ATOM 0 HG2 MET A 31 24.740 -15.871 5.221 1.00 73.41 H new ATOM 0 HG3 MET A 31 26.246 -15.083 4.795 1.00 73.41 H new ATOM 0 HE1 MET A 31 24.387 -15.780 8.874 1.00 60.54 H new ATOM 0 HE2 MET A 31 24.194 -14.075 8.403 1.00 60.54 H new ATOM 0 HE3 MET A 31 23.562 -15.366 7.353 1.00 60.54 H new ATOM 528 N ASN A 32 24.866 -10.633 4.497 1.00 70.22 N ATOM 529 CA ASN A 32 24.242 -9.316 4.443 1.00 74.32 C ATOM 530 C ASN A 32 24.188 -8.798 3.009 1.00 72.12 C ATOM 531 O ASN A 32 23.181 -8.237 2.579 1.00 34.10 O ATOM 532 CB ASN A 32 25.008 -8.329 5.325 1.00 10.03 C ATOM 533 CG ASN A 32 24.323 -6.979 5.412 1.00 13.13 C ATOM 534 OD1 ASN A 32 23.286 -6.837 6.061 1.00 73.44 O ATOM 535 ND2 ASN A 32 24.901 -5.979 4.757 1.00 11.25 N ATOM 0 H ASN A 32 25.681 -10.689 5.108 1.00 70.22 H new ATOM 0 HA ASN A 32 23.222 -9.409 4.815 1.00 74.32 H new ATOM 0 HB2 ASN A 32 25.112 -8.746 6.327 1.00 10.03 H new ATOM 0 HB3 ASN A 32 26.015 -8.198 4.929 1.00 10.03 H new ATOM 0 HD21 ASN A 32 24.486 -5.048 4.779 1.00 11.25 H new ATOM 0 HD22 ASN A 32 25.760 -6.142 4.232 1.00 11.25 H new ATOM 542 N GLU A 33 25.279 -8.991 2.274 1.00 31.32 N ATOM 543 CA GLU A 33 25.355 -8.543 0.889 1.00 63.13 C ATOM 544 C GLU A 33 24.612 -9.503 -0.036 1.00 22.44 C ATOM 545 O GLU A 33 24.127 -9.110 -1.097 1.00 1.54 O ATOM 546 CB GLU A 33 26.816 -8.422 0.448 1.00 13.35 C ATOM 547 CG GLU A 33 27.618 -9.698 0.642 1.00 53.34 C ATOM 548 CD GLU A 33 29.114 -9.461 0.581 1.00 42.11 C ATOM 549 OE1 GLU A 33 29.623 -9.158 -0.518 1.00 45.41 O ATOM 550 OE2 GLU A 33 29.776 -9.579 1.634 1.00 40.15 O ATOM 0 H GLU A 33 26.121 -9.454 2.615 1.00 31.32 H new ATOM 0 HA GLU A 33 24.881 -7.564 0.825 1.00 63.13 H new ATOM 0 HB2 GLU A 33 26.847 -8.140 -0.604 1.00 13.35 H new ATOM 0 HB3 GLU A 33 27.290 -7.616 1.008 1.00 13.35 H new ATOM 0 HG2 GLU A 33 27.363 -10.140 1.605 1.00 53.34 H new ATOM 0 HG3 GLU A 33 27.337 -10.420 -0.125 1.00 53.34 H new ATOM 557 N ILE A 34 24.528 -10.764 0.375 1.00 21.31 N ATOM 558 CA ILE A 34 23.844 -11.780 -0.415 1.00 63.51 C ATOM 559 C ILE A 34 22.332 -11.589 -0.368 1.00 3.54 C ATOM 560 O ILE A 34 21.657 -11.638 -1.396 1.00 13.05 O ATOM 561 CB ILE A 34 24.186 -13.200 0.076 1.00 50.31 C ATOM 562 CG1 ILE A 34 25.595 -13.592 -0.372 1.00 24.31 C ATOM 563 CG2 ILE A 34 23.162 -14.200 -0.441 1.00 3.44 C ATOM 564 CD1 ILE A 34 26.203 -14.707 0.451 1.00 15.44 C ATOM 0 H ILE A 34 24.925 -11.106 1.250 1.00 21.31 H new ATOM 0 HA ILE A 34 24.190 -11.666 -1.442 1.00 63.51 H new ATOM 0 HB ILE A 34 24.156 -13.209 1.166 1.00 50.31 H new ATOM 0 HG12 ILE A 34 25.563 -13.899 -1.417 1.00 24.31 H new ATOM 0 HG13 ILE A 34 26.242 -12.716 -0.317 1.00 24.31 H new ATOM 0 HG21 ILE A 34 23.417 -15.198 -0.086 1.00 3.44 H new ATOM 0 HG22 ILE A 34 22.171 -13.927 -0.077 1.00 3.44 H new ATOM 0 HG23 ILE A 34 23.163 -14.191 -1.531 1.00 3.44 H new ATOM 0 HD11 ILE A 34 27.202 -14.932 0.077 1.00 15.44 H new ATOM 0 HD12 ILE A 34 26.268 -14.396 1.494 1.00 15.44 H new ATOM 0 HD13 ILE A 34 25.578 -15.597 0.376 1.00 15.44 H new ATOM 576 N VAL A 35 21.807 -11.367 0.833 1.00 33.32 N ATOM 577 CA VAL A 35 20.374 -11.165 1.015 1.00 4.53 C ATOM 578 C VAL A 35 19.947 -9.788 0.520 1.00 40.42 C ATOM 579 O VAL A 35 18.803 -9.591 0.111 1.00 35.24 O ATOM 580 CB VAL A 35 19.970 -11.314 2.494 1.00 71.31 C ATOM 581 CG1 VAL A 35 18.462 -11.468 2.622 1.00 20.51 C ATOM 582 CG2 VAL A 35 20.690 -12.496 3.126 1.00 45.40 C ATOM 0 H VAL A 35 22.352 -11.322 1.694 1.00 33.32 H new ATOM 0 HA VAL A 35 19.869 -11.932 0.429 1.00 4.53 H new ATOM 0 HB VAL A 35 20.266 -10.410 3.027 1.00 71.31 H new ATOM 0 HG11 VAL A 35 18.195 -11.572 3.674 1.00 20.51 H new ATOM 0 HG12 VAL A 35 17.970 -10.588 2.208 1.00 20.51 H new ATOM 0 HG13 VAL A 35 18.139 -12.355 2.076 1.00 20.51 H new ATOM 0 HG21 VAL A 35 20.393 -12.587 4.171 1.00 45.40 H new ATOM 0 HG22 VAL A 35 20.427 -13.410 2.593 1.00 45.40 H new ATOM 0 HG23 VAL A 35 21.767 -12.340 3.067 1.00 45.40 H new ATOM 592 N SER A 36 20.875 -8.837 0.558 1.00 12.44 N ATOM 593 CA SER A 36 20.593 -7.476 0.116 1.00 5.22 C ATOM 594 C SER A 36 20.475 -7.412 -1.404 1.00 1.15 C ATOM 595 O SER A 36 19.486 -6.913 -1.941 1.00 21.20 O ATOM 596 CB SER A 36 21.692 -6.524 0.594 1.00 61.30 C ATOM 597 OG SER A 36 21.875 -5.457 -0.320 1.00 12.54 O ATOM 0 H SER A 36 21.828 -8.984 0.890 1.00 12.44 H new ATOM 0 HA SER A 36 19.642 -7.169 0.550 1.00 5.22 H new ATOM 0 HB2 SER A 36 21.432 -6.126 1.575 1.00 61.30 H new ATOM 0 HB3 SER A 36 22.627 -7.072 0.710 1.00 61.30 H new ATOM 0 HG SER A 36 22.581 -4.862 0.009 1.00 12.54 H new ATOM 603 N LYS A 37 21.491 -7.921 -2.092 1.00 5.14 N ATOM 604 CA LYS A 37 21.504 -7.924 -3.550 1.00 34.24 C ATOM 605 C LYS A 37 20.349 -8.755 -4.101 1.00 44.24 C ATOM 606 O LYS A 37 19.679 -8.349 -5.050 1.00 71.23 O ATOM 607 CB LYS A 37 22.835 -8.474 -4.068 1.00 13.42 C ATOM 608 CG LYS A 37 23.669 -7.445 -4.812 1.00 31.14 C ATOM 609 CD LYS A 37 24.101 -6.311 -3.897 1.00 63.14 C ATOM 610 CE LYS A 37 25.337 -6.684 -3.092 1.00 74.33 C ATOM 611 NZ LYS A 37 25.517 -5.797 -1.910 1.00 44.33 N ATOM 0 H LYS A 37 22.317 -8.337 -1.663 1.00 5.14 H new ATOM 0 HA LYS A 37 21.386 -6.896 -3.892 1.00 34.24 H new ATOM 0 HB2 LYS A 37 23.412 -8.858 -3.227 1.00 13.42 H new ATOM 0 HB3 LYS A 37 22.637 -9.317 -4.730 1.00 13.42 H new ATOM 0 HG2 LYS A 37 24.550 -7.927 -5.236 1.00 31.14 H new ATOM 0 HG3 LYS A 37 23.093 -7.042 -5.645 1.00 31.14 H new ATOM 0 HD2 LYS A 37 24.308 -5.421 -4.491 1.00 63.14 H new ATOM 0 HD3 LYS A 37 23.286 -6.059 -3.219 1.00 63.14 H new ATOM 0 HE2 LYS A 37 25.256 -7.719 -2.760 1.00 74.33 H new ATOM 0 HE3 LYS A 37 26.218 -6.622 -3.730 1.00 74.33 H new ATOM 0 HZ1 LYS A 37 26.370 -6.083 -1.388 1.00 44.33 H new ATOM 0 HZ2 LYS A 37 25.620 -4.812 -2.228 1.00 44.33 H new ATOM 0 HZ3 LYS A 37 24.687 -5.875 -1.288 1.00 44.33 H new ATOM 625 N MET A 38 20.123 -9.918 -3.500 1.00 31.11 N ATOM 626 CA MET A 38 19.047 -10.804 -3.930 1.00 44.14 C ATOM 627 C MET A 38 17.695 -10.105 -3.830 1.00 60.44 C ATOM 628 O MET A 38 16.909 -10.115 -4.778 1.00 62.40 O ATOM 629 CB MET A 38 19.039 -12.079 -3.086 1.00 25.43 C ATOM 630 CG MET A 38 20.122 -13.073 -3.475 1.00 71.03 C ATOM 631 SD MET A 38 20.311 -14.402 -2.271 1.00 51.22 S ATOM 632 CE MET A 38 18.941 -15.464 -2.722 1.00 21.33 C ATOM 0 H MET A 38 20.670 -10.269 -2.714 1.00 31.11 H new ATOM 0 HA MET A 38 19.223 -11.069 -4.973 1.00 44.14 H new ATOM 0 HB2 MET A 38 19.163 -11.811 -2.037 1.00 25.43 H new ATOM 0 HB3 MET A 38 18.065 -12.560 -3.179 1.00 25.43 H new ATOM 0 HG2 MET A 38 19.884 -13.501 -4.449 1.00 71.03 H new ATOM 0 HG3 MET A 38 21.071 -12.547 -3.582 1.00 71.03 H new ATOM 0 HE1 MET A 38 18.723 -16.145 -1.900 1.00 21.33 H new ATOM 0 HE2 MET A 38 18.062 -14.855 -2.932 1.00 21.33 H new ATOM 0 HE3 MET A 38 19.204 -16.040 -3.610 1.00 21.33 H new ATOM 642 N ASP A 39 17.430 -9.501 -2.678 1.00 4.34 N ATOM 643 CA ASP A 39 16.173 -8.797 -2.455 1.00 10.45 C ATOM 644 C ASP A 39 15.990 -7.675 -3.472 1.00 60.25 C ATOM 645 O ASP A 39 14.865 -7.330 -3.835 1.00 3.22 O ATOM 646 CB ASP A 39 16.128 -8.227 -1.036 1.00 14.21 C ATOM 647 CG ASP A 39 14.772 -7.644 -0.689 1.00 35.51 C ATOM 648 OD1 ASP A 39 13.798 -7.931 -1.417 1.00 63.25 O ATOM 649 OD2 ASP A 39 14.683 -6.903 0.312 1.00 42.24 O ATOM 0 H ASP A 39 18.069 -9.485 -1.883 1.00 4.34 H new ATOM 0 HA ASP A 39 15.359 -9.511 -2.578 1.00 10.45 H new ATOM 0 HB2 ASP A 39 16.375 -9.014 -0.323 1.00 14.21 H new ATOM 0 HB3 ASP A 39 16.890 -7.454 -0.934 1.00 14.21 H new ATOM 654 N ASP A 40 17.102 -7.110 -3.929 1.00 23.41 N ATOM 655 CA ASP A 40 17.065 -6.028 -4.905 1.00 41.32 C ATOM 656 C ASP A 40 16.529 -6.523 -6.245 1.00 44.51 C ATOM 657 O ASP A 40 15.569 -5.972 -6.783 1.00 53.32 O ATOM 658 CB ASP A 40 18.461 -5.430 -5.089 1.00 52.12 C ATOM 659 CG ASP A 40 18.491 -4.345 -6.148 1.00 1.04 C ATOM 660 OD1 ASP A 40 17.562 -3.511 -6.169 1.00 33.41 O ATOM 661 OD2 ASP A 40 19.444 -4.330 -6.955 1.00 53.04 O ATOM 0 H ASP A 40 18.041 -7.384 -3.639 1.00 23.41 H new ATOM 0 HA ASP A 40 16.394 -5.255 -4.529 1.00 41.32 H new ATOM 0 HB2 ASP A 40 18.804 -5.017 -4.140 1.00 52.12 H new ATOM 0 HB3 ASP A 40 19.159 -6.221 -5.364 1.00 52.12 H new ATOM 666 N PHE A 41 17.158 -7.564 -6.779 1.00 71.44 N ATOM 667 CA PHE A 41 16.746 -8.132 -8.058 1.00 31.42 C ATOM 668 C PHE A 41 15.318 -8.666 -7.981 1.00 43.22 C ATOM 669 O PHE A 41 14.537 -8.519 -8.922 1.00 11.40 O ATOM 670 CB PHE A 41 17.700 -9.254 -8.473 1.00 20.44 C ATOM 671 CG PHE A 41 18.018 -9.259 -9.941 1.00 35.24 C ATOM 672 CD1 PHE A 41 18.347 -8.083 -10.595 1.00 71.34 C ATOM 673 CD2 PHE A 41 17.987 -10.439 -10.666 1.00 22.43 C ATOM 674 CE1 PHE A 41 18.639 -8.085 -11.946 1.00 54.13 C ATOM 675 CE2 PHE A 41 18.278 -10.447 -12.017 1.00 25.31 C ATOM 676 CZ PHE A 41 18.606 -9.268 -12.658 1.00 33.43 C ATOM 0 H PHE A 41 17.955 -8.032 -6.347 1.00 71.44 H new ATOM 0 HA PHE A 41 16.780 -7.340 -8.807 1.00 31.42 H new ATOM 0 HB2 PHE A 41 18.628 -9.158 -7.909 1.00 20.44 H new ATOM 0 HB3 PHE A 41 17.259 -10.213 -8.202 1.00 20.44 H new ATOM 0 HD1 PHE A 41 18.376 -7.155 -10.043 1.00 71.34 H new ATOM 0 HD2 PHE A 41 17.732 -11.364 -10.170 1.00 22.43 H new ATOM 0 HE1 PHE A 41 18.893 -7.161 -12.445 1.00 54.13 H new ATOM 0 HE2 PHE A 41 18.249 -11.374 -12.571 1.00 25.31 H new ATOM 0 HZ PHE A 41 18.836 -9.271 -13.713 1.00 33.43 H new ATOM 686 N LEU A 42 14.985 -9.286 -6.855 1.00 71.40 N ATOM 687 CA LEU A 42 13.652 -9.843 -6.654 1.00 75.11 C ATOM 688 C LEU A 42 12.626 -8.735 -6.435 1.00 62.21 C ATOM 689 O LEU A 42 11.478 -8.846 -6.863 1.00 52.43 O ATOM 690 CB LEU A 42 13.651 -10.798 -5.459 1.00 13.10 C ATOM 691 CG LEU A 42 12.969 -12.149 -5.680 1.00 2.25 C ATOM 692 CD1 LEU A 42 11.475 -11.964 -5.892 1.00 73.22 C ATOM 693 CD2 LEU A 42 13.593 -12.874 -6.863 1.00 53.23 C ATOM 0 H LEU A 42 15.619 -9.416 -6.067 1.00 71.40 H new ATOM 0 HA LEU A 42 13.377 -10.395 -7.553 1.00 75.11 H new ATOM 0 HB2 LEU A 42 14.684 -10.979 -5.163 1.00 13.10 H new ATOM 0 HB3 LEU A 42 13.163 -10.300 -4.622 1.00 13.10 H new ATOM 0 HG LEU A 42 13.115 -12.759 -4.788 1.00 2.25 H new ATOM 0 HD11 LEU A 42 11.007 -12.936 -6.048 1.00 73.22 H new ATOM 0 HD12 LEU A 42 11.039 -11.487 -5.014 1.00 73.22 H new ATOM 0 HD13 LEU A 42 11.307 -11.336 -6.767 1.00 73.22 H new ATOM 0 HD21 LEU A 42 13.095 -13.833 -7.006 1.00 53.23 H new ATOM 0 HD22 LEU A 42 13.479 -12.269 -7.762 1.00 53.23 H new ATOM 0 HD23 LEU A 42 14.653 -13.040 -6.670 1.00 53.23 H new ATOM 705 N MET A 43 13.050 -7.667 -5.767 1.00 62.25 N ATOM 706 CA MET A 43 12.169 -6.537 -5.495 1.00 64.40 C ATOM 707 C MET A 43 11.755 -5.847 -6.790 1.00 53.43 C ATOM 708 O MET A 43 10.598 -5.460 -6.957 1.00 12.51 O ATOM 709 CB MET A 43 12.861 -5.536 -4.568 1.00 40.10 C ATOM 710 CG MET A 43 12.094 -4.235 -4.398 1.00 53.33 C ATOM 711 SD MET A 43 10.415 -4.492 -3.791 1.00 64.24 S ATOM 712 CE MET A 43 9.904 -2.804 -3.483 1.00 2.41 C ATOM 0 H MET A 43 13.997 -7.560 -5.404 1.00 62.25 H new ATOM 0 HA MET A 43 11.273 -6.916 -5.004 1.00 64.40 H new ATOM 0 HB2 MET A 43 13.001 -5.996 -3.590 1.00 40.10 H new ATOM 0 HB3 MET A 43 13.853 -5.315 -4.961 1.00 40.10 H new ATOM 0 HG2 MET A 43 12.632 -3.589 -3.704 1.00 53.33 H new ATOM 0 HG3 MET A 43 12.055 -3.713 -5.354 1.00 53.33 H new ATOM 0 HE1 MET A 43 9.436 -2.739 -2.501 1.00 2.41 H new ATOM 0 HE2 MET A 43 10.775 -2.149 -3.514 1.00 2.41 H new ATOM 0 HE3 MET A 43 9.190 -2.495 -4.246 1.00 2.41 H new ATOM 722 N LYS A 44 12.706 -5.694 -7.705 1.00 61.52 N ATOM 723 CA LYS A 44 12.440 -5.051 -8.986 1.00 63.35 C ATOM 724 C LYS A 44 11.570 -5.939 -9.871 1.00 5.01 C ATOM 725 O LYS A 44 10.744 -5.448 -10.640 1.00 41.30 O ATOM 726 CB LYS A 44 13.755 -4.731 -9.702 1.00 75.43 C ATOM 727 CG LYS A 44 14.607 -5.956 -9.985 1.00 21.33 C ATOM 728 CD LYS A 44 15.755 -5.632 -10.926 1.00 2.44 C ATOM 729 CE LYS A 44 16.621 -4.506 -10.381 1.00 23.34 C ATOM 730 NZ LYS A 44 17.096 -4.792 -8.998 1.00 43.44 N ATOM 0 H LYS A 44 13.669 -6.007 -7.583 1.00 61.52 H new ATOM 0 HA LYS A 44 11.903 -4.123 -8.793 1.00 63.35 H new ATOM 0 HB2 LYS A 44 13.533 -4.228 -10.643 1.00 75.43 H new ATOM 0 HB3 LYS A 44 14.329 -4.032 -9.094 1.00 75.43 H new ATOM 0 HG2 LYS A 44 15.003 -6.349 -9.049 1.00 21.33 H new ATOM 0 HG3 LYS A 44 13.987 -6.738 -10.422 1.00 21.33 H new ATOM 0 HD2 LYS A 44 16.366 -6.522 -11.077 1.00 2.44 H new ATOM 0 HD3 LYS A 44 15.359 -5.349 -11.901 1.00 2.44 H new ATOM 0 HE2 LYS A 44 17.479 -4.358 -11.037 1.00 23.34 H new ATOM 0 HE3 LYS A 