USER MOD reduce.3.24.130724 H: found=0, std=0, add=825, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 825 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 62 GLN : amide:sc= -1.31! C(o=-0.5!,f=-2.1!) USER MOD Set 1.2: B 65 SER OG : rot -105:sc= 0.817 USER MOD Single : A 688 GLN : amide:sc= -1.8 K(o=-1.8,f=-0.44) USER MOD Single : A 691 TYR OH : rot 180:sc= 0 USER MOD Single : A 698 GLN : amide:sc= -0.638 X(o=-0.64,f=-0.26) USER MOD Single : A 699 LYS NZ :NH3+ 172:sc= 1.21 (180deg=1.2) USER MOD Single : A 702 MET CE :methyl 147:sc= -1.39 (180deg=-5.88!) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -156:sc= 1.34 (180deg=0.346) USER MOD Single : B 2 GLN : amide:sc= -0.202 K(o=-0.2,f=-0.99) USER MOD Single : B 6 LYS NZ :NH3+ 163:sc= -0.133 (180deg=-0.318) USER MOD Single : B 7 THR OG1 : rot 180:sc=-0.00206 USER MOD Single : B 9 THR OG1 : rot 180:sc=-0.00102 USER MOD Single : B 11 LYS NZ :NH3+ 180:sc= 1.03 (180deg=1.03) USER MOD Single : B 12 THR OG1 : rot 180:sc= 0 USER MOD Single : B 14 THR OG1 : rot 180:sc=-0.00645 USER MOD Single : B 20 SER OG : rot 180:sc= 0 USER MOD Single : B 22 THR OG1 : rot 74:sc= -0.0897 USER MOD Single : B 25 ASN : amide:sc= -0.742 X(o=-0.74,f=-0.84) USER MOD Single : B 27 LYS NZ :NH3+ -139:sc= 1.27 (180deg=0.615) USER MOD Single : B 29 LYS NZ :NH3+ -178:sc= 1.25 (180deg=1.21) USER MOD Single : B 31 GLN : amide:sc= -0.539 K(o=-0.54,f=-1.6) USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 40 GLN : amide:sc= -0.493 X(o=-0.49,f=-0.33) USER MOD Single : B 41 GLN : amide:sc= 0.48 K(o=0.48,f=-3.8!) USER MOD Single : B 48 LYS NZ :NH3+ 135:sc=-0.00197 (180deg=-0.152) USER MOD Single : B 49 GLN : amide:sc= -1.5! C(o=-1.5!,f=-4.7!) USER MOD Single : B 55 THR OG1 : rot 180:sc= 0.00509 USER MOD Single : B 57 SER OG : rot 180:sc= 0 USER MOD Single : B 59 TYR OH : rot -30:sc= -0.625 USER MOD Single : B 60 ASN : amide:sc= -0.122 X(o=-0.12,f=-0.18) USER MOD Single : B 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 66 THR OG1 : rot 180:sc= 0 USER MOD Single : B 68 HIS : no HD1:sc= -0.528 X(o=-0.53,f=-0.071) USER MOD ----------------------------------------------------------------- ATOM 63 N LEU A 679 18.054 -1.970 5.139 1.00 0.00 N ATOM 64 CA LEU A 679 16.876 -2.445 4.469 1.00 0.00 C ATOM 65 C LEU A 679 17.229 -2.984 3.071 1.00 0.00 C ATOM 66 O LEU A 679 18.368 -2.842 2.627 1.00 0.00 O ATOM 67 CB LEU A 679 15.859 -1.300 4.426 1.00 0.00 C ATOM 68 CG LEU A 679 15.590 -0.556 5.741 1.00 0.00 C ATOM 69 CD1 LEU A 679 15.281 -1.526 6.881 1.00 0.00 C ATOM 70 CD2 LEU A 679 16.710 0.390 6.174 1.00 0.00 C ATOM 0 HA LEU A 679 16.433 -3.282 5.009 1.00 0.00 H new ATOM 0 HB2 LEU A 679 16.199 -0.573 3.689 1.00 0.00 H new ATOM 0 HB3 LEU A 679 14.912 -1.701 4.064 1.00 0.00 H new ATOM 0 HG LEU A 679 14.718 0.062 5.528 1.00 0.00 H new ATOM 0 HD11 LEU A 679 15.096 -0.964 7.797 