USER MOD reduce.3.24.130724 H: found=0, std=0, add=1290, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1288 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: B 57 LYS NZ :NH3+ -112:sc= 0.506 (180deg=0.442) USER MOD Set 1.2: B 64 TYR OH : rot 180:sc= 0.28 USER MOD Set 2.1: A 50 ASN : amide:sc= 0.464 K(o=0.51,f=-7.8!) USER MOD Set 2.2: B 3 LYS NZ :NH3+ 138:sc= 0.0461 (180deg=-0.0274) USER MOD Set 3.1: A 57 LYS NZ :NH3+ -128:sc= 1.19 (180deg=0.237) USER MOD Set 3.2: A 64 TYR OH : rot 59:sc= 1.11 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -168:sc= -0.0411 (180deg=-0.174) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 ASN : amide:sc= -0.201 X(o=-0.2,f=-0.5) USER MOD Single : A 12 LYS NZ :NH3+ 159:sc= -0.125 (180deg=-0.581) USER MOD Single : A 15 HIS : no HD1:sc= -0.491 X(o=-0.49,f=0) USER MOD Single : A 18 ASN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ -113:sc= 0 (180deg=-0.748) USER MOD Single : A 33 ASN : amide:sc= -0.0949 X(o=-0.095,f=-0.43) USER MOD Single : A 35 SER OG : rot 180:sc=-0.000218 USER MOD Single : A 38 SER OG : rot 180:sc= 0.0699 USER MOD Single : A 39 THR OG1 : rot 78:sc= 0.455 USER MOD Single : A 51 LYS NZ :NH3+ 145:sc= -0.216 (180deg=-0.597) USER MOD Single : A 58 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 65 ASN : amide:sc= 0.199 K(o=0.2,f=-2.2) USER MOD Single : A 68 HIS : no HD1:sc= 0.0344 K(o=0.034,f=-1.1) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 77 HIS : no HD1:sc= -0.0132 X(o=-0.013,f=-0.34) USER MOD Single : A 78 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 79 HIS : no HD1:sc= -0.357 K(o=-0.36,f=-2.1!) USER MOD Single : A 80 HIS : no HD1:sc= -0.03 X(o=-0.03,f=-0.055) USER MOD Single : A 81 HIS : no HD1:sc=-0.00707 X(o=-0.0071,f=-0.0071) USER MOD Single : A 82 HIS : no HE2:sc= 0 X(o=0,f=-0.18) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 4 LYS NZ :NH3+ -118:sc= 0.282 (180deg=-0.00867) USER MOD Single : B 9 ASN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : B 12 LYS NZ :NH3+ 154:sc= -0.859 (180deg=-2.16!) USER MOD Single : B 15 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 18 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 24 SER OG : rot 168:sc= -0.707 USER MOD Single : B 31 LYS NZ :NH3+ -162:sc= 0.584 (180deg=0.325) USER MOD Single : B 33 ASN : amide:sc= -0.0251 X(o=-0.025,f=0) USER MOD Single : B 35 SER OG : rot 180:sc= 0 USER MOD Single : B 38 SER OG : rot 180:sc= 0.44 USER MOD Single : B 39 THR OG1 : rot 76:sc= 0.651 USER MOD Single : B 50 ASN : amide:sc= -0.0642 K(o=-0.064,f=-2.8!) USER MOD Single : B 51 LYS NZ :NH3+ 150:sc= 0.00707 (180deg=0) USER MOD Single : B 58 ASN : amide:sc= 0 X(o=0,f=-0.19) USER MOD Single : B 65 ASN : amide:sc= -1.33 K(o=-1.3,f=-2.3) USER MOD Single : B 68 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 72 SER OG : rot 23:sc= 0.0898 USER MOD Single : B 77 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 78 HIS : no HD1:sc= -0.0207 X(o=-0.021,f=-0.39) USER MOD Single : B 79 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 80 HIS : no HD1:sc= -0.0986 X(o=-0.099,f=-0.04) USER MOD Single : B 81 HIS : no HD1:sc= 0 X(o=0,f=-0.0078) USER MOD Single : B 82 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.213 17.002 1.431 1.00 11.31 N ATOM 2 CA MET A 1 -0.191 16.728 1.865 1.00 72.03 C ATOM 3 C MET A 1 -0.488 15.208 1.920 1.00 60.24 C ATOM 4 O MET A 1 -1.317 14.760 2.723 1.00 25.30 O ATOM 5 CB MET A 1 -1.194 17.457 0.926 1.00 50.44 C ATOM 6 CG MET A 1 -2.678 17.205 1.248 1.00 61.14 C ATOM 7 SD MET A 1 -3.055 17.454 2.996 1.00 2.33 S ATOM 8 CE MET A 1 -4.709 16.778 3.120 1.00 41.33 C ATOM 0 H1 MET A 1 1.439 18.003 1.599 1.00 11.31 H new ATOM 0 H2 MET A 1 1.867 16.403 1.974 1.00 11.31 H new ATOM 0 H3 MET A 1 1.311 16.790 0.417 1.00 11.31 H new ATOM 0 HA MET A 1 -0.312 17.115 2.877 1.00 72.03 H new ATOM 0 HB2 MET A 1 -1.003 18.529 0.975 1.00 50.44 H new ATOM 0 HB3 MET A 1 -1.001 17.146 -0.101 1.00 50.44 H new ATOM 0 HG2 MET A 1 -3.296 17.873 0.647 1.00 61.14 H new ATOM 0 HG3 MET A 1 -2.941 16.186 0.964 1.00 61.14 H new ATOM 0 HE1 MET A 1 -5.063 16.868 4.147 1.00 41.33 H new ATOM 0 HE2 MET A 1 -5.377 17.327 2.457 1.00 41.33 H new ATOM 0 HE3 MET A 1 -4.695 15.727 2.832 1.00 41.33 H new ATOM 20 N ASP A 2 0.212 14.439 1.068 1.00 11.24 N ATOM 21 CA ASP A 2 0.062 12.968 0.928 1.00 71.02 C ATOM 22 C ASP A 2 0.074 12.192 2.272 1.00 23.11 C ATOM 23 O ASP A 2 -0.703 11.266 2.452 1.00 52.11 O ATOM 24 CB ASP A 2 1.176 12.440 0.000 1.00 21.42 C ATOM 25 CG ASP A 2 2.589 12.848 0.451 1.00 31.53 C ATOM 26 OD1 ASP A 2 2.975 14.020 0.227 1.00 4.44 O ATOM 27 OD2 ASP A 2 3.303 12.020 1.051 1.00 73.15 O ATOM 0 H ASP A 2 0.916 14.826 0.440 1.00 11.24 H new ATOM 0 HA ASP A 2 -0.925 12.792 0.501 1.00 71.02 H new ATOM 0 HB2 ASP A 2 1.117 11.353 -0.045 1.00 21.42 H new ATOM 0 HB3 ASP A 2 1.004 12.811 -1.010 1.00 21.42 H new ATOM 32 N LYS A 3 0.960 12.595 3.191 1.00 54.41 N ATOM 33 CA LYS A 3 1.106 11.973 4.533 1.00 12.05 C ATOM 34 C LYS A 3 -0.209 12.045 5.366 1.00 32.15 C ATOM 35 O LYS A 3 -0.530 11.127 6.134 1.00 2.32 O ATOM 36 CB LYS A 3 2.263 12.686 5.264 1.00 21.01 C ATOM 37 CG LYS A 3 2.703 12.057 6.604 1.00 52.12 C ATOM 38 CD LYS A 3 3.942 12.769 7.204 1.00 11.25 C ATOM 39 CE LYS A 3 5.173 12.715 6.268 1.00 43.44 C ATOM 40 NZ LYS A 3 6.347 13.409 6.843 1.00 1.10 N ATOM 0 H LYS A 3 1.606 13.368 3.032 1.00 54.41 H new ATOM 0 HA LYS A 3 1.326 10.912 4.412 1.00 12.05 H new ATOM 0 HB2 LYS A 3 3.125 12.715 4.598 1.00 21.01 H new ATOM 0 HB3 LYS A 3 1.969 13.719 5.449 1.00 21.01 H new ATOM 0 HG2 LYS A 3 1.878 12.106 7.315 1.00 52.12 H new ATOM 0 HG3 LYS A 3 2.930 11.002 6.451 1.00 52.12 H new ATOM 0 HD2 LYS A 3 3.693 13.810 7.411 1.00 11.25 H new ATOM 0 HD3 LYS A 3 4.195 12.306 8.158 1.00 11.25 H new ATOM 0 HE2 LYS A 3 5.430 11.675 6.069 1.00 43.44 H new ATOM 0 HE3 LYS A 3 4.919 13.169 5.310 1.00 43.44 H new ATOM 0 HZ1 LYS A 3 7.146 13.346 6.181 1.00 1.10 H new ATOM 0 HZ2 LYS A 3 6.113 14.409 7.009 1.00 1.10 H new ATOM 0 HZ3 LYS A 3 6.608 12.961 7.744 1.00 1.10 H new ATOM 54 N LYS A 4 -0.959 13.148 5.196 1.00 13.45 N ATOM 55 CA LYS A 4 -2.279 13.342 5.842 1.00 42.05 C ATOM 56 C LYS A 4 -3.380 12.540 5.109 1.00 53.02 C ATOM 57 O LYS A 4 -4.291 11.998 5.743 1.00 53.44 O ATOM 58 CB LYS A 4 -2.648 14.851 5.874 1.00 54.33 C ATOM 59 CG LYS A 4 -1.601 15.739 6.574 1.00 35.55 C ATOM 60 CD LYS A 4 -2.043 17.217 6.676 1.00 35.21 C ATOM 61 CE LYS A 4 -1.011 18.087 7.414 1.00 74.20 C ATOM 62 NZ LYS A 4 -1.486 19.479 7.611 1.00 65.00 N ATOM 0 H LYS A 4 -0.672 13.931 4.609 1.00 13.45 H new ATOM 0 HA LYS A 4 -2.211 12.972 6.865 1.00 42.05 H new ATOM 0 HB2 LYS A 4 -2.782 15.203 4.851 1.00 54.33 H new ATOM 0 HB3 LYS A 4 -3.606 14.969 6.380 1.00 54.33 H new ATOM 0 HG2 LYS A 4 -1.412 15.351 7.575 1.00 35.55 H new ATOM 0 HG3 LYS A 4 -0.659 15.683 6.028 1.00 35.55 H new ATOM 0 HD2 LYS A 4 -2.201 17.616 5.674 1.00 35.21 H new ATOM 0 HD3 LYS A 4 -2.999 17.273 7.196 1.00 35.21 H new ATOM 0 HE2 LYS A 4 -0.789 17.640 8.383 1.00 74.20 H new ATOM 0 HE3 LYS A 4 -0.079 18.100 6.849 1.00 74.20 H new ATOM 0 HZ1 LYS A 4 -0.758 20.027 8.112 1.00 65.00 H new ATOM 0 HZ2 LYS A 4 -1.673 19.916 6.686 1.00 65.00 H new ATOM 0 HZ3 LYS A 4 -2.361 19.471 8.173 1.00 65.00 H new ATOM 76 N ILE A 5 -3.275 12.481 3.766 1.00 32.44 N ATOM 77 CA ILE A 5 -4.223 11.738 2.900 1.00 30.53 C ATOM 78 C ILE A 5 -4.200 10.216 3.201 1.00 31.25 C ATOM 79 O ILE A 5 -5.251 9.597 3.362 1.00 31.44 O ATOM 80 CB ILE A 5 -3.903 11.978 1.373 1.00 75.42 C ATOM 81 CG1 ILE A 5 -3.985 13.498 1.018 1.00 61.21 C ATOM 82 CG2 ILE A 5 -4.838 11.149 0.457 1.00 74.01 C ATOM 83 CD1 ILE A 5 -3.615 13.842 -0.422 1.00 1.31 C ATOM 0 H ILE A 5 -2.531 12.947 3.247 1.00 32.44 H new ATOM 0 HA ILE A 5 -5.220 12.120 3.121 1.00 30.53 H new ATOM 0 HB ILE A 5 -2.882 11.639 1.196 1.00 75.42 H new ATOM 0 HG12 ILE A 5 -5.000 13.847 1.210 1.00 61.21 H new ATOM 0 HG13 ILE A 5 -3.326 14.049 1.689 1.00 61.21 H new ATOM 0 HG21 ILE A 5 -4.588 11.340 -0.587 1.00 74.01 H new ATOM 0 HG22 ILE A 5 -4.711 10.088 0.672 1.00 74.01 H new ATOM 0 HG23 ILE A 5 -5.874 11.435 0.640 1.00 74.01 H new ATOM 0 HD11 ILE A 5 -3.702 14.918 -0.573 1.00 1.31 H new ATOM 0 HD12 ILE A 5 -2.589 13.530 -0.619 1.00 1.31 H new ATOM 0 HD13 ILE A 5 -4.289 13.324 -1.104 1.00 1.31 H new ATOM 95 N VAL A 6 -2.983 9.636 3.285 1.00 55.11 N ATOM 96 CA VAL A 6 -2.792 8.185 3.531 1.00 23.03 C ATOM 97 C VAL A 6 -3.251 7.793 4.951 1.00 34.44 C ATOM 98 O VAL A 6 -3.712 6.675 5.161 1.00 10.33 O ATOM 99 CB VAL A 6 -1.296 7.732 3.283 1.00 41.22 C ATOM 100 CG1 VAL A 6 -0.846 8.128 1.862 1.00 73.12 C ATOM 101 CG2 VAL A 6 -0.316 8.293 4.351 1.00 21.33 C ATOM 0 H VAL A 6 -2.110 10.154 3.185 1.00 55.11 H new ATOM 0 HA VAL A 6 -3.417 7.658 2.811 1.00 23.03 H new ATOM 0 HB VAL A 6 -1.268 6.646 3.376 1.00 41.22 H new ATOM 0 HG11 VAL A 6 0.185 7.810 1.705 1.00 73.12 H new ATOM 0 HG12 VAL A 6 -1.491 7.644 1.128 1.00 73.12 H new ATOM 0 HG13 VAL A 6 -0.914 9.210 1.747 1.00 73.12 H new ATOM 0 HG21 VAL A 6 0.696 7.951 4.132 1.00 21.33 H new ATOM 0 HG22 VAL A 6 -0.343 9.383 4.333 1.00 21.33 H new ATOM 0 HG23 VAL A 6 -0.613 7.940 5.338 1.00 21.33 H new ATOM 111 N GLY A 7 -3.128 8.748 5.902 1.00 51.11 N ATOM 112 CA GLY A 7 -3.656 8.578 7.258 1.00 4.00 C ATOM 113 C GLY A 7 -5.186 8.502 7.280 1.00 63.02 C ATOM 114 O GLY A 7 -5.761 7.554 7.828 1.00 52.04 O ATOM 0 H GLY A 7 -2.665 9.643 5.745 1.00 51.11 H new ATOM 0 HA2 GLY A 7 -3.243 7.669 7.695 1.00 4.00 H new ATOM 0 HA3 GLY A 7 -3.327 9.410 7.881 1.00 4.00 H new ATOM 118 N ALA A 8 -5.836 9.495 6.632 1.00 42.31 N ATOM 119 CA ALA A 8 -7.317 9.603 6.555 1.00 60.23 C ATOM 120 C ALA A 8 -7.962 8.371 5.865 1.00 64.45 C ATOM 121 O ALA A 8 -8.914 7.783 6.390 1.00 13.42 O ATOM 122 CB ALA A 8 -7.713 10.896 5.817 1.00 43.24 C ATOM 0 H ALA A 8 -5.350 10.248 6.145 1.00 42.31 H new ATOM 0 HA ALA A 8 -7.696 9.635 7.576 1.00 60.23 H new ATOM 0 HB1 ALA A 8 -8.799 10.967 5.765 1.00 43.24 H new ATOM 0 HB2 ALA A 8 -7.318 11.758 6.355 1.00 43.24 H new ATOM 0 HB3 ALA A 8 -7.302 10.879 4.808 1.00 43.24 H new ATOM 128 N ASN A 9 -7.409 7.986 4.695 1.00 73.24 N ATOM 129 CA ASN A 9 -7.894 6.827 3.900 1.00 42.20 C ATOM 130 C ASN A 9 -7.680 5.485 4.635 1.00 71.32 C ATOM 131 O ASN A 9 -8.451 4.547 4.449 1.00 2.25 O ATOM 132 CB ASN A 9 -7.189 6.777 2.517 1.00 44.42 C ATOM 133 CG ASN A 9 -7.496 7.984 1.630 1.00 4.32 C ATOM 134 OD1 ASN A 9 -8.553 8.598 1.725 1.00 34.55 O ATOM 135 ND2 ASN A 9 -6.579 8.321 0.747 1.00 30.14 N ATOM 0 H ASN A 9 -6.615 8.466 4.272 1.00 73.24 H new ATOM 0 HA ASN A 9 -8.966 6.968 3.760 1.00 42.20 H new ATOM 0 HB2 ASN A 9 -6.112 6.713 2.670 1.00 44.42 H new ATOM 0 HB3 ASN A 9 -7.491 5.868 1.997 1.00 44.42 H new ATOM 0 HD21 ASN A 9 -6.739 9.110 0.121 1.00 30.14 H new ATOM 0 HD22 ASN A 9 -5.708 7.793 0.689 1.00 30.14 H new ATOM 142 N ALA A 10 -6.635 5.416 5.481 1.00 31.40 N ATOM 143 CA ALA A 10 -6.286 4.193 6.231 1.00 12.44 C ATOM 144 C ALA A 10 -7.267 3.946 7.386 1.00 25.03 C ATOM 145 O ALA A 10 -7.734 2.825 7.582 1.00 31.45 O ATOM 146 CB ALA A 10 -4.862 4.300 6.760 1.00 52.44 C ATOM 0 H ALA A 10 -6.011 6.202 5.664 1.00 31.40 H new ATOM 0 HA ALA A 10 -6.355 3.344 5.550 1.00 12.44 H new ATOM 0 HB1 ALA A 10 -4.610 3.395 7.313 1.00 52.44 H new ATOM 0 HB2 ALA A 10 -4.172 4.419 5.925 1.00 52.44 H new ATOM 0 HB3 ALA A 10 -4.784 5.163 7.422 1.00 52.44 H new ATOM 152 N GLY A 11 -7.583 5.018 8.138 1.00 21.51 N ATOM 153 CA GLY A 11 -8.603 4.941 9.191 1.00 44.24 C ATOM 154 C GLY A 11 -9.970 4.558 8.620 1.00 40.35 C ATOM 155 O GLY A 11 -10.702 3.756 9.204 1.00 64.13 O ATOM 0 H GLY A 11 -7.150 5.936 8.035 1.00 21.51 H new ATOM 0 HA2 GLY A 11 -8.301 4.207 9.939 1.00 44.24 H new ATOM 0 HA3 GLY A 11 -8.676 5.902 9.699 1.00 44.24 H new ATOM 159 N LYS A 12 -10.262 5.104 7.424 1.00 61.53 N ATOM 160 CA LYS A 12 -11.502 4.842 6.671 1.00 1.43 C ATOM 161 C LYS A 12 -11.657 3.348 6.279 1.00 63.00 C ATOM 162 O LYS A 12 -12.711 2.749 6.514 1.00 23.23 O ATOM 163 CB LYS A 12 -11.528 5.735 5.408 1.00 64.40 C ATOM 164 CG LYS A 12 -12.829 5.635 4.602 1.00 22.11 C ATOM 165 CD LYS A 12 -12.904 6.637 3.434 1.00 42.44 C ATOM 166 CE LYS A 12 -14.305 6.668 2.814 1.00 22.12 C ATOM 167 NZ LYS A 12 -15.350 7.027 3.809 1.00 15.24 N ATOM 0 H LYS A 12 -9.633 5.750 6.947 1.00 61.53 H new ATOM 0 HA LYS A 12 -12.344 5.083 7.320 1.00 1.43 H new ATOM 0 HB2 LYS A 12 -11.375 6.772 5.706 1.00 64.40 H new ATOM 0 HB3 LYS A 12 -10.692 5.462 4.765 1.00 64.40 H new ATOM 0 HG2 LYS A 12 -12.928 4.623 4.210 1.00 22.11 H new ATOM 0 HG3 LYS A 12 -13.675 5.802 5.269 1.00 22.11 H new ATOM 0 HD2 LYS A 12 -12.639 7.633 3.789 1.00 42.44 H new ATOM 0 HD3 LYS A 12 -12.173 6.366 2.672 1.00 42.44 H new ATOM 0 HE2 LYS A 12 -14.323 7.387 1.995 1.00 22.12 H new ATOM 0 HE3 LYS A 12 -14.533 5.692 2.386 1.00 22.12 H new ATOM 0 HZ1 LYS A 12 -16.194 7.381 3.314 1.00 15.24 H new ATOM 0 HZ2 LYS A 12 -15.603 6.186 4.366 1.00 15.24 H new ATOM 0 HZ3 LYS A 12 -14.986 7.766 4.444 1.00 15.24 H new ATOM 181 N VAL A 13 -10.600 2.754 5.679 1.00 73.21 N ATOM 182 CA VAL A 13 -10.612 1.320 5.284 1.00 44.35 C ATOM 183 C VAL A 13 -10.638 0.385 6.520 1.00 21.01 C ATOM 184 O VAL A 13 -11.183 -0.722 6.461 1.00 13.02 O ATOM 185 CB VAL A 13 -9.435 0.944 4.292 1.00 42.05 C ATOM 186 CG1 VAL A 13 -9.528 1.778 2.991 1.00 53.43 C ATOM 187 CG2 VAL A 13 -8.043 1.096 4.940 1.00 41.42 C ATOM 0 H VAL A 13 -9.731 3.239 5.457 1.00 73.21 H new ATOM 0 HA VAL A 13 -11.539 1.164 4.732 1.00 44.35 H new ATOM 0 HB VAL A 13 -9.555 -0.111 4.044 1.00 42.05 H new ATOM 0 HG11 VAL A 13 -8.711 1.504 2.324 1.00 53.43 H new ATOM 0 HG12 VAL A 13 -10.480 1.579 2.499 1.00 53.43 H new ATOM 0 HG13 VAL A 13 -9.459 2.839 3.233 1.00 53.43 H new ATOM 0 HG21 VAL A 13 -7.274 0.826 4.217 1.00 41.42 H new ATOM 0 HG22 VAL A 13 -7.899 2.130 5.254 1.00 41.42 H new ATOM 0 HG23 VAL A 13 -7.972 0.440 5.808 1.00 41.42 H new ATOM 197 N TRP A 14 -10.049 0.858 7.639 1.00 1.13 N ATOM 198 CA TRP A 14 -10.079 0.145 8.937 1.00 30.43 C ATOM 199 C TRP A 14 -11.518 0.125 9.548 1.00 14.33 C ATOM 200 O TRP A 14 -11.894 -0.841 10.224 1.00 34.52 O ATOM 201 CB TRP A 14 -9.046 0.762 9.920 1.00 42.03 C ATOM 202 CG TRP A 14 -8.711 -0.129 11.102 1.00 70.15 C ATOM 203 CD1 TRP A 14 -7.833 -1.183 11.136 1.00 23.41 C ATOM 204 CD2 TRP A 14 -9.261 -0.034 12.416 1.00 21.52 C ATOM 205 NE1 TRP A 14 -7.820 -1.744 12.389 1.00 21.13 N ATOM 206 CE2 TRP A 14 -8.686 -1.053 13.194 1.00 55.30 C ATOM 207 CE3 TRP A 14 -10.188 0.823 12.992 1.00 71.45 C ATOM 208 CZ2 TRP A 14 -9.011 -1.234 14.536 1.00 53.53 C ATOM 209 CZ3 TRP A 14 -10.518 0.650 14.323 1.00 25.03 C ATOM 210 CH2 TRP A 14 -9.928 -0.373 15.085 1.00 61.53 C ATOM 0 H TRP A 14 -9.541 1.742 7.670 1.00 1.13 H new ATOM 0 HA TRP A 14 -9.797 -0.893 8.761 1.00 30.43 H new ATOM 0 HB2 TRP A 14 -8.129 0.985 9.375 1.00 42.03 H new ATOM 0 HB3 TRP A 14 -9.435 1.710 10.291 1.00 42.03 H new ATOM 0 HD1 TRP A 14 -7.239 -1.522 10.300 1.00 23.41 H new ATOM 0 HE1 TRP A 14 -7.257 -2.545 12.674 1.00 21.13 H new ATOM 0 HE3 TRP A 14 -10.643 1.611 12.411 1.00 71.45 H new ATOM 0 HZ2 TRP A 14 -8.559 -2.021 15.122 1.00 53.53 H new ATOM 0 HZ3 TRP A 14 -11.239 1.310 14.783 1.00 25.03 H new ATOM 0 HH2 TRP A 14 -10.202 -0.484 16.124 1.00 61.53 H new ATOM 221 N HIS A 15 -12.314 1.201 9.303 1.00 12.04 N ATOM 222 CA HIS A 15 -13.766 1.233 9.660 1.00 42.34 C ATOM 223 C HIS A 15 -14.555 0.085 8.963 1.00 71.13 C ATOM 224 O HIS A 15 -15.482 -0.486 9.546 1.00 53.25 O ATOM 225 CB HIS A 15 -14.414 2.607 9.296 1.00 23.43 C ATOM 226 CG HIS A 15 -14.098 3.740 10.239 1.00 33.31 C ATOM 227 ND1 HIS A 15 -14.578 3.788 11.526 1.00 61.33 N ATOM 228 CD2 HIS A 15 -13.370 4.871 10.079 1.00 10.34 C ATOM 229 CE1 HIS A 15 -14.161 4.886 12.114 1.00 40.31 C ATOM 230 NE2 HIS A 15 -13.426 5.565 11.263 1.00 3.24 N ATOM 0 H HIS A 15 -11.979 2.057 8.861 1.00 12.04 H new ATOM 0 HA HIS A 15 -13.824 1.091 10.739 1.00 42.34 H new ATOM 0 HB2 HIS A 15 -14.089 2.889 8.294 1.00 23.43 H new ATOM 0 HB3 HIS A 15 -15.496 2.480 9.257 1.00 23.43 H new ATOM 0 HD2 HIS A 15 -12.843 5.172 9.186 1.00 10.34 H new ATOM 0 HE1 HIS A 15 -14.385 5.181 13.128 1.00 40.31 H new ATOM 0 HE2 HIS A 15 -12.972 6.459 11.450 1.00 3.24 H new ATOM 239 N ALA A 16 -14.175 -0.231 7.709 1.00 23.42 N ATOM 240 CA ALA A 16 -14.790 -1.332 6.926 1.00 64.44 C ATOM 241 C ALA A 16 -14.393 -2.733 7.472 1.00 75.35 C ATOM 242 O ALA A 16 -15.189 -3.682 7.413 1.00 12.04 O ATOM 243 CB ALA A 16 -14.409 -1.191 5.448 1.00 4.43 C ATOM 0 H ALA A 16 -13.437 0.264 7.209 1.00 23.42 H new ATOM 0 HA ALA A 16 -15.872 -1.253 7.027 1.00 64.44 H new ATOM 0 HB1 ALA A 16 -14.862 -2.001 4.877 1.00 4.43 H new ATOM 0 HB2 ALA A 16 -14.769 -0.234 5.069 1.00 4.43 H new ATOM 0 HB3 ALA A 16 -13.325 -1.237 5.346 1.00 4.43 H new ATOM 249 N LEU A 17 -13.157 -2.835 8.006 1.00 21.40 N ATOM 250 CA LEU A 17 -12.626 -4.080 8.634 1.00 42.00 C ATOM 251 C LEU A 17 -13.383 -4.448 9.936 1.00 33.22 C ATOM 252 O LEU A 17 -13.374 -5.612 10.354 1.00 72.25 O ATOM 253 CB LEU A 17 -11.117 -3.905 8.941 1.00 10.42 C ATOM 254 CG LEU A 17 -10.180 -3.767 7.699 1.00 51.21 C ATOM 255 CD1 LEU A 17 -8.772 -3.295 8.114 1.00 14.00 C ATOM 256 CD2 LEU A 17 -10.115 -5.095 6.908 1.00 33.34 C ATOM 0 H LEU A 17 -12.493 -2.060 8.018 1.00 21.40 H new ATOM 0 HA LEU A 17 -12.775 -4.895 7.926 1.00 42.00 H new ATOM 0 HB2 LEU A 17 -10.993 -3.020 9.565 1.00 10.42 H new ATOM 0 HB3 LEU A 17 -10.784 -4.760 9.530 1.00 10.42 H new ATOM 0 HG LEU A 17 -10.602 -3.006 7.042 1.00 51.21 H new ATOM 0 HD11 LEU A 17 -8.142 -3.208 7.229 1.00 14.00 H new ATOM 0 HD12 LEU A 17 -8.844 -2.325 8.605 1.00 14.00 H new ATOM 0 HD13 LEU A 17 -8.334 -4.018 8.802 1.00 14.00 H new ATOM 0 HD21 LEU A 17 -9.457 -4.974 6.048 1.00 33.34 H new ATOM 0 HD22 LEU A 17 -9.728 -5.884 7.553 1.00 33.34 H new ATOM 0 HD23 LEU A 17 -11.114 -5.364 6.565 1.00 33.34 H new ATOM 268 N ASN A 18 -14.028 -3.441 10.565 1.00 14.32 N ATOM 269 CA ASN A 18 -14.816 -3.626 11.806 1.00 3.14 C ATOM 270 C ASN A 18 -16.052 -4.543 11.565 1.00 71.13 C ATOM 271 O ASN A 18 -16.521 -5.226 12.487 1.00 1.42 O ATOM 272 CB ASN A 18 -15.249 -2.236 12.353 1.00 31.53 C ATOM 273 CG ASN A 18 -15.937 -2.285 13.724 1.00 62.41 C ATOM 274 OD1 ASN A 18 -15.647 -3.133 14.557 1.00 42.32 O ATOM 275 ND2 ASN A 18 -16.849 -1.369 13.971 1.00 35.51 N ATOM 0 H ASN A 18 -14.018 -2.478 10.228 1.00 14.32 H new ATOM 0 HA ASN A 18 -14.191 -4.124 12.547 1.00 3.14 H new ATOM 0 HB2 ASN A 18 -14.370 -1.596 12.423 1.00 31.53 H new ATOM 0 HB3 ASN A 18 -15.926 -1.771 11.636 1.00 31.53 H new ATOM 0 HD21 