44 16.053 -3.576 -10.385 1.00 23.34 H new ATOM 0 HZ1 LYS A 44 17.626 -3.973 -8.637 1.00 43.44 H new ATOM 0 HZ2 LYS A 44 16.279 -4.975 -8.381 1.00 43.44 H new ATOM 0 HZ3 LYS A 44 17.715 -5.627 -9.009 1.00 43.44 H new ATOM 744 N LYS A 45 11.761 -7.249 -9.756 1.00 13.14 N ATOM 745 CA LYS A 45 10.992 -8.206 -10.542 1.00 61.32 C ATOM 746 C LYS A 45 9.506 -8.116 -10.208 1.00 64.53 C ATOM 747 O LYS A 45 8.670 -7.949 -11.096 1.00 21.11 O ATOM 748 CB LYS A 45 11.498 -9.628 -10.289 1.00 34.33 C ATOM 749 CG LYS A 45 11.965 -10.341 -11.546 1.00 53.11 C ATOM 750 CD LYS A 45 11.432 -11.763 -11.612 1.00 3.42 C ATOM 751 CE LYS A 45 10.912 -12.099 -13.001 1.00 31.33 C ATOM 752 NZ LYS A 45 9.449 -12.375 -12.993 1.00 55.10 N ATOM 0 H LYS A 45 12.442 -7.672 -9.126 1.00 13.14 H new ATOM 0 HA LYS A 45 11.124 -7.962 -11.596 1.00 61.32 H new ATOM 0 HB2 LYS A 45 12.322 -9.590 -9.576 1.00 34.33 H new ATOM 0 HB3 LYS A 45 10.702 -10.211 -9.826 1.00 34.33 H new ATOM 0 HG2 LYS A 45 11.634 -9.786 -12.424 1.00 53.11 H new ATOM 0 HG3 LYS A 45 13.055 -10.358 -11.572 1.00 53.11 H new ATOM 0 HD2 LYS A 45 12.223 -12.462 -11.339 1.00 3.42 H new ATOM 0 HD3 LYS A 45 10.631 -11.887 -10.883 1.00 3.42 H new ATOM 0 HE2 LYS A 45 11.122 -11.271 -13.678 1.00 31.33 H new ATOM 0 HE3 LYS A 45 11.444 -12.969 -13.387 1.00 31.33 H new ATOM 0 HZ1 LYS A 45 9.039 -12.103 -13.910 1.00 55.10 H new ATOM 0 HZ2 LYS A 45 9.288 -13.389 -12.829 1.00 55.10 H new ATOM 0 HZ3 LYS A 45 8.996 -11.825 -12.235 1.00 55.10 H new ATOM 766 N SER A 46 9.186 -8.227 -8.923 1.00 75.42 N ATOM 767 CA SER A 46 7.800 -8.161 -8.473 1.00 2.02 C ATOM 768 C SER A 46 7.206 -6.782 -8.745 1.00 71.52 C ATOM 769 O SER A 46 5.991 -6.632 -8.877 1.00 41.32 O ATOM 770 CB SER A 46 7.711 -8.481 -6.979 1.00 65.04 C ATOM 771 OG SER A 46 6.448 -9.032 -6.650 1.00 51.50 O ATOM 0 H SER A 46 9.867 -8.363 -8.176 1.00 75.42 H new ATOM 0 HA SER A 46 7.227 -8.901 -9.031 1.00 2.02 H new ATOM 0 HB2 SER A 46 8.499 -9.183 -6.707 1.00 65.04 H new ATOM 0 HB3 SER A 46 7.878 -7.573 -6.399 1.00 65.04 H new ATOM 0 HG SER A 46 6.417 -9.229 -5.691 1.00 51.50 H new ATOM 777 N LYS A 47 8.072 -5.778 -8.828 1.00 54.12 N ATOM 778 CA LYS A 47 7.635 -4.411 -9.086 1.00 45.31 C ATOM 779 C LYS A 47 7.178 -4.249 -10.532 1.00 72.21 C ATOM 780 O LYS A 47 6.313 -3.425 -10.831 1.00 32.14 O ATOM 781 CB LYS A 47 8.769 -3.427 -8.786 1.00 15.23 C ATOM 782 CG LYS A 47 9.386 -2.812 -10.030 1.00 14.42 C ATOM 783 CD LYS A 47 8.564 -1.639 -10.538 1.00 73.25 C ATOM 784 CE LYS A 47 9.432 -0.414 -10.783 1.00 73.40 C ATOM 785 NZ LYS A 47 10.113 0.040 -9.539 1.00 62.33 N ATOM 0 H LYS A 47 9.081 -5.885 -8.720 1.00 54.12 H new ATOM 0 HA LYS A 47 6.791 -4.196 -8.431 1.00 45.31 H new ATOM 0 HB2 LYS A 47 8.388 -2.630 -8.148 1.00 15.23 H new ATOM 0 HB3 LYS A 47 9.546 -3.943 -8.222 1.00 15.23 H new ATOM 0 HG2 LYS A 47 10.400 -2.478 -9.808 1.00 14.42 H new ATOM 0 HG3 LYS A 47 9.464 -3.568 -10.811 1.00 14.42 H new ATOM 0 HD2 LYS A 47 8.060 -1.920 -11.463 1.00 73.25 H new ATOM 0 HD3 LYS A 47 7.787 -1.397 -9.813 1.00 73.25 H new ATOM 0 HE2 LYS A 47 10.179 -0.644 -11.543 1.00 73.40 H new ATOM 0 HE3 LYS A 47 8.816 0.395 -11.176 1.00 73.40 H new ATOM 0 HZ1 LYS A 47 10.272 1.067 -9.585 1.00 62.33 H new ATOM 0 HZ2 LYS A 47 9.517 -0.181 -8.716 1.00 62.33 H new ATOM 0 HZ3 LYS A 47 11.027 -0.448 -9.446 1.00 62.33 H new ATOM 799 N ILE A 48 7.762 -5.041 -11.425 1.00 21.12 N ATOM 800 CA ILE A 48 7.412 -4.987 -12.839 1.00 14.14 C ATOM 801 C ILE A 48 6.146 -5.789 -13.122 1.00 51.34 C ATOM 802 O ILE A 48 5.356 -5.433 -13.998 1.00 32.31 O ATOM 803 CB ILE A 48 8.554 -5.522 -13.723 1.00 14.24 C ATOM 804 CG1 ILE A 48 9.558 -4.408 -14.026 1.00 13.20 C ATOM 805 CG2 ILE A 48 7.996 -6.106 -15.012 1.00 42.53 C ATOM 806 CD1 ILE A 48 10.883 -4.580 -13.318 1.00 1.44 C ATOM 0 H ILE A 48 8.480 -5.728 -11.194 1.00 21.12 H new ATOM 0 HA ILE A 48 7.237 -3.939 -13.081 1.00 14.14 H new ATOM 0 HB ILE A 48 9.072 -6.314 -13.183 1.00 14.24 H new ATOM 0 HG12 ILE A 48 9.732 -4.370 -15.101 1.00 13.20 H new ATOM 0 HG13 ILE A 48 9.124 -3.450 -13.739 1.00 13.20 H new ATOM 0 HG21 ILE A 48 8.815 -6.480 -15.626 1.00 42.53 H new ATOM 0 HG22 ILE A 48 7.316 -6.925 -14.776 1.00 42.53 H new ATOM 0 HG23 ILE A 48 7.457 -5.332 -15.558 1.00 42.53 H new ATOM 0 HD11 ILE A 48 11.545 -3.754 -13.579 1.00 1.44 H new ATOM 0 HD12 ILE A 48 10.721 -4.588 -12.240 1.00 1.44 H new ATOM 0 HD13 ILE A 48 11.339 -5.522 -13.624 1.00 1.44 H new ATOM 818 N LEU A 49 5.958 -6.871 -12.376 1.00 23.24 N ATOM 819 CA LEU A 49 4.787 -7.724 -12.545 1.00 13.21 C ATOM 820 C LEU A 49 3.503 -6.944 -12.280 1.00 32.03 C ATOM 821 O LEU A 49 2.419 -7.356 -12.690 1.00 15.40 O ATOM 822 CB LEU A 49 4.868 -8.929 -11.606 1.00 3.42 C ATOM 823 CG LEU A 49 6.205 -9.670 -11.580 1.00 5.35 C ATOM 824 CD1 LEU A 49 6.023 -11.081 -11.043 1.00 61.15 C ATOM 825 CD2 LEU A 49 6.825 -9.701 -12.969 1.00 4.11 C ATOM 0 H LEU A 49 6.602 -7.179 -11.647 1.00 23.24 H new ATOM 0 HA LEU A 49 4.771 -8.076 -13.576 1.00 13.21 H new ATOM 0 HB2 LEU A 49 4.642 -8.592 -10.594 1.00 3.42 H new ATOM 0 HB3 LEU A 49 4.088 -9.637 -11.887 1.00 3.42 H new ATOM 0 HG LEU A 49 6.882 -9.135 -10.914 1.00 5.35 H new ATOM 0 HD11 LEU A 49 6.985 -11.593 -11.032 1.00 61.15 H new ATOM 0 HD12 LEU A 49 5.624 -11.036 -10.030 1.00 61.15 H new ATOM 0 HD13 LEU A 49 5.329 -11.627 -11.682 1.00 61.15 H new ATOM 0 HD21 LEU A 49 7.776 -10.232 -12.931 1.00 4.11 H new ATOM 0 HD22 LEU A 49 6.151 -10.212 -13.657 1.00 4.11 H new ATOM 0 HD23 LEU A 49 6.993 -8.681 -13.315 1.00 4.11 H new ATOM 837 N GLY A 50 3.634 -5.814 -11.592 1.00 42.51 N ATOM 838 CA GLY A 50 2.477 -4.993 -11.286 1.00 2.21 C ATOM 839 C GLY A 50 2.471 -3.688 -12.057 1.00 45.04 C ATOM 840 O GLY A 50 1.411 -3.157 -12.386 1.00 54.15 O ATOM 0 H GLY A 50 4.521 -5.452 -11.241 1.00 42.51 H new ATOM 0 HA2 GLY A 50 1.569 -5.551 -11.515 1.00 2.21 H new ATOM 0 HA3 GLY A 50 2.459 -4.780 -10.217 1.00 2.21 H new ATOM 844 N LYS A 51 3.660 -3.168 -12.346 1.00 54.00 N ATOM 845 CA LYS A 51 3.789 -1.917 -13.083 1.00 40.32 C ATOM 846 C LYS A 51 3.102 -2.012 -14.442 1.00 20.02 C ATOM 847 O LYS A 51 2.454 -3.012 -14.753 1.00 14.31 O ATOM 848 CB LYS A 51 5.266 -1.562 -13.270 1.00 52.55 C ATOM 849 CG LYS A 51 5.673 -0.271 -12.581 1.00 22.13 C ATOM 850 CD LYS A 51 5.320 -0.293 -11.103 1.00 25.31 C ATOM 851 CE LYS A 51 5.992 0.846 -10.352 1.00 45.23 C ATOM 852 NZ LYS A 51 5.020 1.906 -9.967 1.00 42.55 N ATOM 0 H LYS A 51 4.548 -3.594 -12.081 1.00 54.00 H new ATOM 0 HA LYS A 51 3.303 -1.132 -12.504 1.00 40.32 H new ATOM 0 HB2 LYS A 51 5.879 -2.378 -12.886 1.00 52.55 H new ATOM 0 HB3 LYS A 51 5.479 -1.478 -14.336 1.00 52.55 H new ATOM 0 HG2 LYS A 51 6.746 -0.118 -12.698 1.00 22.13 H new ATOM 0 HG3 LYS A 51 5.176 0.572 -13.062 1.00 22.13 H new ATOM 0 HD2 LYS A 51 4.239 -0.220 -10.985 1.00 25.31 H new ATOM 0 HD3 LYS A 51 5.624 -1.246 -10.669 1.00 25.31 H new ATOM 0 HE2 LYS A 51 6.476 0.455 -9.457 1.00 45.23 H new ATOM 0 HE3 LYS A 51 6.775 1.280 -10.975 1.00 45.23 H new ATOM 0 HZ1 LYS A 51 5.517 2.664 -9.457 1.00 42.55 H new ATOM 0 HZ2 LYS A 51 4.576 2.297 -10.822 1.00 42.55 H new ATOM 0 HZ3 LYS A 51 4.287 1.498 -9.352 1.00 42.55 H new ATOM 866 N THR A 52 3.249 -0.966 -15.249 1.00 61.01 N ATOM 867 CA THR A 52 2.643 -0.932 -16.574 1.00 63.22 C ATOM 868 C THR A 52 3.588 -0.308 -17.595 1.00 12.32 C ATOM 869 O THR A 52 4.748 -0.030 -17.293 1.00 35.05 O ATOM 870 CB THR A 52 1.320 -0.144 -16.567 1.00 31.11 C ATOM 871 OG1 THR A 52 1.586 1.262 -16.627 1.00 64.42 O ATOM 872 CG2 THR A 52 0.510 -0.459 -15.318 1.00 54.35 C ATOM 0 H THR A 52 3.783 -0.131 -15.008 1.00 61.01 H new ATOM 0 HA THR A 52 2.440 -1.965 -16.855 1.00 63.22 H new ATOM 0 HB THR A 52 0.741 -0.441 -17.442 1.00 31.11 H new ATOM 0 HG1 THR A 52 0.739 1.756 -16.624 1.00 64.42 H new ATOM 0 HG21 THR A 52 -0.420 0.109 -15.335 1.00 54.35 H new ATOM 0 HG22 THR A 52 0.284 -1.525 -15.290 1.00 54.35 H new ATOM 0 HG23 THR A 52 1.085 -0.187 -14.433 1.00 54.35 H new ATOM 880 N ASN A 53 3.083 -0.089 -18.805 1.00 3.43 N ATOM 881 CA ASN A 53 3.883 0.504 -19.871 1.00 21.14 C ATOM 882 C ASN A 53 4.288 1.932 -19.517 1.00 72.14 C ATOM 883 O ASN A 53 5.185 2.506 -20.135 1.00 25.44 O ATOM 884 CB ASN A 53 3.104 0.494 -21.187 1.00 71.43 C ATOM 885 CG ASN A 53 1.756 1.177 -21.067 1.00 13.34 C ATOM 886 OD1 ASN A 53 1.670 2.405 -21.043 1.00 11.23 O ATOM 887 ND2 ASN A 53 0.694 0.383 -20.990 1.00 24.14 N ATOM 0 H ASN A 53 2.124 -0.313 -19.072 1.00 3.43 H new ATOM 0 HA ASN A 53 4.788 -0.093 -19.988 1.00 21.14 H new ATOM 0 HB2 ASN A 53 3.693 0.991 -21.958 1.00 71.43 H new ATOM 0 HB3 ASN A 53 2.958 -0.536 -21.512 1.00 71.43 H new ATOM 0 HD21 ASN A 53 -0.239 0.786 -20.907 1.00 24.14 H new ATOM 0 HD22 ASN A 53 0.812 -0.630 -21.014 1.00 24.14 H new ATOM 894 N LYS A 54 3.620 2.501 -18.520 1.00 32.44 N ATOM 895 CA LYS A 54 3.910 3.861 -18.081 1.00 74.33 C ATOM 896 C LYS A 54 5.259 3.928 -17.373 1.00 13.21 C ATOM 897 O LYS A 54 6.118 4.733 -17.732 1.00 21.31 O ATOM 898 CB LYS A 54 2.806 4.364 -17.148 1.00 71.12 C ATOM 899 CG LYS A 54 1.424 4.348 -17.777 1.00 55.53 C ATOM 900 CD LYS A 54 1.276 5.437 -18.827 1.00 45.21 C ATOM 901 CE LYS A 54 0.176 5.106 -19.823 1.00 71.13 C ATOM 902 NZ LYS A 54 -1.179 5.304 -19.239 1.00 13.22 N ATOM 0 H LYS A 54 2.873 2.041 -18.000 1.00 32.44 H new ATOM 0 HA LYS A 54 3.951 4.500 -18.963 1.00 74.33 H new ATOM 0 HB2 LYS A 54 2.794 3.749 -16.248 1.00 71.12 H new ATOM 0 HB3 LYS A 54 3.042 5.381 -16.835 1.00 71.12 H new ATOM 0 HG2 LYS A 54 1.242 3.375 -18.233 1.00 55.53 H new ATOM 0 HG3 LYS A 54 0.669 4.483 -17.002 1.00 55.53 H new ATOM 0 HD2 LYS A 54 1.053 6.386 -18.339 1.00 45.21 H new ATOM 0 HD3 LYS A 54 2.221 5.565 -19.356 1.00 45.21 H new ATOM 0 HE2 LYS A 54 0.286 5.734 -20.707 1.00 71.13 H new ATOM 0 HE3 LYS A 54 0.282 4.072 -20.151 1.00 71.13 H new ATOM 0 HZ1 LYS A 54 -1.901 5.068 -19.949 1.00 13.22 H new ATOM 0 HZ2 LYS A 54 -1.293 4.686 -18.410 1.00 13.22 H new ATOM 0 HZ3 LYS A 54 -1.290 6.297 -18.949 1.00 13.22 H new ATOM 916 N GLN A 55 5.437 3.078 -16.367 1.00 62.11 N ATOM 917 CA GLN A 55 6.683 3.042 -15.610 1.00 33.31 C ATOM 918 C GLN A 55 7.732 2.199 -16.327 1.00 73.44 C ATOM 919 O GLN A 55 8.933 2.433 -16.188 1.00 20.40 O ATOM 920 CB GLN A 55 6.435 2.484 -14.207 1.00 63.02 C ATOM 921 CG GLN A 55 6.842 3.435 -13.094 1.00 3.44 C ATOM 922 CD GLN A 55 5.955 4.663 -13.021 1.00 62.34 C ATOM 923 OE1 GLN A 55 6.421 5.790 -13.191 1.00 14.13 O ATOM 924 NE2 GLN A 55 4.669 4.450 -12.769 1.00 21.20 N ATOM 0 H GLN A 55 4.735 2.406 -16.057 1.00 62.11 H new ATOM 0 HA GLN A 55 7.058 4.062 -15.527 1.00 33.31 H new ATOM 0 HB2 GLN A 55 5.377 2.246 -14.101 1.00 63.02 H new ATOM 0 HB3 GLN A 55 6.985 1.549 -14.094 1.00 63.02 H new ATOM 0 HG2 GLN A 55 6.806 2.908 -12.140 1.00 3.44 H new ATOM 0 HG3 GLN A 55 7.875 3.747 -13.247 1.00 3.44 H new ATOM 0 HE21 GLN A 55 4.326 3.499 -12.635 1.00 21.20 H new ATOM 0 HE22 GLN A 55 4.024 5.238 -12.710 1.00 21.20 H new ATOM 933 N LEU A 56 7.271 1.217 -17.095 1.00 12.31 N ATOM 934 CA LEU A 56 8.170 0.338 -17.835 1.00 14.21 C ATOM 935 C LEU A 56 9.180 1.147 -18.642 1.00 53.05 C ATOM 936 O LEU A 56 8.810 1.909 -19.537 1.00 34.43 O ATOM 937 CB LEU A 56 7.370 -0.575 -18.765 1.00 72.34 C ATOM 938 CG LEU A 56 8.173 -1.304 -19.844 1.00 13.14 C ATOM 939 CD1 LEU A 56 7.540 -2.649 -20.163 1.00 31.55 C ATOM 940 CD2 LEU A 56 8.277 -0.450 -21.099 1.00 73.42 C ATOM 0 H LEU A 56 6.280 1.010 -17.221 1.00 12.31 H new ATOM 0 HA LEU A 56 8.715 -0.274 -17.116 1.00 14.21 H new ATOM 0 HB2 LEU A 56 6.857 -1.320 -18.157 1.00 72.34 H new ATOM 0 HB3 LEU A 56 6.601 0.022 -19.254 1.00 72.34 H new ATOM 0 HG LEU A 56 9.179 -1.481 -19.464 1.00 13.14 H new ATOM 0 HD11 LEU A 56 8.125 -3.153 -20.932 1.00 31.55 H new ATOM 0 HD12 LEU A 56 7.518 -3.263 -19.263 1.00 31.55 H new ATOM 0 HD13 LEU A 56 6.522 -2.496 -20.523 1.00 31.55 H new ATOM 0 HD21 LEU A 56 8.851 -0.984 -21.856 1.00 73.42 H new ATOM 0 HD22 LEU A 56 7.278 -0.242 -21.481 1.00 73.42 H new ATOM 0 HD23 LEU A 56 8.777 0.489 -20.860 1.00 73.42 H new ATOM 952 N THR A 57 10.459 0.975 -18.323 1.00 13.41 N ATOM 953 CA THR A 57 11.523 1.688 -19.019 1.00 14.12 C ATOM 954 C THR A 57 12.479 0.717 -19.702 1.00 41.51 C ATOM 955 O THR A 57 12.246 -0.491 -19.718 1.00 34.24 O ATOM 956 CB THR A 57 12.322 2.585 -18.055 1.00 13.41 C ATOM 957 OG1 THR A 57 13.204 3.436 -18.795 1.00 61.03 O ATOM 958 CG2 THR A 57 13.124 