1.00 0.00 H new ATOM 0 HD12 LEU A 679 14.397 -2.113 6.630 1.00 0.00 H new ATOM 0 HD13 LEU A 679 16.129 -2.194 7.030 1.00 0.00 H new ATOM 0 HD21 LEU A 679 16.436 0.873 7.112 1.00 0.00 H new ATOM 0 HD22 LEU A 679 17.631 -0.176 6.313 1.00 0.00 H new ATOM 0 HD23 LEU A 679 16.863 1.149 5.406 1.00 0.00 H new ATOM 82 N PRO A 680 16.263 -3.602 2.373 1.00 0.00 N ATOM 83 CA PRO A 680 16.424 -4.267 1.080 1.00 0.00 C ATOM 84 C PRO A 680 16.829 -3.342 -0.074 1.00 0.00 C ATOM 85 O PRO A 680 16.670 -3.706 -1.236 1.00 0.00 O ATOM 86 CB PRO A 680 15.071 -4.922 0.789 1.00 0.00 C ATOM 87 CG PRO A 680 14.389 -4.996 2.153 1.00 0.00 C ATOM 88 CD PRO A 680 14.900 -3.734 2.828 1.00 0.00 C ATOM 0 HA PRO A 680 17.247 -4.978 1.146 1.00 0.00 H new ATOM 0 HB2 PRO A 680 14.487 -4.332 0.083 1.00 0.00 H new ATOM 0 HB3 PRO A 680 15.194 -5.913 0.351 1.00 0.00 H new ATOM 0 HG2 PRO A 680 13.302 -5.002 2.067 1.00 0.00 H new ATOM 0 HG3 PRO A 680 14.670 -5.895 2.702 1.00 0.00 H new ATOM 0 HD2 PRO A 680 14.303 -2.866 2.548 1.00 0.00 H new ATOM 0 HD3 PRO A 680 14.851 -3.818 3.914 1.00 0.00 H new ATOM 96 N PHE A 681 17.340 -2.152 0.241 1.00 0.00 N ATOM 97 CA PHE A 681 17.687 -1.123 -0.731 1.00 0.00 C ATOM 98 C PHE A 681 18.851 -1.574 -1.622 1.00 0.00 C ATOM 99 O PHE A 681 19.573 -2.508 -1.271 1.00 0.00 O ATOM 100 CB PHE A 681 18.100 0.141 0.040 1.00 0.00 C ATOM 101 CG PHE A 681 16.990 0.884 0.757 1.00 0.00 C ATOM 102 CD1 PHE A 681 15.750 0.283 1.022 1.00 0.00 C ATOM 103 CD2 PHE A 681 17.211 2.209 1.166 1.00 0.00 C ATOM 104 CE1 PHE A 681 14.743 1.001 1.683 1.00 0.00 C ATOM 105 CE2 PHE A 681 16.204 2.929 1.823 1.00 0.00 C ATOM 106 CZ PHE A 681 14.967 2.323 2.081 1.00 0.00 C ATOM 0 H PHE A 681 17.528 -1.873 1.204 1.00 0.00 H new ATOM 0 HA PHE A 681 16.826 -0.929 -1.371 1.00 0.00 H new ATOM 0 HB2 PHE A 681 18.855 -0.138 0.775 1.00 0.00 H new ATOM 0 HB3 PHE A 681 18.575 0.828 -0.660 1.00 0.00 H new ATOM 0 HD1 PHE A 681 15.570 -0.737 0.716 1.00 0.00 H new ATOM 0 HD2 PHE A 681 18.165 2.677 0.973 1.00 0.00 H new ATOM 0 HE1 PHE A 681 13.792 0.532 1.885 1.00 0.00 H new ATOM 0 HE2 PHE A 681 16.381 3.949 2.130 1.00 0.00 H new ATOM 0 HZ PHE A 681 14.188 2.876 2.586 1.00 0.00 H new ATOM 116 N PRO A 682 19.053 -0.919 -2.778 1.00 0.00 N ATOM 117 CA PRO A 682 18.193 0.106 -3.353 1.00 0.00 C ATOM 118 C PRO A 682 17.028 -0.368 -4.249 1.00 0.00 C ATOM 119 O PRO A 682 16.216 0.485 -4.606 1.00 0.00 O ATOM 120 CB PRO A 682 19.155 0.920 -4.215 1.00 0.00 C ATOM 121 CG PRO A 682 20.073 -0.158 -4.788 1.00 0.00 C ATOM 122 CD PRO A 682 20.228 -1.119 -3.607 1.00 0.00 C ATOM 0 HA PRO A 682 17.687 0.625 -2.539 1.00 0.00 H new ATOM 0 HB2 PRO A 682 18.633 1.468 -4.999 1.00 0.00 H new ATOM 0 HB3 PRO A 682 19.707 1.653 -3.627 1.00 0.00 H new ATOM 0 HG2 PRO A 682 19.632 -0.648 -5.656 1.00 0.00 H new ATOM 0 HG3 PRO A 682 21.031 0.252 -5.107 1.00 0.00 H new ATOM 0 HD2 PRO A 682 