ASN A 18 -17.329 -1.357 14.871 1.00 35.51 H new ATOM 0 HD22 ASN A 18 -17.076 -0.671 13.263 1.00 35.51 H new ATOM 282 N GLU A 19 -16.571 -4.548 10.315 1.00 73.41 N ATOM 283 CA GLU A 19 -17.630 -5.486 9.880 1.00 50.44 C ATOM 284 C GLU A 19 -17.036 -6.887 9.612 1.00 61.22 C ATOM 285 O GLU A 19 -17.447 -7.881 10.219 1.00 5.51 O ATOM 286 CB GLU A 19 -18.311 -4.979 8.584 1.00 75.05 C ATOM 287 CG GLU A 19 -19.110 -3.671 8.712 1.00 1.53 C ATOM 288 CD GLU A 19 -19.749 -3.260 7.373 1.00 5.14 C ATOM 289 OE1 GLU A 19 -20.598 -4.023 6.856 1.00 24.32 O ATOM 290 OE2 GLU A 19 -19.382 -2.211 6.807 1.00 3.13 O ATOM 0 H GLU A 19 -16.269 -3.905 9.583 1.00 73.41 H new ATOM 0 HA GLU A 19 -18.368 -5.547 10.680 1.00 50.44 H new ATOM 0 HB2 GLU A 19 -17.543 -4.840 7.824 1.00 75.05 H new ATOM 0 HB3 GLU A 19 -18.982 -5.758 8.221 1.00 75.05 H new ATOM 0 HG2 GLU A 19 -19.889 -3.793 9.465 1.00 1.53 H new ATOM 0 HG3 GLU A 19 -18.452 -2.875 9.060 1.00 1.53 H new ATOM 297 N ALA A 20 -16.047 -6.936 8.699 1.00 43.30 N ATOM 298 CA ALA A 20 -15.441 -8.193 8.223 1.00 64.51 C ATOM 299 C ALA A 20 -13.983 -7.961 7.771 1.00 35.04 C ATOM 300 O ALA A 20 -13.735 -7.326 6.737 1.00 55.22 O ATOM 301 CB ALA A 20 -16.280 -8.787 7.071 1.00 52.13 C ATOM 0 H ALA A 20 -15.645 -6.102 8.270 1.00 43.30 H new ATOM 0 HA ALA A 20 -15.429 -8.905 9.048 1.00 64.51 H new ATOM 0 HB1 ALA A 20 -15.822 -9.715 6.728 1.00 52.13 H new ATOM 0 HB2 ALA A 20 -17.291 -8.990 7.424 1.00 52.13 H new ATOM 0 HB3 ALA A 20 -16.320 -8.076 6.246 1.00 52.13 H new ATOM 307 N ASP A 21 -13.025 -8.450 8.574 1.00 62.21 N ATOM 308 CA ASP A 21 -11.588 -8.433 8.233 1.00 62.13 C ATOM 309 C ASP A 21 -11.154 -9.783 7.604 1.00 32.41 C ATOM 310 O ASP A 21 -11.855 -10.796 7.728 1.00 71.24 O ATOM 311 CB ASP A 21 -10.744 -8.093 9.485 1.00 75.31 C ATOM 312 CG ASP A 21 -10.994 -9.046 10.661 1.00 21.25 C ATOM 313 OD1 ASP A 21 -11.998 -8.862 11.376 1.00 61.51 O ATOM 314 OD2 ASP A 21 -10.201 -9.986 10.869 1.00 13.53 O ATOM 0 H ASP A 21 -13.223 -8.870 9.482 1.00 62.21 H new ATOM 0 HA ASP A 21 -11.415 -7.656 7.489 1.00 62.13 H new ATOM 0 HB2 ASP A 21 -9.687 -8.122 9.221 1.00 75.31 H new ATOM 0 HB3 ASP A 21 -10.966 -7.073 9.799 1.00 75.31 H new ATOM 319 N GLY A 22 -9.975 -9.788 6.965 1.00 70.14 N ATOM 320 CA GLY A 22 -9.562 -10.895 6.086 1.00 54.30 C ATOM 321 C GLY A 22 -10.178 -10.783 4.690 1.00 73.21 C ATOM 322 O GLY A 22 -10.384 -11.781 3.995 1.00 32.44 O ATOM 0 H GLY A 22 -9.289 -9.037 7.040 1.00 70.14 H new ATOM 0 HA2 GLY A 22 -8.475 -10.905 6.002 1.00 54.30 H new ATOM 0 HA3 GLY A 22 -9.855 -11.843 6.536 1.00 54.30 H new ATOM 326 N ILE A 23 -10.485 -9.541 4.298 1.00 23.43 N ATOM 327 CA ILE A 23 -11.095 -9.203 2.999 1.00 2.41 C ATOM 328 C ILE A 23 -9.996 -8.775 1.987 1.00 44.22 C ATOM 329 O ILE A 23 -8.918 -8.334 2.395 1.00 33.30 O ATOM 330 CB ILE A 23 -12.171 -8.065 3.220 1.00 74.31 C ATOM 331 CG1 ILE A 23 -12.993 -7.780 1.926 1.00 33.04 C ATOM 332 CG2 ILE A 23 -11.521 -6.767 3.771 1.00 0.31 C ATOM 333 CD1 ILE A 23 -14.122 -6.777 2.099 1.00 40.10 C ATOM 0 H ILE A 23 -10.314 -8.724 4.884 1.00 23.43 H new ATOM 0 HA ILE A 23 -11.597 -10.075 2.578 1.00 2.41 H new ATOM 0 HB ILE A 23 -12.870 -8.431 3.972 1.00 74.31 H new ATOM 0 HG12 ILE A 23 -12.315 -7.414 1.155 1.00 33.04 H new ATOM 0 HG13 ILE A 23 -13.412 -8.719 1.564 1.00 33.04 H new ATOM 0 HG21 ILE A 23 -12.289 -6.006 3.911 1.00 0.31 H new ATOM 0 HG22 ILE A 23 -11.041 -6.978 4.727 1.00 0.31 H new ATOM 0 HG23 ILE A 23 -10.776 -6.404 3.063 1.00 0.31 H new ATOM 0 HD11 ILE A 23 -14.638 -6.642 1.148 1.00 40.10 H new ATOM 0 HD12 ILE A 23 -14.826 -7.147 2.844 1.00 40.10 H new ATOM 0 HD13 ILE A 23 -13.713 -5.822 2.429 1.00 40.10 H new ATOM 345 N SER A 24 -10.243 -8.949 0.674 1.00 3.23 N ATOM 346 CA SER A 24 -9.287 -8.514 -0.378 1.00 62.11 C ATOM 347 C SER A 24 -9.384 -6.996 -0.636 1.00 10.22 C ATOM 348 O SER A 24 -10.427 -6.376 -0.389 1.00 4.31 O ATOM 349 CB SER A 24 -9.507 -9.307 -1.683 1.00 25.22 C ATOM 350 OG SER A 24 -9.216 -10.686 -1.500 1.00 54.22 O ATOM 0 H SER A 24 -11.091 -9.385 0.312 1.00 3.23 H new ATOM 0 HA SER A 24 -8.281 -8.724 -0.016 1.00 62.11 H new ATOM 0 HB2 SER A 24 -10.539 -9.191 -2.013 1.00 25.22 H new ATOM 0 HB3 SER A 24 -8.873 -8.900 -2.471 1.00 25.22 H new ATOM 0 HG SER A 24 -9.365 -11.166 -2.341 1.00 54.22 H new ATOM 356 N ILE A 25 -8.285 -6.427 -1.166 1.00 20.14 N ATOM 357 CA ILE A 25 -8.105 -4.967 -1.358 1.00 64.43 C ATOM 358 C ILE A 25 -9.235 -4.293 -2.223 1.00 64.33 C ATOM 359 O ILE A 25 -9.785 -3.278 -1.785 1.00 10.43 O ATOM 360 CB ILE A 25 -6.678 -4.653 -1.964 1.00 54.41 C ATOM 361 CG1 ILE A 25 -5.548 -5.167 -1.004 1.00 14.40 C ATOM 362 CG2 ILE A 25 -6.509 -3.143 -2.281 1.00 40.33 C ATOM 363 CD1 ILE A 25 -4.124 -5.027 -1.536 1.00 44.32 C ATOM 0 H ILE A 25 -7.482 -6.973 -1.479 1.00 20.14 H new ATOM 0 HA ILE A 25 -8.183 -4.525 -0.365 1.00 64.43 H new ATOM 0 HB ILE A 25 -6.590 -5.188 -2.910 1.00 54.41 H new ATOM 0 HG12 ILE A 25 -5.621 -4.624 -0.061 1.00 14.40 H new ATOM 0 HG13 ILE A 25 -5.733 -6.218 -0.782 1.00 14.40 H new ATOM 0 HG21 ILE A 25 -5.516 -2.967 -2.695 1.00 40.33 H new ATOM 0 HG22 ILE A 25 -7.264 -2.836 -3.005 1.00 40.33 H new ATOM 0 HG23 ILE A 25 -6.628 -2.564 -1.365 1.00 40.33 H new ATOM 0 HD11 ILE A 25 -3.420 -5.411 -0.797 1.00 44.32 H new ATOM 0 HD12 ILE A 25 -4.024 -5.594 -2.461 1.00 44.32 H new ATOM 0 HD13 ILE A 25 -3.910 -3.976 -1.730 1.00 44.32 H new ATOM 375 N PRO A 26 -9.612 -4.815 -3.459 1.00 25.42 N ATOM 376 CA PRO A 26 -10.675 -4.165 -4.289 1.00 50.23 C ATOM 377 C PRO A 26 -12.105 -4.261 -3.678 1.00 73.21 C ATOM 378 O PRO A 26 -12.966 -3.422 -3.965 1.00 24.14 O ATOM 379 CB PRO A 26 -10.585 -4.919 -5.647 1.00 22.31 C ATOM 380 CG PRO A 26 -10.041 -6.268 -5.286 1.00 44.52 C ATOM 381 CD PRO A 26 -9.048 -6.012 -4.166 1.00 4.42 C ATOM 0 HA PRO A 26 -10.511 -3.090 -4.370 1.00 50.23 H new ATOM 0 HB2 PRO A 26 -11.562 -4.999 -6.123 1.00 22.31 H new ATOM 0 HB3 PRO A 26 -9.930 -4.400 -6.347 1.00 22.31 H new ATOM 0 HG2 PRO A 26 -10.836 -6.939 -4.961 1.00 44.52 H new ATOM 0 HG3 PRO A 26 -9.557 -6.739 -6.141 1.00 44.52 H new ATOM 0 HD2 PRO A 26 -8.967 -6.870 -3.499 1.00 4.42 H new ATOM 0 HD3 PRO A 26 -8.049 -5.814 -4.554 1.00 4.42 H new ATOM 389 N GLU A 27 -12.331 -5.272 -2.820 1.00 71.53 N ATOM 390 CA GLU A 27 -13.640 -5.508 -2.159 1.00 53.32 C ATOM 391 C GLU A 27 -13.832 -4.498 -1.014 1.00 3.31 C ATOM 392 O GLU A 27 -14.899 -3.908 -0.824 1.00 33.43 O ATOM 393 CB GLU A 27 -13.678 -6.942 -1.583 1.00 50.03 C ATOM 394 CG GLU A 27 -13.312 -8.055 -2.575 1.00 53.24 C ATOM 395 CD GLU A 27 -13.557 -9.454 -1.990 1.00 23.20 C ATOM 396 OE1 GLU A 27 -12.800 -9.881 -1.090 1.00 21.32 O ATOM 397 OE2 GLU A 27 -14.530 -10.121 -2.405 1.00 71.13 O ATOM 0 H GLU A 27 -11.616 -5.952 -2.561 1.00 71.53 H new ATOM 0 HA GLU A 27 -14.438 -5.385 -2.891 1.00 53.32 H new ATOM 0 HB2 GLU A 27 -12.995 -6.994 -0.735 1.00 50.03 H new ATOM 0 HB3 GLU A 27 -14.679 -7.135 -1.198 1.00 50.03 H new ATOM 0 HG2 GLU A 27 -13.899 -7.936 -3.486 1.00 53.24 H new ATOM 0 HG3 GLU A 27 -12.263 -7.959 -2.856 1.00 53.24 H new ATOM 404 N LEU A 28 -12.750 -4.359 -0.253 1.00 74.40 N ATOM 405 CA LEU A 28 -12.577 -3.366 0.811 1.00 43.13 C ATOM 406 C LEU A 28 -12.710 -1.920 0.254 1.00 11.14 C ATOM 407 O LEU A 28 -13.337 -1.054 0.875 1.00 21.04 O ATOM 408 CB LEU A 28 -11.175 -3.622 1.405 1.00 55.11 C ATOM 409 CG LEU A 28 -10.697 -2.701 2.553 1.00 33.45 C ATOM 410 CD1 LEU A 28 -11.617 -2.797 3.789 1.00 73.24 C ATOM 411 CD2 LEU A 28 -9.229 -3.023 2.898 1.00 12.50 C ATOM 0 H LEU A 28 -11.933 -4.960 -0.363 1.00 74.40 H new ATOM 0 HA LEU A 28 -13.348 -3.461 1.576 1.00 43.13 H new ATOM 0 HB2 LEU A 28 -11.148 -4.650 1.767 1.00 55.11 H new ATOM 0 HB3 LEU A 28 -10.450 -3.550 0.594 1.00 55.11 H new ATOM 0 HG LEU A 28 -10.753 -1.666 2.215 1.00 33.45 H new ATOM 0 HD11 LEU A 28 -11.246 -2.135 4.571 1.00 73.24 H new ATOM 0 HD12 LEU A 28 -12.629 -2.501 3.513 1.00 73.24 H new ATOM 0 HD13 LEU A 28 -11.627 -3.823 4.157 1.00 73.24 H new ATOM 0 HD21 LEU A 28 -8.894 -2.373 3.707 1.00 12.50 H new ATOM 0 HD22 LEU A 28 -9.149 -4.064 3.212 1.00 12.50 H new ATOM 0 HD23 LEU A 28 -8.605 -2.860 2.020 1.00 12.50 H new ATOM 423 N ALA A 29 -12.125 -1.711 -0.944 1.00 41.01 N ATOM 424 CA ALA A 29 -12.218 -0.444 -1.711 1.00 12.13 C ATOM 425 C ALA A 29 -13.678 -0.103 -2.087 1.00 3.25 C ATOM 426 O ALA A 29 -14.071 1.065 -2.085 1.00 5.31 O ATOM 427 CB ALA A 29 -11.355 -0.534 -2.978 1.00 72.11 C ATOM 0 H ALA A 29 -11.567 -2.424 -1.414 1.00 41.01 H new ATOM 0 HA ALA A 29 -11.847 0.358 -1.072 1.00 12.13 H new ATOM 0 HB1 ALA A 29 -11.429 0.400 -3.535 1.00 72.11 H new ATOM 0 HB2 ALA A 29 -10.316 -0.709 -2.699 1.00 72.11 H new ATOM 0 HB3 ALA A 29 -11.707 -1.357 -3.600 1.00 72.11 H new ATOM 433 N ARG A 30 -14.462 -1.150 -2.412 1.00 43.33 N ATOM 434 CA ARG A 30 -15.901 -1.026 -2.743 1.00 53.41 C ATOM 435 C ARG A 30 -16.725 -0.541 -1.520 1.00 72.14 C ATOM 436 O ARG A 30 -17.627 0.295 -1.662 1.00 71.12 O ATOM 437 CB ARG A 30 -16.442 -2.392 -3.258 1.00 75.25 C ATOM 438 CG ARG A 30 -17.948 -2.401 -3.613 1.00 72.15 C ATOM 439 CD ARG A 30 -18.451 -3.794 -4.031 1.00 45.30 C ATOM 440 NE ARG A 30 -17.813 -4.266 -5.270 1.00 63.32 N ATOM 441 CZ ARG A 30 -17.954 -5.462 -5.792 1.00 45.52 C ATOM 442 NH1 ARG A 30 -18.627 -6.387 -5.186 1.00 4.53 N ATOM 443 NH2 ARG A 30 -17.389 -5.732 -6.917 1.00 55.45 N ATOM 0 H ARG A 30 -14.117 -2.109 -2.453 1.00 43.33 H new ATOM 0 HA ARG A 30 -16.008 -0.278 -3.528 1.00 53.41 H new ATOM 0 HB2 ARG A 30 -15.873 -2.682 -4.141 1.00 75.25 H new ATOM 0 HB3 ARG A 30 -16.258 -3.150 -2.497 1.00 75.25 H new ATOM 0 HG2 ARG A 30 -18.522 -2.055 -2.753 1.00 72.15 H new ATOM 0 HG3 ARG A 30 -18.130 -1.695 -4.423 1.00 72.15 H new ATOM 0 HD2 ARG A 30 -18.254 -4.505 -3.229 1.00 45.30 H new ATOM 0 HD3 ARG A 30 -19.532 -3.762 -4.170 1.00 45.30 H new ATOM 0 HE ARG A 30 -17.210 -3.608 -5.765 1.00 63.32 H new ATOM 0 HH11 ARG A 30 -19.061 -6.194 -4.283 1.00 4.53 H new ATOM 0 HH12 ARG A 30 -18.723 -7.309 -5.611 1.00 4.53 H new ATOM 0 HH21 ARG A 30 -16.837 -5.019 -7.395 1.00 55.45 H new ATOM 0 HH22 ARG A 30 -17.493 -6.659 -7.330 1.00 55.45 H new ATOM 457 N LYS A 31 -16.394 -1.076 -0.325 1.00 5.41 N ATOM 458 CA LYS A 31 -17.068 -0.705 0.946 1.00 74.20 C ATOM 459 C LYS A 31 -16.836 0.785 1.303 1.00 43.12 C ATOM 460 O LYS A 31 -17.753 1.474 1.760 1.00 60.23 O ATOM 461 CB LYS A 31 -16.574 -1.611 2.111 1.00 42.33 C ATOM 462 CG LYS A 31 -16.815 -3.122 1.892 1.00 43.02 C ATOM 463 CD LYS A 31 -16.422 -3.989 3.117 1.00 61.32 C ATOM 464 CE LYS A 31 -17.254 -3.675 4.383 1.00 35.45 C ATOM 465 NZ LYS A 31 -18.708 -3.912 4.187 1.00 54.21 N ATOM 0 H LYS A 31 -15.658 -1.773 -0.210 1.00 5.41 H new ATOM 0 HA LYS A 31 -18.138 -0.856 0.803 1.00 74.20 H new ATOM 0 HB2 LYS A 31 -15.507 -1.443 2.258 1.00 42.33 H new ATOM 0 HB3 LYS A 31 -17.074 -1.305 3.030 1.00 42.33 H new ATOM 0 HG2 LYS A 31 -17.868 -3.286 1.662 1.00 43.02 H new ATOM 0 HG3 LYS A 31 -16.244 -3.452 1.024 1.00 43.02 H new ATOM 0 HD2 LYS A 31 -16.545 -5.042 2.862 1.00 61.32 H new ATOM 0 HD3 LYS A 31 -15.366 -3.835 3.338 1.00 61.32 H new ATOM 0 HE2 LYS A 31 -16.898 -4.291 5.209 1.00 35.45 H new ATOM 0 HE3 LYS A 31 -17.095 -2.635 4.669 1.00 35.45 H new ATOM 0 HZ1 LYS A 31 -19.216 -3.005 4.224 1.00 54.21 H new ATOM 0 HZ2 LYS A 31 -18.865 -4.359 3.261 1.00 54.21 H new ATOM 0 HZ3 LYS A 31 -19.062 -4.538 4.938 1.00 54.21 H new ATOM 479 N VAL A 32 -15.597 1.267 1.086 1.00 23.33 N ATOM 480 CA VAL A 32 -15.187 2.655 1.423 1.00 40.41 C ATOM 481 C VAL A 32 -15.281 3.625 0.214 1.00 1.35 C ATOM 482 O VAL A 32 -14.973 4.813 0.354 1.00 33.52 O ATOM 483 CB VAL A 32 -13.733 2.667 2.011 1.00 71.41 C ATOM 484 CG1 VAL A 32 -13.667 1.817 3.299 1.00 24.22 C ATOM 485 CG2 VAL A 32 -12.690 2.188 0.965 1.00 44.11 C ATOM 0 H VAL A 32 -14.849 0.710 0.673 1.00 23.33 H new ATOM 0 HA VAL A 32 -15.891 3.014 2.174 1.00 40.41 H new ATOM 0 HB VAL A 32 -13.480 3.696 2.266 1.00 71.41 H new ATOM 0 HG11 VAL A 32 -12.652 1.835 3.695 1.00 24.22 H new ATOM 0 HG12 VAL A 32 -14.353 2.226 4.040 1.00 24.22 H new ATOM 0 HG13 VAL A 32 -13.949 0.789 3.071 1.00 24.22 H new ATOM 0 HG21 VAL A 32 -11.694 2.210 1.408 1.00 44.11 H new ATOM 0 HG22 VAL A 32 -12.927 1.170 0.654 1.00 44.11 H new ATOM 0 HG23 VAL A 32 -12.716 2.847 0.097 1.00 44.11 H new ATOM 495 N ASN A 33 -15.672 3.095 -0.968 1.00 50.43 N ATOM 496 CA ASN A 33 -15.903 3.886 -2.215 1.00 70.00 C ATOM 497 C ASN A 33 -14.572 4.488 -2.802 1.00 55.23 C ATOM 498 O ASN A 33 -14.605 5.341 -3.697 1.00 65.21 O ATOM 499 CB ASN A 33 -16.999 4.984 -1.961 1.00 63.31 C ATOM 500 CG ASN A 33 -17.536 5.670 -3.222 1.00 31.42 C ATOM 501 OD1 ASN A 33 -17.637 5.067 -4.285 1.00 30.35 O ATOM 502 ND2 ASN A 33 -17.863 6.942 -3.122 1.00 50.24 N ATOM 0 H ASN A 33 -15.840 2.097 -1.092 1.00 50.43 H new ATOM 0 HA ASN A 33 -16.276 3.207 -2.982 1.00 70.00 H new ATOM 0 HB2 ASN A 33 -17.834 4.526 -1.432 1.00 63.31 H new ATOM 0 HB3 ASN A 33 -16.583 5.745 -1.301 1.00 63.31 H new ATOM 0 HD21 ASN A 33 -18.208 7.446 -3.939 1.00 50.24 H new ATOM 0 HD22 ASN A 33 -17.771 7.423 -2.228 1.00 50.24 H new ATOM 509 N LEU A 34 -13.397 4.013 -2.320 1.00 43.34 N ATOM 510 CA LEU A 34 -12.069 4.473 -2.823 1.00 11.11 C ATOM 511 C LEU A 34 -11.558 3.558 -3.959 1.00 3.00 C ATOM 512 O LEU A 34 -12.100 2.472 -4.184 1.00 50.13 O ATOM 513 CB LEU A 34 -11.016 4.515 -1.673 1.00 33.42 C ATOM 514 CG LEU A 34 -11.372 5.411 -0.441 1.00 64.50 C ATOM 515 CD1 LEU A 34 -10.291 5.301 0.659 1.00 22.50 C ATOM 516 CD2 LEU A 34 -11.605 6.885 -0.859 1.00 2.22 C ATOM 0 H LEU A 34 -13.337 3.311 -1.583 1.00 43.34 H new ATOM 0 HA LEU A 34 -12.203 5.481 -3.215 1.00 11.11 H new ATOM 0 HB2 LEU A 34 -10.854 3.497 -1.320 1.00 33.42 H new ATOM 0 HB3 LEU A 34 -10.070 4.863 -2.088 1.00 33.42 H new ATOM 0 HG LEU A 34 -12.308 5.040 -0.024 1.00 64.50 H new ATOM 0 HD11 LEU A 34 -10.565 5.934 1.503 1.00 22.50 H new ATOM 0 HD12 LEU A 34 -10.215 4.266 0.992 1.00 22.50 H new ATOM 0 HD13 LEU A 34 -9.330 5.625 0.259 1.00 22.50 H new ATOM 0 HD21 LEU A 34 -11.850 7.479 0.022 1.00 2.22 H new ATOM 0 HD22 LEU A 34 -10.700 7.279 -1.322 1.00 2.22 H new ATOM 0 HD23 LEU A 34 -12.429 6.935 -1.571 1.00 2.22 H new ATOM 528 N SER A 35 -10.521 4.027 -4.684 1.00 65.44 N ATOM 529 CA SER A 35 -9.790 3.202 -5.687 1.00 44.21 C ATOM 530 C SER A 35 -9.060 2.015 -5.026 1.00 22.41 C ATOM 531 O SER A 35 -8.699 2.080 -3.846 1.00 50.32 O ATOM 532 CB SER A 35 -8.762 4.074 -6.454 1.00 41.52 C ATOM 533 OG SER A 35 -7.910 3.298 -7.282 1.00 11.32 O ATOM 0 H SER A 35 -10.164 4.979 -4.597 1.00 65.44 H new ATOM 0 HA SER A 35 -10.530 2.805 -6.382 1.00 44.21 H new ATOM 0 HB2 SER A 35 -9.292 4.804 -7.065 1.00 41.52 H new ATOM 0 HB3 SER A 35 -8.159 4.634 -5.739 1.00 41.52 H new ATOM 0 HG SER A 35 -7.280 3.887 -7.747 1.00 11.32 H new ATOM 539 N VAL A 36 -8.840 0.940 -5.811 1.00 71.40 N ATOM 540 CA VAL A 36 -8.054 -0.247 -5.386 1.00 4.11 C ATOM 541 C VAL A 36 -6.634 0.172 -4.938 1.00 63.42 C ATOM 542 O VAL A 36 -6.158 -0.232 -3.878 1.00 4.23 O ATOM 543 CB VAL A 36 -7.933 -1.300 -6.552 1.00 20.51 C ATOM 544 CG1 VAL A 36 -7.126 -2.557 -6.118 1.00 43.22 C ATOM 545 CG2 VAL A 36 -9.328 -1.684 -7.105 1.00 41.20 C ATOM 0 H VAL A 36 -9.202 0.866 -6.762 1.00 71.40 H new ATOM 0 HA VAL A 36 -8.583 -0.703 -4.549 1.00 4.11 H new ATOM 0 HB VAL A 36 -7.374 -0.827 -7.359 1.00 20.51 H new ATOM 0 HG11 VAL A 36 -7.067 -3.257 -6.951 1.00 43.22 H new ATOM 0 HG12 VAL A 36 -6.120 -2.259 -5.822 1.00 43.22 H new ATOM 0 HG13 VAL A 36 -7.625 -3.037 -5.276 1.00 43.22 H new ATOM 0 HG21 VAL A 36 -9.213 -2.412 -7.908 1.00 41.20 H new ATOM 0 HG22 VAL A 36 -9.930 -2.117 -6.306 1.00 41.20 H new ATOM 0 HG23 VAL A 36 -9.824 -0.793 -7.491 1.00 41.20 H new ATOM 555 N GLU A 37 -5.994 0.997 -5.780 1.00 41.11 N ATOM 556 CA GLU A 37 -4.645 1.561 -5.534 1.00 13.41 C ATOM 557 C GLU A 37 -4.623 2.466 -4.272 1.00 50.34 C ATOM 558 O GLU A 37 -3.694 2.399 -3.457 1.00 4.01 O ATOM 559 CB GLU A 37 -4.217 2.367 -6.783 1.00 62.51 C ATOM 560 CG GLU A 37 -4.197 1.547 -8.089 1.00 41.42 C ATOM 561 CD GLU A 37 -4.079 2.429 -9.343 1.00 52.43 C ATOM 562 OE1 GLU A 37 -2.982 2.969 -9.610 1.00 73.34 O ATOM 563 OE2 GLU A 37 -5.092 2.603 -10.057 1.00 4.31 O ATOM 0 H GLU A 37 -6.399 1.300 -6.666 1.00 41.11 H new ATOM 0 HA GLU A 37 -3.946 0.744 -5.352 1.00 13.41 H new ATOM 0 HB2 GLU A 37 -4.896 3.211 -6.907 1.00 62.51 H new ATOM 0 HB3 GLU A 37 -3.223 2.780 -6.612 1.00 62.51 H new ATOM 0 HG2 GLU A 37 -3.361 0.848 -8.061 1.00 41.42 H new ATOM 0 HG3 GLU A 37 -5.108 0.952 -8.153 1.00 41.42 H new ATOM 570 N SER A 38 -5.677 3.298 -4.129 1.00 3.13 N ATOM 571 CA SER A 38 -5.853 4.213 -2.967 1.00 14.10 C ATOM 572 C SER A 38 -6.061 3.447 -1.648 1.00 21.14 C ATOM 573 O SER A 38 -5.674 3.929 -0.582 1.00 31.44 O ATOM 574 CB SER A 38 -7.037 5.179 -3.211 1.00 24.23 C ATOM 575 OG SER A 38 -6.776 6.017 -4.326 1.00 14.41 O ATOM 0 H SER A 38 -6.432 3.359 -4.812 1.00 3.13 H new ATOM 0 HA SER A 38 -4.932 4.788 -2.872 1.00 14.10 H new ATOM 0 HB2 SER A 38 -7.949 4.608 -3.384 1.00 24.23 H new ATOM 0 HB3 SER A 38 -7.205 5.788 -2.323 1.00 24.23 H new ATOM 0 HG SER A 38 -7.536 6.620 -4.467 1.00 14.41 H new ATOM 581 N THR A 39 -6.672 2.258 -1.750 1.00 63.43 N ATOM 582 CA THR A 39 -6.949 1.375 -0.598 1.00 73.04 C ATOM 583 C THR A 39 -5.704 0.532 -0.215 1.00 31.31 C ATOM 584 O THR A 39 -5.394 0.414 0.959 1.00 41.22 O ATOM 585 CB THR A 39 -8.175 0.449 -0.900 1.00 22.04 C ATOM 586 OG1 THR A 39 -9.344 1.266 -1.069 1.00 52.52 O ATOM 587 CG2 THR A 39 -8.446 -0.588 0.204 1.00 62.44 C ATOM 0 H THR A 39 -6.992 1.875 -2.640 1.00 63.43 H new ATOM 0 HA THR A 39 -7.192 2.007 0.256 1.00 73.04 H new ATOM 0 HB THR A 39 -7.938 -0.107 -1.807 1.00 22.04 H new ATOM 0 HG1 THR A 39 -9.332 1.674 -1.960 1.00 52.52 H new ATOM 0 HG21 THR A 39 -9.309 -1.195 -0.071 1.00 62.44 H new ATOM 0 HG22 THR A 39 -7.573 -1.230 0.322 1.00 62.44 H new ATOM 0 HG23 THR A 39 -8.649 -0.074 1.144 1.00 62.44 H new ATOM 595 N ALA A 40 -4.991 -0.023 -1.222 1.00 44.03 N ATOM 596 CA ALA A 40 -3.786 -0.889 -1.017 1.00 71.53 C ATOM 597 C ALA A 40 -2.669 -0.158 -0.238 1.00 75.12 C ATOM 598 O ALA A 40 -2.139 -0.659 0.764 1.00 2.21 O ATOM 599 CB ALA A 40 -3.249 -1.359 -2.386 1.00 33.01 C ATOM 0 H ALA A 40 -5.228 0.112 -2.205 1.00 44.03 H new ATOM 0 HA ALA A 40 -4.092 -1.748 -0.419 1.00 71.53 H new ATOM 0 HB1 ALA A 40 -2.372 -1.989 -2.236 1.00 33.01 H new ATOM 0 HB2 ALA A 40 -4.021 -1.929 -2.904 1.00 33.01 H new ATOM 0 HB3 ALA A 40 -2.974 -0.492 -2.986 1.00 33.01 H new ATOM 605 N LEU A 41 -2.354 1.043 -0.734 1.00 71.35 N ATOM 606 CA LEU A 41 -1.349 1.954 -0.156 1.00 10.32 C