1.745 -17.073 1.00 63.02 C ATOM 0 H THR A 57 10.783 0.348 -17.587 1.00 13.41 H new ATOM 0 HA THR A 57 11.044 2.313 -19.773 1.00 14.12 H new ATOM 0 HB THR A 57 11.616 3.196 -17.493 1.00 13.41 H new ATOM 0 HG1 THR A 57 13.707 4.004 -18.175 1.00 61.03 H new ATOM 0 HG21 THR A 57 13.680 2.401 -16.403 1.00 63.02 H new ATOM 0 HG22 THR A 57 12.447 1.120 -16.491 1.00 63.02 H new ATOM 0 HG23 THR A 57 13.821 1.111 -17.621 1.00 63.02 H new ATOM 966 N ARG A 58 13.557 1.254 -20.266 1.00 34.15 N ATOM 967 CA ARG A 58 14.548 0.434 -20.951 1.00 44.20 C ATOM 968 C ARG A 58 14.992 -0.731 -20.072 1.00 24.14 C ATOM 969 O ARG A 58 14.997 -1.883 -20.506 1.00 10.11 O ATOM 970 CB ARG A 58 15.760 1.282 -21.342 1.00 50.40 C ATOM 971 CG ARG A 58 16.309 2.122 -20.201 1.00 3.45 C ATOM 972 CD ARG A 58 17.339 3.127 -20.693 1.00 65.54 C ATOM 973 NE ARG A 58 16.715 4.325 -21.247 1.00 15.04 N ATOM 974 CZ ARG A 58 17.343 5.488 -21.378 1.00 64.44 C ATOM 975 NH1 ARG A 58 18.608 5.608 -20.999 1.00 63.43 N ATOM 976 NH2 ARG A 58 16.707 6.533 -21.891 1.00 1.11 N ATOM 0 H ARG A 58 13.765 2.252 -20.262 1.00 34.15 H new ATOM 0 HA ARG A 58 14.088 0.031 -21.853 1.00 44.20 H new ATOM 0 HB2 ARG A 58 16.548 0.626 -21.711 1.00 50.40 H new ATOM 0 HB3 ARG A 58 15.482 1.940 -22.165 1.00 50.40 H new ATOM 0 HG2 ARG A 58 15.491 2.649 -19.710 1.00 3.45 H new ATOM 0 HG3 ARG A 58 16.763 1.471 -19.454 1.00 3.45 H new ATOM 0 HD2 ARG A 58 17.994 3.408 -19.868 1.00 65.54 H new ATOM 0 HD3 ARG A 58 17.966 2.661 -21.453 1.00 65.54 H new ATOM 0 HE ARG A 58 15.743 4.266 -21.550 1.00 15.04 H new ATOM 0 HH11 ARG A 58 19.101 4.806 -20.606 1.00 63.43 H new ATOM 0 HH12 ARG A 58 19.088 6.502 -21.101 1.00 63.43 H new ATOM 0 HH21 ARG A 58 15.734 6.444 -22.185 1.00 1.11 H new ATOM 0 HH22 ARG A 58 17.190 7.426 -21.991 1.00 1.11 H new ATOM 990 N SER A 59 15.365 -0.423 -18.834 1.00 4.14 N ATOM 991 CA SER A 59 15.815 -1.444 -17.894 1.00 43.44 C ATOM 992 C SER A 59 14.717 -2.473 -17.643 1.00 42.33 C ATOM 993 O SER A 59 14.995 -3.621 -17.296 1.00 52.23 O ATOM 994 CB SER A 59 16.238 -0.800 -16.573 1.00 3.43 C ATOM 995 OG SER A 59 17.564 -0.304 -16.648 1.00 31.41 O ATOM 0 H SER A 59 15.365 0.525 -18.458 1.00 4.14 H new ATOM 0 HA SER A 59 16.673 -1.954 -18.332 1.00 43.44 H new ATOM 0 HB2 SER A 59 15.556 0.014 -16.327 1.00 3.43 H new ATOM 0 HB3 SER A 59 16.165 -1.532 -15.768 1.00 3.43 H new ATOM 0 HG SER A 59 17.810 0.104 -15.792 1.00 31.41 H new ATOM 1001 N ASP A 60 13.470 -2.052 -17.821 1.00 73.44 N ATOM 1002 CA ASP A 60 12.328 -2.937 -17.616 1.00 4.44 C ATOM 1003 C ASP A 60 12.193 -3.926 -18.769 1.00 32.25 C ATOM 1004 O ASP A 60 11.775 -5.068 -18.574 1.00 11.22 O ATOM 1005 CB ASP A 60 11.043 -2.120 -17.474 1.00 33.20 C ATOM 1006 CG ASP A 60 9.861 -2.970 -17.049 1.00 3.12 C ATOM 1007 OD1 ASP A 60 9.703 -4.082 -17.595 1.00 5.50 O ATOM 1008 OD2 ASP A 60 9.094 -2.523 -16.170 1.00 40.25 O ATOM 0 H ASP A 60 13.224 -1.104 -18.107 1.00 73.44 H new ATOM 0 HA ASP A 60 12.495 -3.500 -16.697 1.00 4.44 H new ATOM 0 HB2 ASP A 60 11.199 -1.327 -16.742 1.00 33.20 H new ATOM 0 HB3 ASP A 60 10.816 -1.636 -18.424 1.00 33.20 H new ATOM 1013 N ARG A 61 12.548 -3.480 -19.969 1.00 72.42 N ATOM 1014 CA ARG A 61 12.463 -4.326 -21.154 1.00 25.02 C ATOM 1015 C ARG A 61 13.603 -5.340 -21.180 1.00 64.11 C ATOM 1016 O ARG A 61 13.412 -6.493 -21.566 1.00 11.22 O ATOM 1017 CB ARG A 61 12.499 -3.470 -22.421 1.00 72.01 C ATOM 1018 CG ARG A 61 11.312 -3.697 -23.343 1.00 71.40 C ATOM 1019 CD ARG A 61 10.671 -2.383 -23.760 1.00 71.14 C ATOM 1020 NE ARG A 61 9.728 -2.559 -24.862 1.00 23.42 N ATOM 1021 CZ ARG A 61 10.097 -2.843 -26.106 1.00 53.12 C ATOM 1022 NH1 ARG A 61 11.381 -2.982 -26.405 1.00 51.05 N ATOM 1023 NH2 ARG A 61 9.180 -2.988 -27.054 1.00 73.41 N ATOM 0 H ARG A 61 12.897 -2.538 -20.147 1.00 72.42 H new ATOM 0 HA ARG A 61 11.518 -4.868 -21.116 1.00 25.02 H new ATOM 0 HB2 ARG A 61 12.532 -2.418 -22.138 1.00 72.01 H new ATOM 0 HB3 ARG A 61 13.418 -3.682 -22.967 1.00 72.01 H new ATOM 0 HG2 ARG A 61 11.637 -4.242 -24.229 1.00 71.40 H new ATOM 0 HG3 ARG A 61 10.573 -4.320 -22.839 1.00 71.40 H new ATOM 0 HD2 ARG A 61 10.153 -1.945 -22.906 1.00 71.14 H new ATOM 0 HD3 ARG A 61 11.448 -1.679 -24.057 1.00 71.14 H new ATOM 0 HE ARG A 61 8.732 -2.458 -24.665 1.00 23.42 H new ATOM 0 HH11 ARG A 61 12.089 -2.871 -25.679 1.00 51.05 H new ATOM 0 HH12 ARG A 61 11.661 -3.200 -27.361 1.00 51.05 H new ATOM 0 HH21 ARG A 61 8.191 -2.881 -26.828 1.00 73.41 H new ATOM 0 HH22 ARG A 61 9.464 -3.206 -28.009 1.00 73.41 H new ATOM 1037 N GLU A 62 14.789 -4.901 -20.768 1.00 34.42 N ATOM 1038 CA GLU A 62 15.959 -5.771 -20.746 1.00 31.01 C ATOM 1039 C GLU A 62 15.809 -6.858 -19.685 1.00 5.41 C ATOM 1040 O GLU A 62 16.211 -8.003 -19.892 1.00 42.30 O ATOM 1041 CB GLU A 62 17.225 -4.953 -20.480 1.00 35.45 C ATOM 1042 CG GLU A 62 17.497 -4.717 -19.004 1.00 23.45 C ATOM 1043 CD GLU A 62 18.228 -5.876 -18.353 1.00 34.13 C ATOM 1044 OE1 GLU A 62 18.539 -6.855 -19.062 1.00 20.41 O ATOM 1045 OE2 GLU A 62 18.488 -5.803 -17.133 1.00 52.34 O ATOM 0 H GLU A 62 14.964 -3.949 -20.445 1.00 34.42 H new ATOM 0 HA GLU A 62 16.043 -6.250 -21.722 1.00 31.01 H new ATOM 0 HB2 GLU A 62 18.079 -5.467 -20.921 1.00 35.45 H new ATOM 0 HB3 GLU A 62 17.138 -3.990 -20.983 1.00 35.45 H new ATOM 0 HG2 GLU A 62 18.088 -3.808 -18.888 1.00 23.45 H new ATOM 0 HG3 GLU A 62 16.552 -4.551 -18.486 1.00 23.45 H new ATOM 1052 N VAL A 63 15.229 -6.490 -18.547 1.00 1.40 N ATOM 1053 CA VAL A 63 15.026 -7.432 -17.453 1.00 13.30 C ATOM 1054 C VAL A 63 13.927 -8.434 -17.788 1.00 13.20 C ATOM 1055 O VAL A 63 14.022 -9.614 -17.447 1.00 11.42 O ATOM 1056 CB VAL A 63 14.660 -6.704 -16.146 1.00 3.51 C ATOM 1057 CG1 VAL A 63 15.805 -5.809 -15.695 1.00 12.11 C ATOM 1058 CG2 VAL A 63 13.382 -5.898 -16.324 1.00 71.54 C ATOM 0 H VAL A 63 14.891 -5.546 -18.359 1.00 1.40 H new ATOM 0 HA VAL A 63 15.968 -7.963 -17.313 1.00 13.30 H new ATOM 0 HB VAL A 63 14.486 -7.451 -15.371 1.00 3.51 H new ATOM 0 HG11 VAL A 63 15.529 -5.303 -14.770 1.00 12.11 H new ATOM 0 HG12 VAL A 63 16.695 -6.415 -15.525 1.00 12.11 H new ATOM 0 HG13 VAL A 63 16.013 -5.067 -16.466 1.00 12.11 H new ATOM 0 HG21 VAL A 63 13.139 -5.391 -15.390 1.00 71.54 H new ATOM 0 HG22 VAL A 63 13.525 -5.159 -17.112 1.00 71.54 H new ATOM 0 HG23 VAL A 63 12.565 -6.566 -16.597 1.00 71.54 H new ATOM 1068 N LEU A 64 12.884 -7.957 -18.458 1.00 74.24 N ATOM 1069 CA LEU A 64 11.765 -8.812 -18.841 1.00 52.41 C ATOM 1070 C LEU A 64 12.204 -9.863 -19.855 1.00 44.32 C ATOM 1071 O LEU A 64 11.773 -11.014 -19.797 1.00 72.34 O ATOM 1072 CB LEU A 64 10.629 -7.968 -19.423 1.00 63.24 C ATOM 1073 CG LEU A 64 9.295 -8.032 -18.678 1.00 64.44 C ATOM 1074 CD1 LEU A 64 9.526 -8.195 -17.184 1.00 71.00 C ATOM 1075 CD2 LEU A 64 8.467 -6.787 -18.960 1.00 20.23 C ATOM 0 H LEU A 64 12.789 -6.983 -18.747 1.00 74.24 H new ATOM 0 HA LEU A 64 11.408 -9.324 -17.947 1.00 52.41 H new ATOM 0 HB2 LEU A 64 10.955 -6.928 -19.454 1.00 63.24 H new ATOM 0 HB3 LEU A 64 10.462 -8.281 -20.454 1.00 63.24 H new ATOM 0 HG LEU A 64 8.741 -8.900 -19.036 1.00 64.44 H new ATOM 0 HD11 LEU A 64 8.566 -8.239 -16.670 1.00 71.00 H new ATOM 0 HD12 LEU A 64 10.079 -9.116 -17.000 1.00 71.00 H new ATOM 0 HD13 LEU A 64 10.100 -7.347 -16.810 1.00 71.00 H new ATOM 0 HD21 LEU A 64 7.521 -6.849 -18.422 1.00 20.23 H new ATOM 0 HD22 LEU A 64 9.014 -5.904 -18.631 1.00 20.23 H new ATOM 0 HD23 LEU A 64 8.272 -6.715 -20.030 1.00 20.23 H new ATOM 1087 N ASP A 65 13.066 -9.459 -20.782 1.00 25.12 N ATOM 1088 CA ASP A 65 13.568 -10.367 -21.807 1.00 53.22 C ATOM 1089 C ASP A 65 14.468 -11.435 -21.194 1.00 42.23 C ATOM 1090 O ASP A 65 14.403 -12.605 -21.568 1.00 51.13 O ATOM 1091 CB ASP A 65 14.334 -9.588 -22.877 1.00 64.23 C ATOM 1092 CG ASP A 65 13.885 -9.939 -24.282 1.00 52.20 C ATOM 1093 OD1 ASP A 65 13.810 -11.145 -24.598 1.00 20.02 O ATOM 1094 OD2 ASP A 65 13.607 -9.007 -25.065 1.00 71.24 O ATOM 0 H ASP A 65 13.432 -8.509 -20.845 1.00 25.12 H new ATOM 0 HA ASP A 65 12.714 -10.861 -22.270 1.00 53.22 H new ATOM 0 HB2 ASP A 65 14.198 -8.519 -22.712 1.00 64.23 H new ATOM 0 HB3 ASP A 65 15.400 -9.792 -22.778 1.00 64.23 H new ATOM 1099 N ASN A 66 15.309 -11.023 -20.251 1.00 42.53 N ATOM 1100 CA ASN A 66 16.225 -11.944 -19.588 1.00 15.24 C ATOM 1101 C ASN A 66 15.476 -12.843 -18.609 1.00 21.34 C ATOM 1102 O ASN A 66 15.703 -14.052 -18.563 1.00 60.32 O ATOM 1103 CB ASN A 66 17.318 -11.167 -18.851 1.00 35.14 C ATOM 1104 CG ASN A 66 18.395 -12.076 -18.291 1.00 0.41 C ATOM 1105 OD1 ASN A 66 19.438 -12.277 -18.913 1.00 51.14 O ATOM 1106 ND2 ASN A 66 18.147 -12.630 -17.110 1.00 12.42 N ATOM 0 H ASN A 66 15.375 -10.057 -19.929 1.00 42.53 H new ATOM 0 HA ASN A 66 16.687 -12.571 -20.351 1.00 15.24 H new ATOM 0 HB2 ASN A 66 17.772 -10.448 -19.533 1.00 35.14 H new ATOM 0 HB3 ASN A 66 16.869 -10.596 -18.038 1.00 35.14 H new ATOM 0 HD21 ASN A 66 18.835 -13.250 -16.683 1.00 12.42 H new ATOM 0 HD22 ASN A 66 17.268 -12.435 -16.630 1.00 12.42 H new ATOM 1113 N TRP A 67 14.584 -12.245 -17.828 1.00 52.10 N ATOM 1114 CA TRP A 67 13.801 -12.992 -16.850 1.00 22.01 C ATOM 1115 C TRP A 67 12.971 -14.075 -17.530 1.00 22.32 C ATOM 1116 O TRP A 67 12.899 -15.207 -17.050 1.00 54.13 O ATOM 1117 CB TRP A 67 12.887 -12.047 -16.068 1.00 40.05 C ATOM 1118 CG TRP A 67 13.619 -11.204 -15.069 1.00 3.30 C ATOM 1119 CD1 TRP A 67 14.796 -11.507 -14.446 1.00 61.30 C ATOM 1120 CD2 TRP A 67 13.222 -9.919 -14.576 1.00 71.53 C ATOM 1121 NE1 TRP A 67 15.154 -10.489 -13.596 1.00 22.24 N ATOM 1122 CE2 TRP A 67 14.206 -9.503 -13.658 1.00 34.01 C ATOM 1123 CE3 TRP A 67 12.132 -9.080 -14.823 1.00 4.01 C ATOM 1124 CZ2 TRP A 67 14.129 -8.285 -12.987 1.00 22.40 C ATOM 1125 CZ3 TRP A 67 12.058 -7.872 -14.156 1.00 31.11 C ATOM 1126 CH2 TRP A 67 13.051 -7.483 -13.247 1.00 64.45 C ATOM 0 H TRP A 67 14.385 -11.245 -17.853 1.00 52.10 H new ATOM 0 HA TRP A 67 14.493 -13.472 -16.158 1.00 22.01 H new ATOM 0 HB2 TRP A 67 12.365 -11.396 -16.769 1.00 40.05 H new ATOM 0 HB3 TRP A 67 12.127 -12.633 -15.551 1.00 40.05 H new ATOM 0 HD1 TRP A 67 15.362 -12.414 -14.599 1.00 61.30 H new ATOM 0 HE1 TRP A 67 15.991 -10.471 -13.013 1.00 22.24 H new ATOM 0 HE3 TRP A 67 11.362 -9.370 -15.522 1.00 4.01 H new ATOM 0 HZ2 TRP A 67 14.893 -7.984 -12.286 1.00 22.40 H new ATOM 0 HZ3 TRP A 67 11.220 -7.216 -14.339 1.00 31.11 H new ATOM 0 HH2 TRP A 67 12.964 -6.532 -12.742 1.00 64.45 H new ATOM 1137 N ARG A 68 12.347 -13.722 -18.649 1.00 2.13 N ATOM 1138 CA ARG A 68 11.521 -14.665 -19.393 1.00 45.24 C ATOM 1139 C ARG A 68 12.387 -15.696 -20.111 1.00 71.42 C ATOM 1140 O ARG A 68 11.925 -16.790 -20.434 1.00 24.40 O ATOM 1141 CB ARG A 68 10.649 -13.922 -20.407 1.00 11.33 C ATOM 1142 CG ARG A 68 9.283 -13.532 -19.864 1.00 45.15 C ATOM 1143 CD ARG A 68 9.402 -12.750 -18.566 1.00 3.12 C ATOM 1144 NE ARG A 68 8.404 -11.688 -18.473 1.00 41.10 N ATOM 1145 CZ ARG A 68 7.101 -11.913 -18.345 1.00 22.21 C ATOM 1146 NH1 ARG A 68 6.642 -13.156 -18.294 1.00 52.21 N ATOM 1147 NH2 ARG A 68 6.255 -10.894 -18.267 1.00 20.13 N ATOM 0 H ARG A 68 12.398 -12.790 -19.060 1.00 2.13 H new ATOM 0 HA ARG A 68 10.878 -15.186 -18.683 1.00 45.24 H new ATOM 0 HB2 ARG A 68 11.171 -13.023 -20.733 1.00 11.33 H new ATOM 0 HB3 ARG A 68 10.515 -14.550 -21.288 1.00 11.33 H new ATOM 0 HG2 ARG A 68 8.754 -12.932 -20.604 1.00 45.15 H new ATOM 0 HG3 ARG A 68 8.687 -14.429 -19.696 1.00 45.15 H new ATOM 0 HD2 ARG A 68 9.288 -13.430 -17.722 1.00 3.12 H new ATOM 0 HD3 ARG A 68 10.400 -12.317 -18.494 1.00 3.12 H new ATOM 0 HE ARG A 68 8.725 -10.720 -18.508 1.00 41.10 H new ATOM 0 HH11 ARG A 68 7.290 -13.942 -18.353 1.00 52.21 H new ATOM 0 HH12 ARG A 68 5.641 -13.326 -18.196 1.00 52.21 H new ATOM 0 HH21 ARG A 68 6.605 -9.937 -18.305 1.00 20.13 H new ATOM 0 HH22 ARG A 68 5.255 -11.068 -18.169 1.00 20.13 H new ATOM 1161 N GLU A 69 13.643 -15.339 -20.358 1.00 3.32 N ATOM 1162 CA GLU A 69 14.572 -16.233 -21.039 1.00 30.34 C ATOM 1163 C GLU A 69 14.934 -17.420 -20.150 1.00 61.24 C ATOM 1164 O GLU A 69 14.959 -18.565 -20.604 1.00 64.02 O ATOM 1165 CB GLU A 69 15.840 -15.478 -21.441 1.00 43.21 C ATOM 1166 CG GLU A 69 16.941 -16.378 -21.975 1.00 65.32 C ATOM 1167 CD GLU A 69 16.511 -17.164 -23.198 1.00 74.14 C ATOM 1168 OE1 GLU A 69 15.616 -16.686 -23.926 1.00 73.34 O ATOM 1169 OE2 GLU A 69 17.069 -18.257 -23.427 1.00 62.44 O ATOM 0 H GLU A 69 14.041 -14.437 -20.097 1.00 3.32 H