20.294 -2.152 -3.949 1.00 0.00 H new ATOM 0 HD3 PRO A 682 21.141 -0.909 -3.049 1.00 0.00 H new ATOM 130 N PRO A 683 16.876 -1.646 -4.647 1.00 0.00 N ATOM 131 CA PRO A 683 15.852 -2.017 -5.616 1.00 0.00 C ATOM 132 C PRO A 683 14.442 -2.051 -5.025 1.00 0.00 C ATOM 133 O PRO A 683 14.257 -1.968 -3.812 1.00 0.00 O ATOM 134 CB PRO A 683 16.254 -3.410 -6.105 1.00 0.00 C ATOM 135 CG PRO A 683 16.903 -4.017 -4.867 1.00 0.00 C ATOM 136 CD PRO A 683 17.645 -2.822 -4.278 1.00 0.00 C ATOM 0 HA PRO A 683 15.805 -1.277 -6.415 1.00 0.00 H new ATOM 0 HB2 PRO A 683 15.392 -3.989 -6.437 1.00 0.00 H new ATOM 0 HB3 PRO A 683 16.947 -3.361 -6.945 1.00 0.00 H new ATOM 0 HG2 PRO A 683 16.163 -4.419 -4.175 1.00 0.00 H new ATOM 0 HG3 PRO A 683 17.580 -4.833 -5.120 1.00 0.00 H new ATOM 0 HD2 PRO A 683 17.726 -2.910 -3.195 1.00 0.00 H new ATOM 0 HD3 PRO A 683 18.660 -2.762 -4.670 1.00 0.00 H new ATOM 144 N ASP A 684 13.460 -2.182 -5.927 1.00 0.00 N ATOM 145 CA ASP A 684 12.026 -2.330 -5.681 1.00 0.00 C ATOM 146 C ASP A 684 11.340 -1.198 -4.908 1.00 0.00 C ATOM 147 O ASP A 684 10.122 -1.065 -5.017 1.00 0.00 O ATOM 148 CB ASP A 684 11.751 -3.675 -5.007 1.00 0.00 C ATOM 149 CG ASP A 684 12.295 -4.841 -5.831 1.00 0.00 C ATOM 150 OD1 ASP A 684 11.819 -5.011 -6.975 1.00 0.00 O ATOM 151 OD2 ASP A 684 13.181 -5.556 -5.306 1.00 0.00 O ATOM 0 H ASP A 684 13.668 -2.187 -6.925 1.00 0.00 H new ATOM 0 HA ASP A 684 11.575 -2.279 -6.672 1.00 0.00 H new ATOM 0 HB2 ASP A 684 12.206 -3.686 -4.017 1.00 0.00 H new ATOM 0 HB3 ASP A 684 10.677 -3.799 -4.866 1.00 0.00 H new ATOM 156 N ILE A 685 12.071 -0.385 -4.139 1.00 0.00 N ATOM 157 CA ILE A 685 11.488 0.713 -3.374 1.00 0.00 C ATOM 158 C ILE A 685 12.479 1.860 -3.193 1.00 0.00 C ATOM 159 O ILE A 685 13.670 1.728 -3.470 1.00 0.00 O ATOM 160 CB ILE A 685 10.987 0.249 -1.989 1.00 0.00 C ATOM 161 CG1 ILE A 685 11.815 -0.873 -1.351 1.00 0.00 C ATOM 162 CG2 ILE A 685 9.527 -0.191 -2.062 1.00 0.00 C ATOM 163 CD1 ILE A 685 13.165 -0.351 -0.869 1.00 0.00 C ATOM 0 H ILE A 685 13.082 -0.472 -4.032 1.00 0.00 H new ATOM 0 HA ILE A 685 10.635 1.068 -3.953 1.00 0.00 H new ATOM 0 HB ILE A 685 11.099 1.123 -1.347 1.00 0.00 H new ATOM 0 HG12 ILE A 685 11.267 -1.302 -0.512 1.00 0.00 H new ATOM 0 HG13 ILE A 685 11.968 -1.673 -2.075 1.00 0.00 H new ATOM 0 HG21 ILE A 685 9.195 -0.514 -1.075 1.00 0.00 H new ATOM 0 HG22 ILE A 685 8.912 0.644 -2.397 1.00 0.00 H new ATOM 0 HG23 ILE A 685 9.431 -1.018 -2.766 1.00 0.00 H new ATOM 0 HD11 ILE A 685 13.732 -1.167 -0.421 1.00 0.00 H new ATOM 0 HD12 ILE A 685 13.721 0.056 -1.714 1.00 0.00 H new ATOM 0 HD13 ILE A 685 13.008 0.432 -0.127 1.00 0.00 H new ATOM 175 N ASP A 686 11.954 2.990 -2.715 1.00 0.00 N ATOM 176 CA ASP A 686 12.711 4.181 -2.384 1.00 0.00 C ATOM 177 C ASP A 686 12.039 4.797 -1.159 1.00 0.00 C ATOM 178 O ASP A 686 10.812 4.884 -1.111 1.00 0.00 O ATOM 179 CB ASP