ATOM 607 C LEU A 41 -1.809 2.471 1.253 1.00 30.45 C ATOM 608 O LEU A 41 -0.980 2.678 2.148 1.00 31.10 O ATOM 609 CB LEU A 41 -1.097 3.079 -1.225 1.00 71.24 C ATOM 610 CG LEU A 41 -0.122 4.274 -0.910 1.00 71.11 C ATOM 611 CD1 LEU A 41 -0.847 5.416 -0.187 1.00 13.40 C ATOM 612 CD2 LEU A 41 1.136 3.823 -0.129 1.00 41.34 C ATOM 0 H LEU A 41 -2.800 1.422 -1.570 1.00 71.35 H new ATOM 0 HA LEU A 41 -0.401 1.457 0.047 1.00 10.32 H new ATOM 0 HB2 LEU A 41 -0.727 2.590 -2.126 1.00 71.24 H new ATOM 0 HB3 LEU A 41 -2.067 3.511 -1.473 1.00 71.24 H new ATOM 0 HG LEU A 41 0.224 4.653 -1.871 1.00 71.11 H new ATOM 0 HD11 LEU A 41 -0.143 6.224 0.015 1.00 13.40 H new ATOM 0 HD12 LEU A 41 -1.657 5.788 -0.815 1.00 13.40 H new ATOM 0 HD13 LEU A 41 -1.257 5.049 0.754 1.00 13.40 H new ATOM 0 HD21 LEU A 41 1.774 4.686 0.062 1.00 41.34 H new ATOM 0 HD22 LEU A 41 0.835 3.377 0.819 1.00 41.34 H new ATOM 0 HD23 LEU A 41 1.686 3.088 -0.717 1.00 41.34 H new ATOM 624 N ALA A 42 -3.139 2.631 1.442 1.00 61.11 N ATOM 625 CA ALA A 42 -3.735 3.054 2.741 1.00 73.52 C ATOM 626 C ALA A 42 -3.650 1.933 3.811 1.00 23.54 C ATOM 627 O ALA A 42 -3.390 2.200 4.982 1.00 2.23 O ATOM 628 CB ALA A 42 -5.192 3.494 2.539 1.00 55.31 C ATOM 0 H ALA A 42 -3.829 2.473 0.708 1.00 61.11 H new ATOM 0 HA ALA A 42 -3.154 3.899 3.110 1.00 73.52 H new ATOM 0 HB1 ALA A 42 -5.615 3.800 3.495 1.00 55.31 H new ATOM 0 HB2 ALA A 42 -5.226 4.331 1.842 1.00 55.31 H new ATOM 0 HB3 ALA A 42 -5.770 2.663 2.136 1.00 55.31 H new ATOM 634 N VAL A 43 -3.860 0.673 3.388 1.00 3.44 N ATOM 635 CA VAL A 43 -3.722 -0.513 4.269 1.00 0.33 C ATOM 636 C VAL A 43 -2.250 -0.687 4.735 1.00 32.10 C ATOM 637 O VAL A 43 -1.991 -1.164 5.848 1.00 24.54 O ATOM 638 CB VAL A 43 -4.244 -1.822 3.562 1.00 61.11 C ATOM 639 CG1 VAL A 43 -3.957 -3.088 4.405 1.00 13.35 C ATOM 640 CG2 VAL A 43 -5.760 -1.712 3.249 1.00 52.01 C ATOM 0 H VAL A 43 -4.129 0.443 2.431 1.00 3.44 H new ATOM 0 HA VAL A 43 -4.342 -0.344 5.149 1.00 0.33 H new ATOM 0 HB VAL A 43 -3.698 -1.921 2.624 1.00 61.11 H new ATOM 0 HG11 VAL A 43 -4.333 -3.967 3.881 1.00 13.35 H new ATOM 0 HG12 VAL A 43 -2.882 -3.188 4.557 1.00 13.35 H new ATOM 0 HG13 VAL A 43 -4.453 -3.002 5.372 1.00 13.35 H new ATOM 0 HG21 VAL A 43 -6.098 -2.626 2.761 1.00 52.01 H new ATOM 0 HG22 VAL A 43 -6.314 -1.569 4.177 1.00 52.01 H new ATOM 0 HG23 VAL A 43 -5.934 -0.863 2.588 1.00 52.01 H new ATOM 650 N GLY A 44 -1.298 -0.274 3.873 1.00 30.24 N ATOM 651 CA GLY A 44 0.124 -0.196 4.247 1.00 33.13 C ATOM 652 C GLY A 44 0.390 0.738 5.447 1.00 33.35 C ATOM 653 O GLY A 44 1.285 0.475 6.256 1.00 21.14 O ATOM 0 H GLY A 44 -1.492 0.010 2.913 1.00 30.24 H new ATOM 0 HA2 GLY A 44 0.485 -1.196 4.487 1.00 33.13 H new ATOM 0 HA3 GLY A 44 0.699 0.153 3.389 1.00 33.13 H new ATOM 657 N TRP A 45 -0.418 1.821 5.565 1.00 13.31 N ATOM 658 CA TRP A 45 -0.373 2.758 6.719 1.00 53.42 C ATOM 659 C TRP A 45 -0.961 2.099 8.002 1.00 74.12 C ATOM 660 O TRP A 45 -0.539 2.415 9.117 1.00 23.35 O ATOM 661 CB TRP A 45 -1.125 4.074 6.383 1.00 72.31 C ATOM 662 CG TRP A 45 -1.084 5.135 7.477 1.00 1.14 C ATOM 663 CD1 TRP A 45 -2.043 5.399 8.419 1.00 15.05 C ATOM 664 CD2 TRP A 45 -0.023 6.062 7.740 1.00 43.12 C ATOM 665 NE1 TRP A 45 -1.649 6.434 9.222 1.00 41.31 N ATOM 666 CE2 TRP A 45 -0.415 6.859 8.829 1.00 44.13 C ATOM 667 CE3 TRP A 45 1.214 6.292 7.153 1.00 12.51 C ATOM 668 CZ2 TRP A 45 0.390 7.873 9.341 1.00 74.03 C ATOM 669 CZ3 TRP A 45 2.020 7.297 7.657 1.00 24.53 C ATOM 670 CH2 TRP A 45 1.603 8.081 8.741 1.00 42.23 C ATOM 0 H TRP A 45 -1.118 2.070 4.866 1.00 13.31 H new ATOM 0 HA TRP A 45 0.672 2.999 6.917 1.00 53.42 H new ATOM 0 HB2 TRP A 45 -0.700 4.496 5.472 1.00 72.31 H new ATOM 0 HB3 TRP A 45 -2.167 3.835 6.168 1.00 72.31 H new ATOM 0 HD1 TRP A 45 -2.977 4.866 8.514 1.00 15.05 H new ATOM 0 HE1 TRP A 45 -2.192 6.825 9.992 1.00 41.31 H new ATOM 0 HE3 TRP A 45 1.542 5.695 6.315 1.00 12.51 H new ATOM 0 HZ2 TRP A 45 0.070 8.473 10.180 1.00 74.03 H new ATOM 0 HZ3 TRP A 45 2.985 7.480 7.208 1.00 24.53 H new ATOM 0 HH2 TRP A 45 2.250 8.863 9.110 1.00 42.23 H new ATOM 681 N LEU A 46 -1.931 1.182 7.835 1.00 60.30 N ATOM 682 CA LEU A 46 -2.478 0.378 8.960 1.00 54.50 C ATOM 683 C LEU A 46 -1.455 -0.670 9.455 1.00 74.32 C ATOM 684 O LEU A 46 -1.363 -0.935 10.652 1.00 22.21 O ATOM 685 CB LEU A 46 -3.793 -0.321 8.545 1.00 3.15 C ATOM 686 CG LEU A 46 -4.984 0.615 8.206 1.00 51.43 C ATOM 687 CD1 LEU A 46 -6.228 -0.200 7.794 1.00 33.00 C ATOM 688 CD2 LEU A 46 -5.288 1.568 9.390 1.00 60.35 C ATOM 0 H LEU A 46 -2.358 0.974 6.932 1.00 60.30 H new ATOM 0 HA LEU A 46 -2.686 1.064 9.781 1.00 54.50 H new ATOM 0 HB2 LEU A 46 -3.590 -0.947 7.676 1.00 3.15 H new ATOM 0 HB3 LEU A 46 -4.098 -0.986 9.353 1.00 3.15 H new ATOM 0 HG LEU A 46 -4.703 1.231 7.352 1.00 51.43 H new ATOM 0 HD11 LEU A 46 -7.048 0.480 7.562 1.00 33.00 H new ATOM 0 HD12 LEU A 46 -5.995 -0.801 6.915 1.00 33.00 H new ATOM 0 HD13 LEU A 46 -6.521 -0.856 8.614 1.00 33.00 H new ATOM 0 HD21 LEU A 46 -6.126 2.215 9.130 1.00 60.35 H new ATOM 0 HD22 LEU A 46 -5.542 0.982 10.273 1.00 60.35 H new ATOM 0 HD23 LEU A 46 -4.410 2.179 9.600 1.00 60.35 H new ATOM 700 N ALA A 47 -0.717 -1.284 8.511 1.00 5.32 N ATOM 701 CA ALA A 47 0.416 -2.197 8.818 1.00 10.11 C ATOM 702 C ALA A 47 1.550 -1.440 9.546 1.00 52.42 C ATOM 703 O ALA A 47 2.220 -1.990 10.432 1.00 34.22 O ATOM 704 CB ALA A 47 0.929 -2.844 7.519 1.00 24.24 C ATOM 0 H ALA A 47 -0.884 -1.165 7.512 1.00 5.32 H new ATOM 0 HA ALA A 47 0.065 -2.984 9.485 1.00 10.11 H new ATOM 0 HB1 ALA A 47 1.759 -3.512 7.748 1.00 24.24 H new ATOM 0 HB2 ALA A 47 0.124 -3.412 7.053 1.00 24.24 H new ATOM 0 HB3 ALA A 47 1.268 -2.066 6.834 1.00 24.24 H new ATOM 710 N ARG A 48 1.721 -0.162 9.154 1.00 4.42 N ATOM 711 CA ARG A 48 2.624 0.805 9.798 1.00 73.31 C ATOM 712 C ARG A 48 2.182 1.102 11.266 1.00 12.44 C ATOM 713 O ARG A 48 3.014 1.145 12.177 1.00 74.32 O ATOM 714 CB ARG A 48 2.649 2.081 8.882 1.00 4.43 C ATOM 715 CG ARG A 48 3.303 3.367 9.441 1.00 21.04 C ATOM 716 CD ARG A 48 2.342 4.278 10.226 1.00 22.24 C ATOM 717 NE ARG A 48 3.005 5.506 10.689 1.00 3.23 N ATOM 718 CZ ARG A 48 2.946 5.989 11.904 1.00 72.34 C ATOM 719 NH1 ARG A 48 2.272 5.393 12.845 1.00 35.10 N ATOM 720 NH2 ARG A 48 3.570 7.078 12.177 1.00 15.20 N ATOM 0 H ARG A 48 1.220 0.234 8.359 1.00 4.42 H new ATOM 0 HA ARG A 48 3.635 0.409 9.891 1.00 73.31 H new ATOM 0 HB2 ARG A 48 3.166 1.819 7.959 1.00 4.43 H new ATOM 0 HB3 ARG A 48 1.620 2.320 8.615 1.00 4.43 H new ATOM 0 HG2 ARG A 48 4.131 3.086 10.092 1.00 21.04 H new ATOM 0 HG3 ARG A 48 3.727 3.934 8.613 1.00 21.04 H new ATOM 0 HD2 ARG A 48 1.493 4.540 9.594 1.00 22.24 H new ATOM 0 HD3 ARG A 48 1.946 3.734 11.083 1.00 22.24 H new ATOM 0 HE ARG A 48 3.557 6.025 10.006 1.00 3.23 H new ATOM 0 HH11 ARG A 48 1.772 4.527 12.644 1.00 35.10 H new ATOM 0 HH12 ARG A 48 2.244 5.792 13.783 1.00 35.10 H new ATOM 0 HH21 ARG A 48 4.103 7.556 11.451 1.00 15.20 H new ATOM 0 HH22 ARG A 48 3.532 7.465 13.120 1.00 15.20 H new ATOM 734 N GLU A 49 0.858 1.300 11.476 1.00 62.11 N ATOM 735 CA GLU A 49 0.266 1.577 12.820 1.00 42.54 C ATOM 736 C GLU A 49 -0.044 0.283 13.615 1.00 53.02 C ATOM 737 O GLU A 49 -0.541 0.355 14.748 1.00 44.54 O ATOM 738 CB GLU A 49 -1.029 2.418 12.668 1.00 74.34 C ATOM 739 CG GLU A 49 -0.825 3.797 12.012 1.00 52.35 C ATOM 740 CD GLU A 49 -2.129 4.592 11.851 1.00 13.23 C ATOM 741 OE1 GLU A 49 -3.131 4.006 11.387 1.00 71.32 O ATOM 742 OE2 GLU A 49 -2.164 5.795 12.188 1.00 64.23 O ATOM 0 H GLU A 49 0.168 1.274 10.726 1.00 62.11 H new ATOM 0 HA GLU A 49 1.012 2.135 13.386 1.00 42.54 H new ATOM 0 HB2 GLU A 49 -1.747 1.851 12.076 1.00 74.34 H new ATOM 0 HB3 GLU A 49 -1.471 2.561 13.654 1.00 74.34 H new ATOM 0 HG2 GLU A 49 -0.125 4.378 12.613 1.00 52.35 H new ATOM 0 HG3 GLU A 49 -0.367 3.661 11.032 1.00 52.35 H new ATOM 749 N ASN A 50 0.232 -0.887 12.994 1.00 33.44 N ATOM 750 CA ASN A 50 0.050 -2.236 13.602 1.00 42.15 C ATOM 751 C ASN A 50 -1.445 -2.566 13.900 1.00 43.42 C ATOM 752 O ASN A 50 -1.744 -3.439 14.718 1.00 3.43 O ATOM 753 CB ASN A 50 0.943 -2.390 14.876 1.00 53.10 C ATOM 754 CG ASN A 50 2.430 -2.119 14.602 1.00 75.11 C ATOM 755 OD1 ASN A 50 2.930 -2.363 13.508 1.00 32.32 O ATOM 756 ND2 ASN A 50 3.141 -1.609 15.587 1.00 54.42 N ATOM 0 H ASN A 50 0.593 -0.927 12.041 1.00 33.44 H new ATOM 0 HA ASN A 50 0.377 -2.969 12.865 1.00 42.15 H new ATOM 0 HB2 ASN A 50 0.590 -1.704 15.646 1.00 53.10 H new ATOM 0 HB3 ASN A 50 0.830 -3.399 15.272 1.00 53.10 H new ATOM 0 HD21 ASN A 50 4.131 -1.408 15.450 1.00 54.42 H new ATOM 0 HD22 ASN A 50 2.701 -1.416 16.487 1.00 54.42 H new ATOM 763 N LYS A 51 -2.368 -1.882 13.186 1.00 14.44 N ATOM 764 CA LYS A 51 -3.827 -2.096 13.309 1.00 2.42 C ATOM 765 C LYS A 51 -4.302 -3.369 12.569 1.00 1.31 C ATOM 766 O LYS A 51 -5.379 -3.901 12.872 1.00 14.32 O ATOM 767 CB LYS A 51 -4.591 -0.861 12.759 1.00 72.01 C ATOM 768 CG LYS A 51 -4.479 0.415 13.621 1.00 53.22 C ATOM 769 CD LYS A 51 -5.381 1.559 13.087 1.00 24.23 C ATOM 770 CE LYS A 51 -5.422 2.778 14.019 1.00 21.31 C ATOM 771 NZ LYS A 51 -4.086 3.378 14.225 1.00 24.33 N ATOM 0 H LYS A 51 -2.120 -1.163 12.506 1.00 14.44 H new ATOM 0 HA LYS A 51 -4.043 -2.232 14.369 1.00 2.42 H new ATOM 0 HB2 LYS A 51 -4.219 -0.639 11.759 1.00 72.01 H new ATOM 0 HB3 LYS A 51 -5.645 -1.121 12.657 1.00 72.01 H new ATOM 0 HG2 LYS A 51 -4.758 0.184 14.649 1.00 53.22 H new ATOM 0 HG3 LYS A 51 -3.442 0.750 13.640 1.00 53.22 H new ATOM 0 HD2 LYS A 51 -5.020 1.871 12.107 1.00 24.23 H new ATOM 0 HD3 LYS A 51 -6.394 1.181 12.949 1.00 24.23 H new ATOM 0 HE2 LYS A 51 -6.093 3.528 13.601 1.00 21.31 H new ATOM 0 HE3 LYS A 51 -5.836 2.481 14.983 1.00 21.31 H new ATOM 0 HZ1 LYS A 51 -4.179 4.410 14.312 1.00 24.33 H new ATOM 0 HZ2 LYS A 51 -3.663 2.994 15.094 1.00 24.33 H new ATOM 0 HZ3 LYS A 51 -3.475 3.152 13.414 1.00 24.33 H new ATOM 785 N VAL A 52 -3.492 -3.848 11.594 1.00 33.20 N ATOM 786 CA VAL A 52 -3.860 -5.002 10.738 1.00 53.41 C ATOM 787 C VAL A 52 -2.774 -6.096 10.738 1.00 20.11 C ATOM 788 O VAL A 52 -1.584 -5.829 10.976 1.00 33.22 O ATOM 789 CB VAL A 52 -4.178 -4.585 9.244 1.00 63.21 C ATOM 790 CG1 VAL A 52 -5.377 -3.612 9.179 1.00 74.23 C ATOM 791 CG2 VAL A 52 -2.934 -3.996 8.527 1.00 31.32 C ATOM 0 H VAL A 52 -2.577 -3.451 11.380 1.00 33.20 H new ATOM 0 HA VAL A 52 -4.771 -5.404 11.182 1.00 53.41 H new ATOM 0 HB VAL A 52 -4.454 -5.493 8.709 1.00 63.21 H new ATOM 0 HG11 VAL A 52 -5.572 -3.343 8.141 1.00 74.23 H new ATOM 0 HG12 VAL A 52 -6.259 -4.093 9.601 1.00 74.23 H new ATOM 0 HG13 VAL A 52 -5.147 -2.712 9.749 1.00 74.23 H new ATOM 0 HG21 VAL A 52 -3.198 -3.724 7.505 1.00 31.32 H new ATOM 0 HG22 VAL A 52 -2.591 -3.110 9.062 1.00 31.32 H new ATOM 0 HG23 VAL A 52 -2.138 -4.740 8.510 1.00 31.32 H new ATOM 801 N VAL A 53 -3.216 -7.333 10.458 1.00 41.44 N ATOM 802 CA VAL A 53 -2.345 -8.507 10.286 1.00 44.03 C ATOM 803 C VAL A 53 -2.254 -8.853 8.779 1.00 44.14 C ATOM 804 O VAL A 53 -3.216 -9.373 8.200 1.00 71.13 O ATOM 805 CB VAL A 53 -2.889 -9.753 11.086 1.00 33.42 C ATOM 806 CG1 VAL A 53 -1.925 -10.968 10.960 1.00 63.42 C ATOM 807 CG2 VAL A 53 -3.167 -9.395 12.574 1.00 53.35 C ATOM 0 H VAL A 53 -4.206 -7.549 10.343 1.00 41.44 H new ATOM 0 HA VAL A 53 -1.357 -8.264 10.679 1.00 44.03 H new ATOM 0 HB VAL A 53 -3.840 -10.043 10.640 1.00 33.42 H new ATOM 0 HG11 VAL A 53 -2.327 -11.811 11.522 1.00 63.42 H new ATOM 0 HG12 VAL A 53 -1.825 -11.246 9.911 1.00 63.42 H new ATOM 0 HG13 VAL A 53 -0.947 -10.699 11.359 1.00 63.42 H new ATOM 0 HG21 VAL A 53 -3.541 -10.276 13.096 1.00 53.35 H new ATOM 0 HG22 VAL A 53 -2.244 -9.058 13.046 1.00 53.35 H new ATOM 0 HG23 VAL A 53 -3.911 -8.600 12.624 1.00 53.35 H new ATOM 817 N ILE A 54 -1.116 -8.517 8.143 1.00 50.33 N ATOM 818 CA ILE A 54 -0.850 -8.874 6.729 1.00 41.14 C ATOM 819 C ILE A 54 -0.588 -10.396 6.622 1.00 44.14 C ATOM 820 O ILE A 54 0.313 -10.916 7.287 1.00 34.30 O ATOM 821 CB ILE A 54 0.396 -8.086 6.156 1.00 14.42 C ATOM 822 CG1 ILE A 54 0.255 -6.541 6.385 1.00 41.31 C ATOM 823 CG2 ILE A 54 0.631 -8.407 4.650 1.00 5.25 C ATOM 824 CD1 ILE A 54 -0.922 -5.880 5.686 1.00 31.41 C ATOM 0 H ILE A 54 -0.359 -7.996 8.586 1.00 50.33 H new ATOM 0 HA ILE A 54 -1.725 -8.599 6.141 1.00 41.14 H new ATOM 0 HB ILE A 54 1.272 -8.425 6.709 1.00 14.42 H new ATOM 0 HG12 ILE A 54 0.169 -6.357 7.456 1.00 41.31 H new ATOM 0 HG13 ILE A 54 1.172 -6.057 6.050 1.00 41.31 H new ATOM 0 HG21 ILE A 54 1.495 -7.848 4.289 1.00 5.25 H new ATOM 0 HG22 ILE A 54 0.813 -9.475 4.530 1.00 5.25 H new ATOM 0 HG23 ILE A 54 -0.251 -8.123 4.075 1.00 5.25 H new ATOM 0 HD11 ILE A 54 -0.926 -4.813 5.911 1.00 31.41 H new ATOM 0 HD12 ILE A 54 -0.833 -6.024 4.609 1.00 31.41 H new ATOM 0 HD13 ILE A 54 -1.852 -6.328 6.036 1.00 31.41 H new ATOM 836 N GLU A 55 -1.386 -11.105 5.799 1.00 74.20 N ATOM 837 CA GLU A 55 -1.275 -12.575 5.636 1.00 14.21 C ATOM 838 C GLU A 55 -1.346 -12.957 4.143 1.00 42.04 C ATOM 839 O GLU A 55 -2.210 -12.465 3.410 1.00 63.32 O ATOM 840 CB GLU A 55 -2.403 -13.297 6.463 1.00 63.41 C ATOM 841 CG GLU A 55 -1.918 -14.424 7.402 1.00 63.14 C ATOM 842 CD GLU A 55 -1.482 -15.704 6.664 1.00 54.32 C ATOM 843 OE1 GLU A 55 -0.327 -15.782 6.196 1.00 13.41 O ATOM 844 OE2 GLU A 55 -2.302 -16.641 6.554 1.00 13.33 O ATOM 0 H GLU A 55 -2.121 -10.683 5.231 1.00 74.20 H new ATOM 0 HA GLU A 55 -0.309 -12.904 6.019 1.00 14.21 H new ATOM 0 HB2 GLU A 55 -2.927 -12.550 7.060 1.00 63.41 H new ATOM 0 HB3 GLU A 55 -3.130 -13.715 5.766 1.00 63.41 H new ATOM 0 HG2 GLU A 55 -1.081 -14.055 7.995 1.00 63.14 H new ATOM 0 HG3 GLU A 55 -2.718 -14.673 8.099 1.00 63.14 H new ATOM 851 N ARG A 56 -0.428 -13.830 3.699 1.00 22.55 N ATOM 852 CA ARG A 56 -0.406 -14.357 2.314 1.00 74.24 C ATOM 853 C ARG A 56 -0.623 -15.882 2.297 1.00 50.02 C ATOM 854 O ARG A 56 -0.117 -16.605 3.156 1.00 74.54 O ATOM 855 CB ARG A 56 0.916 -13.976 1.584 1.00 1.53 C ATOM 856 CG ARG A 56 0.958 -12.513 1.082 1.00 30.14 C ATOM 857 CD ARG A 56 2.243 -12.189 0.293 1.00 33.44 C ATOM 858 NE ARG A 56 2.155 -10.882 -0.390 1.00 62.31 N ATOM 859 CZ ARG A 56 3.168 -10.221 -0.908 1.00 41.22 C ATOM 860 NH1 ARG A 56 4.381 -10.657 -0.808 1.00 41.44 N ATOM 861 NH2 ARG A 56 2.950 -9.116 -1.533 1.00 14.52 N ATOM 0 H ARG A 56 0.323 -14.194 4.286 1.00 22.55 H new ATOM 0 HA ARG A 56 -1.231 -13.893 1.773 1.00 74.24 H new ATOM 0 HB2 ARG A 56 1.754 -14.141 2.261 1.00 1.53 H new ATOM 0 HB3 ARG A 56 1.056 -14.645 0.735 1.00 1.53 H new ATOM 0 HG2 ARG A 56 0.091 -12.326 0.448 1.00 30.14 H new ATOM 0 HG3 ARG A 56 0.881 -11.839 1.935 1.00 30.14 H new ATOM 0 HD2 ARG A 56 3.095 -12.187 0.972 1.00 33.44 H new ATOM 0 HD3 ARG A 56 2.424 -12.972 -0.443 1.00 33.44 H new ATOM 0 HE ARG A 56 1.231 -10.456 -0.466 1.00 62.31 H new ATOM 0 HH11 ARG A 56 4.570 -11.532 -0.319 1.00 41.44 H new ATOM 0 HH12 ARG A 56 5.149 -10.126 -1.218 1.00 41.44 H new ATOM 0 HH21 ARG A 56 1.998 -8.760 -1.623 1.00 14.52 H new ATOM 0 HH22 ARG A 56 3.729 -8.597 -1.938 1.00 14.52 H new ATOM 875 N LYS A 57 -1.376 -16.343 1.286 1.00 74.41 N ATOM 876 CA LYS A 57 -1.774 -17.757 1.125 1.00 65.22 C ATOM 877 C LYS A 57 -2.023 -18.067 -0.371 1.00 52.31 C ATOM 878 O LYS A 57 -2.958 -17.530 -0.971 1.00 53.24 O ATOM 879 CB LYS A 57 -3.043 -18.058 1.986 1.00 14.23 C ATOM 880 CG LYS A 57 -4.210 -17.010 1.862 1.00 74.45 C ATOM 881 CD LYS A 57 -4.373 -16.128 3.125 1.00 20.42 C ATOM 882 CE LYS A 57 -4.851 -16.943 4.340 1.00 23.45 C ATOM 883 NZ LYS A 57 -4.979 -16.110 5.553 1.00 10.14 N ATOM 0 H LYS A 57 -1.732 -15.739 0.545 1.00 74.41 H new ATOM 0 HA LYS A 57 -0.969 -18.402 1.476 1.00 65.22 H new ATOM 0 HB2 LYS A 57 -3.427 -19.038 1.705 1.00 14.23 H new ATOM 0 HB3 LYS A 57 -2.744 -18.121 3.032 1.00 14.23 H new ATOM 0 HG2 LYS A 57 -4.024 -16.369 1.000 1.00 74.45 H new ATOM 0 HG3 LYS A 57 -5.145 -17.537 1.671 1.00 74.45 H new ATOM 0 HD2 LYS A 57 -3.421 -15.652 3.360 1.00 20.42 H new ATOM 0 HD3 LYS A 57 -5.087 -15.330 2.920 1.00 20.42 H new ATOM 0 HE2 LYS A 57 -5.813 -17.401 4.112 1.00 23.45 H new ATOM 0 HE3 LYS A 57 -4.149 -17.754 4.531 1.00 23.45 H new ATOM 0 HZ1 LYS A 57 -4.456 -16.553 6.335 1.00 10.14 H new ATOM 0 HZ2 LYS A 57 -4.588 -15.164 5.367 1.00 10.14 H new ATOM 0 HZ3 LYS A 57 -5.983 -16.025 5.812 1.00 10.14 H new ATOM 897 N ASN A 58 -1.173 -18.942 -0.957 1.00 10.34 N ATOM 898 CA ASN A 58 -1.159 -19.256 -2.419 1.00 35.54 C ATOM 899 C ASN A 58 -1.026 -17.976 -3.306 1.00 63.24 C ATOM 900 O ASN A 58 -1.489 -17.941 -4.453 1.00 34.25 O ATOM 901 CB ASN A 58 -2.424 -20.074 -2.805 1.00 71.11 C ATOM 902 CG ASN A 58 -2.528 -21.397 -2.043 1.00 72.54 C ATOM 903 OD1 ASN A 58 -2.063 -22.434 -2.501 1.00 32.15 O ATOM 904 ND2 ASN A 58 -3.127 -21.360 -0.872 1.00 25.54 N ATOM 0 H ASN A 58 -0.469 -19.458 -0.430 1.00 10.34 H new ATOM 0 HA ASN A 58 -0.273 -19.860 -2.614 1.00 35.54 H new ATOM 0 HB2 ASN A 58 -3.313 -19.475 -2.608 1.00 71.11 H new ATOM 0 HB3 ASN A 58 -2.408 -20.277 -3.876 1.00 71.11 H new ATOM 0 HD21 ASN A 58 -3.215 -22.211 -0.317 1.00 25.54 H new ATOM 0 HD22 ASN A 58 -3.503 -20.480 -0.519 1.00 25.54 H new ATOM 911 N GLY A 59 -0.331 -16.957 -2.764 1.00 1.42 N ATOM 912 CA GLY A 59 -0.158 -15.651 -3.430 1.00 5.33 C ATOM 913 C GLY A 59 -1.225 -14.597 -3.057 1.00 35.35 C ATOM 914 O GLY A 59 -1.011 -13.395 -3.260 1.00 33.33 O ATOM 0 H GLY A 59 0.126 -17.016 -1.854 1.00 1.42 H new ATOM 0 HA2 GLY A 59 0.827 -15.257 -3.180 1.00 5.33 H new ATOM 0 HA3 GLY A 59 -0.176 -15.802 -4.509 1.00 5.33 H new ATOM 918 N LEU A 60 -2.374 -15.050 -2.507 1.00 20.14 N ATOM 919 CA LEU A 60 -3.532 -14.175 -2.171 1.00 32.21 C ATOM 920 C LEU A 60 -3.294 -13.413 -0.845 1.00 52.14 C ATOM 921 O LEU A 60 -2.827 -13.995 0.136 1.00 40.21 O ATOM 922 CB LEU A 60 -4.855 -15.010 -2.073 1.00 21.11 C ATOM 923 CG LEU A 60 -5.452 -15.554 -3.421 1.00 63.31 C ATOM 924 CD1 LEU A 60 -4.547 -16.611 -4.090 1.00 44.13 C ATOM 925 CD2 LEU A 60 -6.889 -16.095 -3.215 1.00 43.15 C ATOM 0 H LEU A 60 -2.530 -16.032 -2.281 1.00 20.14 H new ATOM 0 HA LEU A 60 -3.633 -13.447 -2.976 1.00 32.21 H new ATOM 0 HB2 LEU A 60 -4.672 -15.860 -1.415 1.00 21.11 H new ATOM 0 HB3 LEU A 60 -5.612 -14.391 -1.592 1.00 21.11 H new ATOM 0 HG LEU A 60 -5.499 -14.708 -4.107 1.00 63.31 H new ATOM 0 HD11 LEU A 60 -5.009 -16.951 -5.017 1.00 44.13 H new ATOM 0 HD12 LEU A 60 -3.574 -16.171 -4.310 1.00 44.13 H new ATOM 0 HD13 LEU A 60 -4.418 -17.458 -3.416 1.00 44.13 H new ATOM 0 HD21 LEU A 60 -7.278 -16.465 -4.164 1.00 43.15 H new ATOM 0 HD22 LEU A 60 -6.871 -16.907 -2.488 1.00 43.15 H new ATOM 0 HD23 LEU A 60 -7.530 -15.294 -2.848 1.00 43.15 H new ATOM 937 N ILE A 61 -3.637 -12.109 -0.828 