new ATOM 0 HA GLU A 69 14.082 -16.609 -21.937 1.00 30.34 H new ATOM 0 HB2 GLU A 69 15.587 -14.738 -22.200 1.00 43.21 H new ATOM 0 HB3 GLU A 69 16.217 -14.931 -20.577 1.00 43.21 H new ATOM 0 HG2 GLU A 69 17.811 -15.771 -22.225 1.00 65.32 H new ATOM 0 HG3 GLU A 69 17.250 -17.071 -21.193 1.00 65.32 H new ATOM 1176 N LEU A 70 15.214 -17.139 -18.883 1.00 3.23 N ATOM 1177 CA LEU A 70 15.576 -18.182 -17.929 1.00 72.23 C ATOM 1178 C LEU A 70 14.345 -18.969 -17.491 1.00 21.51 C ATOM 1179 O LEU A 70 14.428 -20.166 -17.216 1.00 70.04 O ATOM 1180 CB LEU A 70 16.264 -17.569 -16.709 1.00 4.22 C ATOM 1181 CG LEU A 70 15.562 -16.367 -16.075 1.00 65.15 C ATOM 1182 CD1 LEU A 70 14.511 -16.828 -15.078 1.00 1.31 C ATOM 1183 CD2 LEU A 70 16.575 -15.452 -15.402 1.00 32.21 C ATOM 0 H LEU A 70 15.197 -16.197 -18.492 1.00 3.23 H new ATOM 0 HA LEU A 70 16.267 -18.867 -18.421 1.00 72.23 H new ATOM 0 HB2 LEU A 70 16.371 -18.344 -15.950 1.00 4.22 H new ATOM 0 HB3 LEU A 70 17.270 -17.266 -16.999 1.00 4.22 H new ATOM 0 HG LEU A 70 15.062 -15.804 -16.863 1.00 65.15 H new ATOM 0 HD11 LEU A 70 14.022 -15.959 -14.637 1.00 1.31 H new ATOM 0 HD12 LEU A 70 13.769 -17.442 -15.589 1.00 1.31 H new ATOM 0 HD13 LEU A 70 14.987 -17.414 -14.292 1.00 1.31 H new ATOM 0 HD21 LEU A 70 16.058 -14.602 -14.956 1.00 32.21 H new ATOM 0 HD22 LEU A 70 17.103 -16.004 -14.624 1.00 32.21 H new ATOM 0 HD23 LEU A 70 17.290 -15.094 -16.143 1.00 32.21 H new ATOM 1195 N GLU A 71 13.205 -18.289 -17.430 1.00 34.32 N ATOM 1196 CA GLU A 71 11.957 -18.926 -17.026 1.00 74.52 C ATOM 1197 C GLU A 71 11.492 -19.928 -18.080 1.00 14.15 C ATOM 1198 O GLU A 71 10.888 -20.950 -17.755 1.00 65.43 O ATOM 1199 CB GLU A 71 10.872 -17.873 -16.794 1.00 53.34 C ATOM 1200 CG GLU A 71 10.821 -17.355 -15.367 1.00 30.23 C ATOM 1201 CD GLU A 71 9.981 -16.100 -15.231 1.00 5.33 C ATOM 1202 OE1 GLU A 71 8.893 -16.045 -15.841 1.00 64.45 O ATOM 1203 OE2 GLU A 71 10.412 -15.172 -14.515 1.00 21.05 O ATOM 0 H GLU A 71 13.120 -17.298 -17.655 1.00 34.32 H new ATOM 0 HA GLU A 71 12.138 -19.462 -16.094 1.00 74.52 H new ATOM 0 HB2 GLU A 71 11.041 -17.035 -17.470 1.00 53.34 H new ATOM 0 HB3 GLU A 71 9.903 -18.300 -17.051 1.00 53.34 H new ATOM 0 HG2 GLU A 71 10.416 -18.131 -14.717 1.00 30.23 H new ATOM 0 HG3 GLU A 71 11.834 -17.148 -15.023 1.00 30.23 H new ATOM 1210 N MET A 72 11.776 -19.625 -19.342 1.00 24.12 N ATOM 1211 CA MET A 72 11.388 -20.499 -20.443 1.00 41.31 C ATOM 1212 C MET A 72 12.458 -21.554 -20.703 1.00 31.52 C ATOM 1213 O MET A 72 12.196 -22.576 -21.339 1.00 12.33 O ATOM 1214 CB MET A 72 11.146 -19.679 -21.712 1.00 12.43 C ATOM 1215 CG MET A 72 12.425 -19.199 -22.379 1.00 13.55 C ATOM 1216 SD MET A 72 12.114 -18.292 -23.906 1.00 33.30 S ATOM 1217 CE MET A 72 12.459 -19.557 -25.126 1.00 62.03 C ATOM 0 H MET A 72 12.273 -18.781 -19.628 1.00 24.12 H new ATOM 0 HA MET A 72 10.464 -21.005 -20.164 1.00 41.31 H new ATOM 0 HB2 MET A 72 10.580 -20.282 -22.422 1.00 12.43 H new ATOM 0 HB3 MET A 72 10.529 -18.815 -21.464 1.00 12.43 H new ATOM 0 HG2 MET A 72 12.973 -18.560 -21.687 1.00 13.55 H new ATOM 0 HG3 MET A 72 13.062 -20.057 -22.594 1.00 13.55 H new ATOM 0 HE1 MET A 72 12.311 -19.149 -26.126 1.00 62.03 H new ATOM 0 HE2 MET A 72 13.491 -19.893 -25.020 1.00 62.03 H new ATOM 0 HE3 MET A 72 11.786 -20.401 -24.975 1.00 62.03 H new ATOM 1227 N LYS A 73 13.665 -21.302 -20.207 1.00 54.02 N ATOM 1228 CA LYS A 73 14.775 -22.231 -20.384 1.00 53.42 C ATOM 1229 C LYS A 73 14.735 -23.333 -19.331 1.00 2.02 C ATOM 1230 O LYS A 73 15.349 -24.386 -19.498 1.00 23.21 O ATOM 1231 CB LYS A 73 16.108 -21.484 -20.307 1.00 24.03 C ATOM 1232 CG LYS A 73 16.582 -20.944 -21.645 1.00 53.21 C ATOM 1233 CD LYS A 73 17.995 -21.402 -21.963 1.00 70.42 C ATOM 1234 CE LYS A 73 18.003 -22.785 -22.596 1.00 71.34 C ATOM 1235 NZ LYS A 73 18.235 -23.856 -21.588 1.00 15.04 N ATOM 0 H LYS A 73 13.899 -20.461 -19.679 1.00 54.02 H new ATOM 0 HA LYS A 73 14.679 -22.690 -21.368 1.00 53.42 H new ATOM 0 HB2 LYS A 73 16.011 -20.656 -19.605 1.00 24.03 H new ATOM 0 HB3 LYS A 73 16.868 -22.155 -19.906 1.00 24.03 H new ATOM 0 HG2 LYS A 73 15.905 -21.276 -22.432 1.00 53.21 H new ATOM 0 HG3 LYS A 73 16.546 -19.855 -21.632 1.00 53.21 H new ATOM 0 HD2 LYS A 73 18.466 -20.689 -22.639 1.00 70.42 H new ATOM 0 HD3 LYS A 73 18.589 -21.416 -21.049 1.00 70.42 H new ATOM 0 HE2 LYS A 73 17.052 -22.960 -23.099 1.00 71.34 H new ATOM 0 HE3 LYS A 73 18.780 -22.830 -23.359 1.00 71.34 H new ATOM 0 HZ1 LYS A 73 18.436 -24.753 -22.074 1.00 15.04 H new ATOM 0 HZ2 LYS A 73 19.045 -23.599 -20.988 1.00 15.04 H new ATOM 0 HZ3 LYS A 73 17.387 -23.965 -20.996 1.00 15.04 H new ATOM 1249 N ALA A 74 14.008 -23.084 -18.247 1.00 11.42 N ATOM 1250 CA ALA A 74 13.886 -24.057 -17.168 1.00 53.54 C ATOM 1251 C ALA A 74 12.932 -25.183 -17.551 1.00 31.21 C ATOM 1252 O ALA A 74 12.658 -26.076 -16.749 1.00 61.41 O ATOM 1253 CB ALA A 74 13.415 -23.374 -15.893 1.00 33.04 C ATOM 0 H ALA A 74 13.494 -22.216 -18.092 1.00 11.42 H new ATOM 0 HA ALA A 74 14.869 -24.493 -16.991 1.00 53.54 H new ATOM 0 HB1 ALA A 74 13.328 -24.112 -15.096 1.00 33.04 H new ATOM 0 HB2 ALA A 74 14.135 -22.609 -15.603 1.00 33.04 H new ATOM 0 HB3 ALA A 74 12.444 -22.911 -16.066 1.00 33.04 H new ATOM 1259 N ARG A 75 12.428 -25.134 -18.780 1.00 25.41 N ATOM 1260 CA ARG A 75 11.503 -26.150 -19.267 1.00 65.35 C ATOM 1261 C ARG A 75 10.154 -26.039 -18.564 1.00 72.14 C ATOM 1262 O ARG A 75 9.686 -26.992 -17.940 1.00 50.33 O ATOM 1263 CB ARG A 75 12.088 -27.548 -19.054 1.00 2.32 C ATOM 1264 CG ARG A 75 11.539 -28.591 -20.013 1.00 31.02 C ATOM 1265 CD ARG A 75 12.317 -28.611 -21.319 1.00 54.04 C ATOM 1266 NE ARG A 75 11.819 -27.618 -22.268 1.00 3.23 N ATOM 1267 CZ ARG A 75 12.459 -27.280 -23.382 1.00 22.42 C ATOM 1268 NH1 ARG A 75 13.615 -27.854 -23.686 1.00 3.12 N ATOM 1269 NH2 ARG A 75 11.942 -26.368 -24.195 1.00 4.23 N ATOM 0 H ARG A 75 12.645 -24.402 -19.456 1.00 25.41 H new ATOM 0 HA ARG A 75 11.352 -25.986 -20.334 1.00 65.35 H new ATOM 0 HB2 ARG A 75 13.171 -27.500 -19.164 1.00 2.32 H new ATOM 0 HB3 ARG A 75 11.886 -27.865 -18.031 1.00 2.32 H new ATOM 0 HG2 ARG A 75 11.584 -29.575 -19.546 1.00 31.02 H new ATOM 0 HG3 ARG A 75 10.489 -28.382 -20.217 1.00 31.02 H new ATOM 0 HD2 ARG A 75 13.371 -28.422 -21.116 1.00 54.04 H new ATOM 0 HD3 ARG A 75 12.251 -29.603 -21.765 1.00 54.04 H new ATOM 0 HE ARG A 75 10.931 -27.159 -22.064 1.00 3.23 H new ATOM 0 HH11 ARG A 75 14.015 -28.557 -23.064 1.00 3.12 H new ATOM 0 HH12 ARG A 75 14.105 -27.593 -24.542 1.00 3.12 H new ATOM 0 HH21 ARG A 75 11.052 -25.926 -23.965 1.00 4.23 H new ATOM 0 HH22 ARG A 75 12.434 -26.109 -25.050 1.00 4.23 H new ATOM 1283 N LYS A 76 9.533 -24.869 -18.669 1.00 74.23 N ATOM 1284 CA LYS A 76 8.236 -24.632 -18.045 1.00 44.00 C ATOM 1285 C LYS A 76 8.175 -25.268 -16.660 1.00 71.42 C ATOM 1286 O LYS A 76 7.156 -25.842 -16.275 1.00 52.20 O ATOM 1287 CB LYS A 76 7.114 -25.189 -18.924 1.00 43.31 C ATOM 1288 CG LYS A 76 7.158 -26.699 -19.082 1.00 52.33 C ATOM 1289 CD LYS A 76 5.822 -27.249 -19.553 1.00 41.24 C ATOM 1290 CE LYS A 76 4.895 -27.540 -18.383 1.00 62.11 C ATOM 1291 NZ LYS A 76 3.490 -27.752 -18.828 1.00 11.41 N ATOM 0 H LYS A 76 9.907 -24.070 -19.180 1.00 74.23 H new ATOM 0 HA LYS A 76 8.104 -23.555 -17.938 1.00 44.00 H new ATOM 0 HB2 LYS A 76 6.153 -24.905 -18.495 1.00 43.31 H new ATOM 0 HB3 LYS A 76 7.173 -24.727 -19.910 1.00 43.31 H new ATOM 0 HG2 LYS A 76 7.936 -26.969 -19.796 1.00 52.33 H new ATOM 0 HG3 LYS A 76 7.426 -27.158 -18.130 1.00 52.33 H new ATOM 0 HD2 LYS A 76 5.349 -26.532 -20.224 1.00 41.24 H new ATOM 0 HD3 LYS A 76 5.985 -28.162 -20.125 1.00 41.24 H new ATOM 0 HE2 LYS A 76 5.246 -28.426 -17.853 1.00 62.11 H new ATOM 0 HE3 LYS A 76 4.931 -26.711 -17.676 1.00 62.11 H new ATOM 0 HZ1 LYS A 76 2.890 -27.948 -18.001 1.00 11.41 H new ATOM 0 HZ2 LYS A 76 3.146 -26.898 -19.311 1.00 11.41 H new ATOM 0 HZ3 LYS A 76 3.451 -28.559 -19.483 1.00 11.41 H new ATOM 1305 N ARG A 77 9.271 -25.162 -15.916 1.00 32.21 N ATOM 1306 CA ARG A 77 9.341 -25.727 -14.574 1.00 34.33 C ATOM 1307 C ARG A 77 9.182 -24.639 -13.517 1.00 12.55 C ATOM 1308 O ARG A 77 8.913 -23.480 -13.838 1.00 71.31 O ATOM 1309 CB ARG A 77 10.670 -26.458 -14.373 1.00 53.33 C ATOM 1310 CG ARG A 77 10.676 -27.874 -14.926 1.00 12.24 C ATOM 1311 CD ARG A 77 9.676 -28.760 -14.199 1.00 2.45 C ATOM 1312 NE ARG A 77 9.957 -30.179 -14.397 1.00 4.05 N ATOM 1313 CZ ARG A 77 9.173 -31.153 -13.948 1.00 64.00 C ATOM 1314 NH1 ARG A 77 8.066 -30.862 -13.280 1.00 33.41 N ATOM 1315 NH2 ARG A 77 9.497 -32.421 -14.168 1.00 54.01 N ATOM 0 H ARG A 77 10.123 -24.690 -16.220 1.00 32.21 H new ATOM 0 HA ARG A 77 8.523 -26.439 -14.464 1.00 34.33 H new ATOM 0 HB2 ARG A 77 11.465 -25.887 -14.852 1.00 53.33 H new ATOM 0 HB3 ARG A 77 10.899 -26.492 -13.308 1.00 53.33 H new ATOM 0 HG2 ARG A 77 10.438 -27.852 -15.989 1.00 12.24 H new ATOM 0 HG3 ARG A 77 11.676 -28.298 -14.832 1.00 12.24 H new ATOM 0 HD2 ARG A 77 9.697 -28.532 -13.133 1.00 2.45 H new ATOM 0 HD3 ARG A 77 8.670 -28.537 -14.553 1.00 2.45 H new ATOM 0 HE ARG A 77 10.801 -30.437 -14.908 1.00 4.05 H new ATOM 0 HH11 ARG A 77 7.814 -29.888 -13.110 1.00 33.41 H new ATOM 0 HH12 ARG A 77 7.466 -31.612 -12.936 1.00 33.41 H new ATOM 0 HH21 ARG A 77 10.348 -32.648 -14.682 1.00 54.01 H new ATOM 0 HH22 ARG A 77 8.895 -33.168 -13.823 1.00 54.01 H new ATOM 1329 N LEU A 78 9.349 -25.018 -12.254 1.00 42.15 N ATOM 1330 CA LEU A 78 9.224 -24.074 -11.149 1.00 21.41 C ATOM 1331 C LEU A 78 7.803 -23.528 -11.058 1.00 1.42 C ATOM 1332 O LEU A 78 7.324 -22.825 -11.948 1.00 11.53 O ATOM 1333 CB LEU A 78 10.216 -22.923 -11.321 1.00 11.51 C ATOM 1334 CG LEU A 78 11.694 -23.311 -11.368 1.00 1.02 C ATOM 1335 CD1 LEU A 78 12.055 -23.874 -12.734 1.00 10.23 C ATOM 1336 CD2 LEU A 78 12.571 -22.113 -11.034 1.00 21.12 C ATOM 0 H LEU A 78 9.571 -25.972 -11.970 1.00 42.15 H new ATOM 0 HA LEU A 78 9.449 -24.604 -10.223 1.00 21.41 H new ATOM 0 HB2 LEU A 78 9.971 -22.393 -12.242 1.00 11.51 H new ATOM 0 HB3 LEU A 78 10.072 -22.220 -10.501 1.00 11.51 H new ATOM 0 HG LEU A 78 11.871 -24.085 -10.621 1.00 1.02 H new ATOM 0 HD11 LEU A 78 13.111 -24.145 -12.749 1.00 10.23 H new ATOM 0 HD12 LEU A 78 11.451 -24.759 -12.934 1.00 10.23 H new ATOM 0 HD13 LEU A 78 11.862 -23.123 -13.500 1.00 10.23 H new ATOM 0 HD21 LEU A 78 13.620 -22.408 -11.072 1.00 21.12 H new ATOM 0 HD22 LEU A 78 12.391 -21.317 -11.757 1.00 21.12 H new ATOM 0 HD23 LEU A 78 12.331 -21.754 -10.033 1.00 21.12 H new ATOM 1348 N PRO A 79 7.112 -23.855 -9.956 1.00 23.13 N ATOM 1349 CA PRO A 79 5.737 -23.405 -9.720 1.00 41.05 C ATOM 1350 C PRO A 79 5.656 -21.907 -9.445 1.00 25.42 C ATOM 1351 O PRO A 79 4.594 -21.298 -9.572 1.00 51.00 O ATOM 1352 CB PRO A 79 5.310 -24.200 -8.484 1.00 63.01 C ATOM 1353 CG PRO A 79 6.584 -24.516 -7.779 1.00 32.32 C ATOM 1354 CD PRO A 79 7.621 -24.690 -8.854 1.00 54.51 C ATOM 0 HA PRO A 79 5.100 -23.569 -10.589 1.00 41.05 H new ATOM 0 HB2 PRO A 79 4.641 -23.618 -7.851 1.00 63.01 H new ATOM 0 HB3 PRO A 79 4.776 -25.108 -8.762 1.00 63.01 H new ATOM 0 HG2 PRO A 79 6.861 -23.713 -7.096 1.00 32.32 H new ATOM 0 HG3 PRO A 79 6.485 -25.423 -7.182 1.00 32.32 H new ATOM 0 HD2 PRO A 79 8.605 -24.360 -8.521 1.00 54.51 H new ATOM 0 HD3 PRO A 79 7.719 -25.734 -9.153 1.00 54.51 H new ATOM 1362 N THR A 80 6.787 -21.318 -9.067 1.00 34.13 N ATOM 1363 CA THR A 80 6.844 -19.892 -8.772 1.00 54.14 C ATOM 1364 C THR A 80 7.239 -19.091 -10.008 1.00 12.13 C ATOM 1365 O THR A 80 7.605 -19.658 -11.038 1.00 14.10 O ATOM 1366 CB THR A 80 7.842 -19.592 -7.639 1.00 2.43 C ATOM 1367 OG1 THR A 80 8.011 -20.750 -6.815 1.00 34.45 O ATOM 1368 CG2 THR A 80 7.362 -18.424 -6.789 1.00 72.55 C ATOM 0 H THR A 80 7.675 -21.807 -8.958 1.00 34.13 H new ATOM 0 HA THR A 80 5.845 -19.595 -8.453 1.00 54.14 H new ATOM 0 HB THR A 80 8.798 -19.324 -8.089 1.00 2.43 H new ATOM 0 HG1 THR A 80 8.649 -20.551 -6.098 1.00 34.45 H new ATOM 0 HG21 THR A 80 8.084 -18.231 -5.995 1.00 72.55 H new ATOM 0 HG22 THR A 80 7.263 -17.536 -7.413 1.00 72.55 H new ATOM 0 HG23 THR A 80 6.395 -18.667 -6.349 1.00 72.55 H new ATOM 1376 N THR A 81 7.164 -17.768 -9.899 1.00 11.03 N ATOM 1377 CA THR A 81 7.513 -16.889 -11.007 1.00 44.32 C ATOM 1378 C THR A 81 8.307 -15.681 -10.522 1.00 13.12 C ATOM 1379 O THR A 81 8.543 -14.736 -11.276 1.00 74.22 O ATOM 1380 CB THR A 81 6.258 -16.398 -11.753 1.00 31.24 C ATOM 1381 