A 686 12.704 5.155 -3.565 1.00 0.00 C ATOM 180 CG ASP A 686 13.376 4.564 -4.800 1.00 0.00 C ATOM 181 OD1 ASP A 686 14.625 4.605 -4.855 1.00 0.00 O ATOM 182 OD2 ASP A 686 12.638 4.075 -5.684 1.00 0.00 O ATOM 0 H ASP A 686 10.954 3.096 -2.545 1.00 0.00 H new ATOM 0 HA ASP A 686 13.754 3.946 -2.171 1.00 0.00 H new ATOM 0 HB2 ASP A 686 11.676 5.424 -3.806 1.00 0.00 H new ATOM 0 HB3 ASP A 686 13.216 6.074 -3.279 1.00 0.00 H new ATOM 187 N PRO A 687 12.808 5.232 -0.153 1.00 0.00 N ATOM 188 CA PRO A 687 12.235 5.756 1.074 1.00 0.00 C ATOM 189 C PRO A 687 11.450 7.030 0.808 1.00 0.00 C ATOM 190 O PRO A 687 10.545 7.381 1.559 1.00 0.00 O ATOM 191 CB PRO A 687 13.423 5.979 2.009 1.00 0.00 C ATOM 192 CG PRO A 687 14.622 6.120 1.075 1.00 0.00 C ATOM 193 CD PRO A 687 14.258 5.240 -0.117 1.00 0.00 C ATOM 0 HA PRO A 687 11.515 5.071 1.522 1.00 0.00 H new ATOM 0 HB2 PRO A 687 13.287 6.873 2.618 1.00 0.00 H new ATOM 0 HB3 PRO A 687 13.551 5.142 2.695 1.00 0.00 H new ATOM 0 HG2 PRO A 687 14.776 7.157 0.775 1.00 0.00 H new ATOM 0 HG3 PRO A 687 15.543 5.786 1.553 1.00 0.00 H new ATOM 0 HD2 PRO A 687 14.673 5.639 -1.043 1.00 0.00 H new ATOM 0 HD3 PRO A 687 14.655 4.232 0.002 1.00 0.00 H new ATOM 201 N GLN A 688 11.803 7.723 -0.273 1.00 0.00 N ATOM 202 CA GLN A 688 11.146 8.946 -0.706 1.00 0.00 C ATOM 203 C GLN A 688 9.785 8.687 -1.348 1.00 0.00 C ATOM 204 O GLN A 688 9.153 9.640 -1.801 1.00 0.00 O ATOM 205 CB GLN A 688 12.062 9.663 -1.704 1.00 0.00 C ATOM 206 CG GLN A 688 12.572 8.671 -2.757 1.00 0.00 C ATOM 207 CD GLN A 688 14.083 8.512 -2.702 1.00 0.00 C ATOM 208 OE1 GLN A 688 14.749 8.531 -3.732 1.00 0.00 O ATOM 209 NE2 GLN A 688 14.639 8.352 -1.507 1.00 0.00 N ATOM 0 H GLN A 688 12.571 7.440 -0.882 1.00 0.00 H new ATOM 0 HA GLN A 688 10.966 9.563 0.174 1.00 0.00 H new ATOM 0 HB2 GLN A 688 11.520 10.474 -2.190 1.00 0.00 H new ATOM 0 HB3 GLN A 688 12.904 10.113 -1.178 1.00 0.00 H new ATOM 0 HG2 GLN A 688 12.099 7.701 -2.601 1.00 0.00 H new ATOM 0 HG3 GLN A 688 12.279 9.013 -3.750 1.00 0.00 H new ATOM 0 HE21 GLN A 688 14.056 8.341 -0.670 1.00 0.00 H new ATOM 0 HE22 GLN A 688 15.650 8.240 -1.426 1.00 0.00 H new ATOM 218 N VAL A 689 9.314 7.433 -1.407 1.00 0.00 N ATOM 219 CA VAL A 689 8.005 7.159 -1.973 1.00 0.00 C ATOM 220 C VAL A 689 7.227 6.177 -1.100 1.00 0.00 C ATOM 221 O VAL A 689 6.113 5.788 -1.443 1.00 0.00 O ATOM 222 CB VAL A 689 8.152 6.718 -3.431 1.00 0.00 C ATOM 223 CG1 VAL A 689 8.650 5.282 -3.556 1.00 0.00 C ATOM 224 CG2 VAL A 689 6.819 6.859 -4.163 1.00 0.00 C ATOM 0 H VAL A 689 9.818 6.611 -1.073 1.00 0.00 H new ATOM 0 HA VAL A 689 7.406 8.070 -1.984 1.00 0.00 H new ATOM 0 HB VAL A 689 8.898 7.370 -3.886 1.00 0.00 H new ATOM 0 HG11 VAL A 689 8.737 5.018 -4.610 1.00 0.00 H new ATOM 0 HG12 VAL A 689 9.625 5.192 -3.077 1.00 0.00 H new ATOM 0 HG13 VAL A 689 7.944 4.608 -3.070 1.00 0.00 H new ATOM 0 HG21 