1.00 21.43 N ATOM 938 CA ILE A 61 -3.455 -11.233 0.353 1.00 65.34 C ATOM 939 C ILE A 61 -4.801 -11.018 1.103 1.00 30.44 C ATOM 940 O ILE A 61 -5.795 -10.581 0.509 1.00 33.14 O ATOM 941 CB ILE A 61 -2.854 -9.833 -0.068 1.00 11.45 C ATOM 942 CG1 ILE A 61 -1.532 -10.028 -0.891 1.00 73.34 C ATOM 943 CG2 ILE A 61 -2.613 -8.924 1.176 1.00 0.13 C ATOM 944 CD1 ILE A 61 -0.884 -8.743 -1.393 1.00 22.03 C ATOM 0 H ILE A 61 -4.048 -11.632 -1.630 1.00 21.43 H new ATOM 0 HA ILE A 61 -2.755 -11.732 1.023 1.00 65.34 H new ATOM 0 HB ILE A 61 -3.581 -9.329 -0.705 1.00 11.45 H new ATOM 0 HG12 ILE A 61 -0.812 -10.561 -0.270 1.00 73.34 H new ATOM 0 HG13 ILE A 61 -1.747 -10.666 -1.748 1.00 73.34 H new ATOM 0 HG21 ILE A 61 -2.199 -7.968 0.854 1.00 0.13 H new ATOM 0 HG22 ILE A 61 -3.558 -8.755 1.692 1.00 0.13 H new ATOM 0 HG23 ILE A 61 -1.913 -9.413 1.853 1.00 0.13 H new ATOM 0 HD11 ILE A 61 0.022 -8.985 -1.949 1.00 22.03 H new ATOM 0 HD12 ILE A 61 -1.580 -8.215 -2.045 1.00 22.03 H new ATOM 0 HD13 ILE A 61 -0.630 -8.108 -0.544 1.00 22.03 H new ATOM 956 N GLU A 62 -4.808 -11.343 2.412 1.00 1.30 N ATOM 957 CA GLU A 62 -5.915 -11.052 3.351 1.00 11.50 C ATOM 958 C GLU A 62 -5.362 -10.229 4.532 1.00 62.24 C ATOM 959 O GLU A 62 -4.397 -10.651 5.186 1.00 5.52 O ATOM 960 CB GLU A 62 -6.555 -12.365 3.890 1.00 31.34 C ATOM 961 CG GLU A 62 -7.359 -13.170 2.853 1.00 22.05 C ATOM 962 CD GLU A 62 -8.042 -14.416 3.452 1.00 24.21 C ATOM 963 OE1 GLU A 62 -8.929 -14.262 4.315 1.00 41.12 O ATOM 964 OE2 GLU A 62 -7.683 -15.550 3.084 1.00 25.44 O ATOM 0 H GLU A 62 -4.028 -11.826 2.857 1.00 1.30 H new ATOM 0 HA GLU A 62 -6.685 -10.491 2.822 1.00 11.50 H new ATOM 0 HB2 GLU A 62 -5.764 -13.001 4.287 1.00 31.34 H new ATOM 0 HB3 GLU A 62 -7.212 -12.116 4.723 1.00 31.34 H new ATOM 0 HG2 GLU A 62 -8.118 -12.525 2.410 1.00 22.05 H new ATOM 0 HG3 GLU A 62 -6.694 -13.480 2.047 1.00 22.05 H new ATOM 971 N ILE A 63 -5.960 -9.049 4.801 1.00 55.15 N ATOM 972 CA ILE A 63 -5.550 -8.188 5.937 1.00 21.42 C ATOM 973 C ILE A 63 -6.607 -8.265 7.072 1.00 22.12 C ATOM 974 O ILE A 63 -7.768 -7.872 6.917 1.00 50.45 O ATOM 975 CB ILE A 63 -5.218 -6.691 5.494 1.00 23.35 C ATOM 976 CG1 ILE A 63 -6.477 -5.801 5.162 1.00 45.45 C ATOM 977 CG2 ILE A 63 -4.240 -6.709 4.289 1.00 1.12 C ATOM 978 CD1 ILE A 63 -7.278 -6.206 3.940 1.00 54.03 C ATOM 0 H ILE A 63 -6.728 -8.669 4.249 1.00 55.15 H new ATOM 0 HA ILE A 63 -4.609 -8.575 6.329 1.00 21.42 H new ATOM 0 HB ILE A 63 -4.758 -6.220 6.362 1.00 23.35 H new ATOM 0 HG12 ILE A 63 -7.141 -5.811 6.026 1.00 45.45 H new ATOM 0 HG13 ILE A 63 -6.144 -4.772 5.028 1.00 45.45 H new ATOM 0 HG21 ILE A 63 -4.015 -5.686 3.988 1.00 1.12 H new ATOM 0 HG22 ILE A 63 -3.318 -7.214 4.576 1.00 1.12 H new ATOM 0 HG23 ILE A 63 -4.700 -7.240 3.455 1.00 1.12 H new ATOM 0 HD11 ILE A 63 -8.117 -5.523 3.812 1.00 54.03 H new ATOM 0 HD12 ILE A 63 -6.640 -6.166 3.057 1.00 54.03 H new ATOM 0 HD13 ILE A 63 -7.653 -7.221 4.071 1.00 54.03 H new ATOM 990 N TYR A 64 -6.202 -8.867 8.193 1.00 63.30 N ATOM 991 CA TYR A 64 -7.061 -9.076 9.378 1.00 50.22 C ATOM 992 C TYR A 64 -6.961 -7.889 10.355 1.00 20.14 C ATOM 993 O TYR A 64 -6.197 -6.960 10.131 1.00 53.31 O ATOM 994 CB TYR A 64 -6.641 -10.392 10.080 1.00 51.23 C ATOM 995 CG TYR A 64 -6.769 -11.633 9.182 1.00 72.41 C ATOM 996 CD1 TYR A 64 -7.999 -12.271 9.020 1.00 62.14 C ATOM 997 CD2 TYR A 64 -5.671 -12.159 8.491 1.00 24.03 C ATOM 998 CE1 TYR A 64 -8.131 -13.379 8.209 1.00 11.42 C ATOM 999 CE2 TYR A 64 -5.807 -13.270 7.678 1.00 1.21 C ATOM 1000 CZ TYR A 64 -7.035 -13.875 7.543 1.00 4.25 C ATOM 1001 OH TYR A 64 -7.167 -14.978 6.731 1.00 34.50 O ATOM 0 H TYR A 64 -5.256 -9.231 8.312 1.00 63.30 H new ATOM 0 HA TYR A 64 -8.099 -9.147 9.054 1.00 50.22 H new ATOM 0 HB2 TYR A 64 -5.608 -10.302 10.416 1.00 51.23 H new ATOM 0 HB3 TYR A 64 -7.255 -10.532 10.970 1.00 51.23 H new ATOM 0 HD1 TYR A 64 -8.865 -11.890 9.540 1.00 62.14 H new ATOM 0 HD2 TYR A 64 -4.703 -11.691 8.594 1.00 24.03 H new ATOM 0 HE1 TYR A 64 -9.093 -13.856 8.097 1.00 11.42 H new ATOM 0 HE2 TYR A 64 -4.950 -13.662 7.150 1.00 1.21 H new ATOM 0 HH TYR A 64 -7.829 -14.793 6.032 1.00 34.50 H new ATOM 1011 N ASN A 65 -7.760 -7.919 11.423 1.00 4.22 N ATOM 1012 CA ASN A 65 -7.622 -6.981 12.558 1.00 63.41 C ATOM 1013 C ASN A 65 -6.680 -7.575 13.616 1.00 72.24 C ATOM 1014 O ASN A 65 -6.570 -8.796 13.739 1.00 25.14 O ATOM 1015 CB ASN A 65 -9.008 -6.685 13.184 1.00 44.01 C ATOM 1016 CG ASN A 65 -9.879 -5.778 12.314 1.00 62.41 C ATOM 1017 OD1 ASN A 65 -9.384 -4.891 11.626 1.00 22.10 O ATOM 1018 ND2 ASN A 65 -11.177 -6.003 12.323 1.00 2.42 N ATOM 0 H ASN A 65 -8.521 -8.589 11.533 1.00 4.22 H new ATOM 0 HA ASN A 65 -7.200 -6.045 12.191 1.00 63.41 H new ATOM 0 HB2 ASN A 65 -9.531 -7.626 13.355 1.00 44.01 H new ATOM 0 HB3 ASN A 65 -8.867 -6.217 14.158 1.00 44.01 H new ATOM 0 HD21 ASN A 65 -11.797 -5.433 11.748 1.00 2.42 H new ATOM 0 HD22 ASN A 65 -11.562 -6.747 12.905 1.00 2.42 H new ATOM 1025 N GLU A 66 -5.982 -6.708 14.366 1.00 61.44 N ATOM 1026 CA GLU A 66 -5.152 -7.146 15.518 1.00 63.12 C ATOM 1027 C GLU A 66 -5.987 -7.136 16.831 1.00 32.02 C ATOM 1028 O GLU A 66 -7.101 -6.602 16.871 1.00 72.13 O ATOM 1029 CB GLU A 66 -3.836 -6.281 15.638 1.00 43.41 C ATOM 1030 CG GLU A 66 -2.510 -7.097 15.592 1.00 63.25 C ATOM 1031 CD GLU A 66 -2.334 -8.082 16.773 1.00 50.34 C ATOM 1032 OE1 GLU A 66 -2.914 -9.200 16.746 1.00 75.34 O ATOM 1033 OE2 GLU A 66 -1.646 -7.732 17.756 1.00 73.42 O ATOM 0 H GLU A 66 -5.970 -5.701 14.203 1.00 61.44 H new ATOM 0 HA GLU A 66 -4.835 -8.174 15.343 1.00 63.12 H new ATOM 0 HB2 GLU A 66 -3.824 -5.550 14.830 1.00 43.41 H new ATOM 0 HB3 GLU A 66 -3.870 -5.722 16.573 1.00 43.41 H new ATOM 0 HG2 GLU A 66 -2.472 -7.656 14.657 1.00 63.25 H new ATOM 0 HG3 GLU A 66 -1.669 -6.404 15.583 1.00 63.25 H new ATOM 1040 N GLY A 67 -5.424 -7.740 17.897 1.00 44.13 N ATOM 1041 CA GLY A 67 -6.129 -7.954 19.177 1.00 51.14 C ATOM 1042 C GLY A 67 -6.306 -9.442 19.520 1.00 12.54 C ATOM 1043 O GLY A 67 -7.073 -9.785 20.428 1.00 74.03 O ATOM 0 H GLY A 67 -4.467 -8.093 17.895 1.00 44.13 H new ATOM 0 HA2 GLY A 67 -5.574 -7.465 19.978 1.00 51.14 H new ATOM 0 HA3 GLY A 67 -7.108 -7.478 19.131 1.00 51.14 H new ATOM 1047 N HIS A 68 -5.588 -10.333 18.792 1.00 31.41 N ATOM 1048 CA HIS A 68 -5.676 -11.807 19.005 1.00 22.32 C ATOM 1049 C HIS A 68 -4.298 -12.532 18.989 1.00 62.52 C ATOM 1050 O HIS A 68 -4.218 -13.690 19.417 1.00 11.51 O ATOM 1051 CB HIS A 68 -6.657 -12.447 17.979 1.00 74.35 C ATOM 1052 CG HIS A 68 -6.316 -12.231 16.526 1.00 41.33 C ATOM 1053 ND1 HIS A 68 -6.107 -13.261 15.637 1.00 31.54 N ATOM 1054 CD2 HIS A 68 -6.218 -11.096 15.796 1.00 34.02 C ATOM 1055 CE1 HIS A 68 -5.905 -12.772 14.434 1.00 75.52 C ATOM 1056 NE2 HIS A 68 -5.968 -11.462 14.498 1.00 34.43 N ATOM 0 H HIS A 68 -4.941 -10.061 18.052 1.00 31.41 H new ATOM 0 HA HIS A 68 -6.066 -11.945 20.013 1.00 22.32 H new ATOM 0 HB2 HIS A 68 -6.702 -13.520 18.167 1.00 74.35 H new ATOM 0 HB3 HIS A 68 -7.655 -12.050 18.162 1.00 74.35 H new ATOM 0 HD2 HIS A 68 -6.318 -10.087 16.167 1.00 34.02 H new ATOM 0 HE1 HIS A 68 -5.718 -13.351 13.542 1.00 75.52 H new ATOM 0 HE2 HIS A 68 -5.850 -10.822 13.712 1.00 34.43 H new ATOM 1065 N PHE A 69 -3.229 -11.880 18.491 1.00 12.43 N ATOM 1066 CA PHE A 69 -1.853 -12.452 18.535 1.00 15.33 C ATOM 1067 C PHE A 69 -1.182 -12.180 19.900 1.00 71.20 C ATOM 1068 O PHE A 69 -0.930 -11.025 20.265 1.00 34.24 O ATOM 1069 CB PHE A 69 -0.973 -11.888 17.384 1.00 31.35 C ATOM 1070 CG PHE A 69 -1.220 -12.554 16.032 1.00 10.50 C ATOM 1071 CD1 PHE A 69 -2.295 -12.185 15.229 1.00 64.11 C ATOM 1072 CD2 PHE A 69 -0.370 -13.566 15.571 1.00 65.01 C ATOM 1073 CE1 PHE A 69 -2.510 -12.802 14.011 1.00 45.44 C ATOM 1074 CE2 PHE A 69 -0.590 -14.177 14.353 1.00 34.41 C ATOM 1075 CZ PHE A 69 -1.660 -13.796 13.574 1.00 72.23 C ATOM 0 H PHE A 69 -3.283 -10.960 18.054 1.00 12.43 H new ATOM 0 HA PHE A 69 -1.943 -13.530 18.402 1.00 15.33 H new ATOM 0 HB2 PHE A 69 -1.158 -10.818 17.290 1.00 31.35 H new ATOM 0 HB3 PHE A 69 0.077 -12.008 17.651 1.00 31.35 H new ATOM 0 HD1 PHE A 69 -2.968 -11.408 15.561 1.00 64.11 H new ATOM 0 HD2 PHE A 69 0.470 -13.873 16.177 1.00 65.01 H new ATOM 0 HE1 PHE A 69 -3.348 -12.504 13.398 1.00 45.44 H new ATOM 0 HE2 PHE A 69 0.077 -14.954 14.011 1.00 34.41 H new ATOM 0 HZ PHE A 69 -1.833 -14.275 12.622 1.00 72.23 H new ATOM 1085 N ASP A 70 -0.904 -13.261 20.649 1.00 3.14 N ATOM 1086 CA ASP A 70 -0.220 -13.199 21.958 1.00 61.33 C ATOM 1087 C ASP A 70 1.140 -13.930 21.912 1.00 73.22 C ATOM 1088 O ASP A 70 1.369 -14.802 21.063 1.00 3.13 O ATOM 1089 CB ASP A 70 -1.115 -13.810 23.058 1.00 52.23 C ATOM 1090 CG ASP A 70 -2.460 -13.087 23.184 1.00 30.24 C ATOM 1091 OD1 ASP A 70 -2.518 -12.031 23.852 1.00 64.11 O ATOM 1092 OD2 ASP A 70 -3.461 -13.562 22.605 1.00 14.40 O ATOM 0 H ASP A 70 -1.148 -14.209 20.364 1.00 3.14 H new ATOM 0 HA ASP A 70 -0.034 -12.151 22.192 1.00 61.33 H new ATOM 0 HB2 ASP A 70 -1.291 -14.863 22.837 1.00 52.23 H new ATOM 0 HB3 ASP A 70 -0.592 -13.768 24.013 1.00 52.23 H new ATOM 1097 N PHE A 71 2.031 -13.551 22.837 1.00 40.44 N ATOM 1098 CA PHE A 71 3.395 -14.123 22.964 1.00 51.31 C ATOM 1099 C PHE A 71 3.882 -14.011 24.440 1.00 4.12 C ATOM 1100 O PHE A 71 5.054 -14.245 24.759 1.00 25.11 O ATOM 1101 CB PHE A 71 4.342 -13.369 21.973 1.00 14.13 C ATOM 1102 CG PHE A 71 5.749 -13.959 21.821 1.00 64.53 C ATOM 1103 CD1 PHE A 71 5.932 -15.251 21.321 1.00 20.25 C ATOM 1104 CD2 PHE A 71 6.886 -13.228 22.182 1.00 63.44 C ATOM 1105 CE1 PHE A 71 7.200 -15.788 21.185 1.00 53.54 C ATOM 1106 CE2 PHE A 71 8.151 -13.769 22.044 1.00 3.53 C ATOM 1107 CZ PHE A 71 8.307 -15.047 21.546 1.00 54.10 C ATOM 0 H PHE A 71 1.831 -12.830 23.531 1.00 40.44 H new ATOM 0 HA PHE A 71 3.396 -15.182 22.707 1.00 51.31 H new ATOM 0 HB2 PHE A 71 3.869 -13.348 20.991 1.00 14.13 H new ATOM 0 HB3 PHE A 71 4.435 -12.335 22.304 1.00 14.13 H new ATOM 0 HD1 PHE A 71 5.072 -15.839 21.037 1.00 20.25 H new ATOM 0 HD2 PHE A 71 6.774 -12.228 22.574 1.00 63.44 H new ATOM 0 HE1 PHE A 71 7.324 -16.788 20.796 1.00 53.54 H new ATOM 0 HE2 PHE A 71 9.018 -13.191 22.326 1.00 3.53 H new ATOM 0 HZ PHE A 71 9.296 -15.467 21.439 1.00 54.10 H new ATOM 1117 N SER A 72 2.945 -13.682 25.348 1.00 12.32 N ATOM 1118 CA SER A 72 3.241 -13.390 26.768 1.00 3.31 C ATOM 1119 C SER A 72 3.108 -14.656 27.648 1.00 74.35 C ATOM 1120 O SER A 72 2.339 -15.568 27.323 1.00 33.24 O ATOM 1121 CB SER A 72 2.282 -12.285 27.266 1.00 70.02 C ATOM 1122 OG SER A 72 2.574 -11.886 28.593 1.00 74.53 O ATOM 0 H SER A 72 1.954 -13.610 25.118 1.00 12.32 H new ATOM 0 HA SER A 72 4.273 -13.048 26.846 1.00 3.31 H new ATOM 0 HB2 SER A 72 2.350 -11.421 26.605 1.00 70.02 H new ATOM 0 HB3 SER A 72 1.255 -12.646 27.214 1.00 70.02 H new ATOM 0 HG SER A 72 1.947 -11.185 28.869 1.00 74.53 H new ATOM 1128 N PHE A 73 3.855 -14.696 28.769 1.00 12.22 N ATOM 1129 CA PHE A 73 3.815 -15.824 29.729 1.00 63.02 C ATOM 1130 C PHE A 73 2.494 -15.795 30.543 1.00 64.51 C ATOM 1131 O PHE A 73 2.367 -15.047 31.523 1.00 5.24 O ATOM 1132 CB PHE A 73 5.050 -15.778 30.671 1.00 52.15 C ATOM 1133 CG PHE A 73 6.388 -15.888 29.938 1.00 54.25 C ATOM 1134 CD1 PHE A 73 6.869 -17.126 29.508 1.00 44.42 C ATOM 1135 CD2 PHE A 73 7.165 -14.758 29.674 1.00 63.34 C ATOM 1136 CE1 PHE A 73 8.079 -17.229 28.844 1.00 12.13 C ATOM 1137 CE2 PHE A 73 8.374 -14.864 29.009 1.00 52.32 C ATOM 1138 CZ PHE A 73 8.832 -16.099 28.594 1.00 0.45 C ATOM 0 H PHE A 73 4.501 -13.953 29.036 1.00 12.22 H new ATOM 0 HA PHE A 73 3.849 -16.760 29.171 1.00 63.02 H new ATOM 0 HB2 PHE A 73 5.031 -14.846 31.235 1.00 52.15 H new ATOM 0 HB3 PHE A 73 4.974 -16.590 31.394 1.00 52.15 H new ATOM 0 HD1 PHE A 73 6.288 -18.017 29.696 1.00 44.42 H new ATOM 0 HD2 PHE A 73 6.817 -13.787 29.994 1.00 63.34 H new ATOM 0 HE1 PHE A 73 8.435 -18.196 28.521 1.00 12.13 H new ATOM 0 HE2 PHE A 73 8.961 -13.979 28.814 1.00 52.32 H new ATOM 0 HZ PHE A 73 9.776 -16.181 28.076 1.00 0.45 H new ATOM 1148 N GLY A 74 1.502 -16.586 30.099 1.00 24.11 N ATOM 1149 CA GLY A 74 0.172 -16.606 30.718 1.00 52.43 C ATOM 1150 C GLY A 74 0.077 -17.529 31.940 1.00 43.25 C ATOM 1151 O GLY A 74 -0.364 -18.679 31.825 1.00 71.22 O ATOM 0 H GLY A 74 1.601 -17.223 29.308 1.00 24.11 H new ATOM 0 HA2 GLY A 74 -0.096 -15.593 31.017 1.00 52.43 H new ATOM 0 HA3 GLY A 74 -0.560 -16.923 29.976 1.00 52.43 H new ATOM 1155 N LEU A 75 0.524 -17.034 33.112 1.00 42.33 N ATOM 1156 CA LEU A 75 0.322 -17.720 34.412 1.00 60.44 C ATOM 1157 C LEU A 75 -0.401 -16.781 35.407 1.00 44.34 C ATOM 1158 O LEU A 75 0.013 -15.633 35.616 1.00 54.52 O ATOM 1159 CB LEU A 75 1.652 -18.279 35.024 1.00 0.13 C ATOM 1160 CG LEU A 75 2.809 -17.265 35.359 1.00 11.35 C ATOM 1161 CD1 LEU A 75 3.847 -17.891 36.322 1.00 20.31 C ATOM 1162 CD2 LEU A 75 3.512 -16.745 34.078 1.00 70.32 C ATOM 0 H LEU A 75 1.033 -16.153 33.188 1.00 42.33 H new ATOM 0 HA LEU A 75 -0.309 -18.588 34.220 1.00 60.44 H new ATOM 0 HB2 LEU A 75 1.398 -18.807 35.943 1.00 0.13 H new ATOM 0 HB3 LEU A 75 2.051 -19.019 34.330 1.00 0.13 H new ATOM 0 HG LEU A 75 2.345 -16.414 35.856 1.00 11.35 H new ATOM 0 HD11 LEU A 75 4.632 -17.165 36.533 1.00 20.31 H new ATOM 0 HD12 LEU A 75 3.355 -18.174 37.253 1.00 20.31 H new ATOM 0 HD13 LEU A 75 4.285 -18.775 35.859 1.00 20.31 H new ATOM 0 HD21 LEU A 75 4.303 -16.048 34.355 1.00 70.32 H new ATOM 0 HD22 LEU A 75 3.942 -17.585 33.533 1.00 70.32 H new ATOM 0 HD23 LEU A 75 2.785 -16.236 33.445 1.00 70.32 H new ATOM 1174 N GLU A 76 -1.492 -17.298 36.002 1.00 41.40 N ATOM 1175 CA GLU A 76 -2.388 -16.539 36.903 1.00 73.52 C ATOM 1176 C GLU A 76 -1.713 -16.158 38.248 1.00 33.12 C ATOM 1177 O GLU A 76 -2.055 -15.133 38.851 1.00 2.30 O ATOM 1178 CB GLU A 76 -3.670 -17.376 37.165 1.00 44.53 C ATOM 1179 CG GLU A 76 -3.407 -18.738 37.846 1.00 3.21 C ATOM 1180 CD GLU A 76 -4.675 -19.573 38.077 1.00 22.22 C ATOM 1181 OE1 GLU A 76 -5.313 -19.426 39.141 1.00 61.34 O ATOM 1182 OE2 GLU A 76 -5.026 -20.397 37.205 1.00 22.33 O ATOM 0 H GLU A 76 -1.782 -18.267 35.871 1.00 41.40 H new ATOM 0 HA GLU A 76 -2.638 -15.601 36.407 1.00 73.52 H new ATOM 0 HB2 GLU A 76 -4.349 -16.795 37.789 1.00 44.53 H new ATOM 0 HB3 GLU A 76 -4.178 -17.549 36.216 1.00 44.53 H new ATOM 0 HG2 GLU A 76 -2.713 -19.312 37.232 1.00 3.21 H new ATOM 0 HG3 GLU A 76 -2.918 -18.565 38.805 1.00 3.21 H new ATOM 1189 N HIS A 77 -0.769 -17.000 38.710 1.00 34.43 N ATOM 1190 CA HIS A 77 -0.060 -16.805 39.998 1.00 71.34 C ATOM 1191 C HIS A 77 1.198 -15.914 39.839 1.00 23.04 C ATOM 1192 O HIS A 77 1.514 -15.453 38.731 1.00 22.35 O ATOM 1193 CB HIS A 77 0.290 -18.185 40.618 1.00 51.33 C ATOM 1194 CG HIS A 77 -0.927 -18.986 41.006 1.00 2.32 C ATOM 1195 ND1 HIS A 77 -1.344 -20.111 40.332 1.00 72.24 N ATOM 1196 CD2 HIS A 77 -1.821 -18.806 42.007 1.00 22.20 C ATOM 1197 CE1 HIS A 77 -2.431 -20.584 40.899 1.00 55.11 C ATOM 1198 NE2 HIS A 77 -2.744 -19.815 41.917 1.00 15.22 N ATOM 0 H HIS A 77 -0.474 -17.835 38.204 1.00 34.43 H new ATOM 0 HA HIS A 77 -0.726 -16.275 40.679 1.00 71.34 H new ATOM 0 HB2 HIS A 77 0.882 -18.758 39.904 1.00 51.33 H new ATOM 0 HB3 HIS A 77 0.913 -18.033 41.499 1.00 51.33 H new ATOM 0 HD2 HIS A 77 -1.809 -18.014 42.741 1.00 22.20 H new ATOM 0 HE1 HIS A 77 -2.977 -21.460 40.581 1.00 55.11 H new ATOM 0 HE2 HIS A 77 -3.542 -19.947 42.538 1.00 15.22 H new ATOM 1207 N HIS A 78 1.902 -15.684 40.973 1.00 42.50 N ATOM 1208 CA HIS A 78 3.035 -14.733 41.069 1.00 15.30 C ATOM 1209 C HIS A 78 4.213 -15.073 40.114 1.00 71.34 C ATOM 1210 O HIS A 78 5.101 -15.862 40.446 1.00 42.05 O ATOM 1211 CB HIS A 78 3.551 -14.642 42.532 1.00 12.21 C ATOM 1212 CG HIS A 78 2.552 -14.113 43.523 1.00 72.13 C ATOM 1213 ND1 HIS A 78 2.010 -14.879 44.530 1.00 54.24 N ATOM 1214 CD2 HIS A 78 2.021 -12.874 43.679 1.00 34.11 C ATOM 1215 CE1 HIS A 78 1.198 -14.143 45.258 1.00 3.15 C ATOM 1216 NE2 HIS A 78 1.187 -12.925 44.765 1.00 23.31 N ATOM 0 H HIS A 78 1.698 -16.157 41.853 1.00 42.50 H new ATOM 0 HA HIS A 78 2.642 -13.767 40.753 1.00 15.30 H new ATOM 0 HB2 HIS A 78 3.868 -15.634 42.852 1.00 12.21 H new ATOM 0 HB3 HIS A 78 4.434 -14.003 42.552 1.00 12.21 H new ATOM 0 HD2 HIS A 78 2.219 -12.010 43.063 1.00 34.11 H new ATOM 0 HE1 HIS A 78 0.636 -14.482 46.115 1.00 3.15 H new ATOM 0 HE2 HIS A 78 0.645 -12.143 45.132 1.00 23.31 H new ATOM 1225 N HIS A 79 4.165 -14.485 38.913 1.00 21.23 N ATOM 1226 CA HIS A 79 5.327 -14.401 37.998 1.00 4.24 C ATOM 1227 C HIS A 79 6.295 -13.310 38.527 1.00 55.33 C ATOM 1228 O HIS A 79 6.181 -12.134 38.172 1.00 3.23 O ATOM 1229 CB HIS A 79 4.861 -14.132 36.526 1.00 74.22 C ATOM 1230 CG HIS A 79 3.656 -13.229 36.399 1.00 34.03 C ATOM 1231 ND1 HIS A 79 2.367 -13.719 36.334 1.00 52.32 N ATOM 1232 CD2 HIS A 79 3.538 -11.880 36.343 1.00 73.23 C ATOM 1233 CE1 HIS A 79 1.520 -12.721 36.244 1.00 13.43 C ATOM 1234 NE2 HIS A 79 2.199 -11.594 36.247 1.00 40.44 N ATOM 0 H HIS A 79 3.321 -14.051 38.540 1.00 21.23 H new ATOM 0 HA HIS A 79 5.859 -15.352 37.975 1.00 4.24 H new ATOM 0 HB2 HIS A 79 5.689 -13.690 35.972 1.00 74.22 H new ATOM 0 HB3 HIS A 79 4.634 -15.087 36.051 1.00 74.22 H new ATOM 0 HD2 HIS A 79 4.346 -11.164 36.369 1.00 73.23 H new ATOM 0 HE1 HIS A 79 0.446 -12.810 36.178 1.00 13.43 H new ATOM 0 HE2 HIS A 79 1.796 -10.659 36.188 1.00 40.44 H new ATOM 1243 N HIS A 80 7.214 -13.738 39.412 1.00 55.42 N ATOM 1244 CA HIS A 80 8.035 -12.846 40.272 1.00 65.40 C ATOM 1245 C HIS A 80 8.934 -11.883 39.450 1.00 14.51 C ATOM 1246 O HIS A 80 10.007 -12.277 38.974 1.00 62.33 O ATOM 1247 CB HIS A 80 8.901 -13.699 41.242 1.00 64.51 C ATOM 1248 CG HIS A 80 8.112 -14.687 42.066 1.00 14.24 C ATOM 1249 ND1 HIS A 80 8.060 -16.034 41.773 1.00 1.41 N ATOM 1250 CD2 HIS A 80 7.345 -14.523 43.173 1.00 61.55 C ATOM 1251 CE1 HIS A 80 7.299 -16.650 42.651 1.00 44.32 C ATOM 1252 NE2 HIS A 80 6.855 -15.760 43.509 1.00 51.23 N ATOM 0 H HIS A 80 7.415 -14.727 39.557 1.00 55.42 H new ATOM 0 HA HIS A 80 7.347 -12.223 40.843 1.00 65.40 H new ATOM 0 HB2 HIS A 80 9.649 -14.241 40.663 1.00 64.51 H new ATOM 0 HB3 HIS A 80 9.440 -13.031 41.914 1.00 64.51 H new ATOM 0 HD2 HIS A 80 7.156 -13.595 43.692 1.00 61.55 H new ATOM 0 HE1 HIS A 80 7.077 -17.707 42.664 1.00 44.32 H new ATOM 0 HE2 HIS A 80 6.242 -15.957 44.300 1.00 51.23 H new ATOM 1261 N HIS A 81 8.422 -10.646 39.234 1.00 41.35 N ATOM 1262 CA HIS A 81 9.134 -9.519 38.568 1.00 14.13 C ATOM 1263 C HIS A 81 9.254 -9.671 37.009 1.00 72.13 C ATOM 1264 O HIS A 81 9.457 -8.661 36.308 1.00 44.54 O ATOM 1265 CB HIS A 81 10.520 -9.263 39.242 1.00 62.03 C ATOM 1266 CG HIS A 81 11.287 -8.092 