OG1 THR A 81 5.337 -17.481 -11.927 1.00 64.11 O ATOM 1382 CG2 THR A 81 6.627 -15.816 -13.109 1.00 13.02 C ATOM 0 H THR A 81 6.864 -17.282 -9.054 1.00 11.03 H new ATOM 0 HA THR A 81 8.128 -17.474 -11.692 1.00 44.32 H new ATOM 0 HB THR A 81 5.790 -15.616 -11.156 1.00 31.24 H new ATOM 0 HG1 THR A 81 4.541 -17.161 -12.401 1.00 64.11 H new ATOM 0 HG21 THR A 81 5.724 -15.476 -13.617 1.00 13.02 H new ATOM 0 HG22 THR A 81 7.305 -14.974 -12.971 1.00 13.02 H new ATOM 0 HG23 THR A 81 7.117 -16.581 -13.712 1.00 13.02 H new ATOM 1390 N LEU A 82 8.717 -15.717 -9.259 1.00 31.21 N ATOM 1391 CA LEU A 82 9.486 -14.625 -8.672 1.00 54.34 C ATOM 1392 C LEU A 82 10.866 -15.104 -8.236 1.00 4.43 C ATOM 1393 O LEU A 82 11.184 -15.115 -7.046 1.00 54.31 O ATOM 1394 CB LEU A 82 8.737 -14.032 -7.477 1.00 70.51 C ATOM 1395 CG LEU A 82 7.721 -12.936 -7.798 1.00 34.11 C ATOM 1396 CD1 LEU A 82 7.013 -12.478 -6.532 1.00 53.44 C ATOM 1397 CD2 LEU A 82 8.402 -11.762 -8.485 1.00 51.14 C ATOM 0 H LEU A 82 8.530 -16.491 -8.621 1.00 31.21 H new ATOM 0 HA LEU A 82 9.613 -13.854 -9.432 1.00 54.34 H new ATOM 0 HB2 LEU A 82 8.219 -14.840 -6.961 1.00 70.51 H new ATOM 0 HB3 LEU A 82 9.470 -13.627 -6.779 1.00 70.51 H new ATOM 0 HG LEU A 82 6.975 -13.346 -8.479 1.00 34.11 H new ATOM 0 HD11 LEU A 82 6.293 -11.698 -6.780 1.00 53.44 H new ATOM 0 HD12 LEU A 82 6.492 -13.322 -6.081 1.00 53.44 H new ATOM 0 HD13 LEU A 82 7.746 -12.085 -5.827 1.00 53.44 H new ATOM 0 HD21 LEU A 82 7.663 -10.991 -8.706 1.00 51.14 H new ATOM 0 HD22 LEU A 82 9.169 -11.352 -7.829 1.00 51.14 H new ATOM 0 HD23 LEU A 82 8.862 -12.101 -9.413 1.00 51.14 H new ATOM 1409 N PHE A 83 11.685 -15.497 -9.206 1.00 52.30 N ATOM 1410 CA PHE A 83 13.033 -15.975 -8.922 1.00 73.41 C ATOM 1411 C PHE A 83 14.035 -15.402 -9.919 1.00 50.45 C ATOM 1412 O PHE A 83 13.656 -14.750 -10.893 1.00 14.13 O ATOM 1413 CB PHE A 83 13.073 -17.504 -8.964 1.00 21.43 C ATOM 1414 CG PHE A 83 12.460 -18.087 -10.205 1.00 42.32 C ATOM 1415 CD1 PHE A 83 13.029 -17.857 -11.448 1.00 31.44 C ATOM 1416 CD2 PHE A 83 11.315 -18.863 -10.130 1.00 10.12 C ATOM 1417 CE1 PHE A 83 12.468 -18.392 -12.592 1.00 73.01 C ATOM 1418 CE2 PHE A 83 10.750 -19.401 -11.271 1.00 14.54 C ATOM 1419 CZ PHE A 83 11.326 -19.164 -12.503 1.00 51.23 C ATOM 0 H PHE A 83 11.439 -15.494 -10.196 1.00 52.30 H new ATOM 0 HA PHE A 83 13.308 -15.638 -7.923 1.00 73.41 H new ATOM 0 HB2 PHE A 83 14.109 -17.834 -8.891 1.00 21.43 H new ATOM 0 HB3 PHE A 83 12.551 -17.897 -8.092 1.00 21.43 H new ATOM 0 HD1 PHE A 83 13.921 -17.253 -11.523 1.00 31.44 H new ATOM 0 HD2 PHE A 83 10.859 -19.050 -9.169 1.00 10.12 H new ATOM 0 HE1 PHE A 83 12.922 -18.207 -13.554 1.00 73.01 H new ATOM 0 HE2 PHE A 83 9.859 -20.006 -11.199 1.00 14.54 H new ATOM 0 HZ PHE A 83 10.884 -19.582 -13.396 1.00 51.23 H new ATOM 1429 N PHE A 84 15.317 -15.648 -9.670 1.00 34.45 N ATOM 1430 CA PHE A 84 16.375 -15.156 -10.544 1.00 13.43 C ATOM 1431 C PHE A 84 17.513 -16.167 -10.643 1.00 2.40 C ATOM 1432 O PHE A 84 17.537 -17.164 -9.921 1.00 15.33 O ATOM 1433 CB PHE A 84 16.909 -13.818 -10.029 1.00 2.44 C ATOM 1434 CG PHE A 84 17.166 -13.804 -8.549 1.00 33.43 C ATOM 1435 CD1 PHE A 84 17.986 -14.757 -7.966 1.00 33.11 C ATOM 1436 CD2 PHE A 84 16.587 -12.839 -7.741 1.00 3.15 C ATOM 1437 CE1 PHE A 84 18.223 -14.748 -6.604 1.00 53.43 C ATOM 1438 CE2 PHE A 84 16.821 -12.824 -6.378 1.00 60.13 C ATOM 1439 CZ PHE A 84 17.641 -13.779 -5.810 1.00 33.23 C ATOM 0 H PHE A 84 15.648 -16.186 -8.869 1.00 34.45 H new ATOM 0 HA PHE A 84 15.953 -15.012 -11.539 1.00 13.43 H new ATOM 0 HB2 PHE A 84 17.835 -13.580 -10.553 1.00 2.44 H new ATOM 0 HB3 PHE A 84 16.194 -13.032 -10.273 1.00 2.44 H new ATOM 0 HD1 PHE A 84 18.445 -15.515 -8.583 1.00 33.11 H new ATOM 0 HD2 PHE A 84 15.945 -12.090 -8.181 1.00 3.15 H new ATOM 0 HE1 PHE A 84 18.862 -15.498 -6.161 1.00 53.43 H new ATOM 0 HE2 PHE A 84 16.363 -12.067 -5.759 1.00 60.13 H new ATOM 0 HZ PHE A 84 17.827 -13.768 -4.746 1.00 33.23 H new ATOM 1449 N ILE A 85 18.455 -15.902 -11.542 1.00 54.05 N ATOM 1450 CA ILE A 85 19.596 -16.788 -11.736 1.00 51.32 C ATOM 1451 C ILE A 85 20.826 -16.269 -10.999 1.00 51.31 C ATOM 1452 O ILE A 85 21.051 -15.061 -10.922 1.00 65.52 O ATOM 1453 CB ILE A 85 19.936 -16.949 -13.230 1.00 3.15 C ATOM 1454 CG1 ILE A 85 20.390 -15.612 -13.819 1.00 10.31 C ATOM 1455 CG2 ILE A 85 18.735 -17.489 -13.991 1.00 64.41 C ATOM 1456 CD1 ILE A 85 20.895 -15.718 -15.241 1.00 22.33 C ATOM 0 H ILE A 85 18.450 -15.081 -12.147 1.00 54.05 H new ATOM 0 HA ILE A 85 19.315 -17.759 -11.329 1.00 51.32 H new ATOM 0 HB ILE A 85 20.754 -17.663 -13.327 1.00 3.15 H new ATOM 0 HG12 ILE A 85 19.557 -14.910 -13.789 1.00 10.31 H new ATOM 0 HG13 ILE A 85 21.179 -15.197 -13.192 1.00 10.31 H new ATOM 0 HG21 ILE A 85 18.991 -17.597 -15.045 1.00 64.41 H new ATOM 0 HG22 ILE A 85 18.453 -18.460 -13.584 1.00 64.41 H new ATOM 0 HG23 ILE A 85 17.899 -16.797 -13.890 1.00 64.41 H new ATOM 0 HD11 ILE A 85 21.199 -14.733 -15.593 1.00 22.33 H new ATOM 0 HD12 ILE A 85 21.749 -16.395 -15.274 1.00 22.33 H new ATOM 0 HD13 ILE A 85 20.101 -16.103 -15.881 1.00 22.33 H new ATOM 1468 N GLU A 86 21.619 -17.190 -10.460 1.00 54.32 N ATOM 1469 CA GLU A 86 22.827 -16.824 -9.730 1.00 72.20 C ATOM 1470 C GLU A 86 23.755 -15.983 -10.601 1.00 64.11 C ATOM 1471 O GLU A 86 24.564 -15.204 -10.095 1.00 41.05 O ATOM 1472 CB GLU A 86 23.558 -18.079 -9.250 1.00 23.35 C ATOM 1473 CG GLU A 86 24.802 -17.782 -8.429 1.00 63.22 C ATOM 1474 CD GLU A 86 24.798 -18.488 -7.087 1.00 2.51 C ATOM 1475 OE1 GLU A 86 23.706 -18.636 -6.499 1.00 4.12 O ATOM 1476 OE2 GLU A 86 25.886 -18.891 -6.625 1.00 13.35 O ATOM 0 H GLU A 86 21.447 -18.194 -10.515 1.00 54.32 H new ATOM 0 HA GLU A 86 22.533 -16.230 -8.865 1.00 72.20 H new ATOM 0 HB2 GLU A 86 22.874 -18.682 -8.653 1.00 23.35 H new ATOM 0 HB3 GLU A 86 23.839 -18.679 -10.115 1.00 23.35 H new ATOM 0 HG2 GLU A 86 25.685 -18.085 -8.992 1.00 63.22 H new ATOM 0 HG3 GLU A 86 24.879 -16.707 -8.269 1.00 63.22 H new ATOM 1483 N THR A 87 23.634 -16.147 -11.915 1.00 0.51 N ATOM 1484 CA THR A 87 24.462 -15.405 -12.857 1.00 44.11 C ATOM 1485 C THR A 87 24.041 -13.942 -12.927 1.00 13.45 C ATOM 1486 O THR A 87 24.729 -13.115 -13.526 1.00 32.20 O ATOM 1487 CB THR A 87 24.391 -16.015 -14.270 1.00 20.45 C ATOM 1488 OG1 THR A 87 23.455 -17.099 -14.288 1.00 61.01 O ATOM 1489 CG2 THR A 87 25.758 -16.512 -14.714 1.00 64.11 C ATOM 0 H THR A 87 22.970 -16.787 -12.351 1.00 0.51 H new ATOM 0 HA THR A 87 25.487 -15.468 -12.492 1.00 44.11 H new ATOM 0 HB THR A 87 24.062 -15.239 -14.961 1.00 20.45 H new ATOM 0 HG1 THR A 87 23.529 -17.581 -15.138 1.00 61.01 H new ATOM 0 HG21 THR A 87 25.683 -16.938 -15.714 1.00 64.11 H new ATOM 0 HG22 THR A 87 26.461 -15.679 -14.726 1.00 64.11 H new ATOM 0 HG23 THR A 87 26.111 -17.275 -14.020 1.00 64.11 H new ATOM 1497 N ASP A 88 22.907 -13.628 -12.310 1.00 10.35 N ATOM 1498 CA ASP A 88 22.394 -12.263 -12.300 1.00 3.51 C ATOM 1499 C ASP A 88 22.686 -11.582 -10.966 1.00 50.01 C ATOM 1500 O ASP A 88 22.786 -10.357 -10.892 1.00 41.12 O ATOM 1501 CB ASP A 88 20.889 -12.258 -12.570 1.00 71.42 C ATOM 1502 CG ASP A 88 20.527 -11.481 -13.821 1.00 25.42 C ATOM 1503 OD1 ASP A 88 21.015 -10.342 -13.974 1.00 4.35 O ATOM 1504 OD2 ASP A 88 19.757 -12.013 -14.647 1.00 64.24 O ATOM 0 H ASP A 88 22.325 -14.301 -11.810 1.00 10.35 H new ATOM 0 HA ASP A 88 22.898 -11.707 -13.090 1.00 3.51 H new ATOM 0 HB2 ASP A 88 20.537 -13.285 -12.669 1.00 71.42 H new ATOM 0 HB3 ASP A 88 20.371 -11.825 -11.714 1.00 71.42 H new ATOM 1509 N ILE A 89 22.820 -12.384 -9.915 1.00 61.13 N ATOM 1510 CA ILE A 89 23.100 -11.859 -8.585 1.00 0.22 C ATOM 1511 C ILE A 89 24.594 -11.901 -8.280 1.00 53.44 C ATOM 1512 O ILE A 89 25.130 -11.006 -7.626 1.00 55.35 O ATOM 1513 CB ILE A 89 22.344 -12.646 -7.498 1.00 51.12 C ATOM 1514 CG1 ILE A 89 20.900 -12.902 -7.935 1.00 11.32 C ATOM 1515 CG2 ILE A 89 22.378 -11.892 -6.177 1.00 50.34 C ATOM 1516 CD1 ILE A 89 20.059 -11.646 -8.008 1.00 24.21 C ATOM 0 H ILE A 89 22.739 -13.400 -9.959 1.00 61.13 H new ATOM 0 HA ILE A 89 22.759 -10.824 -8.577 1.00 0.22 H new ATOM 0 HB ILE A 89 22.837 -13.608 -7.357 1.00 51.12 H new ATOM 0 HG12 ILE A 89 20.905 -13.384 -8.913 1.00 11.32 H new ATOM 0 HG13 ILE A 89 20.436 -13.600 -7.238 1.00 11.32 H new ATOM 0 HG21 ILE A 89 21.840 -12.461 -5.419 1.00 50.34 H new ATOM 0 HG22 ILE A 89 23.413 -11.756 -5.862 1.00 50.34 H new ATOM 0 HG23 ILE A 89 21.906 -10.917 -6.302 1.00 50.34 H new ATOM 0 HD11 ILE A 89 19.048 -11.903 -8.324 1.00 24.21 H new ATOM 0 HD12 ILE A 89 20.023 -11.174 -7.026 1.00 24.21 H new ATOM 0 HD13 ILE A 89 20.499 -10.955 -8.727 1.00 24.21 H new ATOM 1528 N ARG A 90 25.261 -12.945 -8.760 1.00 72.04 N ATOM 1529 CA ARG A 90 26.693 -13.103 -8.540 1.00 63.42 C ATOM 1530 C ARG A 90 27.446 -11.831 -8.920 1.00 35.24 C ATOM 1531 O ARG A 90 28.150 -11.231 -8.107 1.00 71.51 O ATOM 1532 CB ARG A 90 27.228 -14.286 -9.351 1.00 12.42 C ATOM 1533 CG ARG A 90 28.698 -14.159 -9.715 1.00 71.04 C ATOM 1534 CD ARG A 90 29.573 -14.061 -8.476 1.00 11.54 C ATOM 1535 NE ARG A 90 29.502 -15.269 -7.658 1.00 42.24 N ATOM 1536 CZ ARG A 90 30.046 -16.428 -8.012 1.00 71.10 C ATOM 1537 NH1 ARG A 90 30.697 -16.535 -9.162 1.00 22.21 N ATOM 1538 NH2 ARG A 90 29.939 -17.483 -7.214 1.00 60.15 N ATOM 0 H ARG A 90 24.833 -13.694 -9.304 1.00 72.04 H new ATOM 0 HA ARG A 90 26.852 -13.296 -7.479 1.00 63.42 H new ATOM 0 HB2 ARG A 90 27.082 -15.203 -8.780 1.00 12.42 H new ATOM 0 HB3 ARG A 90 26.643 -14.383 -10.266 1.00 12.42 H new ATOM 0 HG2 ARG A 90 29.002 -15.021 -10.309 1.00 71.04 H new ATOM 0 HG3 ARG A 90 28.845 -13.275 -10.336 1.00 71.04 H new ATOM 0 HD2 ARG A 90 30.606 -13.886 -8.775 1.00 11.54 H new ATOM 0 HD3 ARG A 90 29.264 -13.202 -7.881 1.00 11.54 H new ATOM 0 HE ARG A 90 29.008 -15.220 -6.767 1.00 42.24 H new ATOM 0 HH11 ARG A 90 30.781 -15.726 -9.778 1.00 22.21 H new ATOM 0 HH12 ARG A 90 31.114 -17.426 -9.431 1.00 22.21 H new ATOM 0 HH21 ARG A 90 29.439 -17.404 -6.329 1.00 60.15 H new ATOM 0 HH22 ARG A 90 30.357 -18.373 -7.486 1.00 60.15 H new ATOM 1552 N PRO A 91 27.295 -11.409 -10.184 1.00 15.34 N ATOM 1553 CA PRO A 91 27.952 -10.204 -10.700 1.00 34.25 C ATOM 1554 C PRO A 91 27.374 -8.927 -10.100 1.00 52.30 C ATOM 1555 O PRO A 91 27.748 -7.822 -10.492 1.00 12.20 O ATOM 1556 CB PRO A 91 27.671 -10.264 -12.203 1.00 43.42 C ATOM 1557 CG PRO A 91 26.424 -11.070 -12.325 1.00 4.35 C ATOM 1558 CD PRO A 91 26.470 -12.074 -11.206 1.00 63.24 C ATOM 0 HA PRO A 91 29.013 -10.179 -10.451 1.00 34.25 H new ATOM 0 HB2 PRO A 91 27.539 -9.266 -12.621 1.00 43.42 H new ATOM 0 HB3 PRO A 91 28.497 -10.729 -12.742 1.00 43.42 H new ATOM 0 HG2 PRO A 91 25.540 -10.437 -12.245 1.00 4.35 H new ATOM 0 HG3 PRO A 91 26.374 -11.567 -13.294 1.00 4.35 H new ATOM 0 HD2 PRO A 91 25.473 -12.303 -10.831 1.00 63.24 H new ATOM 0 HD3 PRO A 91 26.913 -13.016 -11.529 1.00 63.24 H new ATOM 1566 N MET A 92 26.461 -9.086 -9.148 1.00 14.14 N ATOM 1567 CA MET A 92 25.833 -7.944 -8.493 1.00 73.01 C ATOM 1568 C MET A 92 26.317 -7.809 -7.053 1.00 11.11 C ATOM 1569 O MET A 92 26.251 -6.729 -6.464 1.00 30.23 O ATOM 1570 CB MET A 92 24.310 -8.088 -8.520 1.00 13.50 C ATOM 1571 CG MET A 92 23.645 -7.299 -9.636 1.00 53.13 C ATOM 1572 SD MET A 92 22.084 -6.554 -9.126 1.00 1.41 S ATOM 1573 CE MET A 92 22.267 -4.899 -9.788 1.00 34.24 C ATOM 0 H MET A 92 26.139 -9.994 -8.813 1.00 14.14 H new ATOM 0 HA MET A 92 26.116 -7.044 -9.038 1.00 73.01 H new ATOM 0 HB2 MET A 92 24.055 -9.142 -8.629 1.00 13.50 H new ATOM 0 HB3 MET A 92 23.905 -7.760 -7.563 1.00 13.50 H new ATOM 0 HG2 MET A 92 24.323 -6.516 -9.976 1.00 53.13 H new ATOM 0 HG3 MET A 92 23.468 -7.958 -10.486 1.00 53.13 H new ATOM 0 HE1 MET A 92 21.378 -4.313 -9.554 1.00 34.24 H new ATOM 0 HE2 MET A 92 23.142 -4.424 -9.344 1.00 34.24 H new ATOM 0 HE3 MET A 92 22.392 -4.952 -10.870 1.00 34.24 H new ATOM 1583 N LEU A 93 26.803 -8.910 -6.491 1.00 70.33 N ATOM 1584 CA LEU A 93 27.298 -8.915 -5.119 1.00 44.32 C ATOM 1585 C LEU A 93 28.619 -8.159 -5.015 1.00 3.03 C ATOM 1586 O LEU A 93 28.668 -6.945 -5.213 1.00 35.43 O ATOM 1587 CB LEU A 93 27.479 -10.351 -4.626 1.00 64.41 C ATOM 1588 CG LEU A 93 26.205 -11.189 -4.516 1.00 53.21 C ATOM 1589 CD1 LEU A 93 26.544 -12.639 -4.210 1.00 72.53 C ATOM 1590 CD2 LEU A 93 25.282 -10.618 -3.449 1.00 23.44 C ATOM 0 H LEU A 93 26.865 -9.811 -6.965 1.00 70.33 H new ATOM 0 HA LEU A 93 