VAL A 689 6.938 6.542 -5.199 1.00 0.00 H new ATOM 0 HG22 VAL A 689 6.069 6.236 -3.676 1.00 0.00 H new ATOM 0 HG23 VAL A 689 6.498 7.900 -4.137 1.00 0.00 H new ATOM 234 N PHE A 690 7.805 5.773 0.038 1.00 0.00 N ATOM 235 CA PHE A 690 7.068 5.001 1.027 1.00 0.00 C ATOM 236 C PHE A 690 7.009 5.733 2.367 1.00 0.00 C ATOM 237 O PHE A 690 6.205 5.372 3.216 1.00 0.00 O ATOM 238 CB PHE A 690 7.623 3.578 1.132 1.00 0.00 C ATOM 239 CG PHE A 690 8.694 3.348 2.173 1.00 0.00 C ATOM 240 CD1 PHE A 690 8.347 3.176 3.522 1.00 0.00 C ATOM 241 CD2 PHE A 690 10.041 3.290 1.788 1.00 0.00 C ATOM 242 CE1 PHE A 690 9.344 2.966 4.486 1.00 0.00 C ATOM 243 CE2 PHE A 690 11.036 3.092 2.756 1.00 0.00 C ATOM 244 CZ PHE A 690 10.690 2.938 4.101 1.00 0.00 C ATOM 0 H PHE A 690 8.774 5.970 0.289 1.00 0.00 H new ATOM 0 HA PHE A 690 6.034 4.901 0.696 1.00 0.00 H new ATOM 0 HB2 PHE A 690 6.793 2.903 1.341 1.00 0.00 H new ATOM 0 HB3 PHE A 690 8.026 3.296 0.159 1.00 0.00 H new ATOM 0 HD1 PHE A 690 7.309 3.205 3.819 1.00 0.00 H new ATOM 0 HD2 PHE A 690 10.312 3.398 0.748 1.00 0.00 H new ATOM 0 HE1 PHE A 690 9.074 2.826 5.522 1.00 0.00 H new ATOM 0 HE2 PHE A 690 12.074 3.058 2.461 1.00 0.00 H new ATOM 0 HZ PHE A 690 11.461 2.797 4.844 1.00 0.00 H new ATOM 254 N TYR A 691 7.844 6.759 2.574 1.00 0.00 N ATOM 255 CA TYR A 691 7.697 7.655 3.714 1.00 0.00 C ATOM 256 C TYR A 691 6.579 8.676 3.459 1.00 0.00 C ATOM 257 O TYR A 691 6.232 9.443 4.355 1.00 0.00 O ATOM 258 CB TYR A 691 9.018 8.374 3.997 1.00 0.00 C ATOM 259 CG TYR A 691 10.108 7.502 4.596 1.00 0.00 C ATOM 260 CD1 TYR A 691 9.794 6.330 5.302 1.00 0.00 C ATOM 261 CD2 TYR A 691 11.448 7.890 4.450 1.00 0.00 C ATOM 262 CE1 TYR A 691 10.810 5.562 5.882 1.00 0.00 C ATOM 263 CE2 TYR A 691 12.472 7.125 5.032 1.00 0.00 C ATOM 264 CZ TYR A 691 12.156 5.954 5.748 1.00 0.00 C ATOM 265 OH TYR A 691 13.146 5.202 6.311 1.00 0.00 O ATOM 0 H TYR A 691 8.628 6.985 1.962 1.00 0.00 H new ATOM 0 HA TYR A 691 7.427 7.060 4.587 1.00 0.00 H new ATOM 0 HB2 TYR A 691 9.388 8.803 3.066 1.00 0.00 H new ATOM 0 HB3 TYR A 691 8.824 9.205 4.676 1.00 0.00 H new ATOM 0 HD1 TYR A 691 8.764 6.020 5.398 1.00 0.00 H new ATOM 0 HD2 TYR A 691 11.693 8.779 3.889 1.00 0.00 H new ATOM 0 HE1 TYR A 691 10.561 4.667 6.433 1.00 0.00 H new ATOM 0 HE2 TYR A 691 13.502 7.435 4.931 1.00 0.00 H new ATOM 0 HH TYR A 691 14.016 5.613 6.123 1.00 0.00 H new ATOM 275 N GLU A 692 6.010 8.692 2.244 1.00 0.00 N ATOM 276 CA GLU A 692 4.862 9.528 1.887 1.00 0.00 C ATOM 277 C GLU A 692 3.569 8.992 2.522 1.00 0.00 C ATOM 278 O GLU A 692 2.513 8.984 1.892 1.00 0.00 O ATOM 279 CB GLU A 692 4.721 9.604 0.364 1.00 0.00 C ATOM 280 CG GLU A 692 5.951 10.245 -0.276 1.00 0.00 C ATOM 281 CD GLU A 692 5.692 10.588 -1.744 1.00 0.00 C ATOM 282 OE1 GLU A 692 5.267 9.682 -2.493 1.00 0.00 O ATOM 283 OE2 GLU A 692 5.921 11.762 -2.110 1.00 0.00 O ATOM 0 H GLU A 692 