38.692 1.00 5.10 C ATOM 1267 ND1 HIS A 81 12.411 -8.237 37.914 1.00 1.22 N ATOM 1268 CD2 HIS A 81 11.077 -6.757 38.789 1.00 11.20 C ATOM 1269 CE1 HIS A 81 12.859 -7.057 37.558 1.00 61.45 C ATOM 1270 NE2 HIS A 81 12.069 -6.141 38.073 1.00 5.43 N ATOM 0 H HIS A 81 7.477 -10.395 39.525 1.00 41.35 H new ATOM 0 HA HIS A 81 8.512 -8.636 38.714 1.00 14.13 H new ATOM 0 HB2 HIS A 81 10.365 -9.107 40.310 1.00 62.03 H new ATOM 0 HB3 HIS A 81 11.130 -10.160 39.136 1.00 62.03 H new ATOM 0 HD2 HIS A 81 10.278 -6.270 39.329 1.00 11.20 H new ATOM 0 HE1 HIS A 81 13.729 -6.870 36.946 1.00 61.45 H new ATOM 0 HE2 HIS A 81 12.177 -5.133 37.958 1.00 5.43 H new ATOM 1279 N HIS A 82 9.103 -10.919 36.482 1.00 42.14 N ATOM 1280 CA HIS A 82 9.220 -11.245 35.035 1.00 60.21 C ATOM 1281 C HIS A 82 10.608 -10.847 34.470 1.00 35.11 C ATOM 1282 O HIS A 82 11.093 -11.407 33.478 1.00 4.45 O ATOM 1283 CB HIS A 82 8.051 -10.593 34.231 1.00 2.24 C ATOM 1284 CG HIS A 82 8.099 -10.820 32.740 1.00 40.45 C ATOM 1285 ND1 HIS A 82 8.444 -9.830 31.843 1.00 60.25 N ATOM 1286 CD2 HIS A 82 7.846 -11.923 31.991 1.00 64.33 C ATOM 1287 CE1 HIS A 82 8.402 -10.309 30.620 1.00 32.12 C ATOM 1288 NE2 HIS A 82 8.044 -11.573 30.678 1.00 23.30 N ATOM 0 H HIS A 82 8.894 -11.734 37.058 1.00 42.14 H new ATOM 0 HA HIS A 82 9.138 -12.326 34.922 1.00 60.21 H new ATOM 0 HB2 HIS A 82 7.107 -10.981 34.612 1.00 2.24 H new ATOM 0 HB3 HIS A 82 8.054 -9.520 34.420 1.00 2.24 H new ATOM 0 HD1 HIS A 82 8.694 -8.873 32.091 1.00 60.25 H new ATOM 0 HD2 HIS A 82 7.546 -12.893 32.358 1.00 64.33 H new ATOM 0 HE1 HIS A 82 8.624 -9.757 29.719 1.00 32.12 H new TER 1297 HIS A 82 ATOM 1298 N MET B 1 4.277 -16.764 8.764 1.00 3.44 N ATOM 1299 CA MET B 1 4.145 -15.415 8.199 1.00 25.34 C ATOM 1300 C MET B 1 4.808 -14.350 9.111 1.00 62.10 C ATOM 1301 O MET B 1 4.641 -14.368 10.335 1.00 2.13 O ATOM 1302 CB MET B 1 2.646 -15.078 7.960 1.00 41.23 C ATOM 1303 CG MET B 1 2.387 -13.689 7.345 1.00 51.15 C ATOM 1304 SD MET B 1 3.300 -13.438 5.805 1.00 41.22 S ATOM 1305 CE MET B 1 2.819 -11.773 5.344 1.00 32.22 C ATOM 0 H1 MET B 1 3.823 -17.452 8.130 1.00 3.44 H new ATOM 0 H2 MET B 1 5.285 -17.000 8.867 1.00 3.44 H new ATOM 0 H3 MET B 1 3.817 -16.797 9.696 1.00 3.44 H new ATOM 0 HA MET B 1 4.667 -15.397 7.242 1.00 25.34 H new ATOM 0 HB2 MET B 1 2.218 -15.836 7.304 1.00 41.23 H new ATOM 0 HB3 MET B 1 2.117 -15.143 8.911 1.00 41.23 H new ATOM 0 HG2 MET B 1 1.320 -13.572 7.155 1.00 51.15 H new ATOM 0 HG3 MET B 1 2.670 -12.918 8.062 1.00 51.15 H new ATOM 0 HE1 MET B 1 3.312 -11.497 4.412 1.00 32.22 H new ATOM 0 HE2 MET B 1 1.738 -11.731 5.209 1.00 32.22 H new ATOM 0 HE3 MET B 1 3.114 -11.078 6.130 1.00 32.22 H new ATOM 1315 N ASP B 2 5.557 -13.417 8.487 1.00 32.41 N ATOM 1316 CA ASP B 2 6.206 -12.271 9.171 1.00 53.22 C ATOM 1317 C ASP B 2 5.765 -10.932 8.531 1.00 61.34 C ATOM 1318 O ASP B 2 5.448 -10.878 7.340 1.00 62.54 O ATOM 1319 CB ASP B 2 7.749 -12.408 9.093 1.00 52.11 C ATOM 1320 CG ASP B 2 8.290 -13.573 9.935 1.00 13.44 C ATOM 1321 OD1 ASP B 2 8.570 -13.364 11.135 1.00 3.34 O ATOM 1322 OD2 ASP B 2 8.450 -14.690 9.404 1.00 21.20 O ATOM 0 H ASP B 2 5.732 -13.435 7.482 1.00 32.41 H new ATOM 0 HA ASP B 2 5.898 -12.276 10.216 1.00 53.22 H new ATOM 0 HB2 ASP B 2 8.044 -12.550 8.053 1.00 52.11 H new ATOM 0 HB3 ASP B 2 8.209 -11.479 9.430 1.00 52.11 H new ATOM 1327 N LYS B 3 5.756 -9.848 9.331 1.00 44.14 N ATOM 1328 CA LYS B 3 5.464 -8.485 8.824 1.00 52.20 C ATOM 1329 C LYS B 3 6.716 -7.882 8.137 1.00 13.03 C ATOM 1330 O LYS B 3 6.597 -7.162 7.151 1.00 75.01 O ATOM 1331 CB LYS B 3 4.966 -7.559 9.972 1.00 63.52 C ATOM 1332 CG LYS B 3 4.624 -6.112 9.520 1.00 21.30 C ATOM 1333 CD LYS B 3 4.098 -5.207 10.660 1.00 74.33 C ATOM 1334 CE LYS B 3 2.709 -5.623 11.172 1.00 42.14 C ATOM 1335 NZ LYS B 3 2.230 -4.714 12.237 1.00 24.03 N ATOM 0 H LYS B 3 5.947 -9.886 10.332 1.00 44.14 H new ATOM 0 HA LYS B 3 4.667 -8.561 8.084 1.00 52.20 H new ATOM 0 HB2 LYS B 3 4.081 -8.005 10.425 1.00 63.52 H new ATOM 0 HB3 LYS B 3 5.732 -7.514 10.746 1.00 63.52 H new ATOM 0 HG2 LYS B 3 5.515 -5.656 9.089 1.00 21.30 H new ATOM 0 HG3 LYS B 3 3.875 -6.156 8.729 1.00 21.30 H new ATOM 0 HD2 LYS B 3 4.805 -5.230 11.489 1.00 74.33 H new ATOM 0 HD3 LYS B 3 4.054 -4.177 10.306 1.00 74.33 H new ATOM 0 HE2 LYS B 3 1.999 -5.622 10.345 1.00 42.14 H new ATOM 0 HE3 LYS B 3 2.751 -6.643 11.554 1.00 42.14 H new ATOM 0 HZ1 LYS B 3 1.222 -4.506 12.089 1.00 24.03 H new ATOM 0 HZ2 LYS B 3 2.357 -5.168 13.164 1.00 24.03 H new ATOM 0 HZ3 LYS B 3 2.774 -3.828 12.208 1.00 24.03 H new ATOM 1349 N LYS B 4 7.919 -8.232 8.651 1.00 62.21 N ATOM 1350 CA LYS B 4 9.218 -7.733 8.111 1.00 13.50 C ATOM 1351 C LYS B 4 9.479 -8.136 6.625 1.00 40.13 C ATOM 1352 O LYS B 4 10.417 -7.622 6.006 1.00 3.23 O ATOM 1353 CB LYS B 4 10.406 -8.175 9.009 1.00 1.44 C ATOM 1354 CG LYS B 4 10.569 -9.700 9.202 1.00 4.14 C ATOM 1355 CD LYS B 4 11.880 -10.048 9.947 1.00 73.31 C ATOM 1356 CE LYS B 4 12.015 -11.543 10.267 1.00 4.24 C ATOM 1357 NZ LYS B 4 11.003 -11.994 11.253 1.00 13.33 N ATOM 0 H LYS B 4 8.022 -8.863 9.446 1.00 62.21 H new ATOM 0 HA LYS B 4 9.142 -6.646 8.126 1.00 13.50 H new ATOM 0 HB2 LYS B 4 11.328 -7.781 8.581 1.00 1.44 H new ATOM 0 HB3 LYS B 4 10.288 -7.714 9.990 1.00 1.44 H new ATOM 0 HG2 LYS B 4 9.718 -10.088 9.762 1.00 4.14 H new ATOM 0 HG3 LYS B 4 10.562 -10.192 8.230 1.00 4.14 H new ATOM 0 HD2 LYS B 4 12.729 -9.735 9.340 1.00 73.31 H new ATOM 0 HD3 LYS B 4 11.925 -9.479 10.876 1.00 73.31 H new ATOM 0 HE2 LYS B 4 11.909 -12.121 9.349 1.00 4.24 H new ATOM 0 HE3 LYS B 4 13.014 -11.742 10.656 1.00 4.24 H new ATOM 0 HZ1 LYS B 4 11.482 -12.339 12.109 1.00 13.33 H new ATOM 0 HZ2 LYS B 4 10.381 -11.198 11.501 1.00 13.33 H new ATOM 0 HZ3 LYS B 4 10.435 -12.762 10.841 1.00 13.33 H new ATOM 1371 N ILE B 5 8.678 -9.086 6.090 1.00 61.10 N ATOM 1372 CA ILE B 5 8.694 -9.462 4.650 1.00 35.40 C ATOM 1373 C ILE B 5 8.454 -8.226 3.736 1.00 31.23 C ATOM 1374 O ILE B 5 9.179 -8.023 2.755 1.00 20.15 O ATOM 1375 CB ILE B 5 7.613 -10.572 4.339 1.00 75.41 C ATOM 1376 CG1 ILE B 5 7.864 -11.844 5.218 1.00 22.23 C ATOM 1377 CG2 ILE B 5 7.579 -10.938 2.826 1.00 43.14 C ATOM 1378 CD1 ILE B 5 6.826 -12.952 5.066 1.00 22.22 C ATOM 0 H ILE B 5 8.002 -9.615 6.640 1.00 61.10 H new ATOM 0 HA ILE B 5 9.684 -9.864 4.436 1.00 35.40 H new ATOM 0 HB ILE B 5 6.635 -10.162 4.593 1.00 75.41 H new ATOM 0 HG12 ILE B 5 8.845 -12.250 4.970 1.00 22.23 H new ATOM 0 HG13 ILE B 5 7.899 -11.542 6.265 1.00 22.23 H new ATOM 0 HG21 ILE B 5 6.823 -11.704 2.654 1.00 43.14 H new ATOM 0 HG22 ILE B 5 7.335 -10.050 2.242 1.00 43.14 H new ATOM 0 HG23 ILE B 5 8.555 -11.316 2.521 1.00 43.14 H new ATOM 0 HD11 ILE B 5 7.088 -13.788 5.715 1.00 22.22 H new ATOM 0 HD12 ILE B 5 5.844 -12.571 5.345 1.00 22.22 H new ATOM 0 HD13 ILE B 5 6.804 -13.290 4.030 1.00 22.22 H new ATOM 1390 N VAL B 6 7.441 -7.393 4.086 1.00 24.24 N ATOM 1391 CA VAL B 6 7.161 -6.131 3.347 1.00 62.10 C ATOM 1392 C VAL B 6 8.315 -5.115 3.524 1.00 64.42 C ATOM 1393 O VAL B 6 8.500 -4.249 2.680 1.00 61.24 O ATOM 1394 CB VAL B 6 5.783 -5.462 3.745 1.00 61.31 C ATOM 1395 CG1 VAL B 6 4.613 -6.461 3.585 1.00 23.22 C ATOM 1396 CG2 VAL B 6 5.809 -4.848 5.170 1.00 50.50 C ATOM 0 H VAL B 6 6.809 -7.568 4.867 1.00 24.24 H new ATOM 0 HA VAL B 6 7.084 -6.413 2.297 1.00 62.10 H new ATOM 0 HB VAL B 6 5.622 -4.635 3.053 1.00 61.31 H new ATOM 0 HG11 VAL B 6 3.679 -5.975 3.865 1.00 23.22 H new ATOM 0 HG12 VAL B 6 4.554 -6.789 2.547 1.00 23.22 H new ATOM 0 HG13 VAL B 6 4.781 -7.324 4.230 1.00 23.22 H new ATOM 0 HG21 VAL B 6 4.839 -4.403 5.392 1.00 50.50 H new ATOM 0 HG22 VAL B 6 6.025 -5.629 5.899 1.00 50.50 H new ATOM 0 HG23 VAL B 6 6.581 -4.080 5.221 1.00 50.50 H new ATOM 1406 N GLY B 7 9.061 -5.237 4.649 1.00 44.53 N ATOM 1407 CA GLY B 7 10.271 -4.437 4.898 1.00 2.32 C ATOM 1408 C GLY B 7 11.423 -4.770 3.945 1.00 43.52 C ATOM 1409 O GLY B 7 12.154 -3.876 3.505 1.00 63.13 O ATOM 0 H GLY B 7 8.838 -5.890 5.400 1.00 44.53 H new ATOM 0 HA2 GLY B 7 10.025 -3.379 4.804 1.00 2.32 H new ATOM 0 HA3 GLY B 7 10.600 -4.598 5.925 1.00 2.32 H new ATOM 1413 N ALA B 8 11.581 -6.071 3.632 1.00 71.42 N ATOM 1414 CA ALA B 8 12.547 -6.551 2.615 1.00 21.35 C ATOM 1415 C ALA B 8 12.164 -6.038 1.200 1.00 33.42 C ATOM 1416 O ALA B 8 13.026 -5.634 0.407 1.00 22.23 O ATOM 1417 CB ALA B 8 12.616 -8.088 2.637 1.00 63.53 C ATOM 0 H ALA B 8 11.046 -6.819 4.073 1.00 71.42 H new ATOM 0 HA ALA B 8 13.532 -6.153 2.858 1.00 21.35 H new ATOM 0 HB1 ALA B 8 13.328 -8.431 1.887 1.00 63.53 H new ATOM 0 HB2 ALA B 8 12.938 -8.424 3.623 1.00 63.53 H new ATOM 0 HB3 ALA B 8 11.631 -8.500 2.417 1.00 63.53 H new ATOM 1423 N ASN B 9 10.848 -6.053 0.917 1.00 10.35 N ATOM 1424 CA ASN B 9 10.274 -5.521 -0.339 1.00 21.25 C ATOM 1425 C ASN B 9 10.354 -3.972 -0.393 1.00 42.24 C ATOM 1426 O ASN B 9 10.484 -3.396 -1.470 1.00 2.25 O ATOM 1427 CB ASN B 9 8.800 -5.989 -0.486 1.00 74.12 C ATOM 1428 CG ASN B 9 8.649 -7.515 -0.533 1.00 74.05 C ATOM 1429 OD1 ASN B 9 9.531 -8.228 -1.000 1.00 41.42 O ATOM 1430 ND2 ASN B 9 7.528 -8.026 -0.062 1.00 61.35 N ATOM 0 H ASN B 9 10.148 -6.435 1.553 1.00 10.35 H new ATOM 0 HA ASN B 9 10.862 -5.911 -1.170 1.00 21.25 H new ATOM 0 HB2 ASN B 9 8.217 -5.599 0.349 1.00 74.12 H new ATOM 0 HB3 ASN B 9 8.379 -5.561 -1.396 1.00 74.12 H new ATOM 0 HD21 ASN B 9 7.380 -9.035 -0.081 1.00 61.35 H new ATOM 0 HD22 ASN B 9 6.809 -7.412 0.321 1.00 61.35 H new ATOM 1437 N ALA B 10 10.300 -3.313 0.783 1.00 30.01 N ATOM 1438 CA ALA B 10 10.318 -1.833 0.897 1.00 63.13 C ATOM 1439 C ALA B 10 11.739 -1.266 0.688 1.00 45.41 C ATOM 1440 O ALA B 10 11.913 -0.194 0.098 1.00 10.44 O ATOM 1441 CB ALA B 10 9.755 -1.400 2.257 1.00 52.10 C ATOM 0 H ALA B 10 10.243 -3.789 1.683 1.00 30.01 H new ATOM 0 HA ALA B 10 9.685 -1.426 0.108 1.00 63.13 H new ATOM 0 HB1 ALA B 10 9.773 -0.313 2.329 1.00 52.10 H new ATOM 0 HB2 ALA B 10 8.728 -1.753 2.355 1.00 52.10 H new ATOM 0 HB3 ALA B 10 10.363 -1.827 3.055 1.00 52.10 H new ATOM 1447 N GLY B 11 12.748 -2.013 1.182 1.00 63.53 N ATOM 1448 CA GLY B 11 14.161 -1.700 0.918 1.00 41.31 C ATOM 1449 C GLY B 11 14.523 -1.822 -0.568 1.00 42.10 C ATOM 1450 O GLY B 11 15.401 -1.113 -1.072 1.00 1.12 O ATOM 0 H GLY B 11 12.606 -2.837 1.766 1.00 63.53 H new ATOM 0 HA2 GLY B 11 14.375 -0.687 1.259 1.00 41.31 H new ATOM 0 HA3 GLY B 11 14.793 -2.372 1.499 1.00 41.31 H new ATOM 1454 N LYS B 12 13.829 -2.742 -1.260 1.00 1.13 N ATOM 1455 CA LYS B 12 13.961 -2.950 -2.711 1.00 32.33 C ATOM 1456 C LYS B 12 13.310 -1.798 -3.526 1.00 64.53 C ATOM 1457 O LYS B 12 13.964 -1.190 -4.387 1.00 73.01 O ATOM 1458 CB LYS B 12 13.322 -4.314 -3.078 1.00 2.41 C ATOM 1459 CG LYS B 12 13.312 -4.656 -4.585 1.00 0.11 C ATOM 1460 CD LYS B 12 12.648 -6.025 -4.907 1.00 52.12 C ATOM 1461 CE LYS B 12 13.558 -7.253 -4.660 1.00 24.23 C ATOM 1462 NZ LYS B 12 13.968 -7.415 -3.241 1.00 12.45 N ATOM 0 H LYS B 12 13.154 -3.368 -0.822 1.00 1.13 H new ATOM 0 HA LYS B 12 15.020 -2.953 -2.969 1.00 32.33 H new ATOM 0 HB2 LYS B 12 13.857 -5.101 -2.547 1.00 2.41 H new ATOM 0 HB3 LYS B 12 12.295 -4.325 -2.713 1.00 2.41 H new ATOM 0 HG2 LYS B 12 12.784 -3.870 -5.124 1.00 0.11 H new ATOM 0 HG3 LYS B 12 14.337 -4.663 -4.955 1.00 0.11 H new ATOM 0 HD2 LYS B 12 11.747 -6.129 -4.302 1.00 52.12 H new ATOM 0 HD3 LYS B 12 12.333 -6.026 -5.951 1.00 52.12 H new ATOM 0 HE2 LYS B 12 13.035 -8.153 -4.983 1.00 24.23 H new ATOM 0 HE3 LYS B 12 14.451 -7.163 -5.279 1.00 24.23 H new ATOM 0 HZ1 LYS B 12 14.176 -8.416 -3.052 1.00 12.45 H new ATOM 0 HZ2 LYS B 12 14.818 -6.845 -3.058 1.00 12.45 H new ATOM 0 HZ3 LYS B 12 13.198 -7.098 -2.619 1.00 12.45 H new ATOM 1476 N VAL B 13 12.023 -1.488 -3.226 1.00 35.04 N ATOM 1477 CA VAL B 13 11.241 -0.491 -4.005 1.00 74.14 C ATOM 1478 C VAL B 13 11.764 0.950 -3.814 1.00 41.51 C ATOM 1479 O VAL B 13 11.767 1.735 -4.770 1.00 23.31 O ATOM 1480 CB VAL B 13 9.681 -0.551 -3.714 1.00 34.12 C ATOM 1481 CG1 VAL B 13 9.094 -1.942 -4.062 1.00 31.42 C ATOM 1482 CG2 VAL B 13 9.345 -0.157 -2.256 1.00 1.54 C ATOM 0 H VAL B 13 11.506 -1.911 -2.455 1.00 35.04 H new ATOM 0 HA VAL B 13 11.389 -0.773 -5.047 1.00 74.14 H new ATOM 0 HB VAL B 13 9.211 0.186 -4.365 1.00 34.12 H new ATOM 0 HG11 VAL B 13 8.025 -1.949 -3.851 1.00 31.42 H new ATOM 0 HG12 VAL B 13 9.257 -2.151 -5.119 1.00 31.42 H new ATOM 0 HG13 VAL B 13 9.587 -2.706 -3.461 1.00 31.42 H new ATOM 0 HG21 VAL B 13 8.267 -0.213 -2.103 1.00 1.54 H new ATOM 0 HG22 VAL B 13 9.844 -0.841 -1.570 1.00 1.54 H new ATOM 0 HG23 VAL B 13 9.686 0.861 -2.066 1.00 1.54 H new ATOM 1492 N TRP B 14 12.219 1.292 -2.586 1.00 62.40 N ATOM 1493 CA TRP B 14 12.742 2.644 -2.297 1.00 31.53 C ATOM 1494 C TRP B 14 14.140 2.862 -2.907 1.00 50.41 C ATOM 1495 O TRP B 14 14.479 3.982 -3.261 1.00 71.05 O ATOM 1496 CB TRP B 14 12.759 2.986 -0.788 1.00 53.35 C ATOM 1497 CG TRP B 14 12.917 4.479 -0.547 1.00 72.24 C ATOM 1498 CD1 TRP B 14 11.936 5.430 -0.585 1.00 35.22 C ATOM 1499 CD2 TRP B 14 14.135 5.185 -0.298 1.00 71.13 C ATOM 1500 NE1 TRP B 14 12.475 6.672 -0.381 1.00 33.23 N ATOM 1501 CE2 TRP B 14 13.823 6.546 -0.194 1.00 54.21 C ATOM 1502 CE3 TRP B 14 15.452 4.780 -0.156 1.00 24.21 C ATOM 1503 CZ2 TRP B 14 14.790 7.515 0.052 1.00 23.13 C ATOM 1504 CZ3 TRP B 14 16.421 5.734 0.088 1.00 31.02 C ATOM 1505 CH2 TRP B 14 16.084 7.090 0.193 1.00 43.21 C ATOM 0 H TRP B 14 12.234 0.656 -1.788 1.00 62.40 H new ATOM 0 HA TRP B 14 12.041 3.329 -2.773 1.00 31.53 H new ATOM 0 HB2 TRP B 14 11.834 2.640 -0.327 1.00 53.35 H new ATOM 0 HB3 TRP B 14 13.576 2.452 -0.304 1.00 53.35 H new ATOM 0 HD1 TRP B 14 10.888 5.231 -0.752 1.00 35.22 H new ATOM 0 HE1 TRP B 14 11.955 7.549 -0.370 1.00 33.23 H new ATOM 0 HE3 TRP B 14 15.717 3.736 -0.235 1.00 24.21 H new ATOM 0 HZ2 TRP B 14 14.531 8.561 0.129 1.00 23.13 H new ATOM 0 HZ3 TRP B 14 17.452 5.431 0.199 1.00 31.02 H new ATOM 0 HH2 TRP B 14 16.861 7.815 0.389 1.00 43.21 H new ATOM 1516 N HIS B 15 14.965 1.806 -2.991 1.00 31.34 N ATOM 1517 CA HIS B 15 16.276 1.892 -3.686 1.00 61.34 C ATOM 1518 C HIS B 15 16.072 2.166 -5.205 1.00 72.24 C ATOM 1519 O HIS B 15 16.871 2.865 -5.839 1.00 53.01 O ATOM 1520 CB HIS B 15 17.097 0.601 -3.453 1.00 13.13 C ATOM 1521 CG HIS B 15 18.506 0.664 -3.993 1.00 70.25 C ATOM 1522 ND1 HIS B 15 19.494 1.445 -3.428 1.00 32.31 N ATOM 1523 CD2 HIS B 15 19.086 0.063 -5.062 1.00 43.25 C ATOM 1524 CE1 HIS B 15 20.606 1.320 -4.120 1.00 11.10 C ATOM 1525 NE2 HIS B 15 20.386 0.491 -5.113 1.00 51.04 N ATOM 0 H HIS B 15 14.758 0.889 -2.594 1.00 31.34 H new ATOM 0 HA HIS B 15 16.839 2.727 -3.269 1.00 61.34 H new ATOM 0 HB2 HIS B 15 17.138 0.396 -2.383 1.00 13.13 H new ATOM 0 HB3 HIS B 15 16.578 -0.237 -3.918 1.00 13.13 H new ATOM 0 HD2 HIS B 15 18.611 -0.625 -5.746 1.00 43.25 H new ATOM 0 HE1 HIS B 15 21.541 1.816 -3.907 1.00 11.10 H new ATOM 0 HE2 HIS B 15 21.074 0.210 -5.812 1.00 51.04 H new ATOM 1534 N ALA B 16 14.973 1.612 -5.751 1.00 14.40 N ATOM 1535 CA ALA B 16 14.524 1.863 -7.138 1.00 43.12 C ATOM 1536 C ALA B 16 14.007 3.318 -7.330 1.00 73.25 C ATOM 1537 O ALA B 16 14.137 3.890 -8.418 1.00 60.01 O ATOM 1538 CB ALA B 16 13.437 0.848 -7.507 1.00 34.24 C ATOM 0 H ALA B 16 14.365 0.972 -5.240 1.00 14.40 H new ATOM 0 HA ALA B 16 15.380 1.744 -7.803 1.00 43.12 H new ATOM 0 HB1 ALA B 16 13.102 1.028 -8.529 1.00 34.24 H new ATOM 0 HB2 ALA B 16 13.841 -0.162 -7.430 1.00 34.24 H new ATOM 0 HB3 ALA B 16 12.593 0.954 -6.825 1.00 34.24 H new ATOM 1544 N LEU B 17 13.406 3.882 -6.260 1.00 2.34 N ATOM 1545 CA LEU B 17 12.975 5.305 -6.202 1.00 1.01 C ATOM 1546 C LEU B 17 14.193 6.252 -6.116 1.00 43.43 C ATOM 1547 O LEU B 17 14.265 7.255 -6.822 1.00 21.44 O ATOM 1548 CB LEU B 17 12.060 5.527 -4.970 1.00 61.15 C ATOM 1549 CG LEU B 17 10.656 4.856 -5.032 1.00 71.41 C ATOM 1550 CD1 LEU B 17 9.983 4.844 -3.640 1.00 34.24 C ATOM 1551 CD2 LEU B 17 9.770 5.560 -6.086 1.00 71.14 C ATOM 0 H LEU B 17 13.203 3.364 -5.405 1.00 2.34 H new ATOM 0 HA LEU B 17 12.425 5.531 -7.116 1.00 1.01 H new ATOM 0 HB2 LEU B 17 12.579 5.157 -4.086 1.00 61.15 H new ATOM 0 HB3 LEU B 17 11.922 6.600 -4.833 1.00 61.15 H new ATOM 0 HG LEU B 17 10.782 3.817 -5.338 1.00 71.41 H new ATOM 0 HD11 LEU B 17 9.004 4.370 -3.713 1.00 34.24 H new ATOM 0 HD12 LEU B 17 10.605 4.286 -2.940 1.00 34.24 H new ATOM 0 HD13 LEU B 17 9.865 5.867 -3.284 1.00 34.24 H new ATOM 0 HD21 LEU B 17 8.792 5.080 -6.118 1.00 71.14 H new ATOM 0 HD22 LEU B 17 9.651 6.610 -5.818 1.00 71.14 H new ATOM 0 HD23 LEU B 17 10.242 5.487 -7.066 1.00 71.14 H new ATOM 1563 N ASN B 18 15.147 5.914 -5.227 1.00 50.01 N ATOM 1564 CA ASN B 18 16.385 6.699 -4.999 1.00 22.05 C ATOM 1565 C ASN B 18 17.255 6.731 -6.282 1.00 74.43 C ATOM 1566 O ASN B 18 18.046 7.655 -6.500 1.00 33.34 O ATOM 1567 CB ASN B 18 17.161 6.104 -3.792 1.00 34.43 C ATOM 1568 CG ASN B 18 18.346 6.965 -3.351 1.00 20.31 C ATOM 1569 OD1 ASN B 18 19.470 6.772 -3.791 1.00 14.31 O ATOM 1570 ND2 ASN B 18 18.095 7.942 -2.498 1.00 10.41 N ATOM 0 H ASN B 18 15.084 5.082 -4.640 1.00 50.01 H new ATOM 0 HA ASN B 18 16.123 7.730 -4.763 1.00 22.05 H new ATOM 0 HB2 ASN B 18 16.476 5.983 -2.953 1.00 34.43 H new ATOM 0 HB3 ASN B 18 17.521 5.110 -4.055 1.00 34.43 H new ATOM 0 HD21 ASN B 18 18.848 8.557 -2.191 1.00 10.41 H new ATOM 0 HD22 ASN B 18 17.148 8.081 -2.146 1.00 10.41 H new ATOM 1577 N GLU B 19 17.076 5.703 -7.129 1.00 24.30 N ATOM 1578 CA GLU B 19 17.637 5.661 -8.483 1.00 21.13 C ATOM 1579 C GLU B 19 16.823 6.577 -9.436 1.00 21.23 C ATOM 1580 O GLU B 19 17.385 7.449 -10.106 1.00 11.21 O ATOM 1581 CB GLU B 19 17.617 4.204 -9.001 1.00 51.44 C ATOM 1582 CG GLU B 19 18.150 4.033 -10.434 1.00 54.32 C ATOM 1583 CD GLU B 19 18.060 2.588 -10.925 1.00 11.33 C ATOM 1584 OE1 GLU B 19 19.010 1.807 -10.691 1.00 74.11 O ATOM 1585 OE2 GLU B 19 17.032 2.218 -11.532 1.00 11.35 O ATOM 0 H GLU B 19 16.533 4.874 -6.888 1.00 24.30 H new ATOM 0 HA GLU B 19 18.665 6.022 -8.455 1.00 21.13 H new ATOM 0 HB2 GLU B 19 18.210 3.584 -8.329 1.00 51.44 H new ATOM 0 HB3 GLU B 19 16.594 3.830 -8.960 1.00 51.44 H new ATOM 0 HG2 GLU B 19 17.585 4.678 -11.107 1.00 54.32 H new ATOM 0 HG3 GLU B 19 19.188 4.362 -10.473 1.00 54.32 H new ATOM 1592 N ALA B 20 15.487 6.369 -9.463 1.00 41.03 N ATOM 1593 CA ALA B 20 14.561 7.083 -10.375 1.00 33.43 C ATOM 1594 C ALA B 20 13.132 7.129 -9.777 1.00 0.13 C ATOM 1595 O ALA B 20 12.386 6.139 -9.843 1.00 31.32 O ATOM 1596 CB ALA B 20 14.561 6.414 -11.767 1.00 32.34 C ATOM 0 H ALA B 20 15.018 5.700 -8.852 1.00 41.03 H new ATOM 0 HA ALA B 20 14.906 8.110 -10.491 1.00 33.43 H new ATOM 0 HB1 ALA B 20 13.877 6.948 -12.427 1.00 32.34 