26.562 -8.413 -4.491 1.00 44.32 H new ATOM 0 HB2 LEU A 93 28.168 -10.861 -5.299 1.00 64.41 H new ATOM 0 HB3 LEU A 93 27.955 -10.320 -3.646 1.00 64.41 H new ATOM 0 HG LEU A 93 25.686 -11.154 -5.474 1.00 53.21 H new ATOM 0 HD11 LEU A 93 25.625 -13.220 -4.135 1.00 72.53 H new ATOM 0 HD12 LEU A 93 27.165 -13.044 -5.009 1.00 72.53 H new ATOM 0 HD13 LEU A 93 27.086 -12.695 -3.266 1.00 72.53 H new ATOM 0 HD21 LEU A 93 24.380 -11.227 -3.384 1.00 23.44 H new ATOM 0 HD22 LEU A 93 25.793 -10.622 -2.486 1.00 23.44 H new ATOM 0 HD23 LEU A 93 25.011 -9.595 -3.712 1.00 23.44 H new ATOM 1602 N GLN A 94 29.688 -8.886 -4.705 1.00 10.34 N ATOM 1603 CA GLN A 94 31.010 -8.283 -4.576 1.00 34.33 C ATOM 1604 C GLN A 94 32.070 -9.149 -5.247 1.00 24.41 C ATOM 1605 O GLN A 94 32.019 -10.377 -5.176 1.00 61.50 O ATOM 1606 CB GLN A 94 31.359 -8.080 -3.100 1.00 51.04 C ATOM 1607 CG GLN A 94 31.332 -6.624 -2.664 1.00 64.01 C ATOM 1608 CD GLN A 94 32.462 -6.279 -1.713 1.00 75.11 C ATOM 1609 OE1 GLN A 94 32.796 -7.058 -0.820 1.00 1.11 O ATOM 1610 NE2 GLN A 94 33.056 -5.107 -1.900 1.00 42.32 N ATOM 0 H GLN A 94 29.665 -9.892 -4.539 1.00 10.34 H new ATOM 0 HA GLN A 94 30.990 -7.314 -5.074 1.00 34.33 H new ATOM 0 HB2 GLN A 94 30.658 -8.647 -2.488 1.00 51.04 H new ATOM 0 HB3 GLN A 94 32.351 -8.489 -2.910 1.00 51.04 H new ATOM 0 HG2 GLN A 94 31.394 -5.984 -3.544 1.00 64.01 H new ATOM 0 HG3 GLN A 94 30.378 -6.411 -2.182 1.00 64.01 H new ATOM 0 HE21 GLN A 94 32.746 -4.493 -2.653 1.00 42.32 H new ATOM 0 HE22 GLN A 94 33.822 -4.821 -1.291 1.00 42.32 H new ATOM 1619 N ASP A 95 33.030 -8.502 -5.898 1.00 43.11 N ATOM 1620 CA ASP A 95 34.104 -9.213 -6.582 1.00 22.11 C ATOM 1621 C ASP A 95 35.023 -9.904 -5.579 1.00 44.51 C ATOM 1622 O ASP A 95 35.713 -10.866 -5.915 1.00 64.12 O ATOM 1623 CB ASP A 95 34.911 -8.248 -7.452 1.00 2.35 C ATOM 1624 CG ASP A 95 34.031 -7.417 -8.364 1.00 51.14 C ATOM 1625 OD1 ASP A 95 32.894 -7.849 -8.648 1.00 32.54 O ATOM 1626 OD2 ASP A 95 34.479 -6.334 -8.795 1.00 15.31 O ATOM 0 H ASP A 95 33.087 -7.486 -5.967 1.00 43.11 H new ATOM 0 HA ASP A 95 33.654 -9.974 -7.220 1.00 22.11 H new ATOM 0 HB2 ASP A 95 35.493 -7.586 -6.811 1.00 2.35 H new ATOM 0 HB3 ASP A 95 35.622 -8.814 -8.054 1.00 2.35 H new ATOM 1631 N ARG A 96 35.028 -9.405 -4.347 1.00 50.43 N ATOM 1632 CA ARG A 96 35.864 -9.972 -3.296 1.00 41.13 C ATOM 1633 C ARG A 96 35.043 -10.865 -2.371 1.00 72.21 C ATOM 1634 O ARG A 96 35.577 -11.476 -1.444 1.00 45.34 O ATOM 1635 CB ARG A 96 36.530 -8.857 -2.488 1.00 22.24 C ATOM 1636 CG ARG A 96 35.567 -7.770 -2.041 1.00 51.53 C ATOM 1637 CD ARG A 96 36.269 -6.714 -1.201 1.00 33.42 C ATOM 1638 NE ARG A 96 37.485 -6.223 -1.843 1.00 54.41 N ATOM 1639 CZ ARG A 96 37.484 -5.377 -2.867 1.00 41.33 C ATOM 1640 NH1 ARG A 96 36.338 -4.931 -3.362 1.00 51.53 N ATOM 1641 NH2 ARG A 96 38.632 -4.975 -3.398 1.00 50.20 N ATOM 0 H ARG A 96 34.462 -8.609 -4.052 1.00 50.43 H new ATOM 0 HA ARG A 96 36.636 -10.580 -3.768 1.00 41.13 H new ATOM 0 HB2 ARG A 96 37.007 -9.292 -1.610 1.00 22.24 H new ATOM 0 HB3 ARG A 96 37.320 -8.406 -3.089 1.00 22.24 H new ATOM 0 HG2 ARG A 96 35.116 -7.300 -2.915 1.00 51.53 H new ATOM 0 HG3 ARG A 96 34.756 -8.215 -1.464 1.00 51.53 H new ATOM 0 HD2 ARG A 96 35.590 -5.880 -1.026 1.00 33.42 H new ATOM 0 HD3 ARG A 96 36.518 -7.133 -0.226 1.00 33.42 H new ATOM 0 HE ARG A 96 38.384 -6.547 -1.486 1.00 54.41 H new ATOM 0 HH11 ARG A 96 35.454 -5.237 -2.956 1.00 51.53 H new ATOM 0 HH12 ARG A 96 36.341 -4.281 -4.148 1.00 51.53 H new ATOM 0 HH21 ARG A 96 39.516 -5.316 -3.020 1.00 50.20 H new ATOM 0 HH22 ARG A 96 38.630 -4.325 -4.184 1.00 50.20 H new ATOM 1655 N LEU A 97 33.741 -10.936 -2.628 1.00 65.40 N ATOM 1656 CA LEU A 97 32.845 -11.755 -1.818 1.00 44.32 C ATOM 1657 C LEU A 97 33.190 -13.235 -1.951 1.00 40.42 C ATOM 1658 O LEU A 97 32.851 -14.041 -1.085 1.00 63.21 O ATOM 1659 CB LEU A 97 31.392 -11.518 -2.233 1.00 62.43 C ATOM 1660 CG LEU A 97 30.333 -12.266 -1.423 1.00 73.11 C ATOM 1661 CD1 LEU A 97 30.590 -12.108 0.067 1.00 3.23 C ATOM 1662 CD2 LEU A 97 28.939 -11.770 -1.781 1.00 43.01 C ATOM 0 H LEU A 97 33.283 -10.437 -3.390 1.00 65.40 H new ATOM 0 HA LEU A 97 32.970 -11.465 -0.775 1.00 44.32 H new ATOM 0 HB2 LEU A 97 31.185 -10.450 -2.165 1.00 62.43 H new ATOM 0 HB3 LEU A 97 31.284 -11.798 -3.281 1.00 62.43 H new ATOM 0 HG LEU A 97 30.395 -13.326 -1.671 1.00 73.11 H new ATOM 0 HD11 LEU A 97 29.826 -12.647 0.627 1.00 3.23 H new ATOM 0 HD12 LEU A 97 31.572 -12.512 0.312 1.00 3.23 H new ATOM 0 HD13 LEU A 97 30.556 -11.051 0.332 1.00 3.23 H new ATOM 0 HD21 LEU A 97 28.198 -12.313 -1.195 1.00 43.01 H new ATOM 0 HD22 LEU A 97 28.865 -10.705 -1.562 1.00 43.01 H new ATOM 0 HD23 LEU A 97 28.755 -11.936 -2.842 1.00 43.01 H new ATOM 1674 N ARG A 98 33.867 -13.584 -3.040 1.00 41.43 N ATOM 1675 CA ARG A 98 34.259 -14.966 -3.286 1.00 74.31 C ATOM 1676 C ARG A 98 33.032 -15.864 -3.418 1.00 55.40 C ATOM 1677 O ARG A 98 31.921 -15.499 -3.031 1.00 21.32 O ATOM 1678 CB ARG A 98 35.155 -15.473 -2.155 1.00 63.52 C ATOM 1679 CG ARG A 98 36.639 -15.411 -2.480 1.00 31.14 C ATOM 1680 CD ARG A 98 37.456 -16.254 -1.514 1.00 24.34 C ATOM 1681 NE ARG A 98 38.820 -16.466 -1.991 1.00 3.01 N ATOM 1682 CZ ARG A 98 39.825 -16.837 -1.205 1.00 33.11 C ATOM 1683 NH1 ARG A 98 39.619 -17.037 0.090 1.00 51.14 N ATOM 1684 NH2 ARG A 98 41.038 -17.010 -1.714 1.00 1.35 N ATOM 0 H ARG A 98 34.155 -12.928 -3.766 1.00 41.43 H new ATOM 0 HA ARG A 98 34.814 -14.998 -4.223 1.00 74.31 H new ATOM 0 HB2 ARG A 98 34.963 -14.883 -1.259 1.00 63.52 H new ATOM 0 HB3 ARG A 98 34.885 -16.503 -1.923 1.00 63.52 H new ATOM 0 HG2 ARG A 98 36.804 -15.760 -3.499 1.00 31.14 H new ATOM 0 HG3 ARG A 98 36.979 -14.376 -2.439 1.00 31.14 H new ATOM 0 HD2 ARG A 98 37.484 -15.765 -0.540 1.00 24.34 H new ATOM 0 HD3 ARG A 98 36.968 -17.218 -1.372 1.00 24.34 H new ATOM 0 HE ARG A 98 39.012 -16.321 -2.982 1.00 3.01 H new ATOM 0 HH11 ARG A 98 38.688 -16.906 0.484 1.00 51.14 H new ATOM 0 HH12 ARG A 98 40.392 -17.322 0.691 1.00 51.14 H new ATOM 0 HH21 ARG A 98 41.200 -16.858 -2.710 1.00 1.35 H new ATOM 0 HH22 ARG A 98 41.809 -17.295 -1.110 1.00 1.35 H new ATOM 1698 N PRO A 99 33.234 -17.065 -3.978 1.00 64.33 N ATOM 1699 CA PRO A 99 32.157 -18.039 -4.174 1.00 74.34 C ATOM 1700 C PRO A 99 31.661 -18.628 -2.858 1.00 54.11 C ATOM 1701 O PRO A 99 31.860 -19.811 -2.582 1.00 3.44 O ATOM 1702 CB PRO A 99 32.811 -19.125 -5.032 1.00 43.25 C ATOM 1703 CG PRO A 99 34.266 -19.022 -4.728 1.00 40.14 C ATOM 1704 CD PRO A 99 34.532 -17.566 -4.463 1.00 54.20 C ATOM 0 HA PRO A 99 31.278 -17.586 -4.632 1.00 74.34 H new ATOM 0 HB2 PRO A 99 32.423 -20.113 -4.783 1.00 43.25 H new ATOM 0 HB3 PRO A 99 32.616 -18.963 -6.092 1.00 43.25 H new ATOM 0 HG2 PRO A 99 34.528 -19.630 -3.862 1.00 40.14 H new ATOM 0 HG3 PRO A 99 34.866 -19.382 -5.564 1.00 40.14 H new ATOM 0 HD2 PRO A 99 35.318 -17.430 -3.720 1.00 54.20 H new ATOM 0 HD3 PRO A 99 34.852 -17.045 -5.365 1.00 54.20 H new ATOM 1712 N SER A 100 31.013 -17.795 -2.050 1.00 33.14 N ATOM 1713 CA SER A 100 30.491 -18.233 -0.760 1.00 52.23 C ATOM 1714 C SER A 100 29.005 -18.563 -0.860 1.00 14.15 C ATOM 1715 O SER A 100 28.441 -19.212 0.022 1.00 72.02 O ATOM 1716 CB SER A 100 30.715 -17.151 0.298 1.00 20.22 C ATOM 1717 OG SER A 100 31.619 -16.164 -0.165 1.00 44.44 O ATOM 0 H SER A 100 30.837 -16.814 -2.265 1.00 33.14 H new ATOM 0 HA SER A 100 31.027 -19.135 -0.466 1.00 52.23 H new ATOM 0 HB2 SER A 100 29.763 -16.685 0.554 1.00 20.22 H new ATOM 0 HB3 SER A 100 31.103 -17.605 1.210 1.00 20.22 H new ATOM 0 HG SER A 100 31.884 -15.587 0.582 1.00 44.44 H new ATOM 1723 N PHE A 101 28.375 -18.111 -1.939 1.00 44.12 N ATOM 1724 CA PHE A 101 26.954 -18.357 -2.155 1.00 2.52 C ATOM 1725 C PHE A 101 26.628 -19.839 -1.996 1.00 1.44 C ATOM 1726 O PHE A 101 25.729 -20.210 -1.241 1.00 43.34 O ATOM 1727 CB PHE A 101 26.538 -17.878 -3.547 1.00 53.22 C ATOM 1728 CG PHE A 101 25.095 -17.468 -3.633 1.00 44.44 C ATOM 1729 CD1 PHE A 101 24.089 -18.420 -3.634 1.00 23.15 C ATOM 1730 CD2 PHE A 101 24.746 -16.129 -3.715 1.00 32.30 C ATOM 1731 CE1 PHE A 101 22.761 -18.046 -3.712 1.00 70.04 C ATOM 1732 CE2 PHE A 101 23.419 -15.749 -3.794 1.00 24.24 C ATOM 1733 CZ PHE A 101 22.426 -16.709 -3.794 1.00 12.34 C ATOM 0 H PHE A 101 28.826 -17.572 -2.678 1.00 44.12 H new ATOM 0 HA PHE A 101 26.396 -17.798 -1.404 1.00 2.52 H new ATOM 0 HB2 PHE A 101 27.165 -17.034 -3.835 1.00 53.22 H new ATOM 0 HB3 PHE A 101 26.725 -18.674 -4.268 1.00 53.22 H new ATOM 0 HD1 PHE A 101 24.346 -19.467 -3.573 1.00 23.15 H new ATOM 0 HD2 PHE A 101 25.519 -15.375 -3.717 1.00 32.30 H new ATOM 0 HE1 PHE A 101 21.986 -18.798 -3.709 1.00 70.04 H new ATOM 0 HE2 PHE A 101 23.159 -14.703 -3.856 1.00 24.24 H new ATOM 0 HZ PHE A 101 21.389 -16.414 -3.858 1.00 12.34 H new ATOM 1743 N ALA A 102 27.365 -20.681 -2.712 1.00 42.22 N ATOM 1744 CA ALA A 102 27.156 -22.122 -2.650 1.00 63.01 C ATOM 1745 C ALA A 102 27.235 -22.627 -1.213 1.00 53.32 C ATOM 1746 O ALA A 102 26.703 -23.688 -0.887 1.00 13.12 O ATOM 1747 CB ALA A 102 28.176 -22.841 -3.521 1.00 21.25 C ATOM 0 H ALA A 102 28.112 -20.390 -3.342 1.00 42.22 H new ATOM 0 HA ALA A 102 26.156 -22.336 -3.028 1.00 63.01 H new ATOM 0 HB1 ALA A 102 28.008 -23.917 -3.465 1.00 21.25 H new ATOM 0 HB2 ALA A 102 28.070 -22.510 -4.554 1.00 21.25 H new ATOM 0 HB3 ALA A 102 29.182 -22.612 -3.168 1.00 21.25 H new ATOM 1753 N LYS A 103 27.902 -21.860 -0.358 1.00 23.15 N ATOM 1754 CA LYS A 103 28.051 -22.228 1.045 1.00 34.45 C ATOM 1755 C LYS A 103 27.013 -21.516 1.908 1.00 61.34 C ATOM 1756 O LYS A 103 26.697 -21.962 3.010 1.00 71.30 O ATOM 1757 CB LYS A 103 29.459 -21.887 1.537 1.00 30.34 C ATOM 1758 CG LYS A 103 30.482 -22.974 1.254 1.00 0.41 C ATOM 1759 CD LYS A 103 30.776 -23.088 -0.232 1.00 64.42 C ATOM 1760 CE LYS A 103 31.980 -23.981 -0.495 1.00 11.33 C ATOM 1761 NZ LYS A 103 31.615 -25.424 -0.474 1.00 21.31 N ATOM 0 H LYS A 103 28.348 -20.979 -0.612 1.00 23.15 H new ATOM 0 HA LYS A 103 27.894 -23.303 1.131 1.00 34.45 H new ATOM 0 HB2 LYS A 103 29.785 -20.961 1.065 1.00 30.34 H new ATOM 0 HB3 LYS A 103 29.425 -21.702 2.611 1.00 30.34 H new ATOM 0 HG2 LYS A 103 31.404 -22.756 1.793 1.00 0.41 H new ATOM 0 HG3 LYS A 103 30.112 -23.929 1.627 1.00 0.41 H new ATOM 0 HD2 LYS A 103 29.904 -23.491 -0.747 1.00 64.42 H new ATOM 0 HD3 LYS A 103 30.960 -22.096 -0.645 1.00 64.42 H new ATOM 0 HE2 LYS A 103 32.414 -23.730 -1.463 1.00 11.33 H new ATOM 0 HE3 LYS A 103 32.746 -23.789 0.257 1.00 11.33 H new ATOM 0 HZ1 LYS A 103 32.462 -25.999 -0.657 1.00 21.31 H new ATOM 0 HZ2 LYS A 103 31.225 -25.670 0.458 1.00 21.31 H new ATOM 0 HZ3 LYS A 103 30.903 -25.613 -1.208 1.00 21.31 H new ATOM 1775 N ALA A 104 26.486 -20.408 1.397 1.00 22.10 N ATOM 1776 CA ALA A 104 25.482 -19.637 2.119 1.00 11.10 C ATOM 1777 C ALA A 104 24.084 -20.200 1.885 1.00 24.54 C ATOM 1778 O ALA A 104 23.153 -19.907 2.636 1.00 24.21 O ATOM 1779 CB ALA A 104 25.540 -18.175 1.703 1.00 52.51 C ATOM 0 H ALA A 104 26.738 -20.025 0.486 1.00 22.10 H new ATOM 0 HA ALA A 104 25.701 -19.710 3.184 1.00 11.10 H new ATOM 0 HB1 ALA A 104 24.785 -17.611 2.250 1.00 52.51 H new ATOM 0 HB2 ALA A 104 26.527 -17.772 1.927 1.00 52.51 H new ATOM 0 HB3 ALA A 104 25.349 -18.093 0.633 1.00 52.51 H new ATOM 1785 N ILE A 105 23.945 -21.009 0.841 1.00 72.53 N ATOM 1786 CA ILE A 105 22.660 -21.614 0.509 1.00 4.14 C ATOM 1787 C ILE A 105 21.995 -22.204 1.748 1.00 60.52 C ATOM 1788 O ILE A 105 20.837 -21.920 2.056 1.00 24.52 O ATOM 1789 CB ILE A 105 22.815 -22.718 -0.553 1.00 22.54 C ATOM 1790 CG1 ILE A 105 23.238 -22.112 -1.893 1.00 33.55 C ATOM 1791 CG2 ILE A 105 21.516 -23.495 -0.702 1.00 55.05 C ATOM 1792 CD1 ILE A 105 22.414 -20.910 -2.299 1.00 31.55 C ATOM 0 H ILE A 105 24.706 -21.261 0.210 1.00 72.53 H new ATOM 0 HA ILE A 105 22.032 -20.820 0.105 1.00 4.14 H new ATOM 0 HB ILE A 105 23.593 -23.409 -0.227 1.00 22.54 H new ATOM 0 HG12 ILE A 105 24.287 -21.821 -1.836 1.00 33.55 H new ATOM 0 HG13 ILE A 105 23.160 -22.874 -2.668 1.00 33.55 H new ATOM 0 HG21 ILE A 105 21.641 -24.272 -1.456 1.00 55.05 H new ATOM 0 HG22 ILE A 105 21.255 -23.954 0.252 1.00 55.05 H new ATOM 0 HG23 ILE A 105 20.720 -22.817 -1.008 1.00 55.05 H new ATOM 0 HD11 ILE A 105 22.769 -20.532 -3.258 1.00 31.55 H new ATOM 0 HD12 ILE A 105 21.367 -21.200 -2.388 1.00 31.55 H new ATOM 0 HD13 ILE A 105 22.511 -20.130 -1.544 1.00 31.55 H new