6.343 8.114 1.472 1.00 0.00 H new ATOM 0 HA GLU A 692 5.034 10.531 2.276 1.00 0.00 H new ATOM 0 HB2 GLU A 692 4.578 8.602 -0.041 1.00 0.00 H new ATOM 0 HB3 GLU A 692 3.833 10.181 0.107 1.00 0.00 H new ATOM 0 HG2 GLU A 692 6.219 11.149 0.270 1.00 0.00 H new ATOM 0 HG3 GLU A 692 6.799 9.565 -0.202 1.00 0.00 H new ATOM 290 N LEU A 693 3.658 8.539 3.776 1.00 0.00 N ATOM 291 CA LEU A 693 2.614 7.818 4.486 1.00 0.00 C ATOM 292 C LEU A 693 2.617 8.239 5.957 1.00 0.00 C ATOM 293 O LEU A 693 3.519 8.952 6.389 1.00 0.00 O ATOM 294 CB LEU A 693 2.982 6.331 4.459 1.00 0.00 C ATOM 295 CG LEU A 693 3.081 5.680 3.080 1.00 0.00 C ATOM 296 CD1 LEU A 693 3.540 4.234 3.285 1.00 0.00 C ATOM 297 CD2 LEU A 693 1.739 5.692 2.357 1.00 0.00 C ATOM 0 H LEU A 693 4.496 8.674 4.341 1.00 0.00 H new ATOM 0 HA LEU A 693 1.646 8.019 4.027 1.00 0.00 H new ATOM 0 HB2 LEU A 693 3.940 6.207 4.965 1.00 0.00 H new ATOM 0 HB3 LEU A 693 2.240 5.785 5.042 1.00 0.00 H new ATOM 0 HG LEU A 693 3.787 6.239 2.465 1.00 0.00 H new ATOM 0 HD11 LEU A 693 3.622 3.738 2.318 1.00 0.00 H new ATOM 0 HD12 LEU A 693 4.511 4.227 3.780 1.00 0.00 H new ATOM 0 HD13 LEU A 693 2.814 3.706 3.904 1.00 0.00 H new ATOM 0 HD21 LEU A 693 1.848 5.221 1.380 1.00 0.00 H new ATOM 0 HD22 LEU A 693 1.004 5.142 2.945 1.00 0.00 H new ATOM 0 HD23 LEU A 693 1.404 6.721 2.228 1.00 0.00 H new ATOM 309 N PRO A 694 1.626 7.808 6.744 1.00 0.00 N ATOM 310 CA PRO A 694 1.696 7.861 8.193 1.00 0.00 C ATOM 311 C PRO A 694 2.624 6.728 8.633 1.00 0.00 C ATOM 312 O PRO A 694 2.771 5.736 7.922 1.00 0.00 O ATOM 313 CB PRO A 694 0.261 7.629 8.664 1.00 0.00 C ATOM 314 CG PRO A 694 -0.327 6.744 7.567 1.00 0.00 C ATOM 315 CD PRO A 694 0.367 7.242 6.299 1.00 0.00 C ATOM 0 HA PRO A 694 2.079 8.797 8.598 1.00 0.00 H new ATOM 0 HB2 PRO A 694 0.231 7.138 9.637 1.00 0.00 H new ATOM 0 HB3 PRO A 694 -0.287 8.566 8.763 1.00 0.00 H new ATOM 0 HG2 PRO A 694 -0.122 5.689 7.749 1.00 0.00 H new ATOM 0 HG3 PRO A 694 -1.410 6.852 7.501 1.00 0.00 H new ATOM 0 HD2 PRO A 694 0.530 6.426 5.595 1.00 0.00 H new ATOM 0 HD3 PRO A 694 -0.240 7.989 5.787 1.00 0.00 H new ATOM 323 N GLU A 695 3.257 6.861 9.803 1.00 0.00 N ATOM 324 CA GLU A 695 4.180 5.906 10.349 1.00 0.00 C ATOM 325 C GLU A 695 3.584 4.517 10.296 1.00 0.00 C ATOM 326 O GLU A 695 4.261 3.558 9.966 1.00 0.00 O ATOM 327 CB GLU A 695 4.341 6.331 11.804 1.00 0.00 C ATOM 328 CG GLU A 695 5.658 5.820 12.337 1.00 0.00 C ATOM 329 CD GLU A 695 5.767 5.992 13.852 1.00 0.00 C ATOM 330 OE1 GLU A 695 4.981 5.334 14.570 1.00 0.00 O ATOM 331 OE2 GLU A 695 6.638 6.781 14.283 1.00 0.00 O ATOM 0 H GLU A 695 3.124 7.673 10.405 1.00 0.00 H new ATOM 0 HA GLU A 695 5.123 5.880 9.803 1.00 0.00 H new ATOM 0 HB2 GLU A 695 4.302 7.417 11.883 1.00 0.00 H new ATOM 0 HB3 GLU A 695 3.518 5.938 12.401 1.00 0.00 H new ATOM 0 HG2 GLU A 695 5.768 4.766 12.083 1.00 0.00 H new ATOM 0 HG3 