H new ATOM 0 HB2 ALA B 20 15.567 6.444 -12.185 1.00 32.34 H new ATOM 0 HB3 ALA B 20 14.239 5.377 -11.672 1.00 32.34 H new ATOM 1602 N ASP B 21 12.775 8.273 -9.163 1.00 74.40 N ATOM 1603 CA ASP B 21 11.443 8.498 -8.548 1.00 53.42 C ATOM 1604 C ASP B 21 10.512 9.289 -9.496 1.00 12.52 C ATOM 1605 O ASP B 21 10.898 9.633 -10.626 1.00 24.33 O ATOM 1606 CB ASP B 21 11.591 9.214 -7.179 1.00 23.13 C ATOM 1607 CG ASP B 21 12.159 10.638 -7.286 1.00 55.54 C ATOM 1608 OD1 ASP B 21 13.373 10.780 -7.543 1.00 10.11 O ATOM 1609 OD2 ASP B 21 11.399 11.618 -7.103 1.00 35.32 O ATOM 0 H ASP B 21 13.401 9.073 -9.077 1.00 74.40 H new ATOM 0 HA ASP B 21 10.981 7.526 -8.376 1.00 53.42 H new ATOM 0 HB2 ASP B 21 10.616 9.257 -6.694 1.00 23.13 H new ATOM 0 HB3 ASP B 21 12.241 8.620 -6.537 1.00 23.13 H new ATOM 1614 N GLY B 22 9.285 9.570 -9.025 1.00 74.22 N ATOM 1615 CA GLY B 22 8.241 10.158 -9.872 1.00 31.33 C ATOM 1616 C GLY B 22 7.652 9.134 -10.835 1.00 32.31 C ATOM 1617 O GLY B 22 7.329 9.447 -11.984 1.00 23.02 O ATOM 0 H GLY B 22 8.995 9.398 -8.062 1.00 74.22 H new ATOM 0 HA2 GLY B 22 7.448 10.564 -9.243 1.00 31.33 H new ATOM 0 HA3 GLY B 22 8.658 10.991 -10.437 1.00 31.33 H new ATOM 1621 N ILE B 23 7.513 7.894 -10.335 1.00 21.51 N ATOM 1622 CA ILE B 23 7.190 6.712 -11.150 1.00 65.20 C ATOM 1623 C ILE B 23 5.899 6.018 -10.650 1.00 13.42 C ATOM 1624 O ILE B 23 5.663 5.911 -9.441 1.00 74.32 O ATOM 1625 CB ILE B 23 8.416 5.719 -11.150 1.00 73.43 C ATOM 1626 CG1 ILE B 23 8.153 4.484 -12.063 1.00 71.32 C ATOM 1627 CG2 ILE B 23 8.809 5.290 -9.712 1.00 44.21 C ATOM 1628 CD1 ILE B 23 9.327 3.532 -12.195 1.00 15.42 C ATOM 0 H ILE B 23 7.623 7.683 -9.343 1.00 21.51 H new ATOM 0 HA ILE B 23 7.000 7.033 -12.174 1.00 65.20 H new ATOM 0 HB ILE B 23 9.266 6.259 -11.568 1.00 73.43 H new ATOM 0 HG12 ILE B 23 7.299 3.933 -11.669 1.00 71.32 H new ATOM 0 HG13 ILE B 23 7.875 4.836 -13.056 1.00 71.32 H new ATOM 0 HG21 ILE B 23 9.657 4.606 -9.755 1.00 44.21 H new ATOM 0 HG22 ILE B 23 9.082 6.171 -9.131 1.00 44.21 H new ATOM 0 HG23 ILE B 23 7.964 4.791 -9.238 1.00 44.21 H new ATOM 0 HD11 ILE B 23 9.052 2.704 -12.848 1.00 15.42 H new ATOM 0 HD12 ILE B 23 10.179 4.062 -12.620 1.00 15.42 H new ATOM 0 HD13 ILE B 23 9.594 3.145 -11.212 1.00 15.42 H new ATOM 1640 N SER B 24 5.069 5.566 -11.609 1.00 64.33 N ATOM 1641 CA SER B 24 3.779 4.886 -11.341 1.00 54.14 C ATOM 1642 C SER B 24 3.986 3.546 -10.608 1.00 72.04 C ATOM 1643 O SER B 24 5.015 2.898 -10.806 1.00 71.54 O ATOM 1644 CB SER B 24 3.043 4.635 -12.676 1.00 34.51 C ATOM 1645 OG SER B 24 2.883 5.828 -13.428 1.00 22.14 O ATOM 0 H SER B 24 5.274 5.662 -12.604 1.00 64.33 H new ATOM 0 HA SER B 24 3.183 5.533 -10.698 1.00 54.14 H new ATOM 0 HB2 SER B 24 3.600 3.907 -13.266 1.00 34.51 H new ATOM 0 HB3 SER B 24 2.064 4.200 -12.474 1.00 34.51 H new ATOM 0 HG SER B 24 2.593 5.605 -14.337 1.00 22.14 H new ATOM 1651 N ILE B 25 2.987 3.126 -9.799 1.00 72.23 N ATOM 1652 CA ILE B 25 3.038 1.849 -9.033 1.00 61.33 C ATOM 1653 C ILE B 25 3.346 0.599 -9.947 1.00 50.10 C ATOM 1654 O ILE B 25 4.238 -0.183 -9.604 1.00 70.31 O ATOM 1655 CB ILE B 25 1.707 1.586 -8.209 1.00 1.12 C ATOM 1656 CG1 ILE B 25 1.354 2.797 -7.285 1.00 2.53 C ATOM 1657 CG2 ILE B 25 1.805 0.269 -7.387 1.00 23.22 C ATOM 1658 CD1 ILE B 25 0.056 2.652 -6.491 1.00 55.14 C ATOM 0 H ILE B 25 2.127 3.655 -9.656 1.00 72.23 H new ATOM 0 HA ILE B 25 3.865 1.971 -8.333 1.00 61.33 H new ATOM 0 HB ILE B 25 0.896 1.474 -8.929 1.00 1.12 H new ATOM 0 HG12 ILE B 25 2.175 2.950 -6.584 1.00 2.53 H new ATOM 0 HG13 ILE B 25 1.287 3.695 -7.899 1.00 2.53 H new ATOM 0 HG21 ILE B 25 0.879 0.116 -6.833 1.00 23.22 H new ATOM 0 HG22 ILE B 25 1.967 -0.571 -8.063 1.00 23.22 H new ATOM 0 HG23 ILE B 25 2.638 0.338 -6.688 1.00 23.22 H new ATOM 0 HD11 ILE B 25 -0.099 3.542 -5.882 1.00 55.14 H new ATOM 0 HD12 ILE B 25 -0.780 2.533 -7.180 1.00 55.14 H new ATOM 0 HD13 ILE B 25 0.121 1.777 -5.844 1.00 55.14 H new ATOM 1670 N PRO B 26 2.630 0.377 -11.128 1.00 64.23 N ATOM 1671 CA PRO B 26 2.904 -0.796 -12.008 1.00 73.15 C ATOM 1672 C PRO B 26 4.260 -0.727 -12.776 1.00 72.02 C ATOM 1673 O PRO B 26 4.824 -1.766 -13.114 1.00 54.35 O ATOM 1674 CB PRO B 26 1.697 -0.796 -12.990 1.00 62.43 C ATOM 1675 CG PRO B 26 1.294 0.642 -13.077 1.00 5.40 C ATOM 1676 CD PRO B 26 1.497 1.190 -11.677 1.00 53.13 C ATOM 0 HA PRO B 26 3.003 -1.709 -11.421 1.00 73.15 H new ATOM 0 HB2 PRO B 26 1.978 -1.190 -13.966 1.00 62.43 H new ATOM 0 HB3 PRO B 26 0.881 -1.416 -12.618 1.00 62.43 H new ATOM 0 HG2 PRO B 26 1.903 1.180 -13.804 1.00 5.40 H new ATOM 0 HG3 PRO B 26 0.256 0.743 -13.394 1.00 5.40 H new ATOM 0 HD2 PRO B 26 1.741 2.252 -11.696 1.00 53.13 H new ATOM 0 HD3 PRO B 26 0.597 1.080 -11.071 1.00 53.13 H new ATOM 1684 N GLU B 27 4.780 0.491 -13.023 1.00 22.02 N ATOM 1685 CA GLU B 27 6.066 0.686 -13.751 1.00 15.21 C ATOM 1686 C GLU B 27 7.245 0.394 -12.808 1.00 64.12 C ATOM 1687 O GLU B 27 8.254 -0.222 -13.173 1.00 13.53 O ATOM 1688 CB GLU B 27 6.158 2.139 -14.281 1.00 41.41 C ATOM 1689 CG GLU B 27 7.368 2.418 -15.204 1.00 72.40 C ATOM 1690 CD GLU B 27 7.387 1.542 -16.478 1.00 25.12 C ATOM 1691 OE1 GLU B 27 6.628 1.844 -17.427 1.00 21.40 O ATOM 1692 OE2 GLU B 27 8.154 0.552 -16.532 1.00 34.55 O ATOM 0 H GLU B 27 4.334 1.361 -12.732 1.00 22.02 H new ATOM 0 HA GLU B 27 6.107 -0.001 -14.596 1.00 15.21 H new ATOM 0 HB2 GLU B 27 5.243 2.371 -14.826 1.00 41.41 H new ATOM 0 HB3 GLU B 27 6.204 2.819 -13.430 1.00 41.41 H new ATOM 0 HG2 GLU B 27 7.358 3.468 -15.495 1.00 72.40 H new ATOM 0 HG3 GLU B 27 8.288 2.251 -14.644 1.00 72.40 H new ATOM 1699 N LEU B 28 7.072 0.889 -11.589 1.00 24.45 N ATOM 1700 CA LEU B 28 7.936 0.624 -10.440 1.00 4.00 C ATOM 1701 C LEU B 28 7.947 -0.885 -10.100 1.00 45.11 C ATOM 1702 O LEU B 28 9.001 -1.448 -9.822 1.00 45.32 O ATOM 1703 CB LEU B 28 7.397 1.482 -9.276 1.00 0.31 C ATOM 1704 CG LEU B 28 8.103 1.379 -7.900 1.00 24.23 C ATOM 1705 CD1 LEU B 28 9.595 1.789 -7.972 1.00 70.04 C ATOM 1706 CD2 LEU B 28 7.317 2.214 -6.866 1.00 40.04 C ATOM 0 H LEU B 28 6.296 1.511 -11.362 1.00 24.45 H new ATOM 0 HA LEU B 28 8.973 0.889 -10.649 1.00 4.00 H new ATOM 0 HB2 LEU B 28 7.429 2.526 -9.589 1.00 0.31 H new ATOM 0 HB3 LEU B 28 6.348 1.225 -9.132 1.00 0.31 H new ATOM 0 HG LEU B 28 8.105 0.336 -7.583 1.00 24.23 H new ATOM 0 HD11 LEU B 28 10.045 1.700 -6.983 1.00 70.04 H new ATOM 0 HD12 LEU B 28 10.119 1.135 -8.669 1.00 70.04 H new ATOM 0 HD13 LEU B 28 9.673 2.821 -8.314 1.00 70.04 H new ATOM 0 HD21 LEU B 28 7.808 2.146 -5.895 1.00 40.04 H new ATOM 0 HD22 LEU B 28 7.288 3.256 -7.186 1.00 40.04 H new ATOM 0 HD23 LEU B 28 6.300 1.830 -6.786 1.00 40.04 H new ATOM 1718 N ALA B 29 6.758 -1.523 -10.192 1.00 24.31 N ATOM 1719 CA ALA B 29 6.585 -2.987 -9.986 1.00 20.12 C ATOM 1720 C ALA B 29 7.443 -3.818 -10.977 1.00 40.30 C ATOM 1721 O ALA B 29 7.971 -4.876 -10.620 1.00 35.23 O ATOM 1722 CB ALA B 29 5.100 -3.374 -10.101 1.00 73.20 C ATOM 0 H ALA B 29 5.887 -1.040 -10.411 1.00 24.31 H new ATOM 0 HA ALA B 29 6.935 -3.219 -8.980 1.00 20.12 H new ATOM 0 HB1 ALA B 29 4.991 -4.448 -9.948 1.00 73.20 H new ATOM 0 HB2 ALA B 29 4.525 -2.839 -9.345 1.00 73.20 H new ATOM 0 HB3 ALA B 29 4.731 -3.109 -11.092 1.00 73.20 H new ATOM 1728 N ARG B 30 7.576 -3.305 -12.215 1.00 61.14 N ATOM 1729 CA ARG B 30 8.410 -3.919 -13.272 1.00 54.52 C ATOM 1730 C ARG B 30 9.913 -3.903 -12.904 1.00 32.44 C ATOM 1731 O ARG B 30 10.581 -4.944 -12.972 1.00 31.24 O ATOM 1732 CB ARG B 30 8.178 -3.177 -14.613 1.00 50.21 C ATOM 1733 CG ARG B 30 6.757 -3.353 -15.190 1.00 3.43 C ATOM 1734 CD ARG B 30 6.497 -2.454 -16.410 1.00 25.31 C ATOM 1735 NE ARG B 30 7.587 -2.528 -17.403 1.00 64.23 N ATOM 1736 CZ ARG B 30 7.640 -3.337 -18.440 1.00 41.34 C ATOM 1737 NH1 ARG B 30 6.699 -4.196 -18.684 1.00 2.40 N ATOM 1738 NH2 ARG B 30 8.657 -3.281 -19.231 1.00 71.32 N ATOM 0 H ARG B 30 7.107 -2.450 -12.514 1.00 61.14 H new ATOM 0 HA ARG B 30 8.112 -4.963 -13.372 1.00 54.52 H new ATOM 0 HB2 ARG B 30 8.370 -2.114 -14.466 1.00 50.21 H new ATOM 0 HB3 ARG B 30 8.903 -3.534 -15.344 1.00 50.21 H new ATOM 0 HG2 ARG B 30 6.611 -4.395 -15.474 1.00 3.43 H new ATOM 0 HG3 ARG B 30 6.024 -3.128 -14.415 1.00 3.43 H new ATOM 0 HD2 ARG B 30 5.559 -2.747 -16.881 1.00 25.31 H new ATOM 0 HD3 ARG B 30 6.379 -1.422 -16.080 1.00 25.31 H new ATOM 0 HE ARG B 30 8.374 -1.892 -17.273 1.00 64.23 H new ATOM 0 HH11 ARG B 30 5.891 -4.257 -18.064 1.00 2.40 H new ATOM 0 HH12 ARG B 30 6.767 -4.810 -19.495 1.00 2.40 H new ATOM 0 HH21 ARG B 30 9.408 -2.615 -19.050 1.00 71.32 H new ATOM 0 HH22 ARG B 30 8.710 -3.902 -20.038 1.00 71.32 H new ATOM 1752 N LYS B 31 10.434 -2.722 -12.494 1.00 42.43 N ATOM 1753 CA LYS B 31 11.878 -2.563 -12.182 1.00 31.01 C ATOM 1754 C LYS B 31 12.263 -3.234 -10.834 1.00 61.22 C ATOM 1755 O LYS B 31 13.427 -3.588 -10.628 1.00 51.02 O ATOM 1756 CB LYS B 31 12.307 -1.065 -12.206 1.00 1.12 C ATOM 1757 CG LYS B 31 11.731 -0.176 -11.077 1.00 50.04 C ATOM 1758 CD LYS B 31 12.171 1.307 -11.189 1.00 34.33 C ATOM 1759 CE LYS B 31 13.705 1.488 -11.186 1.00 14.55 C ATOM 1760 NZ LYS B 31 14.112 2.915 -11.227 1.00 22.21 N ATOM 0 H LYS B 31 9.884 -1.872 -12.372 1.00 42.43 H new ATOM 0 HA LYS B 31 12.428 -3.080 -12.968 1.00 31.01 H new ATOM 0 HB2 LYS B 31 13.395 -1.018 -12.159 1.00 1.12 H new ATOM 0 HB3 LYS B 31 12.011 -0.638 -13.164 1.00 1.12 H new ATOM 0 HG2 LYS B 31 10.643 -0.229 -11.100 1.00 50.04 H new ATOM 0 HG3 LYS B 31 12.049 -0.572 -10.112 1.00 50.04 H new ATOM 0 HD2 LYS B 31 11.763 1.732 -12.106 1.00 34.33 H new ATOM 0 HD3 LYS B 31 11.743 1.870 -10.359 1.00 34.33 H new ATOM 0 HE2 LYS B 31 14.120 1.021 -10.293 1.00 14.55 H new ATOM 0 HE3 LYS B 31 14.130 0.968 -12.045 1.00 14.55 H new ATOM 0 HZ1 LYS B 31 15.105 2.984 -11.527 1.00 22.21 H new ATOM 0 HZ2 LYS B 31 13.510 3.428 -11.902 1.00 22.21 H new ATOM 0 HZ3 LYS B 31 14.006 3.334 -10.281 1.00 22.21 H new ATOM 1774 N VAL B 32 11.278 -3.402 -9.918 1.00 61.11 N ATOM 1775 CA VAL B 32 11.496 -4.108 -8.624 1.00 2.03 C ATOM 1776 C VAL B 32 11.104 -5.604 -8.705 1.00 50.35 C ATOM 1777 O VAL B 32 11.264 -6.341 -7.730 1.00 4.40 O ATOM 1778 CB VAL B 32 10.737 -3.412 -7.434 1.00 41.04 C ATOM 1779 CG1 VAL B 32 11.104 -1.916 -7.363 1.00 45.33 C ATOM 1780 CG2 VAL B 32 9.203 -3.614 -7.517 1.00 72.14 C ATOM 0 H VAL B 32 10.326 -3.060 -10.048 1.00 61.11 H new ATOM 0 HA VAL B 32 12.566 -4.047 -8.424 1.00 2.03 H new ATOM 0 HB VAL B 32 11.063 -3.892 -6.511 1.00 41.04 H new ATOM 0 HG11 VAL B 32 10.571 -1.449 -6.535 1.00 45.33 H new ATOM 0 HG12 VAL B 32 12.178 -1.812 -7.208 1.00 45.33 H new ATOM 0 HG13 VAL B 32 10.823 -1.428 -8.296 1.00 45.33 H new ATOM 0 HG21 VAL B 32 8.724 -3.115 -6.674 1.00 72.14 H new ATOM 0 HG22 VAL B 32 8.830 -3.190 -8.449 1.00 72.14 H new ATOM 0 HG23 VAL B 32 8.974 -4.679 -7.486 1.00 72.14 H new ATOM 1790 N ASN B 33 10.570 -6.026 -9.874 1.00 35.24 N ATOM 1791 CA ASN B 33 10.242 -7.449 -10.182 1.00 31.44 C ATOM 1792 C ASN B 33 9.106 -8.021 -9.269 1.00 14.25 C ATOM 1793 O ASN B 33 8.967 -9.241 -9.128 1.00 62.14 O ATOM 1794 CB ASN B 33 11.528 -8.335 -10.115 1.00 5.25 C ATOM 1795 CG ASN B 33 12.644 -7.835 -11.041 1.00 11.40 C ATOM 1796 OD1 ASN B 33 12.744 -8.236 -12.192 1.00 13.11 O ATOM 1797 ND2 ASN B 33 13.489 -6.947 -10.547 1.00 60.10 N ATOM 0 H ASN B 33 10.351 -5.389 -10.640 1.00 35.24 H new ATOM 0 HA ASN B 33 9.854 -7.475 -11.200 1.00 31.44 H new ATOM 0 HB2 ASN B 33 11.896 -8.356 -9.089 1.00 5.25 H new ATOM 0 HB3 ASN B 33 11.272 -9.360 -10.383 1.00 5.25 H new ATOM 0 HD21 ASN B 33 14.243 -6.582 -11.129 1.00 60.10 H new ATOM 0 HD22 ASN B 33 13.387 -6.626 -9.584 1.00 60.10 H new ATOM 1804 N LEU B 34 8.281 -7.126 -8.680 1.00 32.32 N ATOM 1805 CA LEU B 34 7.127 -7.505 -7.817 1.00 71.42 C ATOM 1806 C LEU B 34 5.783 -7.226 -8.538 1.00 41.51 C ATOM 1807 O LEU B 34 5.756 -6.588 -9.595 1.00 61.11 O ATOM 1808 CB LEU B 34 7.182 -6.713 -6.473 1.00 22.31 C ATOM 1809 CG LEU B 34 8.483 -6.886 -5.614 1.00 72.23 C ATOM 1810 CD1 LEU B 34 8.446 -5.993 -4.351 1.00 40.24 C ATOM 1811 CD2 LEU B 34 8.729 -8.373 -5.250 1.00 51.42 C ATOM 0 H LEU B 34 8.392 -6.118 -8.787 1.00 32.32 H new ATOM 0 HA LEU B 34 7.192 -8.573 -7.609 1.00 71.42 H new ATOM 0 HB2 LEU B 34 7.058 -5.653 -6.696 1.00 22.31 H new ATOM 0 HB3 LEU B 34 6.329 -7.013 -5.865 1.00 22.31 H new ATOM 0 HG LEU B 34 9.324 -6.557 -6.224 1.00 72.23 H new ATOM 0 HD11 LEU B 34 9.362 -6.136 -3.777 1.00 40.24 H new ATOM 0 HD12 LEU B 34 8.363 -4.947 -4.647 1.00 40.24 H new ATOM 0 HD13 LEU B 34 7.587 -6.266 -3.738 1.00 40.24 H new ATOM 0 HD21 LEU B 34 9.638 -8.456 -4.655 1.00 51.42 H new ATOM 0 HD22 LEU B 34 7.883 -8.752 -4.676 1.00 51.42 H new ATOM 0 HD23 LEU B 34 8.838 -8.958 -6.163 1.00 51.42 H new ATOM 1823 N SER B 35 4.670 -7.727 -7.964 1.00 42.41 N ATOM 1824 CA SER B 35 3.299 -7.404 -8.451 1.00 54.04 C ATOM 1825 C SER B 35 2.880 -5.971 -8.044 1.00 12.15 C ATOM 1826 O SER B 35 3.482 -5.379 -7.143 1.00 35.03 O ATOM 1827 CB SER B 35 2.277 -8.426 -7.902 1.00 23.12 C ATOM 1828 OG SER B 35 2.595 -9.745 -8.317 1.00 54.21 O ATOM 0 H SER B 35 4.686 -8.357 -7.162 1.00 42.41 H new ATOM 0 HA SER B 35 3.313 -7.460 -9.539 1.00 54.04 H new ATOM 0 HB2 SER B 35 2.261 -8.379 -6.813 1.00 23.12 H new ATOM 0 HB3 SER B 35 1.277 -8.165 -8.247 1.00 23.12 H new ATOM 0 HG SER B 35 1.934 -10.371 -7.954 1.00 54.21 H new ATOM 1834 N VAL B 36 1.835 -5.439 -8.706 1.00 43.41 N ATOM 1835 CA VAL B 36 1.323 -4.063 -8.465 1.00 24.24 C ATOM 1836 C VAL B 36 0.892 -3.856 -6.983 1.00 12.23 C ATOM 1837 O VAL B 36 1.337 -2.907 -6.329 1.00 65.34 O ATOM 1838 CB VAL B 36 0.122 -3.727 -9.431 1.00 4.14 C ATOM 1839 CG1 VAL B 36 -0.393 -2.271 -9.235 1.00 41.43 C ATOM 1840 CG2 VAL B 36 0.518 -3.984 -10.910 1.00 21.12 C ATOM 0 H VAL B 36 1.317 -5.945 -9.424 1.00 43.41 H new ATOM 0 HA VAL B 36 2.144 -3.378 -8.675 1.00 24.24 H new ATOM 0 HB VAL B 36 -0.700 -4.395 -9.174 1.00 4.14 H new ATOM 0 HG11 VAL B 36 -1.220 -2.082 -9.920 1.00 41.43 H new ATOM 0 HG12 VAL B 36 -0.735 -2.141 -8.208 1.00 41.43 H new ATOM 0 HG13 VAL B 36 0.415 -1.569 -9.439 1.00 41.43 H new ATOM 0 HG21 VAL B 36 -0.325 -3.746 -11.559 1.00 21.12 H new ATOM 0 HG22 VAL B 36 1.368 -3.355 -11.174 1.00 21.12 H new ATOM 0 HG23 VAL B 36 0.789 -5.032 -11.037 1.00 21.12 H new ATOM 1850 N GLU B 37 0.045 -4.775 -6.468 1.00 50.15 N ATOM 1851 CA GLU B 37 -0.415 -4.757 -5.050 1.00 30.24 C ATOM 1852 C GLU B 37 0.762 -4.938 -4.055 1.00 63.35 C ATOM 1853 O GLU B 37 0.802 -4.284 -3.011 1.00 4.10 O ATOM 1854 CB GLU B 37 -1.478 -5.863 -4.811 1.00 73.41 C ATOM 1855 CG GLU B 37 -2.762 -5.702 -5.644 1.00 34.25 C ATOM 1856 CD GLU B 37 -3.759 -6.854 -5.421 1.00 34.54 C ATOM 1857 OE1 GLU B 37 -3.530 -7.952 -5.970 1.00 2.12 O ATOM 1858 OE2 GLU B 37 -4.772 -6.665 -4.708 1.00 35.34 O ATOM 0 H GLU B 37 -0.340 -5.546 -7.013 1.00 50.15 H new ATOM 0 HA GLU B 37 -0.860 -3.779 -4.869 1.00 30.24 H new ATOM 0 HB2 GLU B 37 -1.033 -6.832 -5.036 1.00 73.41 H new ATOM 0 HB3 GLU B 37 -1.744 -5.872 -3.754 1.00 73.41 H new ATOM 0 HG2 GLU B 37 -3.241 -4.757 -5.388 1.00 34.25 H new ATOM 0 HG3 GLU B 37 -2.501 -5.651 -6.701 1.00 34.25 H new ATOM 1865 N SER B 38 1.721 -5.819 -4.416 1.00 4.22 N ATOM 1866 CA SER B 38 2.916 -6.120 -3.579 1.00 1.42 C ATOM 1867 C SER B 38 3.827 -4.877 -3.421 1.00 41.43 C ATOM 1868 O SER B 38 4.376 -4.622 -2.342 1.00 21.11 O ATOM 1869 CB SER B 38 3.730 -7.283 -4.204 1.00 33.23 C ATOM 1870 OG SER B 38 4.813 -7.668 -3.365 1.00 5.35 O ATOM 0 H SER B 38 1.694 -6.342 -5.291 1.00 4.22 H new ATOM 0 HA SER B 38 2.560 -6.412 -2.591 1.00 1.42 H new ATOM 0 HB2 SER B 38 3.076 -8.138 -4.371 1.00 33.23 H new ATOM 0 HB3 SER B 38 4.113 -6.979 -5.178 1.00 33.23 H new ATOM 0 HG SER B 38 5.306 -8.404 -3.785 1.00 5.35 H new ATOM 1876 N THR B 39 3.962 -4.115 -4.518 1.00 24.40 N ATOM 1877 CA THR B 39 4.773 -2.881 -4.566 1.00 10.12 C ATOM 1878 C THR B 39 4.100 -1.743 -3.757 1.00 4.01 C ATOM 1879 O THR B 39 4.747 -1.116 -2.924 1.00 50.15 O ATOM 1880 CB THR B 39 5.013 -2.439 -6.050 1.00 23.23 C ATOM 1881 OG1 THR B 39 5.682 -3.499 -6.753 1.00 45.13 O ATOM 1882 CG2 THR B 39 5.852 -1.154 -6.166 1.00 32.51 C ATOM 0 H THR B 39 3.509 -4.337 -5.405 1.00 24.40 H new ATOM 0 HA THR B 39 5.740 -3.092 -4.109 1.00 10.12 H new ATOM 0 HB THR B 39 4.036 -2.229 -6.486 1.00 23.23 H new ATOM 0 HG1 THR B 39 5.039 -4.208 -6.964 1.00 45.13 H new ATOM 0 HG21 THR B 39 5.984 -0.899 -7.218 1.00 32.51 H new ATOM 0 HG22 THR B 39 5.340 -0.338 -5.656 1.00 32.51 H new ATOM 0 HG23 THR B 39 6.827 -1.314 -5.706 1.00 32.51 H new ATOM 1890 N ALA B 40 2.784 -1.524 -3.995 1.00 42.34 N ATOM 1891 CA ALA B 40 1.969 -0.497 -3.277 1.00 2.51 C ATOM 1892 C ALA B 40 1.955 -0.722 -1.739 1.00 35.24 C ATOM 1893 O ALA B 40 1.942 0.235 -0.956 1.00 13.32 O ATOM 1894 CB ALA B 40 0.526 -0.496 -3.826 1.00 43.42 C ATOM 0 H ALA B 40 2.252 -2.050 -4.688 1.00 42.34 H new ATOM 0 HA ALA B 40 2.434 0.473 -3.456 1.00 2.51 H new ATOM 0 HB1 ALA B 40 -0.063 0.254 -3.299 1.00 43.42 H new ATOM 0 HB2 ALA B 40 0.542 -0.263 -4.891 1.00 43.42 H new ATOM 0 HB3 ALA B 40 0.079 -1.479 -3.676 1.00 43.42 H new ATOM 1900 N LEU B 41 1.961 -2.008 -1.340 1.00 14.35 N ATOM 1901 CA LEU B 41 2.025 -2.441 0.079 1.00 21.20 C ATOM 1902 C LEU B 41 3.397 -2.042 0.690 1.00 42.21 C ATOM 1903 O LEU B 41 3.471 -1.474 1.787 1.00 4.33 O ATOM 1904 CB LEU B 41 1.827 -3.991 0.143 1.00 33.41 C ATOM 1905 CG LEU B 41 1.144 -4.617 1.413 1.00 73.43 C ATOM 1906 CD1 LEU B 41 1.224 -6.153 1.336 1.00 74.35 C ATOM 1907 CD2 LEU B 41 1.720 -4.092 2.756 1.00 43.15 C ATOM 0 H LEU B 41 1.921 -2.788 -1.996 1.00 14.35 H new ATOM 0 HA LEU B 41 1.238 -1.953 0.654 1.00 21.20 H new ATOM 0 HB2 LEU B 41 1.238 -4.284 -0.726 1.00 33.41 H new ATOM 0 HB3 LEU B 41 2.808 -4.453 0.035 1.00 33.41 H new ATOM 0 HG LEU B 41 0.101 -4.299 1.404 1.00 73.43 H new ATOM 0 HD11 LEU B 41 0.750 -6.587 2.217 1.00 74.35 H new ATOM 0 HD12 LEU B 41 0.710 -6.500 0.440 1.00 74.35 H new ATOM 0 HD13 LEU B 41 2.269 -6.461 1.297 1.00 74.35 H new ATOM 0 HD21 LEU B 41 1.199 -4.569 3.586 1.00 43.15 H new ATOM 0 HD22 LEU B 41 2.783 -4.326 2.812 1.00 43.15 H new ATOM 0 HD23 LEU B 41 1.582 -3.012 2.814 1.00 43.15 H new ATOM 1919 N ALA B 42 4.475 -2.372 -0.051 1.00 43.43 N ATOM 1920 CA ALA B 42 5.868 -2.055 0.338 1.00 53.10 C ATOM 1921 C ALA B 42 6.096 -0.527 0.455 1.00 72.13 C ATOM 1922 O ALA B 42 6.908 -0.069 1.261 1.00 40.12 O ATOM 1923 CB ALA B 42 6.837 -2.671 -0.678 1.00 54.12 C ATOM 0 H ALA B 42 4.405 -2.868 -0.940 1.00 43.43 H new ATOM 0 HA ALA B 42 6.055 -2.484 1.322 1.00 53.10 H new ATOM 0 HB1 ALA B 42 7.862 -2.437 -0.391 1.00 54.12 H new ATOM 0 HB2 ALA B 42 6.704 -3.753 -0.699 