ATOM 1804 N PRO A 106 22.743 -23.045 2.477 1.00 22.52 N ATOM 1805 CA PRO A 106 22.247 -23.692 3.696 1.00 64.22 C ATOM 1806 C PRO A 106 22.064 -22.704 4.843 1.00 64.41 C ATOM 1807 O PRO A 106 21.305 -22.959 5.779 1.00 61.13 O ATOM 1808 CB PRO A 106 23.345 -24.705 4.032 1.00 43.51 C ATOM 1809 CG PRO A 106 24.579 -24.144 3.413 1.00 24.34 C ATOM 1810 CD PRO A 106 24.131 -23.429 2.169 1.00 70.41 C ATOM 0 HA PRO A 106 21.265 -24.141 3.549 1.00 64.22 H new ATOM 0 HB2 PRO A 106 23.460 -24.821 5.110 1.00 43.51 H new ATOM 0 HB3 PRO A 106 23.112 -25.690 3.628 1.00 43.51 H new ATOM 0 HG2 PRO A 106 25.082 -23.460 4.096 1.00 24.34 H new ATOM 0 HG3 PRO A 106 25.290 -24.935 3.174 1.00 24.34 H new ATOM 0 HD2 PRO A 106 24.752 -22.558 1.961 1.00 70.41 H new ATOM 0 HD3 PRO A 106 24.184 -24.075 1.293 1.00 70.41 H new ATOM 1818 N CYS A 107 22.763 -21.578 4.764 1.00 4.43 N ATOM 1819 CA CYS A 107 22.678 -20.551 5.797 1.00 32.10 C ATOM 1820 C CYS A 107 21.473 -19.645 5.565 1.00 72.41 C ATOM 1821 O CYS A 107 20.924 -19.071 6.506 1.00 11.21 O ATOM 1822 CB CYS A 107 23.960 -19.718 5.824 1.00 12.33 C ATOM 1823 SG CYS A 107 23.823 -18.183 6.771 1.00 74.04 S ATOM 0 H CYS A 107 23.395 -21.352 3.996 1.00 4.43 H new ATOM 0 HA CYS A 107 22.556 -21.048 6.759 1.00 32.10 H new ATOM 0 HB2 CYS A 107 24.764 -20.322 6.245 1.00 12.33 H new ATOM 0 HB3 CYS A 107 24.245 -19.477 4.800 1.00 12.33 H new ATOM 0 HG CYS A 107 22.570 -17.855 6.887 1.00 74.04 H new ATOM 1829 N LEU A 108 21.067 -19.521 4.306 1.00 11.12 N ATOM 1830 CA LEU A 108 19.927 -18.683 3.949 1.00 21.22 C ATOM 1831 C LEU A 108 18.617 -19.444 4.123 1.00 75.12 C ATOM 1832 O LEU A 108 17.594 -18.864 4.488 1.00 1.31 O ATOM 1833 CB LEU A 108 20.060 -18.196 2.505 1.00 13.13 C ATOM 1834 CG LEU A 108 20.803 -16.874 2.309 1.00 54.14 C ATOM 1835 CD1 LEU A 108 19.896 -15.698 2.639 1.00 63.13 C ATOM 1836 CD2 LEU A 108 22.061 -16.837 3.164 1.00 15.31 C ATOM 0 H LEU A 108 21.510 -19.990 3.516 1.00 11.12 H new ATOM 0 HA LEU A 108 19.917 -17.822 4.617 1.00 21.22 H new ATOM 0 HB2 LEU A 108 20.572 -18.966 1.928 1.00 13.13 H new ATOM 0 HB3 LEU A 108 19.060 -18.094 2.083 1.00 13.13 H new ATOM 0 HG LEU A 108 21.098 -16.796 1.262 1.00 54.14 H new ATOM 0 HD11 LEU A 108 20.442 -14.766 2.494 1.00 63.13 H new ATOM 0 HD12 LEU A 108 19.025 -15.715 1.983 1.00 63.13 H new ATOM 0 HD13 LEU A 108 19.570 -15.770 3.677 1.00 63.13 H new ATOM 0 HD21 LEU A 108 22.577 -15.889 3.012 1.00 15.31 H new ATOM 0 HD22 LEU A 108 21.790 -16.938 4.215 1.00 15.31 H new ATOM 0 HD23 LEU A 108 22.719 -17.658 2.879 1.00 15.31 H new ATOM 1848 N ARG A 109 18.655 -20.746 3.860 1.00 21.34 N ATOM 1849 CA ARG A 109 17.471 -21.587 3.989 1.00 51.13 C ATOM 1850 C ARG A 109 17.224 -21.959 5.448 1.00 71.44 C ATOM 1851 O ARG A 109 16.079 -22.115 5.875 1.00 43.25 O ATOM 1852 CB ARG A 109 17.626 -22.855 3.147 1.00 53.23 C ATOM 1853 CG ARG A 109 18.788 -23.734 3.578 1.00 43.13 C ATOM 1854 CD ARG A 109 18.997 -24.892 2.615 1.00 24.41 C ATOM 1855 NE ARG A 109 17.760 -25.628 2.366 1.00 2.55 N ATOM 1856 CZ ARG A 109 17.256 -26.524 3.207 1.00 24.13 C ATOM 1857 NH1 ARG A 109 17.880 -26.795 4.345 1.00 5.44 N ATOM 1858 NH2 ARG A 109 16.126 -27.152 2.911 1.00 54.24 N ATOM 0 H ARG A 109 19.493 -21.242 3.556 1.00 21.34 H new ATOM 0 HA ARG A 109 16.613 -21.021 3.627 1.00 51.13 H new ATOM 0 HB2 ARG A 109 16.704 -23.433 3.203 1.00 53.23 H new ATOM 0 HB3 ARG A 109 17.762 -22.573 2.103 1.00 53.23 H new ATOM 0 HG2 ARG A 109 19.698 -23.136 3.632 1.00 43.13 H new ATOM 0 HG3 ARG A 109 18.601 -24.121 4.580 1.00 43.13 H new ATOM 0 HD2 ARG A 109 19.389 -24.512 1.671 1.00 24.41 H new ATOM 0 HD3 ARG A 109 19.747 -25.571 3.022 1.00 24.41 H new ATOM 0 HE ARG A 109 17.256 -25.444 1.499 1.00 2.55 H new ATOM 0 HH11 ARG A 109 18.750 -26.315 4.577 1.00 5.44 H new ATOM 0 HH12 ARG A 109 17.490 -27.484 4.989 1.00 5.44 H new ATOM 0 HH21 ARG A 109 15.643 -26.947 2.036 1.00 54.24 H new ATOM 0 HH22 ARG A 109 15.740 -27.840 3.558 1.00 54.24 H new ATOM 1872 N HIS A 110 18.305 -22.102 6.208 1.00 50.50 N ATOM 1873 CA HIS A 110 18.206 -22.456 7.619 1.00 12.24 C ATOM 1874 C HIS A 110 17.314 -21.468 8.366 1.00 72.41 C ATOM 1875 O HIS A 110 16.789 -21.778 9.436 1.00 0.00 O ATOM 1876 CB HIS A 110 19.595 -22.489 8.257 1.00 32.34 C ATOM 1877 CG HIS A 110 19.576 -22.825 9.717 1.00 54.40 C ATOM 1878 ND1 HIS A 110 19.818 -24.093 10.201 1.00 1.21 N ATOM 1879 CD2 HIS A 110 19.343 -22.048 10.801 1.00 53.02 C ATOM 1880 CE1 HIS A 110 19.733 -24.082 11.519 1.00 23.14 C ATOM 1881 NE2 HIS A 110 19.446 -22.853 11.908 1.00 22.05 N ATOM 0 H HIS A 110 19.259 -21.978 5.870 1.00 50.50 H new ATOM 0 HA HIS A 110 17.758 -23.447 7.689 1.00 12.24 H new ATOM 0 HB2 HIS A 110 20.210 -23.221 7.732 1.00 32.34 H new ATOM 0 HB3 HIS A 110 20.071 -21.518 8.122 1.00 32.34 H new ATOM 0 HD2 HIS A 110 19.118 -20.992 10.796 1.00 53.02 H new ATOM 0 HE1 HIS A 110 19.874 -24.933 12.168 1.00 23.14 H new ATOM 0 HE2 HIS A 110 19.321 -22.551 12.874 1.00 22.05 H new ATOM 1889 N ILE A 111 17.148 -20.280 7.795 1.00 34.21 N ATOM 1890 CA ILE A 111 16.319 -19.249 8.407 1.00 43.53 C ATOM 1891 C ILE A 111 15.001 -19.087 7.658 1.00 53.30 C ATOM 1892 O ILE A 111 14.085 -18.413 8.131 1.00 21.21 O ATOM 1893 CB ILE A 111 17.046 -17.891 8.443 1.00 31.10 C ATOM 1894 CG1 ILE A 111 17.648 -17.574 7.073 1.00 45.31 C ATOM 1895 CG2 ILE A 111 18.126 -17.897 9.514 1.00 22.22 C ATOM 1896 CD1 ILE A 111 18.320 -16.220 7.007 1.00 11.20 C ATOM 0 H ILE A 111 17.576 -20.008 6.910 1.00 34.21 H new ATOM 0 HA ILE A 111 16.116 -19.571 9.428 1.00 43.53 H new ATOM 0 HB ILE A 111 16.322 -17.114 8.689 1.00 31.10 H new ATOM 0 HG12 ILE A 111 18.375 -18.345 6.818 1.00 45.31 H new ATOM 0 HG13 ILE A 111 16.861 -17.617 6.320 1.00 45.31 H new ATOM 0 HG21 ILE A 111 18.631 -16.931 9.527 1.00 22.22 H new ATOM 0 HG22 ILE A 111 17.672 -18.083 10.487 1.00 22.22 H new ATOM 0 HG23 ILE A 111 18.850 -18.682 9.296 1.00 22.22 H new ATOM 0 HD11 ILE A 111 18.724 -16.063 6.007 1.00 11.20 H new ATOM 0 HD12 ILE A 111 17.591 -15.441 7.231 1.00 11.20 H new ATOM 0 HD13 ILE A 111 19.130 -16.180 7.736 1.00 11.20 H new ATOM 1908 N ARG A 112 14.911 -19.710 6.488 1.00 73.22 N ATOM 1909 CA ARG A 112 13.704 -19.636 5.673 1.00 13.04 C ATOM 1910 C ARG A 112 13.532 -18.240 5.082 1.00 61.15 C ATOM 1911 O ARG A 112 12.440 -17.673 5.109 1.00 35.40 O ATOM 1912 CB ARG A 112 12.476 -20.002 6.509 1.00 13.42 C ATOM 1913 CG ARG A 112 12.690 -21.206 7.412 1.00 54.15 C ATOM 1914 CD ARG A 112 12.659 -20.814 8.880 1.00 3.25 C ATOM 1915 NE ARG A 112 12.098 -21.871 9.718 1.00 42.24 N ATOM 1916 CZ ARG A 112 12.765 -22.967 10.063 1.00 51.33 C ATOM 1917 NH1 ARG A 112 14.010 -23.148 9.645 1.00 21.32 N ATOM 1918 NH2 ARG A 112 12.186 -23.884 10.828 1.00 41.44 N ATOM 0 H ARG A 112 15.660 -20.272 6.083 1.00 73.22 H new ATOM 0 HA ARG A 112 13.804 -20.349 4.854 1.00 13.04 H new ATOM 0 HB2 ARG A 112 12.195 -19.145 7.121 1.00 13.42 H new ATOM 0 HB3 ARG A 112 11.639 -20.204 5.841 1.00 13.42 H new ATOM 0 HG2 ARG A 112 11.918 -21.950 7.217 1.00 54.15 H new ATOM 0 HG3 ARG A 112 13.648 -21.671 7.179 1.00 54.15 H new ATOM 0 HD2 ARG A 112 13.670 -20.584 9.215 1.00 3.25 H new ATOM 0 HD3 ARG A 112 12.069 -19.905 9.000 1.00 3.25 H new ATOM 0 HE ARG A 112 11.142 -21.762 10.057 1.00 42.24 H new ATOM 0 HH11 ARG A 112 14.458 -22.445 9.057 1.00 21.32 H new ATOM 0 HH12 ARG A 112 14.520 -23.990 9.911 1.00 21.32 H new ATOM 0 HH21 ARG A 112 11.228 -23.748 11.151 1.00 41.44 H new ATOM 0 HH22 ARG A 112 12.699 -24.725 11.092 1.00 41.44 H new ATOM 1932 N ARG A 113 14.619 -17.692 4.548 1.00 54.24 N ATOM 1933 CA ARG A 113 14.589 -16.362 3.951 1.00 52.12 C ATOM 1934 C ARG A 113 14.495 -16.450 2.430 1.00 33.34 C ATOM 1935 O ARG A 113 13.940 -15.564 1.781 1.00 53.34 O ATOM 1936 CB ARG A 113 15.837 -15.572 4.350 1.00 33.32 C ATOM 1937 CG ARG A 113 15.902 -14.184 3.734 1.00 22.32 C ATOM 1938 CD ARG A 113 15.004 -13.204 4.472 1.00 33.32 C ATOM 1939 NE ARG A 113 15.414 -13.026 5.862 1.00 12.15 N ATOM 1940 CZ ARG A 113 14.603 -12.582 6.817 1.00 61.33 C ATOM 1941 NH1 ARG A 113 13.345 -12.274 6.532 1.00 23.23 N ATOM 1942 NH2 ARG A 113 15.050 -12.447 8.059 1.00 41.33 N ATOM 0 H ARG A 113 15.531 -18.148 4.517 1.00 54.24 H new ATOM 0 HA ARG A 113 13.705 -15.845 4.323 1.00 52.12 H new ATOM 0 HB2 ARG A 113 15.867 -15.480 5.436 1.00 33.32 H new ATOM 0 HB3 ARG A 113 16.723 -16.134 4.053 1.00 33.32 H new ATOM 0 HG2 ARG A 113 16.930 -13.823 3.755 1.00 22.32 H new ATOM 0 HG3 ARG A 113 15.603 -14.235 2.687 1.00 22.32 H new ATOM 0 HD2 ARG A 113 15.023 -12.241 3.962 1.00 33.32 H new ATOM 0 HD3 ARG A 113 13.975 -13.561 4.441 1.00 33.32 H new ATOM 0 HE ARG A 113 16.375 -13.255 6.114 1.00 12.15 H new ATOM 0 HH11 ARG A 113 12.998 -12.378 5.578 1.00 23.23 H new ATOM 0 HH12 ARG A 113 12.724 -11.933 7.266 1.00 23.23 H new ATOM 0 HH21 ARG A 113 16.017 -12.684 8.282 1.00 41.33 H new ATOM 0 HH22 ARG A 113 14.427 -12.106 8.791 1.00 41.33 H new ATOM 1956 N ILE A 114 15.041 -17.524 1.870 1.00 33.45 N ATOM 1957 CA ILE A 114 15.018 -17.728 0.427 1.00 34.24 C ATOM 1958 C ILE A 114 14.993 -19.213 0.082 1.00 24.33 C ATOM 1959 O ILE A 114 14.991 -20.067 0.969 1.00 33.12 O ATOM 1960 CB ILE A 114 16.235 -17.074 -0.253 1.00 72.31 C ATOM 1961 CG1 ILE A 114 17.511 -17.848 0.083 1.00 22.02 C ATOM 1962 CG2 ILE A 114 16.362 -15.620 0.174 1.00 4.22 C ATOM 1963 CD1 ILE A 114 17.922 -18.832 -0.990 1.00 11.02 C ATOM 0 H ILE A 114 15.505 -18.266 2.394 1.00 33.45 H new ATOM 0 HA ILE A 114 14.108 -17.256 0.056 1.00 34.24 H new ATOM 0 HB ILE A 114 16.089 -17.103 -1.333 1.00 72.31 H new ATOM 0 HG12 ILE A 114 18.324 -17.140 0.245 1.00 22.02 H new ATOM 0 HG13 ILE A 114 17.364 -18.385 1.020 1.00 22.02 H new ATOM 0 HG21 ILE A 114 17.227 -15.171 -0.315 1.00 4.22 H new ATOM 0 HG22 ILE A 114 15.461 -15.077 -0.112 1.00 4.22 H new ATOM 0 HG23 ILE A 114 16.489 -15.568 1.255 1.00 4.22 H new ATOM 0 HD11 ILE A 114 18.834 -19.344 -0.684 1.00 11.02 H new ATOM 0 HD12 ILE A 114 17.127 -19.563 -1.137 1.00 11.02 H new ATOM 0 HD13 ILE A 114 18.101 -18.299 -1.923 1.00 11.02 H new ATOM 1975 N ARG A 115 14.978 -19.514 -1.212 1.00 74.21 N ATOM 1976 CA ARG A 115 14.954 -20.897 -1.675 1.00 4.51 C ATOM 1977 C ARG A 115 15.849 -21.076 -2.898 1.00 5.43 C ATOM 1978 O ARG A 115 16.325 -20.100 -3.478 1.00 22.40 O ATOM 1979 CB ARG A 115 13.523 -21.320 -2.011 1.00 24.43 C ATOM 1980 CG ARG A 115 12.711 -21.737 -0.796 1.00 14.12 C ATOM 1981 CD ARG A 115 11.912 -23.003 -1.067 1.00 3.52 C ATOM 1982 NE ARG A 115 11.780 -23.833 0.128 1.00 42.45 N ATOM 1983 CZ ARG A 115 12.777 -24.543 0.643 1.00 45.12 C ATOM 1984 NH1 ARG A 115 13.974 -24.524 0.072 1.00 52.35 N ATOM 1985 NH2 ARG A 115 12.579 -25.274 1.732 1.00 2.03 N ATOM 0 H ARG A 115 14.982 -18.819 -1.959 1.00 74.21 H new ATOM 0 HA ARG A 115 15.333 -21.529 -0.872 1.00 4.51 H new ATOM 0 HB2 ARG A 115 13.016 -20.494 -2.510 1.00 24.43 H new ATOM 0 HB3 ARG A 115 13.555 -22.149 -2.718 1.00 24.43 H new ATOM 0 HG2 ARG A 115 13.378 -21.901 0.050 1.00 14.12 H new ATOM 0 HG3 ARG A 115 12.033 -20.931 -0.516 1.00 14.12 H new ATOM 0 HD2 ARG A 115 10.921 -22.735 -1.433 1.00 3.52 H new ATOM 0 HD3 ARG A 115 12.399 -23.577 -1.855 1.00 3.52 H new ATOM 0 HE ARG A 115 10.872 -23.869 0.592 1.00 42.45 H new ATOM 0 HH11 ARG A 115 14.131 -23.963 -0.765 1.00 52.35 H new ATOM 0 HH12 ARG A 115 14.738 -25.070 0.470 1.00 52.35 H new ATOM 0 HH21 ARG A 115 11.660 -25.291 2.175 1.00 2.03 H new ATOM 0 HH22 ARG A 115 13.346 -25.819 2.127 1.00 2.03 H new ATOM 1999 N GLU A 116 16.074 -22.328 -3.282 1.00 61.21 N ATOM 2000 CA GLU A 116 16.913 -22.634 -4.435 1.00 2.02 C ATOM 2001 C GLU A 116 16.362 -23.828 -5.208 1.00 35.52 C ATOM 2002 O GLU A 116 16.118 -24.891 -4.637 1.00 12.34 O ATOM 2003 CB GLU A 116 18.348 -22.921 -3.987 1.00 41.34 C ATOM 2004 CG GLU A 116 18.463 -23.310 -2.523 1.00 73.43 C ATOM 2005 CD GLU A 116 17.665 -24.555 -2.187 1.00 33.04 C ATOM 2006 OE1 GLU A 116 18.070 -25.655 -2.617 1.00 53.24 O ATOM 2007 OE2 GLU A 116 16.635 -24.429 -1.492 1.00 13.44 O ATOM 0 H GLU A 116 15.687 -23.147 -2.812 1.00 61.21 H new ATOM 0 HA GLU A 116 16.912 -21.765 -5.094 1.00 2.02 H new ATOM 0 HB2 GLU A 116 18.757 -23.724 -4.601 1.00 41.34 H new ATOM 0 HB3 GLU A 116 18.960 -22.037 -4.168 1.00 41.34 H new ATOM 0 HG2 GLU A 116 19.511 -23.477 -2.276 1.00 73.43 H new ATOM 0 HG3 GLU A 116 18.118 -22.483 -1.903 1.00 73.43 H new ATOM 2014 N GLU A 117 16.167 -23.645 -6.510 