GLU A 695 6.477 6.352 11.852 1.00 0.00 H new ATOM 338 N GLU A 696 2.299 4.449 10.629 1.00 0.00 N ATOM 339 CA GLU A 696 1.467 3.278 10.764 1.00 0.00 C ATOM 340 C GLU A 696 1.593 2.279 9.613 1.00 0.00 C ATOM 341 O GLU A 696 1.135 1.144 9.738 1.00 0.00 O ATOM 342 CB GLU A 696 0.031 3.777 10.943 1.00 0.00 C ATOM 343 CG GLU A 696 -0.965 2.625 11.023 1.00 0.00 C ATOM 344 CD GLU A 696 -2.357 3.129 11.398 1.00 0.00 C ATOM 345 OE1 GLU A 696 -3.094 3.539 10.474 1.00 0.00 O ATOM 346 OE2 GLU A 696 -2.677 3.102 12.605 1.00 0.00 O ATOM 0 H GLU A 696 1.772 5.299 10.828 1.00 0.00 H new ATOM 0 HA GLU A 696 1.798 2.703 11.629 1.00 0.00 H new ATOM 0 HB2 GLU A 696 -0.034 4.377 11.851 1.00 0.00 H new ATOM 0 HB3 GLU A 696 -0.233 4.429 10.110 1.00 0.00 H new ATOM 0 HG2 GLU A 696 -1.007 2.109 10.064 1.00 0.00 H new ATOM 0 HG3 GLU A 696 -0.627 1.898 11.761 1.00 0.00 H new ATOM 353 N VAL A 697 2.204 2.670 8.495 1.00 0.00 N ATOM 354 CA VAL A 697 2.431 1.748 7.397 1.00 0.00 C ATOM 355 C VAL A 697 3.845 1.891 6.839 1.00 0.00 C ATOM 356 O VAL A 697 4.333 0.974 6.180 1.00 0.00 O ATOM 357 CB VAL A 697 1.333 1.924 6.344 1.00 0.00 C ATOM 358 CG1 VAL A 697 1.258 3.381 5.892 1.00 0.00 C ATOM 359 CG2 VAL A 697 1.558 1.020 5.134 1.00 0.00 C ATOM 0 H VAL A 697 2.547 3.617 8.332 1.00 0.00 H new ATOM 0 HA VAL A 697 2.367 0.721 7.758 1.00 0.00 H new ATOM 0 HB VAL A 697 0.389 1.638 6.808 1.00 0.00 H new ATOM 0 HG11 VAL A 697 0.473 3.490 5.144 1.00 0.00 H new ATOM 0 HG12 VAL A 697 1.033 4.017 6.749 1.00 0.00 H new ATOM 0 HG13 VAL A 697 2.214 3.678 5.461 1.00 0.00 H new ATOM 0 HG21 VAL A 697 0.758 1.175 4.410 1.00 0.00 H new ATOM 0 HG22 VAL A 697 2.516 1.261 4.673 1.00 0.00 H new ATOM 0 HG23 VAL A 697 1.561 -0.022 5.454 1.00 0.00 H new ATOM 369 N GLN A 698 4.524 3.016 7.091 1.00 0.00 N ATOM 370 CA GLN A 698 5.947 3.093 6.779 1.00 0.00 C ATOM 371 C GLN A 698 6.681 2.113 7.692 1.00 0.00 C ATOM 372 O GLN A 698 7.659 1.483 7.306 1.00 0.00 O ATOM 373 CB GLN A 698 6.527 4.460 7.130 1.00 0.00 C ATOM 374 CG GLN A 698 5.851 5.685 6.544 1.00 0.00 C ATOM 375 CD GLN A 698 6.438 6.924 7.209 1.00 0.00 C ATOM 376 OE1 GLN A 698 7.651 7.053 7.343 1.00 0.00 O ATOM 377 NE2 GLN A 698 5.594 7.847 7.637 1.00 0.00 N ATOM 0 H GLN A 698 4.122 3.860 7.498 1.00 0.00 H new ATOM 0 HA GLN A 698 6.064 2.887 5.715 1.00 0.00 H new ATOM 0 HB2 GLN A 698 6.518 4.559 8.215 1.00 0.00 H new ATOM 0 HB3 GLN A 698 7.571 4.471 6.817 1.00 0.00 H new ATOM 0 HG2 GLN A 698 6.006 5.724 5.466 1.00 0.00 H new ATOM 0 HG3 GLN A 698 4.775 5.640 6.710 1.00 0.00 H new ATOM 0 HE21 GLN A 698 4.590 7.716 7.514 1.00 0.00 H new ATOM 0 HE22 GLN A 698 5.947 8.690 8.090 1.00 0.00 H new ATOM 386 N LYS A 699 6.174 2.008 8.923 1.00 0.00 N ATOM 387 CA LYS A 699 6.787 1.292 10.022 1.00 0.00 C ATOM 388 C LYS A 699 6.462 -0.196 9.948 1.00 0.00 C ATOM 389 O LYS A 699 7.191 -1.032 10.480 1.00 0.00 O ATOM 390 CB