1.00 54.12 H new ATOM 0 HB3 ALA B 42 6.635 -2.262 -1.668 1.00 54.12 H new ATOM 1929 N VAL B 43 5.348 0.247 -0.353 1.00 1.02 N ATOM 1930 CA VAL B 43 5.372 1.735 -0.301 1.00 5.44 C ATOM 1931 C VAL B 43 4.640 2.251 0.973 1.00 12.15 C ATOM 1932 O VAL B 43 5.018 3.283 1.553 1.00 54.34 O ATOM 1933 CB VAL B 43 4.759 2.377 -1.605 1.00 61.44 C ATOM 1934 CG1 VAL B 43 4.690 3.925 -1.509 1.00 35.01 C ATOM 1935 CG2 VAL B 43 5.556 1.947 -2.869 1.00 4.23 C ATOM 0 H VAL B 43 4.713 -0.129 -1.057 1.00 1.02 H new ATOM 0 HA VAL B 43 6.415 2.046 -0.249 1.00 5.44 H new ATOM 0 HB VAL B 43 3.739 2.004 -1.695 1.00 61.44 H new ATOM 0 HG11 VAL B 43 4.262 4.328 -2.427 1.00 35.01 H new ATOM 0 HG12 VAL B 43 4.066 4.210 -0.662 1.00 35.01 H new ATOM 0 HG13 VAL B 43 5.694 4.326 -1.370 1.00 35.01 H new ATOM 0 HG21 VAL B 43 5.111 2.404 -3.753 1.00 4.23 H new ATOM 0 HG22 VAL B 43 6.592 2.273 -2.774 1.00 4.23 H new ATOM 0 HG23 VAL B 43 5.525 0.862 -2.967 1.00 4.23 H new ATOM 1945 N GLY B 44 3.609 1.501 1.414 1.00 63.53 N ATOM 1946 CA GLY B 44 2.931 1.774 2.692 1.00 23.21 C ATOM 1947 C GLY B 44 3.841 1.543 3.911 1.00 33.34 C ATOM 1948 O GLY B 44 3.654 2.162 4.965 1.00 34.54 O ATOM 0 H GLY B 44 3.230 0.704 0.903 1.00 63.53 H new ATOM 0 HA2 GLY B 44 2.578 2.805 2.698 1.00 23.21 H new ATOM 0 HA3 GLY B 44 2.051 1.136 2.775 1.00 23.21 H new ATOM 1952 N TRP B 45 4.827 0.630 3.765 1.00 44.43 N ATOM 1953 CA TRP B 45 5.883 0.412 4.784 1.00 74.40 C ATOM 1954 C TRP B 45 6.943 1.553 4.760 1.00 2.22 C ATOM 1955 O TRP B 45 7.615 1.808 5.748 1.00 62.40 O ATOM 1956 CB TRP B 45 6.564 -0.962 4.571 1.00 23.11 C ATOM 1957 CG TRP B 45 7.475 -1.371 5.714 1.00 1.33 C ATOM 1958 CD1 TRP B 45 8.843 -1.340 5.749 1.00 71.10 C ATOM 1959 CD2 TRP B 45 7.060 -1.828 7.010 1.00 2.21 C ATOM 1960 NE1 TRP B 45 9.295 -1.802 6.955 1.00 33.54 N ATOM 1961 CE2 TRP B 45 8.225 -2.098 7.752 1.00 52.23 C ATOM 1962 CE3 TRP B 45 5.815 -2.046 7.606 1.00 73.34 C ATOM 1963 CZ2 TRP B 45 8.184 -2.580 9.055 1.00 52.13 C ATOM 1964 CZ3 TRP B 45 5.772 -2.518 8.902 1.00 1.21 C ATOM 1965 CH2 TRP B 45 6.951 -2.780 9.616 1.00 11.11 C ATOM 0 H TRP B 45 4.915 0.028 2.946 1.00 44.43 H new ATOM 0 HA TRP B 45 5.406 0.421 5.764 1.00 74.40 H new ATOM 0 HB2 TRP B 45 5.795 -1.723 4.440 1.00 23.11 H new ATOM 0 HB3 TRP B 45 7.143 -0.932 3.648 1.00 23.11 H new ATOM 0 HD1 TRP B 45 9.474 -1.000 4.941 1.00 71.10 H new ATOM 0 HE1 TRP B 45 10.275 -1.909 7.217 1.00 33.54 H new ATOM 0 HE3 TRP B 45 4.903 -1.849 7.062 1.00 73.34 H new ATOM 0 HZ2 TRP B 45 9.090 -2.789 9.604 1.00 52.13 H new ATOM 0 HZ3 TRP B 45 4.816 -2.688 9.374 1.00 1.21 H new ATOM 0 HH2 TRP B 45 6.885 -3.147 10.629 1.00 11.11 H new ATOM 1976 N LEU B 46 7.103 2.211 3.609 1.00 32.10 N ATOM 1977 CA LEU B 46 7.963 3.414 3.476 1.00 14.13 C ATOM 1978 C LEU B 46 7.336 4.644 4.171 1.00 21.21 C ATOM 1979 O LEU B 46 8.043 5.586 4.529 1.00 20.32 O ATOM 1980 CB LEU B 46 8.248 3.697 1.987 1.00 31.25 C ATOM 1981 CG LEU B 46 9.040 2.578 1.250 1.00 3.45 C ATOM 1982 CD1 LEU B 46 9.178 2.880 -0.255 1.00 34.51 C ATOM 1983 CD2 LEU B 46 10.415 2.348 1.922 1.00 2.55 C ATOM 0 H LEU B 46 6.647 1.935 2.740 1.00 32.10 H new ATOM 0 HA LEU B 46 8.909 3.214 3.980 1.00 14.13 H new ATOM 0 HB2 LEU B 46 7.299 3.850 1.473 1.00 31.25 H new ATOM 0 HB3 LEU B 46 8.807 4.630 1.909 1.00 31.25 H new ATOM 0 HG LEU B 46 8.472 1.651 1.333 1.00 3.45 H new ATOM 0 HD11 LEU B 46 9.736 2.078 -0.737 1.00 34.51 H new ATOM 0 HD12 LEU B 46 8.187 2.953 -0.704 1.00 34.51 H new ATOM 0 HD13 LEU B 46 9.708 3.823 -0.390 1.00 34.51 H new ATOM 0 HD21 LEU B 46 10.952 1.562 1.391 1.00 2.55 H new ATOM 0 HD22 LEU B 46 10.995 3.270 1.889 1.00 2.55 H new ATOM 0 HD23 LEU B 46 10.267 2.050 2.960 1.00 2.55 H new ATOM 1995 N ALA B 47 5.995 4.647 4.264 1.00 63.03 N ATOM 1996 CA ALA B 47 5.214 5.681 4.986 1.00 30.51 C ATOM 1997 C ALA B 47 5.632 5.876 6.489 1.00 34.22 C ATOM 1998 O ALA B 47 5.545 7.000 6.997 1.00 61.22 O ATOM 1999 CB ALA B 47 3.719 5.364 4.864 1.00 2.00 C ATOM 0 H ALA B 47 5.412 3.927 3.838 1.00 63.03 H new ATOM 0 HA ALA B 47 5.438 6.635 4.509 1.00 30.51 H new ATOM 0 HB1 ALA B 47 3.142 6.122 5.394 1.00 2.00 H new ATOM 0 HB2 ALA B 47 3.433 5.359 3.812 1.00 2.00 H new ATOM 0 HB3 ALA B 47 3.518 4.385 5.299 1.00 2.00 H new ATOM 2005 N ARG B 48 6.080 4.796 7.200 1.00 54.15 N ATOM 2006 CA ARG B 48 6.664 4.948 8.585 1.00 72.01 C ATOM 2007 C ARG B 48 8.061 5.595 8.541 1.00 51.22 C ATOM 2008 O ARG B 48 8.469 6.269 9.491 1.00 31.22 O ATOM 2009 CB ARG B 48 6.753 3.608 9.386 1.00 42.04 C ATOM 2010 CG ARG B 48 7.353 2.417 8.622 1.00 40.02 C ATOM 2011 CD ARG B 48 7.694 1.223 9.522 1.00 11.30 C ATOM 2012 NE ARG B 48 8.875 1.493 10.355 1.00 63.41 N ATOM 2013 CZ ARG B 48 9.406 0.670 11.225 1.00 11.31 C ATOM 2014 NH1 ARG B 48 8.865 -0.477 11.493 1.00 33.11 N ATOM 2015 NH2 ARG B 48 10.489 1.010 11.827 1.00 64.14 N ATOM 0 H ARG B 48 6.053 3.836 6.856 1.00 54.15 H new ATOM 0 HA ARG B 48 5.965 5.599 9.110 1.00 72.01 H new ATOM 0 HB2 ARG B 48 7.350 3.780 10.282 1.00 42.04 H new ATOM 0 HB3 ARG B 48 5.751 3.336 9.718 1.00 42.04 H new ATOM 0 HG2 ARG B 48 6.648 2.095 7.856 1.00 40.02 H new ATOM 0 HG3 ARG B 48 8.256 2.744 8.107 1.00 40.02 H new ATOM 0 HD2 ARG B 48 6.842 0.994 10.162 1.00 11.30 H new ATOM 0 HD3 ARG B 48 7.876 0.343 8.906 1.00 11.30 H new ATOM 0 HE ARG B 48 9.321 2.404 10.246 1.00 63.41 H new ATOM 0 HH11 ARG B 48 8.005 -0.758 11.022 1.00 33.11 H new ATOM 0 HH12 ARG B 48 9.299 -1.099 12.175 1.00 33.11 H new ATOM 0 HH21 ARG B 48 10.924 1.910 11.625 1.00 64.14 H new ATOM 0 HH22 ARG B 48 10.914 0.380 12.507 1.00 64.14 H new ATOM 2029 N GLU B 49 8.786 5.355 7.442 1.00 72.43 N ATOM 2030 CA GLU B 49 10.108 5.964 7.194 1.00 41.44 C ATOM 2031 C GLU B 49 9.955 7.429 6.693 1.00 70.05 C ATOM 2032 O GLU B 49 10.908 8.213 6.748 1.00 0.01 O ATOM 2033 CB GLU B 49 10.886 5.106 6.157 1.00 24.33 C ATOM 2034 CG GLU B 49 10.945 3.594 6.480 1.00 74.04 C ATOM 2035 CD GLU B 49 11.600 3.288 7.843 1.00 41.52 C ATOM 2036 OE1 GLU B 49 12.844 3.363 7.939 1.00 43.31 O ATOM 2037 OE2 GLU B 49 10.878 2.987 8.823 1.00 35.45 O ATOM 0 H GLU B 49 8.476 4.733 6.696 1.00 72.43 H new ATOM 0 HA GLU B 49 10.669 5.990 8.128 1.00 41.44 H new ATOM 0 HB2 GLU B 49 10.424 5.236 5.179 1.00 24.33 H new ATOM 0 HB3 GLU B 49 11.904 5.487 6.082 1.00 24.33 H new ATOM 0 HG2 GLU B 49 9.934 3.188 6.471 1.00 74.04 H new ATOM 0 HG3 GLU B 49 11.501 3.083 5.694 1.00 74.04 H new ATOM 2044 N ASN B 50 8.731 7.752 6.187 1.00 4.33 N ATOM 2045 CA ASN B 50 8.327 9.092 5.673 1.00 52.53 C ATOM 2046 C ASN B 50 9.195 9.562 4.474 1.00 30.45 C ATOM 2047 O ASN B 50 9.226 10.748 4.143 1.00 51.31 O ATOM 2048 CB ASN B 50 8.339 10.145 6.819 1.00 42.11 C ATOM 2049 CG ASN B 50 7.411 9.773 7.979 1.00 34.10 C ATOM 2050 OD1 ASN B 50 6.244 10.140 7.999 1.00 70.01 O ATOM 2051 ND2 ASN B 50 7.915 9.034 8.949 1.00 20.10 N ATOM 0 H ASN B 50 7.977 7.067 6.124 1.00 4.33 H new ATOM 0 HA ASN B 50 7.309 8.994 5.297 1.00 52.53 H new ATOM 0 HB2 ASN B 50 9.356 10.254 7.195 1.00 42.11 H new ATOM 0 HB3 ASN B 50 8.041 11.114 6.418 1.00 42.11 H new ATOM 0 HD21 ASN B 50 7.329 8.757 9.736 1.00 20.10 H new ATOM 0 HD22 ASN B 50 8.891 8.740 8.911 1.00 20.10 H new ATOM 2058 N LYS B 51 9.834 8.600 3.784 1.00 50.35 N ATOM 2059 CA LYS B 51 10.791 8.890 2.692 1.00 74.44 C ATOM 2060 C LYS B 51 10.109 8.979 1.299 1.00 72.44 C ATOM 2061 O LYS B 51 10.800 9.123 0.283 1.00 35.44 O ATOM 2062 CB LYS B 51 11.912 7.815 2.675 1.00 51.22 C ATOM 2063 CG LYS B 51 12.768 7.756 3.962 1.00 63.43 C ATOM 2064 CD LYS B 51 13.992 6.815 3.841 1.00 53.24 C ATOM 2065 CE LYS B 51 13.608 5.348 3.563 1.00 62.04 C ATOM 2066 NZ LYS B 51 14.796 4.470 3.496 1.00 2.04 N ATOM 0 H LYS B 51 9.705 7.604 3.963 1.00 50.35 H new ATOM 0 HA LYS B 51 11.221 9.871 2.893 1.00 74.44 H new ATOM 0 HB2 LYS B 51 11.458 6.838 2.512 1.00 51.22 H new ATOM 0 HB3 LYS B 51 12.568 8.007 1.826 1.00 51.22 H new ATOM 0 HG2 LYS B 51 13.113 8.760 4.207 1.00 63.43 H new ATOM 0 HG3 LYS B 51 12.143 7.423 4.791 1.00 63.43 H new ATOM 0 HD2 LYS B 51 14.638 7.172 3.039 1.00 53.24 H new ATOM 0 HD3 LYS B 51 14.571 6.863 4.763 1.00 53.24 H new ATOM 0 HE2 LYS B 51 12.938 4.993 4.346 1.00 62.04 H new ATOM 0 HE3 LYS B 51 13.059 5.288 2.623 1.00 62.04 H new ATOM 0 HZ1 LYS B 51 14.539 3.513 3.813 1.00 2.04 H new ATOM 0 HZ2 LYS B 51 15.143 4.429 2.516 1.00 2.04 H new ATOM 0 HZ3 LYS B 51 15.543 4.849 4.112 1.00 2.04 H new ATOM 2080 N VAL B 52 8.760 8.904 1.254 1.00 22.14 N ATOM 2081 CA VAL B 52 7.984 8.902 -0.013 1.00 74.14 C ATOM 2082 C VAL B 52 6.929 10.035 -0.066 1.00 15.14 C ATOM 2083 O VAL B 52 6.363 10.425 0.958 1.00 44.31 O ATOM 2084 CB VAL B 52 7.281 7.509 -0.250 1.00 51.25 C ATOM 2085 CG1 VAL B 52 8.335 6.409 -0.519 1.00 53.45 C ATOM 2086 CG2 VAL B 52 6.356 7.122 0.941 1.00 52.30 C ATOM 0 H VAL B 52 8.178 8.843 2.089 1.00 22.14 H new ATOM 0 HA VAL B 52 8.705 9.081 -0.811 1.00 74.14 H new ATOM 0 HB VAL B 52 6.647 7.601 -1.132 1.00 51.25 H new ATOM 0 HG11 VAL B 52 7.833 5.455 -0.680 1.00 53.45 H new ATOM 0 HG12 VAL B 52 8.914 6.669 -1.405 1.00 53.45 H new ATOM 0 HG13 VAL B 52 9.002 6.327 0.339 1.00 53.45 H new ATOM 0 HG21 VAL B 52 5.890 6.157 0.741 1.00 52.30 H new ATOM 0 HG22 VAL B 52 6.947 7.057 1.855 1.00 52.30 H new ATOM 0 HG23 VAL B 52 5.583 7.880 1.062 1.00 52.30 H new ATOM 2096 N VAL B 53 6.706 10.564 -1.288 1.00 45.13 N ATOM 2097 CA VAL B 53 5.673 11.581 -1.585 1.00 1.20 C ATOM 2098 C VAL B 53 4.661 11.007 -2.616 1.00 21.32 C ATOM 2099 O VAL B 53 5.002 10.790 -3.783 1.00 65.40 O ATOM 2100 CB VAL B 53 6.324 12.904 -2.140 1.00 24.42 C ATOM 2101 CG1 VAL B 53 5.246 13.979 -2.465 1.00 64.42 C ATOM 2102 CG2 VAL B 53 7.400 13.452 -1.160 1.00 74.32 C ATOM 0 H VAL B 53 7.247 10.293 -2.109 1.00 45.13 H new ATOM 0 HA VAL B 53 5.151 11.827 -0.660 1.00 1.20 H new ATOM 0 HB VAL B 53 6.825 12.658 -3.076 1.00 24.42 H new ATOM 0 HG11 VAL B 53 5.731 14.878 -2.845 1.00 64.42 H new ATOM 0 HG12 VAL B 53 4.560 13.591 -3.218 1.00 64.42 H new ATOM 0 HG13 VAL B 53 4.690 14.222 -1.559 1.00 64.42 H new ATOM 0 HG21 VAL B 53 7.833 14.365 -1.568 1.00 74.32 H new ATOM 0 HG22 VAL B 53 6.938 13.668 -0.197 1.00 74.32 H new ATOM 0 HG23 VAL B 53 8.184 12.707 -1.027 1.00 74.32 H new ATOM 2112 N ILE B 54 3.428 10.740 -2.161 1.00 25.34 N ATOM 2113 CA ILE B 54 2.363 10.114 -2.985 1.00 0.35 C ATOM 2114 C ILE B 54 1.486 11.186 -3.687 1.00 2.32 C ATOM 2115 O ILE B 54 0.864 12.018 -3.026 1.00 51.42 O ATOM 2116 CB ILE B 54 1.448 9.196 -2.082 1.00 33.50 C ATOM 2117 CG1 ILE B 54 2.308 8.189 -1.241 1.00 63.23 C ATOM 2118 CG2 ILE B 54 0.373 8.455 -2.920 1.00 14.21 C ATOM 2119 CD1 ILE B 54 3.199 7.261 -2.050 1.00 50.10 C ATOM 0 H ILE B 54 3.132 10.950 -1.208 1.00 25.34 H new ATOM 0 HA ILE B 54 2.848 9.510 -3.752 1.00 0.35 H new ATOM 0 HB ILE B 54 0.922 9.848 -1.385 1.00 33.50 H new ATOM 0 HG12 ILE B 54 2.934 8.758 -0.553 1.00 63.23 H new ATOM 0 HG13 ILE B 54 1.636 7.582 -0.634 1.00 63.23 H new ATOM 0 HG21 ILE B 54 -0.236 7.834 -2.263 1.00 14.21 H new ATOM 0 HG22 ILE B 54 -0.263 9.184 -3.423 1.00 14.21 H new ATOM 0 HG23 ILE B 54 0.862 7.826 -3.664 1.00 14.21 H new ATOM 0 HD11 ILE B 54 3.750 6.606 -1.375 1.00 50.10 H new ATOM 0 HD12 ILE B 54 2.585 6.658 -2.719 1.00 50.10 H new ATOM 0 HD13 ILE B 54 3.902 7.852 -2.637 1.00 50.10 H new ATOM 2131 N GLU B 55 1.413 11.158 -5.030 1.00 11.31 N ATOM 2132 CA GLU B 55 0.556 12.098 -5.801 1.00 10.35 C ATOM 2133 C GLU B 55 -0.547 11.355 -6.587 1.00 62.41 C ATOM 2134 O GLU B 55 -0.309 10.276 -7.137 1.00 13.35 O ATOM 2135 CB GLU B 55 1.402 12.931 -6.794 1.00 60.30 C ATOM 2136 CG GLU B 55 2.482 13.840 -6.171 1.00 32.42 C ATOM 2137 CD GLU B 55 3.125 14.811 -7.190 1.00 24.31 C ATOM 2138 OE1 GLU B 55 3.071 14.543 -8.420 1.00 71.21 O ATOM 2139 OE2 GLU B 55 3.663 15.857 -6.773 1.00 33.33 O ATOM 0 H GLU B 55 1.933 10.499 -5.609 1.00 11.31 H new ATOM 0 HA GLU B 55 0.086 12.760 -5.074 1.00 10.35 H new ATOM 0 HB2 GLU B 55 1.889 12.246 -7.488 1.00 60.30 H new ATOM 0 HB3 GLU B 55 0.727 13.553 -7.381 1.00 60.30 H new ATOM 0 HG2 GLU B 55 2.038 14.417 -5.360 1.00 32.42 H new ATOM 0 HG3 GLU B 55 3.261 13.218 -5.730 1.00 32.42 H new ATOM 2146 N ARG B 56 -1.755 11.959 -6.636 1.00 74.40 N ATOM 2147 CA ARG B 56 -2.869 11.519 -7.510 1.00 24.43 C ATOM 2148 C ARG B 56 -3.160 12.591 -8.584 1.00 74.42 C ATOM 2149 O ARG B 56 -3.632 13.686 -8.274 1.00 15.54 O ATOM 2150 CB ARG B 56 -4.150 11.214 -6.679 1.00 4.43 C ATOM 2151 CG ARG B 56 -4.017 9.967 -5.789 1.00 2.11 C ATOM 2152 CD ARG B 56 -5.299 9.627 -5.012 1.00 22.52 C ATOM 2153 NE ARG B 56 -5.108 8.427 -4.173 1.00 63.23 N ATOM 2154 CZ ARG B 56 -4.656 8.426 -2.937 1.00 70.40 C ATOM 2155 NH1 ARG B 56 -4.467 9.532 -2.286 1.00 3.14 N ATOM 2156 NH2 ARG B 56 -4.416 7.304 -2.344 1.00 73.13 N ATOM 0 H ARG B 56 -1.988 12.772 -6.066 1.00 74.40 H new ATOM 0 HA ARG B 56 -2.568 10.597 -8.007 1.00 24.43 H new ATOM 0 HB2 ARG B 56 -4.382 12.075 -6.053 1.00 4.43 H new ATOM 0 HB3 ARG B 56 -4.991 11.078 -7.359 1.00 4.43 H new ATOM 0 HG2 ARG B 56 -3.742 9.115 -6.410 1.00 2.11 H new ATOM 0 HG3 ARG B 56 -3.203 10.121 -5.081 1.00 2.11 H new ATOM 0 HD2 ARG B 56 -5.583 10.472 -4.385 1.00 22.52 H new ATOM 0 HD3 ARG B 56 -6.118 9.459 -5.711 1.00 22.52 H new ATOM 0 HE ARG B 56 -5.346 7.525 -4.585 1.00 63.23 H new ATOM 0 HH11 ARG B 56 -4.670 10.427 -2.731 1.00 3.14 H new ATOM 0 HH12 ARG B 56 -4.116 9.507 -1.329 1.00 3.14 H new ATOM 0 HH21 ARG B 56 -4.577 6.424 -2.834 1.00 73.13 H new ATOM 0 HH22 ARG B 56 -4.066 7.298 -1.386 1.00 73.13 H new ATOM 2170 N LYS B 57 -2.860 12.253 -9.847 1.00 22.51 N ATOM 2171 CA LYS B 57 -3.038 13.146 -11.015 1.00 14.15 C ATOM 2172 C LYS B 57 -3.464 12.306 -12.240 1.00 41.24 C ATOM 2173 O LYS B 57 -2.813 11.307 -12.566 1.00 12.24 O ATOM 2174 CB LYS B 57 -1.748 13.992 -11.314 1.00 72.21 C ATOM 2175 CG LYS B 57 -0.418 13.199 -11.501 1.00 51.50 C ATOM 2176 CD LYS B 57 0.136 12.621 -10.177 1.00 23.21 C ATOM 2177 CE LYS B 57 1.429 11.824 -10.353 1.00 74.55 C ATOM 2178 NZ LYS B 57 2.566 12.671 -10.785 1.00 53.21 N ATOM 0 H LYS B 57 -2.481 11.339 -10.095 1.00 22.51 H new ATOM 0 HA LYS B 57 -3.824 13.865 -10.785 1.00 14.15 H new ATOM 0 HB2 LYS B 57 -1.926 14.576 -12.217 1.00 72.21 H new ATOM 0 HB3 LYS B 57 -1.609 14.701 -10.498 1.00 72.21 H new ATOM 0 HG2 LYS B 57 -0.584 12.384 -12.205 1.00 51.50 H new ATOM 0 HG3 LYS B 57 0.330 13.856 -11.945 1.00 51.50 H new ATOM 0 HD2 LYS B 57 0.315 13.439 -9.479 1.00 23.21 H new ATOM 0 HD3 LYS B 57 -0.620 11.977 -9.726 1.00 23.21 H new ATOM 0 HE2 LYS B 57 1.681 11.336 -9.412 1.00 74.55 H new ATOM 0 HE3 LYS B 57 1.268 11.035 -11.088 1.00 74.55 H new ATOM 0 HZ1 LYS B 57 2.837 12.419 -11.757 1.00 53.21 H new ATOM 0 HZ2 LYS B 57 2.285 13.672 -10.752 1.00 53.21 H new ATOM 0 HZ3 LYS B 57 3.375 12.517 -10.149 1.00 53.21 H new ATOM 2192 N ASN B 58 -4.587 12.717 -12.881 1.00 51.10 N ATOM 2193 CA ASN B 58 -5.276 11.964 -13.970 1.00 52.35 C ATOM 2194 C ASN B 58 -5.764 10.565 -13.482 1.00 13.35 C ATOM 2195 O ASN B 58 -5.915 9.627 -14.282 1.00 62.12 O ATOM 2196 CB ASN B 58 -4.346 11.810 -15.218 1.00 42.43 C ATOM 2197 CG ASN B 58 -3.834 13.134 -15.792 1.00 2.55 C ATOM 2198 OD1 ASN B 58 -4.498 14.162 -15.721 1.00 21.01 O ATOM 2199 ND2 ASN B 58 -2.647 13.114 -16.366 1.00 23.04 N ATOM 0 H ASN B 58 -5.051 13.597 -12.654 1.00 51.10 H new ATOM 0 HA ASN B 58 -6.153 12.543 -14.259 1.00 52.35 H new ATOM 0 HB2 ASN B 58 -3.491 11.192 -14.945 1.00 42.43 H new ATOM 0 HB3 ASN B 58 -4.890 11.276 -15.997 1.00 42.43 H new ATOM 0 HD21 ASN B 58 -2.259 13.969 -16.765 1.00 23.04 H new ATOM 0 HD22 ASN B 58 -2.117 12.244 -16.411 1.00 23.04 H new ATOM 2206 N GLY B 59 -6.064 10.460 -12.165 1.00 72.40 N ATOM 2207 CA GLY B 59 -6.443 9.183 -11.530 1.00 35.24 C ATOM 2208 C GLY B 59 -5.250 8.234 -11.278 1.00 14.01 C ATOM 2209 O GLY B 59 -5.425 7.141 -10.727 1.00 24.42 O ATOM 0 H GLY B 59 -6.049 11.252 -11.522 1.00 72.40 H new ATOM 0 HA2 GLY B 59 -6.936 9.392 -10.581 1.00 35.24 H new ATOM 0 HA3 GLY B 59 -7.172 8.676 -12.162 1.00 35.24 H new ATOM 2213 N LEU B 60 -4.036 8.663 -11.674 1.00 70.34 N ATOM 2214 CA LEU B 60 -2.801 7.855 -11.586 1.00 10.11 C ATOM 2215 C LEU B 60 -2.006 8.199 -10.306 1.00 55.21 C ATOM 2216 O LEU B 60 -1.773 9.377 -10.009 1.00 41.54 O ATOM 2217 CB LEU B 60 -1.926 8.107 -12.842 1.00 35.53 C ATOM 2218 CG LEU B 60 -0.598 7.288 -12.934 1.00 51.43 C ATOM 2219 CD1 LEU B 60 -0.869 5.768 -13.055 1.00 54.21 C ATOM 2220 CD2 LEU B 60 0.292 7.806 -14.089 1.00 4.43 C ATOM 0 H LEU B 60 -3.882 9.591 -12.069 1.00 70.34 H new ATOM 0 HA LEU B 60 -3.076 6.801 -11.540 1.00 10.11 H new ATOM 0 HB2 LEU B 60 -2.525 7.889 -13.726 1.00 35.53 H new ATOM 0 HB3 LEU B 60 -1.678 9.168 -12.879 1.00 35.53 H new ATOM 0 HG LEU B 60 -0.051 7.437 -12.003 1.00 51.43 H new ATOM 0 HD11 LEU B 60 0.079 5.233 -13.117 1.00 54.21 H new ATOM 0 HD12 LEU B 60 -1.422 5.426 -12.180 1.00 54.21 H new ATOM 0 HD13 LEU B 60 -1.455 5.573 -13.954 1.00 54.21 H new ATOM 0 HD21 LEU B 60 1.210 7.220 -14.132 1.00 4.43 H new ATOM 0 HD22 LEU B 60 -0.244 7.710 -15.033 1.00 4.43 H new ATOM 0 HD23 LEU B 60 0.538 8.854 -13.917 1.00 4.43 H new ATOM 2232 N ILE B 61 -1.597 7.159 -9.557 1.00 30.22 N ATOM 2233 CA ILE B 61 -0.749 7.312 -8.359 1.00 61.51 C ATOM 2234 C ILE B 61 0.736 7.064 -8.716 1.00 22.31 C ATOM 2235 O ILE B 61 1.090 5.987 -9.212 1.00 60.05 O ATOM 2236 CB ILE B 61 -1.193 6.335 -7.202 1.00 5.12 C ATOM 2237 CG1 ILE B 61 -2.694 6.581 -6.829 1.00 33.34 C ATOM 2238 CG2 ILE B 61 -0.268 6.476 -5.957 1.00 41.12 C ATOM 2239 CD1 ILE B 61 -3.219 5.760 -5.659 1.00 41.35 C ATOM 0 H ILE B 61 -1.844 6.191 -9.764 1.00 30.22 H new ATOM 0 HA ILE B 61 -0.869 8.334 -8.001 1.00 61.51 H new ATOM 0 HB ILE B 61 -1.095 5.311 -7.562 1.00 5.12 H new ATOM 0 HG12 ILE B 61 -2.825 7.638 -6.597 1.00 33.34 H new ATOM 0 HG13 ILE B 61 -3.308 6.369 -7.704 1.00 33.34 H new ATOM 0 HG21 ILE B 61 -0.600 5.790 -5.178 1.00 41.12 H new ATOM 0 HG22 ILE B 61 0.758 6.238 -6.237 1.00 41.12 H new ATOM 0 HG23 ILE B 61 -0.314 7.499 -5.584 1.00 41.12 H new ATOM 0 HD11 ILE B 61 -4.266 6.005 -5.483 1.00 41.35 H new ATOM 0 HD12 ILE B 61 -3.129 4.699 -5.890 1.00 41.35 H new ATOM 0 HD13 ILE B 61 -2.638 5.988 -4.765 1.00 41.35 H new ATOM 2251 N GLU B 62 1.600 8.064 -8.453 1.00 54.24 N ATOM 2252 CA GLU B 62 3.064 7.953 -8.663 1.00 35.03 C ATOM 2253 C GLU B 62 3.810 8.307 -7.366 1.00 31.34 C ATOM 2254 O GLU B 62 3.428 9.241 -6.646 1.00 5.53 O ATOM 2255 CB GLU B 62 3.558 8.858 -9.828 1.00 32.54 C ATOM 2256 CG GLU B 62 2.920 8.544 -11.197 1.00 25.44 C ATOM 2257 CD GLU B 62 3.648 9.220 -12.372 1.00 70.04 C ATOM 2258 OE1 GLU B 62 3.458 10.436 -12.578 1.00 35.50 O ATOM 2259 OE2 GLU B 62 