1.00 0.40 N ATOM 2015 CA GLU A 117 15.643 -24.706 -7.361 1.00 32.52 C ATOM 2016 C GLU A 117 16.679 -25.137 -8.395 1.00 3.22 C ATOM 2017 O GLU A 117 17.013 -24.380 -9.306 1.00 45.14 O ATOM 2018 CB GLU A 117 14.366 -24.243 -8.065 1.00 10.31 C ATOM 2019 CG GLU A 117 13.801 -25.265 -9.036 1.00 73.41 C ATOM 2020 CD GLU A 117 12.458 -25.812 -8.592 1.00 30.13 C ATOM 2021 OE1 GLU A 117 11.478 -25.038 -8.579 1.00 31.04 O ATOM 2022 OE2 GLU A 117 12.387 -27.013 -8.257 1.00 0.10 O ATOM 0 H GLU A 117 16.364 -22.771 -6.998 1.00 0.40 H new ATOM 0 HA GLU A 117 15.410 -25.562 -6.727 1.00 32.52 H new ATOM 0 HB2 GLU A 117 13.611 -24.012 -7.314 1.00 10.31 H new ATOM 0 HB3 GLU A 117 14.573 -23.318 -8.604 1.00 10.31 H new ATOM 0 HG2 GLU A 117 13.695 -24.807 -10.019 1.00 73.41 H new ATOM 0 HG3 GLU A 117 14.507 -26.088 -9.143 1.00 73.41 H new ATOM 2029 N ARG A 118 17.184 -26.357 -8.245 1.00 44.12 N ATOM 2030 CA ARG A 118 18.184 -26.888 -9.164 1.00 40.11 C ATOM 2031 C ARG A 118 17.523 -27.467 -10.411 1.00 73.33 C ATOM 2032 O ARG A 118 17.009 -28.587 -10.391 1.00 3.44 O ATOM 2033 CB ARG A 118 19.023 -27.964 -8.472 1.00 42.23 C ATOM 2034 CG ARG A 118 18.202 -29.123 -7.931 1.00 52.52 C ATOM 2035 CD ARG A 118 18.633 -30.445 -8.545 1.00 31.42 C ATOM 2036 NE ARG A 118 19.869 -30.948 -7.950 1.00 54.22 N ATOM 2037 CZ ARG A 118 19.925 -31.541 -6.763 1.00 73.31 C ATOM 2038 NH1 ARG A 118 18.821 -31.706 -6.048 1.00 34.31 N ATOM 2039 NH2 ARG A 118 21.087 -31.972 -6.289 1.00 41.25 N ATOM 0 H ARG A 118 16.917 -26.996 -7.496 1.00 44.12 H new ATOM 0 HA ARG A 118 18.835 -26.068 -9.466 1.00 40.11 H new ATOM 0 HB2 ARG A 118 19.758 -28.349 -9.178 1.00 42.23 H new ATOM 0 HB3 ARG A 118 19.577 -27.508 -7.651 1.00 42.23 H new ATOM 0 HG2 ARG A 118 18.309 -29.172 -6.847 1.00 52.52 H new ATOM 0 HG3 ARG A 118 17.146 -28.951 -8.139 1.00 52.52 H new ATOM 0 HD2 ARG A 118 17.841 -31.182 -8.412 1.00 31.42 H new ATOM 0 HD3 ARG A 118 18.773 -30.318 -9.618 1.00 31.42 H new ATOM 0 HE ARG A 118 20.736 -30.838 -8.475 1.00 54.22 H new ATOM 0 HH11 ARG A 118 17.926 -31.377 -6.409 1.00 34.31 H new ATOM 0 HH12 ARG A 118 18.867 -32.162 -5.137 1.00 34.31 H new ATOM 0 HH21 ARG A 118 21.939 -31.848 -6.836 1.00 41.25 H new ATOM 0 HH22 ARG A 118 21.129 -32.427 -5.377 1.00 41.25 H new ATOM 2053 N CYS A 119 17.539 -26.698 -11.494 1.00 73.32 N ATOM 2054 CA CYS A 119 16.939 -27.134 -12.751 1.00 24.35 C ATOM 2055 C CYS A 119 17.973 -27.141 -13.872 1.00 54.34 C ATOM 2056 O CYS A 119 18.149 -26.145 -14.574 1.00 32.34 O ATOM 2057 CB CYS A 119 15.769 -26.224 -13.124 1.00 74.11 C ATOM 2058 SG CYS A 119 14.241 -26.580 -12.225 1.00 12.21 S ATOM 0 H CYS A 119 17.961 -25.770 -11.528 1.00 73.32 H new ATOM 0 HA CYS A 119 16.569 -28.150 -12.616 1.00 24.35 H new ATOM 0 HB2 CYS A 119 16.054 -25.189 -12.938 1.00 74.11 H new ATOM 0 HB3 CYS A 119 15.578 -26.315 -14.193 1.00 74.11 H new ATOM 0 HG CYS A 119 13.228 -26.475 -13.033 1.00 12.21 H new ATOM 2064 N GLY A 120 18.655 -28.270 -14.035 1.00 61.23 N ATOM 2065 CA GLY A 120 19.664 -28.384 -15.072 1.00 71.42 C ATOM 2066 C GLY A 120 20.817 -27.421 -14.868 1.00 75.33 C ATOM 2067 O GLY A 120 21.174 -27.078 -13.742 1.00 4.44 O ATOM 0 H GLY A 120 18.527 -29.108 -13.468 1.00 61.23 H new ATOM 0 HA2 GLY A 120 20.046 -29.405 -15.092 1.00 71.42 H new ATOM 0 HA3 GLY A 120 19.205 -28.196 -16.043 1.00 71.42 H new ATOM 2071 N PRO A 121 21.420 -26.971 -15.978 1.00 53.24 N ATOM 2072 CA PRO A 121 22.549 -26.036 -15.942 1.00 75.32 C ATOM 2073 C PRO A 121 22.133 -24.642 -15.484 1.00 72.44 C ATOM 2074 O PRO A 121 22.661 -23.638 -15.962 1.00 43.51 O ATOM 2075 CB PRO A 121 23.027 -26.001 -17.396 1.00 33.21 C ATOM 2076 CG PRO A 121 21.827 -26.370 -18.198 1.00 51.44 C ATOM 2077 CD PRO A 121 21.046 -27.338 -17.354 1.00 73.44 C ATOM 0 HA PRO A 121 23.316 -26.350 -15.234 1.00 75.32 H new ATOM 0 HB2 PRO A 121 23.396 -25.012 -17.668 1.00 33.21 H new ATOM 0 HB3 PRO A 121 23.845 -26.703 -17.561 1.00 33.21 H new ATOM 0 HG2 PRO A 121 21.230 -25.489 -18.435 1.00 51.44 H new ATOM 0 HG3 PRO A 121 22.116 -26.824 -19.146 1.00 51.44 H new ATOM 0 HD2 PRO A 121 19.973 -27.239 -17.518 1.00 73.44 H new ATOM 0 HD3 PRO A 121 21.309 -28.371 -17.580 1.00 73.44 H new ATOM 2085 N LEU A 122 21.184 -24.588 -14.556 1.00 71.23 N ATOM 2086 CA LEU A 122 20.697 -23.316 -14.033 1.00 63.40 C ATOM 2087 C LEU A 122 20.371 -23.428 -12.547 1.00 73.12 C ATOM 2088 O LEU A 122 20.288 -24.528 -11.999 1.00 1.20 O ATOM 2089 CB LEU A 122 19.457 -22.865 -14.807 1.00 4.02 C ATOM 2090 CG LEU A 122 19.711 -22.270 -16.193 1.00 33.25 C ATOM 2091 CD1 LEU A 122 18.430 -22.265 -17.013 1.00 44.23 C ATOM 2092 CD2 LEU A 122 20.276 -20.862 -16.073 1.00 60.45 C ATOM 0 H LEU A 122 20.736 -25.410 -14.150 1.00 71.23 H new ATOM 0 HA LEU A 122 21.485 -22.574 -14.158 1.00 63.40 H new ATOM 0 HB2 LEU A 122 18.791 -23.721 -14.917 1.00 4.02 H new ATOM 0 HB3 LEU A 122 18.928 -22.125 -14.207 1.00 4.02 H new ATOM 0 HG LEU A 122 20.445 -22.891 -16.707 1.00 33.25 H new ATOM 0 HD11 LEU A 122 18.629 -21.838 -17.996 1.00 44.23 H new ATOM 0 HD12 LEU A 122 18.067 -23.286 -17.127 1.00 44.23 H new ATOM 0 HD13 LEU A 122 17.674 -21.667 -16.504 1.00 44.23 H new ATOM 0 HD21 LEU A 122 20.451 -20.454 -17.069 1.00 60.45 H new ATOM 0 HD22 LEU A 122 19.566 -20.229 -15.541 1.00 60.45 H new ATOM 0 HD23 LEU A 122 21.217 -20.893 -15.523 1.00 60.45 H new ATOM 2104 N THR A 123 20.184 -22.282 -11.900 1.00 34.12 N ATOM 2105 CA THR A 123 19.865 -22.251 -10.478 1.00 51.41 C ATOM 2106 C THR A 123 18.983 -21.054 -10.139 1.00 25.15 C ATOM 2107 O THR A 123 19.440 -19.911 -10.151 1.00 52.34 O ATOM 2108 CB THR A 123 21.141 -22.194 -9.617 1.00 61.43 C ATOM 2109 OG1 THR A 123 22.266 -22.649 -10.378 1.00 53.24 O ATOM 2110 CG2 THR A 123 20.989 -23.049 -8.368 1.00 2.11 C ATOM 0 H THR A 123 20.248 -21.363 -12.338 1.00 34.12 H new ATOM 0 HA THR A 123 19.326 -23.172 -10.255 1.00 51.41 H new ATOM 0 HB THR A 123 21.302 -21.160 -9.313 1.00 61.43 H new ATOM 0 HG1 THR A 123 23.074 -22.608 -9.824 1.00 53.24 H new ATOM 0 HG21 THR A 123 21.902 -22.993 -7.776 1.00 2.11 H new ATOM 0 HG22 THR A 123 20.150 -22.683 -7.776 1.00 2.11 H new ATOM 0 HG23 THR A 123 20.806 -24.084 -8.656 1.00 2.11 H new ATOM 2118 N PHE A 124 17.718 -21.324 -9.834 1.00 65.51 N ATOM 2119 CA PHE A 124 16.772 -20.269 -9.491 1.00 24.10 C ATOM 2120 C PHE A 124 16.651 -20.118 -7.977 1.00 61.44 C ATOM 2121 O PHE A 124 17.046 -21.006 -7.221 1.00 14.14 O ATOM 2122 CB PHE A 124 15.400 -20.569 -10.097 1.00 14.14 C ATOM 2123 CG PHE A 124 15.443 -20.847 -11.572 1.00 40.30 C ATOM 2124 CD1 PHE A 124 15.337 -19.813 -12.488 1.00 53.05 C ATOM 2125 CD2 PHE A 124 15.590 -22.142 -12.042 1.00 54.35 C ATOM 2126 CE1 PHE A 124 15.377 -20.065 -13.847 1.00 33.11 C ATOM 2127 CE2 PHE A 124 15.631 -22.400 -13.400 1.00 13.24 C ATOM 2128 CZ PHE A 124 15.523 -21.360 -14.303 1.00 32.50 C ATOM 0 H PHE A 124 17.324 -22.265 -9.817 1.00 65.51 H new ATOM 0 HA PHE A 124 17.146 -19.332 -9.903 1.00 24.10 H new ATOM 0 HB2 PHE A 124 14.966 -21.429 -9.586 1.00 14.14 H new ATOM 0 HB3 PHE A 124 14.738 -19.722 -9.914 1.00 14.14 H new ATOM 0 HD1 PHE A 124 15.222 -18.798 -12.137 1.00 53.05 H new ATOM 0 HD2 PHE A 124 15.673 -22.959 -11.340 1.00 54.35 H new ATOM 0 HE1 PHE A 124 15.294 -19.250 -14.551 1.00 33.11 H new ATOM 0 HE2 PHE A 124 15.747 -23.414 -13.754 1.00 13.24 H new ATOM 0 HZ PHE A 124 15.553 -21.560 -15.364 1.00 32.50 H new ATOM 2138 N TYR A 125 16.104 -18.989 -7.544 1.00 15.34 N ATOM 2139 CA TYR A 125 15.933 -18.719 -6.121 1.00 34.32 C ATOM 2140 C TYR A 125 14.701 -17.853 -5.874 1.00 70.25 C ATOM 2141 O TYR A 125 14.578 -16.759 -6.424 1.00 55.45 O ATOM 2142 CB TYR A 125 17.176 -18.029 -5.558 1.00 42.22 C ATOM 2143 CG TYR A 125 18.473 -18.695 -5.960 1.00 34.35 C ATOM 2144 CD1 TYR A 125 19.126 -18.339 -7.133 1.00 0.34 C ATOM 2145 CD2 TYR A 125 19.045 -19.681 -5.165 1.00 33.13 C ATOM 2146 CE1 TYR A 125 20.310 -18.946 -7.503 1.00 43.34 C ATOM 2147 CE2 TYR A 125 20.229 -20.292 -5.527 1.00 25.41 C ATOM 2148 CZ TYR A 125 20.858 -19.922 -6.697 1.00 41.43 C ATOM 2149 OH TYR A 125 22.038 -20.528 -7.062 1.00 44.45 O ATOM 0 H TYR A 125 15.771 -18.245 -8.157 1.00 15.34 H new ATOM 0 HA TYR A 125 15.793 -19.672 -5.611 1.00 34.32 H new ATOM 0 HB2 TYR A 125 17.190 -16.993 -5.895 1.00 42.22 H new ATOM 0 HB3 TYR A 125 17.109 -18.010 -4.470 1.00 42.22 H new ATOM 0 HD1 TYR A 125 18.701 -17.575 -7.766 1.00 0.34 H new ATOM 0 HD2 TYR A 125 18.555 -19.974 -4.248 1.00 33.13 H new ATOM 0 HE1 TYR A 125 20.804 -18.658 -8.419 1.00 43.34 H new ATOM 0 HE2 TYR A 125 20.660 -21.056 -4.897 1.00 25.41 H new ATOM 0 HH TYR A 125 22.784 -20.105 -6.587 1.00 44.45 H new ATOM 2159 N TYR A 126 13.792 -18.352 -5.043 1.00 44.45 N ATOM 2160 CA TYR A 126 12.569 -17.626 -4.724 1.00 52.33 C ATOM 2161 C TYR A 126 12.448 -17.397 -3.221 1.00 13.32 C ATOM 2162 O TYR A 126 13.082 -18.073 -2.411 1.00 1.24 O ATOM 2163 CB TYR A 126 11.348 -18.393 -5.235 1.00 11.14 C ATOM 2164 CG TYR A 126 11.564 -19.887 -5.322 1.00 4.25 C ATOM 2165 CD1 TYR A 126 12.143 -20.461 -6.447 1.00 3.44 C ATOM 2166 CD2 TYR A 126 11.191 -20.724 -4.278 1.00 32.43 C ATOM 2167 CE1 TYR A 126 12.342 -21.825 -6.530 1.00 61.05 C ATOM 2168 CE2 TYR A 126 11.387 -22.090 -4.352 1.00 42.12 C ATOM 2169 CZ TYR A 126 11.963 -22.635 -5.481 1.00 33.42 C ATOM 2170 OH TYR A 126 12.160 -23.995 -5.560 1.00 4.11 O ATOM 0 H TYR A 126 13.879 -19.256 -4.579 1.00 44.45 H new ATOM 0 HA TYR A 126 12.613 -16.656 -5.218 1.00 52.33 H new ATOM 0 HB2 TYR A 126 10.503 -18.194 -4.576 1.00 11.14 H new ATOM 0 HB3 TYR A 126 11.079 -18.015 -6.221 1.00 11.14 H new ATOM 0 HD1 TYR A 126 12.443 -19.830 -7.271 1.00 3.44 H new ATOM 0 HD2 TYR A 126 10.740 -20.300 -3.393 1.00 32.43 H new ATOM 0 HE1 TYR A 126 12.792 -22.255 -7.412 1.00 61.05 H new ATOM 0 HE2 TYR A 126 11.091 -22.727 -3.531 1.00 42.12 H new ATOM 0 HH TYR A 126 11.839 -24.420 -4.738 1.00 4.11 H new ATOM 2180 N PRO A 127 11.612 -16.420 -2.838 1.00 2.14 N ATOM 2181 CA PRO A 127 11.386 -16.079 -1.430 1.00 51.51 C ATOM 2182 C PRO A 127 10.614 -17.164 -0.687 1.00 43.12 C ATOM 2183 O PRO A 127 9.386 -17.213 -0.741 1.00 22.31 O ATOM 2184 CB PRO A 127 10.560 -14.792 -1.505 1.00 42.24 C ATOM 2185 CG PRO A 127 9.876 -14.858 -2.827 1.00 13.10 C ATOM 2186 CD PRO A 127 10.824 -15.574 -3.749 1.00 54.30 C ATOM 0 HA PRO A 127 12.322 -15.970 -0.882 1.00 51.51 H new ATOM 0 HB2 PRO A 127 9.840 -14.736 -0.689 1.00 42.24 H new ATOM 0 HB3 PRO A 127 11.195 -13.909 -1.431 1.00 42.24 H new ATOM 0 HG2 PRO A 127 8.929 -15.392 -2.750 1.00 13.10 H new ATOM 0 HG3 PRO A 127 9.649 -13.859 -3.199 1.00 13.10 H new ATOM 0 HD2 PRO A 127 10.291 -16.170 -4.490 1.00 54.30 H new ATOM 0 HD3 PRO A 127 11.457 -14.875 -4.297 1.00 54.30 H new ATOM 2194 N GLY A 128 11.344 -18.033 0.007 1.00 54.33 N ATOM 2195 CA GLY A 128 10.710 -19.105 0.751 1.00 70.41 C ATOM 2196 C GLY A 128 9.716 -19.884 -0.087 1.00 55.13 C ATOM 2197 O GLY A 128 9.880 -20.009 -1.301 1.00 12.12 O ATOM 0 H GLY A 128 12.362 -18.013 0.067 1.00 54.33 H new ATOM 0 HA2 GLY A 128 11.475 -19.784 1.126 1.00 70.41 H new ATOM 0 HA3 GLY A 128 10.200 -18.688 1.620 1.00 70.41 H new ATOM 2201 N SER A 129 8.681 -20.410 0.561 1.00 24.30 N ATOM 2202 CA SER A 129 7.659 -21.186 -0.132 1.00 2.21 C ATOM 2203 C SER A 129 6.262 -20.739 0.287 1.00 73.13 C ATOM 2204 O SER A 129 6.017 -20.441 1.456 1.00 64.32 O ATOM 2205 CB SER A 129 7.838 -22.678 0.157 1.00 51.45 C ATOM 2206 OG SER A 129 6.617 -23.378 -0.006 1.00 31.22 O ATOM 0 H SER A 129 8.528 -20.313 1.565 1.00 24.30 H new ATOM 0 HA SER A 129 7.771 -21.015 -1.203 1.00 2.21 H new ATOM 0 HB2 SER A 129 8.591 -23.094 -0.512 1.00 51.45 H new ATOM 0 HB3 SER A 129 8.206 -22.813 1.174 1.00 51.45 H new ATOM 0 HG SER A 129 6.758 -24.329 0.183 1.00 31.22 H new ATOM 2212 N SER A 130 5.348 -20.695 -0.678 1.00 32.25 N ATOM 2213 CA SER A 130 3.975 -20.281 -0.411 1.00 61.43 C ATOM 2214 C SER A 130 3.123 -21.471 0.018 1.00 34.43 C ATOM 2215 O SER A 130 1.965 -21.312 0.401 1.00 11.14 O ATOM 2216 CB SER A 130 3.368 -19.626 -1.653 1.00 74.33 C ATOM 2217 OG SER A 130 4.117 -18.490 -2.049 1.00 31.32 O ATOM 0 H SER A 130 5.533 -20.941 -1.650 1.00 32.25 H new ATOM 0 HA SER A 130 3.991 -19.556 0.403 1.00 61.43 H new ATOM 0 HB2 SER A 130 3.337 -20.347 -2.470 1.00 74.33 H new ATOM 0 HB3 SER A 130 2.339 -19.333 -1.447 1.00 74.33 H new ATOM 0 HG SER A 130 3.709 -18.091 -2.846 1.00 31.32 H new TER 2223 SER A 130