4.423 8.538 -13.082 1.00 31.14 O ATOM 0 H GLU B 62 1.307 8.971 -8.090 1.00 54.24 H new ATOM 0 HA GLU B 62 3.279 6.920 -8.938 1.00 35.03 H new ATOM 0 HB2 GLU B 62 3.352 9.898 -9.576 1.00 32.54 H new ATOM 0 HB3 GLU B 62 4.640 8.759 -9.914 1.00 32.54 H new ATOM 0 HG2 GLU B 62 2.918 7.465 -11.351 1.00 25.44 H new ATOM 0 HG3 GLU B 62 1.879 8.867 -11.188 1.00 25.44 H new ATOM 2266 N ILE B 63 4.876 7.543 -7.082 1.00 54.14 N ATOM 2267 CA ILE B 63 5.661 7.667 -5.846 1.00 32.25 C ATOM 2268 C ILE B 63 6.947 8.466 -6.131 1.00 74.34 C ATOM 2269 O ILE B 63 7.700 8.155 -7.062 1.00 50.22 O ATOM 2270 CB ILE B 63 6.049 6.270 -5.206 1.00 32.04 C ATOM 2271 CG1 ILE B 63 4.807 5.322 -5.028 1.00 70.24 C ATOM 2272 CG2 ILE B 63 6.762 6.487 -3.847 1.00 23.02 C ATOM 2273 CD1 ILE B 63 4.298 4.676 -6.300 1.00 35.41 C ATOM 0 H ILE B 63 5.220 6.816 -7.710 1.00 54.14 H new ATOM 0 HA ILE B 63 5.029 8.185 -5.125 1.00 32.25 H new ATOM 0 HB ILE B 63 6.729 5.775 -5.899 1.00 32.04 H new ATOM 0 HG12 ILE B 63 5.070 4.535 -4.321 1.00 70.24 H new ATOM 0 HG13 ILE B 63 3.995 5.895 -4.581 1.00 70.24 H new ATOM 0 HG21 ILE B 63 7.024 5.521 -3.415 1.00 23.02 H new ATOM 0 HG22 ILE B 63 7.668 7.074 -4.001 1.00 23.02 H new ATOM 0 HG23 ILE B 63 6.096 7.019 -3.168 1.00 23.02 H new ATOM 0 HD11 ILE B 63 3.441 4.043 -6.069 1.00 35.41 H new ATOM 0 HD12 ILE B 63 3.997 5.450 -7.006 1.00 35.41 H new ATOM 0 HD13 ILE B 63 5.089 4.070 -6.742 1.00 35.41 H new ATOM 2285 N TYR B 64 7.150 9.506 -5.330 1.00 44.10 N ATOM 2286 CA TYR B 64 8.337 10.391 -5.374 1.00 44.51 C ATOM 2287 C TYR B 64 9.198 10.180 -4.104 1.00 20.13 C ATOM 2288 O TYR B 64 8.775 9.498 -3.164 1.00 51.13 O ATOM 2289 CB TYR B 64 7.883 11.882 -5.482 1.00 11.13 C ATOM 2290 CG TYR B 64 7.147 12.253 -6.790 1.00 65.42 C ATOM 2291 CD1 TYR B 64 5.907 11.690 -7.120 1.00 21.43 C ATOM 2292 CD2 TYR B 64 7.702 13.159 -7.701 1.00 4.50 C ATOM 2293 CE1 TYR B 64 5.260 12.011 -8.300 1.00 45.23 C ATOM 2294 CE2 TYR B 64 7.058 13.481 -8.880 1.00 25.21 C ATOM 2295 CZ TYR B 64 5.840 12.906 -9.178 1.00 55.44 C ATOM 2296 OH TYR B 64 5.206 13.221 -10.362 1.00 22.13 O ATOM 0 H TYR B 64 6.482 9.775 -4.607 1.00 44.10 H new ATOM 0 HA TYR B 64 8.938 10.144 -6.249 1.00 44.51 H new ATOM 0 HB2 TYR B 64 7.229 12.108 -4.640 1.00 11.13 H new ATOM 0 HB3 TYR B 64 8.761 12.520 -5.384 1.00 11.13 H new ATOM 0 HD1 TYR B 64 5.446 10.990 -6.438 1.00 21.43 H new ATOM 0 HD2 TYR B 64 8.654 13.616 -7.477 1.00 4.50 H new ATOM 0 HE1 TYR B 64 4.305 11.564 -8.534 1.00 45.23 H new ATOM 0 HE2 TYR B 64 7.508 14.182 -9.568 1.00 25.21 H new ATOM 0 HH TYR B 64 5.749 13.866 -10.862 1.00 22.13 H new ATOM 2306 N ASN B 65 10.414 10.748 -4.093 1.00 54.12 N ATOM 2307 CA ASN B 65 11.290 10.751 -2.893 1.00 64.20 C ATOM 2308 C ASN B 65 11.041 11.999 -2.016 1.00 32.34 C ATOM 2309 O ASN B 65 10.566 13.039 -2.505 1.00 22.31 O ATOM 2310 CB ASN B 65 12.782 10.700 -3.314 1.00 23.01 C ATOM 2311 CG ASN B 65 13.231 9.339 -3.831 1.00 12.32 C ATOM 2312 OD1 ASN B 65 12.772 8.297 -3.375 1.00 73.14 O ATOM 2313 ND2 ASN B 65 14.126 9.342 -4.790 1.00 43.20 N ATOM 0 H ASN B 65 10.822 11.216 -4.903 1.00 54.12 H new ATOM 0 HA ASN B 65 11.048 9.865 -2.306 1.00 64.20 H new ATOM 0 HB2 ASN B 65 12.957 11.447 -4.088 1.00 23.01 H new ATOM 0 HB3 ASN B 65 13.400 10.975 -2.459 1.00 23.01 H new ATOM 0 HD21 ASN B 65 14.460 8.460 -5.178 1.00 43.20 H new ATOM 0 HD22 ASN B 65 14.488 10.226 -5.147 1.00 43.20 H new ATOM 2320 N GLU B 66 11.369 11.870 -0.711 1.00 1.23 N ATOM 2321 CA GLU B 66 11.344 12.992 0.258 1.00 0.32 C ATOM 2322 C GLU B 66 12.321 14.116 -0.188 1.00 64.42 C ATOM 2323 O GLU B 66 13.542 13.982 -0.075 1.00 41.54 O ATOM 2324 CB GLU B 66 11.718 12.478 1.677 1.00 74.35 C ATOM 2325 CG GLU B 66 11.675 13.551 2.789 1.00 73.11 C ATOM 2326 CD GLU B 66 12.213 13.041 4.138 1.00 3.22 C ATOM 2327 OE1 GLU B 66 13.430 12.777 4.225 1.00 4.53 O ATOM 2328 OE2 GLU B 66 11.436 12.902 5.112 1.00 30.02 O ATOM 0 H GLU B 66 11.659 10.984 -0.298 1.00 1.23 H new ATOM 0 HA GLU B 66 10.336 13.406 0.290 1.00 0.32 H new ATOM 0 HB2 GLU B 66 11.038 11.669 1.946 1.00 74.35 H new ATOM 0 HB3 GLU B 66 12.721 12.053 1.641 1.00 74.35 H new ATOM 0 HG2 GLU B 66 12.259 14.416 2.475 1.00 73.11 H new ATOM 0 HG3 GLU B 66 10.647 13.891 2.919 1.00 73.11 H new ATOM 2335 N GLY B 67 11.755 15.196 -0.735 1.00 74.23 N ATOM 2336 CA GLY B 67 12.527 16.289 -1.355 1.00 30.01 C ATOM 2337 C GLY B 67 11.840 16.825 -2.617 1.00 74.44 C ATOM 2338 O GLY B 67 12.144 17.922 -3.084 1.00 25.34 O ATOM 0 H GLY B 67 10.746 15.342 -0.763 1.00 74.23 H new ATOM 0 HA2 GLY B 67 12.652 17.099 -0.637 1.00 30.01 H new ATOM 0 HA3 GLY B 67 13.525 15.931 -1.608 1.00 30.01 H new ATOM 2342 N HIS B 68 10.915 16.016 -3.179 1.00 42.04 N ATOM 2343 CA HIS B 68 10.093 16.385 -4.353 1.00 52.01 C ATOM 2344 C HIS B 68 8.624 16.602 -3.910 1.00 61.01 C ATOM 2345 O HIS B 68 7.756 15.761 -4.163 1.00 0.14 O ATOM 2346 CB HIS B 68 10.194 15.277 -5.442 1.00 12.21 C ATOM 2347 CG HIS B 68 11.603 14.985 -5.897 1.00 32.32 C ATOM 2348 ND1 HIS B 68 12.172 15.557 -7.015 1.00 13.23 N ATOM 2349 CD2 HIS B 68 12.560 14.176 -5.376 1.00 64.21 C ATOM 2350 CE1 HIS B 68 13.402 15.119 -7.157 1.00 61.03 C ATOM 2351 NE2 HIS B 68 13.666 14.285 -6.179 1.00 41.13 N ATOM 0 H HIS B 68 10.716 15.080 -2.827 1.00 42.04 H new ATOM 0 HA HIS B 68 10.464 17.315 -4.783 1.00 52.01 H new ATOM 0 HB2 HIS B 68 9.752 14.360 -5.053 1.00 12.21 H new ATOM 0 HB3 HIS B 68 9.600 15.576 -6.305 1.00 12.21 H new ATOM 0 HD2 HIS B 68 12.468 13.561 -4.493 1.00 64.21 H new ATOM 0 HE1 HIS B 68 14.083 15.399 -7.947 1.00 61.03 H new ATOM 0 HE2 HIS B 68 14.551 13.797 -6.039 1.00 41.13 H new ATOM 2360 N PHE B 69 8.369 17.728 -3.208 1.00 4.13 N ATOM 2361 CA PHE B 69 7.025 18.047 -2.639 1.00 2.40 C ATOM 2362 C PHE B 69 6.861 19.551 -2.320 1.00 53.55 C ATOM 2363 O PHE B 69 5.752 20.085 -2.414 1.00 12.04 O ATOM 2364 CB PHE B 69 6.739 17.206 -1.353 1.00 64.13 C ATOM 2365 CG PHE B 69 7.661 17.486 -0.151 1.00 22.54 C ATOM 2366 CD1 PHE B 69 8.920 16.891 -0.055 1.00 12.21 C ATOM 2367 CD2 PHE B 69 7.263 18.341 0.888 1.00 73.14 C ATOM 2368 CE1 PHE B 69 9.746 17.138 1.028 1.00 53.11 C ATOM 2369 CE2 PHE B 69 8.095 18.585 1.968 1.00 4.34 C ATOM 2370 CZ PHE B 69 9.336 17.983 2.036 1.00 44.23 C ATOM 0 H PHE B 69 9.075 18.439 -3.017 1.00 4.13 H new ATOM 0 HA PHE B 69 6.300 17.784 -3.409 1.00 2.40 H new ATOM 0 HB2 PHE B 69 5.709 17.385 -1.046 1.00 64.13 H new ATOM 0 HB3 PHE B 69 6.816 16.149 -1.608 1.00 64.13 H new ATOM 0 HD1 PHE B 69 9.255 16.227 -0.838 1.00 12.21 H new ATOM 0 HD2 PHE B 69 6.294 18.816 0.845 1.00 73.14 H new ATOM 0 HE1 PHE B 69 10.716 16.666 1.083 1.00 53.11 H new ATOM 0 HE2 PHE B 69 7.773 19.247 2.758 1.00 4.34 H new ATOM 0 HZ PHE B 69 9.984 18.174 2.878 1.00 44.23 H new ATOM 2380 N ASP B 70 7.975 20.204 -1.922 1.00 53.20 N ATOM 2381 CA ASP B 70 8.011 21.622 -1.449 1.00 55.40 C ATOM 2382 C ASP B 70 7.262 22.613 -2.388 1.00 3.31 C ATOM 2383 O ASP B 70 6.558 23.518 -1.916 1.00 14.24 O ATOM 2384 CB ASP B 70 9.493 22.051 -1.259 1.00 22.31 C ATOM 2385 CG ASP B 70 10.351 21.745 -2.498 1.00 73.33 C ATOM 2386 OD1 ASP B 70 10.836 20.601 -2.612 1.00 43.14 O ATOM 2387 OD2 ASP B 70 10.506 22.622 -3.380 1.00 74.11 O ATOM 0 H ASP B 70 8.894 19.761 -1.917 1.00 53.20 H new ATOM 0 HA ASP B 70 7.477 21.665 -0.500 1.00 55.40 H new ATOM 0 HB2 ASP B 70 9.535 23.119 -1.045 1.00 22.31 H new ATOM 0 HB3 ASP B 70 9.910 21.536 -0.394 1.00 22.31 H new ATOM 2392 N PHE B 71 7.416 22.413 -3.707 1.00 32.34 N ATOM 2393 CA PHE B 71 6.718 23.201 -4.738 1.00 64.05 C ATOM 2394 C PHE B 71 6.743 22.445 -6.086 1.00 23.40 C ATOM 2395 O PHE B 71 7.812 22.025 -6.546 1.00 24.41 O ATOM 2396 CB PHE B 71 7.373 24.607 -4.883 1.00 11.44 C ATOM 2397 CG PHE B 71 6.658 25.549 -5.854 1.00 73.30 C ATOM 2398 CD1 PHE B 71 5.314 25.882 -5.666 1.00 52.24 C ATOM 2399 CD2 PHE B 71 7.322 26.100 -6.948 1.00 52.22 C ATOM 2400 CE1 PHE B 71 4.664 26.730 -6.540 1.00 21.24 C ATOM 2401 CE2 PHE B 71 6.671 26.949 -7.818 1.00 3.25 C ATOM 2402 CZ PHE B 71 5.344 27.264 -7.614 1.00 11.13 C ATOM 0 H PHE B 71 8.032 21.696 -4.091 1.00 32.34 H new ATOM 0 HA PHE B 71 5.680 23.339 -4.435 1.00 64.05 H new ATOM 0 HB2 PHE B 71 7.409 25.079 -3.901 1.00 11.44 H new ATOM 0 HB3 PHE B 71 8.404 24.480 -5.214 1.00 11.44 H new ATOM 0 HD1 PHE B 71 4.776 25.470 -4.825 1.00 52.24 H new ATOM 0 HD2 PHE B 71 8.361 25.859 -7.117 1.00 52.22 H new ATOM 0 HE1 PHE B 71 3.624 26.975 -6.383 1.00 21.24 H new ATOM 0 HE2 PHE B 71 7.201 27.368 -8.660 1.00 3.25 H new ATOM 0 HZ PHE B 71 4.837 27.930 -8.296 1.00 11.13 H new ATOM 2412 N SER B 72 5.560 22.274 -6.705 1.00 10.21 N ATOM 2413 CA SER B 72 5.424 21.625 -8.030 1.00 1.42 C ATOM 2414 C SER B 72 5.918 22.574 -9.151 1.00 71.43 C ATOM 2415 O SER B 72 5.504 23.743 -9.211 1.00 3.33 O ATOM 2416 CB SER B 72 3.950 21.213 -8.285 1.00 24.14 C ATOM 2417 OG SER B 72 3.087 22.344 -8.304 1.00 13.44 O ATOM 0 H SER B 72 4.672 22.579 -6.306 1.00 10.21 H new ATOM 0 HA SER B 72 6.041 20.727 -8.037 1.00 1.42 H new ATOM 0 HB2 SER B 72 3.878 20.684 -9.235 1.00 24.14 H new ATOM 0 HB3 SER B 72 3.626 20.520 -7.509 1.00 24.14 H new ATOM 0 HG SER B 72 3.606 23.148 -8.518 1.00 13.44 H new ATOM 2423 N PHE B 73 6.808 22.069 -10.024 1.00 32.11 N ATOM 2424 CA PHE B 73 7.376 22.859 -11.134 1.00 22.14 C ATOM 2425 C PHE B 73 6.393 22.901 -12.337 1.00 12.22 C ATOM 2426 O PHE B 73 6.244 21.917 -13.068 1.00 74.42 O ATOM 2427 CB PHE B 73 8.756 22.287 -11.564 1.00 65.12 C ATOM 2428 CG PHE B 73 9.422 23.078 -12.701 1.00 54.12 C ATOM 2429 CD1 PHE B 73 9.949 24.349 -12.467 1.00 15.02 C ATOM 2430 CD2 PHE B 73 9.501 22.566 -14.000 1.00 42.45 C ATOM 2431 CE1 PHE B 73 10.532 25.079 -13.487 1.00 23.02 C ATOM 2432 CE2 PHE B 73 10.086 23.297 -15.018 1.00 51.40 C ATOM 2433 CZ PHE B 73 10.599 24.553 -14.761 1.00 20.21 C ATOM 0 H PHE B 73 7.152 21.110 -9.982 1.00 32.11 H new ATOM 0 HA PHE B 73 7.527 23.881 -10.786 1.00 22.14 H new ATOM 0 HB2 PHE B 73 9.421 22.278 -10.701 1.00 65.12 H new ATOM 0 HB3 PHE B 73 8.629 21.251 -11.879 1.00 65.12 H new ATOM 0 HD1 PHE B 73 9.901 24.769 -11.473 1.00 15.02 H new ATOM 0 HD2 PHE B 73 9.100 21.586 -14.211 1.00 42.45 H new ATOM 0 HE1 PHE B 73 10.935 26.061 -13.286 1.00 23.02 H new ATOM 0 HE2 PHE B 73 10.142 22.885 -16.015 1.00 51.40 H new ATOM 0 HZ PHE B 73 11.053 25.124 -15.557 1.00 20.21 H new ATOM 2443 N GLY B 74 5.700 24.034 -12.487 1.00 31.22 N ATOM 2444 CA GLY B 74 4.824 24.293 -13.638 1.00 3.24 C ATOM 2445 C GLY B 74 4.765 25.782 -13.952 1.00 32.35 C ATOM 2446 O GLY B 74 3.689 26.350 -14.150 1.00 52.50 O ATOM 0 H GLY B 74 5.729 24.800 -11.814 1.00 31.22 H new ATOM 0 HA2 GLY B 74 5.190 23.748 -14.508 1.00 3.24 H new ATOM 0 HA3 GLY B 74 3.821 23.922 -13.428 1.00 3.24 H new ATOM 2450 N LEU B 75 5.950 26.416 -13.973 1.00 52.32 N ATOM 2451 CA LEU B 75 6.096 27.874 -14.144 1.00 0.54 C ATOM 2452 C LEU B 75 6.072 28.258 -15.639 1.00 12.24 C ATOM 2453 O LEU B 75 6.910 27.783 -16.415 1.00 43.45 O ATOM 2454 CB LEU B 75 7.421 28.385 -13.488 1.00 50.43 C ATOM 2455 CG LEU B 75 7.508 28.340 -11.917 1.00 10.03 C ATOM 2456 CD1 LEU B 75 7.517 26.895 -11.363 1.00 41.44 C ATOM 2457 CD2 LEU B 75 8.732 29.142 -11.401 1.00 20.13 C ATOM 0 H LEU B 75 6.840 25.929 -13.871 1.00 52.32 H new ATOM 0 HA LEU B 75 5.252 28.350 -13.645 1.00 0.54 H new ATOM 0 HB2 LEU B 75 8.246 27.796 -13.889 1.00 50.43 H new ATOM 0 HB3 LEU B 75 7.580 29.415 -13.806 1.00 50.43 H new ATOM 0 HG LEU B 75 6.602 28.816 -11.540 1.00 10.03 H new ATOM 0 HD11 LEU B 75 7.578 26.923 -10.275 1.00 41.44 H new ATOM 0 HD12 LEU B 75 6.601 26.385 -11.662 1.00 41.44 H new ATOM 0 HD13 LEU B 75 8.378 26.358 -11.761 1.00 41.44 H new ATOM 0 HD21 LEU B 75 8.766 29.093 -10.313 1.00 20.13 H new ATOM 0 HD22 LEU B 75 9.647 28.715 -11.812 1.00 20.13 H new ATOM 0 HD23 LEU B 75 8.644 30.182 -11.715 1.00 20.13 H new ATOM 2469 N GLU B 76 5.105 29.109 -16.032 1.00 63.41 N ATOM 2470 CA GLU B 76 5.039 29.660 -17.403 1.00 63.04 C ATOM 2471 C GLU B 76 6.181 30.685 -17.628 1.00 45.01 C ATOM 2472 O GLU B 76 6.518 31.466 -16.727 1.00 11.40 O ATOM 2473 CB GLU B 76 3.658 30.326 -17.676 1.00 2.43 C ATOM 2474 CG GLU B 76 3.484 30.860 -19.123 1.00 2.14 C ATOM 2475 CD GLU B 76 2.148 31.592 -19.364 1.00 61.30 C ATOM 2476 OE1 GLU B 76 2.062 32.805 -19.082 1.00 63.11 O ATOM 2477 OE2 GLU B 76 1.180 30.959 -19.830 1.00 11.21 O ATOM 0 H GLU B 76 4.356 29.432 -15.419 1.00 63.41 H new ATOM 0 HA GLU B 76 5.161 28.834 -18.103 1.00 63.04 H new ATOM 0 HB2 GLU B 76 2.871 29.601 -17.471 1.00 2.43 H new ATOM 0 HB3 GLU B 76 3.521 31.151 -16.977 1.00 2.43 H new ATOM 0 HG2 GLU B 76 4.305 31.540 -19.350 1.00 2.14 H new ATOM 0 HG3 GLU B 76 3.560 30.025 -19.819 1.00 2.14 H new ATOM 2484 N HIS B 77 6.770 30.662 -18.827 1.00 55.23 N ATOM 2485 CA HIS B 77 7.865 31.566 -19.224 1.00 2.04 C ATOM 2486 C HIS B 77 7.499 32.266 -20.555 1.00 62.35 C ATOM 2487 O HIS B 77 6.901 31.633 -21.431 1.00 44.41 O ATOM 2488 CB HIS B 77 9.179 30.745 -19.363 1.00 32.30 C ATOM 2489 CG HIS B 77 10.421 31.578 -19.511 1.00 24.22 C ATOM 2490 ND1 HIS B 77 11.165 31.992 -18.430 1.00 55.11 N ATOM 2491 CD2 HIS B 77 11.054 32.075 -20.606 1.00 25.35 C ATOM 2492 CE1 HIS B 77 12.188 32.698 -18.844 1.00 23.22 C ATOM 2493 NE2 HIS B 77 12.149 32.766 -20.159 1.00 34.41 N ATOM 0 H HIS B 77 6.500 30.008 -19.562 1.00 55.23 H new ATOM 0 HA HIS B 77 8.015 32.334 -18.465 1.00 2.04 H new ATOM 0 HB2 HIS B 77 9.288 30.106 -18.487 1.00 32.30 H new ATOM 0 HB3 HIS B 77 9.092 30.088 -20.228 1.00 32.30 H new ATOM 0 HD2 HIS B 77 10.751 31.949 -21.635 1.00 25.35 H new ATOM 0 HE1 HIS B 77 12.939 33.149 -18.212 1.00 23.22 H new ATOM 0 HE2 HIS B 77 12.824 33.254 -20.748 1.00 34.41 H new ATOM 2502 N HIS B 78 7.847 33.569 -20.685 1.00 0.24 N ATOM 2503 CA HIS B 78 7.603 34.360 -21.926 1.00 62.22 C ATOM 2504 C HIS B 78 8.186 33.654 -23.184 1.00 13.12 C ATOM 2505 O HIS B 78 9.395 33.394 -23.265 1.00 63.02 O ATOM 2506 CB HIS B 78 8.161 35.810 -21.780 1.00 30.23 C ATOM 2507 CG HIS B 78 9.624 35.898 -21.404 1.00 74.22 C ATOM 2508 ND1 HIS B 78 10.651 35.851 -22.324 1.00 53.35 N ATOM 2509 CD2 HIS B 78 10.227 36.012 -20.196 1.00 73.22 C ATOM 2510 CE1 HIS B 78 11.810 35.926 -21.702 1.00 40.32 C ATOM 2511 NE2 HIS B 78 11.581 36.024 -20.414 1.00 25.53 N ATOM 0 H HIS B 78 8.301 34.102 -19.943 1.00 0.24 H new ATOM 0 HA HIS B 78 6.524 34.426 -22.067 1.00 62.22 H new ATOM 0 HB2 HIS B 78 8.011 36.337 -22.722 1.00 30.23 H new ATOM 0 HB3 HIS B 78 7.575 36.334 -21.025 1.00 30.23 H new ATOM 0 HD2 HIS B 78 9.733 36.081 -19.238 1.00 73.22 H new ATOM 0 HE1 HIS B 78 12.782 35.910 -22.172 1.00 40.32 H new ATOM 0 HE2 HIS B 78 12.296 36.097 -19.690 1.00 25.53 H new ATOM 2520 N HIS B 79 7.292 33.332 -24.140 1.00 25.43 N ATOM 2521 CA HIS B 79 7.621 32.535 -25.335 1.00 44.34 C ATOM 2522 C HIS B 79 8.545 33.319 -26.299 1.00 52.23 C ATOM 2523 O HIS B 79 8.090 34.212 -27.022 1.00 13.10 O ATOM 2524 CB HIS B 79 6.312 32.095 -26.051 1.00 22.24 C ATOM 2525 CG HIS B 79 6.507 31.072 -27.148 1.00 50.12 C ATOM 2526 ND1 HIS B 79 6.320 29.722 -26.949 1.00 33.51 N ATOM 2527 CD2 HIS B 79 6.861 31.203 -28.457 1.00 0.03 C ATOM 2528 CE1 HIS B 79 6.548 29.072 -28.069 1.00 52.12 C ATOM 2529 NE2 HIS B 79 6.875 29.943 -28.996 1.00 45.21 N ATOM 0 H HIS B 79 6.314 33.621 -24.103 1.00 25.43 H new ATOM 0 HA HIS B 79 8.166 31.645 -25.019 1.00 44.34 H new ATOM 0 HB2 HIS B 79 5.627 31.686 -25.308 1.00 22.24 H new ATOM 0 HB3 HIS B 79 5.832 32.977 -26.476 1.00 22.24 H new ATOM 0 HD2 HIS B 79 7.088 32.125 -28.972 1.00 0.03 H new ATOM 0 HE1 HIS B 79 6.478 28.003 -28.204 1.00 52.12 H new ATOM 0 HE2 HIS B 79 7.103 29.717 -29.964 1.00 45.21 H new ATOM 2538 N HIS B 80 9.850 32.995 -26.266 1.00 20.42 N ATOM 2539 CA HIS B 80 10.843 33.554 -27.210 1.00 24.40 C ATOM 2540 C HIS B 80 10.702 32.893 -28.608 1.00 50.41 C ATOM 2541 O HIS B 80 10.390 31.698 -28.699 1.00 1.25 O ATOM 2542 CB HIS B 80 12.283 33.390 -26.652 1.00 52.33 C ATOM 2543 CG HIS B 80 12.710 31.968 -26.389 1.00 52.32 C ATOM 2544 ND1 HIS B 80 13.396 31.206 -27.311 1.00 3.44 N ATOM 2545 CD2 HIS B 80 12.576 31.181 -25.290 1.00 12.34 C ATOM 2546 CE1 HIS B 80 13.662 30.024 -26.799 1.00 32.51 C ATOM 2547 NE2 HIS B 80 13.178 29.983 -25.578 1.00 34.35 N ATOM 0 H HIS B 80 10.247 32.343 -25.590 1.00 20.42 H new ATOM 0 HA HIS B 80 10.649 34.621 -27.324 1.00 24.40 H new ATOM 0 HB2 HIS B 80 12.982 33.838 -27.358 1.00 52.33 H new ATOM 0 HB3 HIS B 80 12.362 33.954 -25.723 1.00 52.33 H new ATOM 0 HD2 HIS B 80 12.088 31.448 -24.364 1.00 12.34 H new ATOM 0 HE1 HIS B 80 14.189 29.223 -27.297 1.00 32.51 H new ATOM 0 HE2 HIS B 80 13.240 29.186 -24.945 1.00 34.35 H new ATOM 2556 N HIS B 81 10.913 33.679 -29.684 1.00 53.10 N ATOM 2557 CA HIS B 81 10.814 33.179 -31.081 1.00 53.34 C ATOM 2558 C HIS B 81 12.210 33.124 -31.752 1.00 10.22 C ATOM 2559 O HIS B 81 13.026 34.031 -31.577 1.00 53.13 O ATOM 2560 CB HIS B 81 9.822 34.053 -31.905 1.00 51.41 C ATOM 2561 CG HIS B 81 10.270 35.466 -32.203 1.00 70.45 C ATOM 2562 ND1 HIS B 81 10.179 36.500 -31.296 1.00 61.32 N ATOM 2563 CD2 HIS B 81 10.801 36.014 -33.327 1.00 63.25 C ATOM 2564 CE1 HIS B 81 10.631 37.612 -31.842 1.00 63.45 C ATOM 2565 NE2 HIS B 81 11.016 37.345 -33.069 1.00 72.21 N ATOM 0 H HIS B 81 11.154 34.668 -29.617 1.00 53.10 H new ATOM 0 HA HIS B 81 10.424 32.162 -31.054 1.00 53.34 H new ATOM 0 HB2 HIS B 81 9.625 33.549 -32.851 1.00 51.41 H new ATOM 0 HB3 HIS B 81 8.876 34.100 -31.365 1.00 51.41 H new ATOM 0 HD2 HIS B 81 11.014 35.498 -34.252 1.00 63.25 H new ATOM 0 HE1 HIS B 81 10.677 38.578 -31.362 1.00 63.45 H new ATOM 0 HE2 HIS B 81 11.411 38.019 -33.725 1.00 72.21 H new ATOM 2574 N HIS B 82 12.471 32.053 -32.520 1.00 22.34 N ATOM 2575 CA HIS B 82 13.765 31.850 -33.210 1.00 63.22 C ATOM 2576 C HIS B 82 13.574 30.892 -34.403 1.00 33.32 C ATOM 2577 O HIS B 82 14.311 30.932 -35.393 1.00 65.32 O ATOM 2578 CB HIS B 82 14.818 31.292 -32.201 1.00 22.05 C ATOM 2579 CG HIS B 82 16.252 31.324 -32.678 1.00 10.03 C ATOM 2580 ND1 HIS B 82 17.136 32.320 -32.323 1.00 53.13 N ATOM 2581 CD2 HIS B 82 16.963 30.468 -33.456 1.00 14.40 C ATOM 2582 CE1 HIS B 82 18.314 32.079 -32.856 1.00 4.55 C ATOM 2583 NE2 HIS B 82 18.237 30.965 -33.546 1.00 0.35 N ATOM 0 H HIS B 82 11.797 31.304 -32.682 1.00 22.34 H new ATOM 0 HA HIS B 82 14.131 32.802 -33.593 1.00 63.22 H new ATOM 0 HB2 HIS B 82 14.748 31.863 -31.275 1.00 22.05 H new ATOM 0 HB3 HIS B 82 14.556 30.262 -31.960 1.00 22.05 H new ATOM 0 HD2 HIS B 82 16.594 29.564 -33.918 1.00 14.40 H new ATOM 0 HE1 HIS B 82 19.195 32.693 -32.745 1.00 4.55 H new ATOM 0 HE2 HIS B 82 19.003 30.537 -34.066 1.00 0.35 H new TER 2592 HIS B 82