LYS A 699 6.335 1.967 11.325 1.00 0.00 C ATOM 391 CG LYS A 699 5.007 1.498 11.917 1.00 0.00 C ATOM 392 CD LYS A 699 4.858 2.221 13.256 1.00 0.00 C ATOM 393 CE LYS A 699 3.413 2.602 13.542 1.00 0.00 C ATOM 394 NZ LYS A 699 3.278 3.166 14.899 1.00 0.00 N ATOM 0 H LYS A 699 5.288 2.441 9.182 1.00 0.00 H new ATOM 0 HA LYS A 699 7.875 1.341 9.974 1.00 0.00 H new ATOM 0 HB2 LYS A 699 7.113 1.817 12.073 1.00 0.00 H new ATOM 0 HB3 LYS A 699 6.268 3.040 11.146 1.00 0.00 H new ATOM 0 HG2 LYS A 699 4.178 1.737 11.251 1.00 0.00 H new ATOM 0 HG3 LYS A 699 5.003 0.417 12.056 1.00 0.00 H new ATOM 0 HD2 LYS A 699 5.229 1.581 14.057 1.00 0.00 H new ATOM 0 HD3 LYS A 699 5.476 3.119 13.254 1.00 0.00 H new ATOM 0 HE2 LYS A 699 3.071 3.329 12.805 1.00 0.00 H new ATOM 0 HE3 LYS A 699 2.774 1.724 13.443 1.00 0.00 H new ATOM 0 HZ1 LYS A 699 2.317 3.543 15.024 1.00 0.00 H new ATOM 0 HZ2 LYS A 699 3.453 2.421 15.603 1.00 0.00 H new ATOM 0 HZ3 LYS A 699 3.969 3.932 15.027 1.00 0.00 H new ATOM 408 N GLU A 700 5.359 -0.526 9.277 1.00 0.00 N ATOM 409 CA GLU A 700 5.017 -1.912 9.010 1.00 0.00 C ATOM 410 C GLU A 700 5.986 -2.412 7.951 1.00 0.00 C ATOM 411 O GLU A 700 6.388 -3.568 7.962 1.00 0.00 O ATOM 412 CB GLU A 700 3.584 -2.011 8.489 1.00 0.00 C ATOM 413 CG GLU A 700 2.577 -1.736 9.606 1.00 0.00 C ATOM 414 CD GLU A 700 1.138 -1.913 9.121 1.00 0.00 C ATOM 415 OE1 GLU A 700 0.877 -1.606 7.935 1.00 0.00 O ATOM 416 OE2 GLU A 700 0.306 -2.358 9.943 1.00 0.00 O ATOM 0 H GLU A 700 4.690 0.152 8.911 1.00 0.00 H new ATOM 0 HA GLU A 700 5.086 -2.509 9.919 1.00 0.00 H new ATOM 0 HB2 GLU A 700 3.438 -1.297 7.678 1.00 0.00 H new ATOM 0 HB3 GLU A 700 3.411 -3.004 8.075 1.00 0.00 H new ATOM 0 HG2 GLU A 700 2.766 -2.410 10.441 1.00 0.00 H new ATOM 0 HG3 GLU A 700 2.714 -0.721 9.979 1.00 0.00 H new ATOM 423 N LEU A 701 6.363 -1.514 7.034 1.00 0.00 N ATOM 424 CA LEU A 701 7.362 -1.783 6.022 1.00 0.00 C ATOM 425 C LEU A 701 8.728 -1.958 6.688 1.00 0.00 C ATOM 426 O LEU A 701 9.508 -2.816 6.281 1.00 0.00 O ATOM 427 CB LEU A 701 7.364 -0.611 5.037 1.00 0.00 C ATOM 428 CG LEU A 701 6.866 -1.021 3.649 1.00 0.00 C ATOM 429 CD1 LEU A 701 5.400 -1.451 3.712 1.00 0.00 C ATOM 430 CD2 LEU A 701 6.975 0.167 2.697 1.00 0.00 C ATOM 0 H LEU A 701 5.972 -0.573 6.982 1.00 0.00 H new ATOM 0 HA LEU A 701 7.138 -2.703 5.482 1.00 0.00 H new ATOM 0 HB2 LEU A 701 6.734 0.189 5.426 1.00 0.00 H new ATOM 0 HB3 LEU A 701 8.374 -0.210 4.955 1.00 0.00 H new ATOM 0 HG LEU A 701 7.477 -1.852 3.297 1.00 0.00 H new ATOM 0 HD11 LEU A 701 5.062 -1.739 2.717 1.00 0.00 H new ATOM 0 HD12 LEU A 701 5.298 -2.299 4.389 1.00 0.00 H new ATOM 0 HD13 LEU A 701 4.793 -0.622 4.075 1.00 0.00 H new ATOM 0 HD21 LEU A 701 6.620 -0.125 1.709 1.00 0.00 H new ATOM 0 HD22 LEU A 701 6.367 0.991 3.072 1.00 0.00 H new ATOM 0 HD23 LEU A 701 8.015 0.485 2.630 1.00 0.00 H new ATOM 442 N MET A 702 9.027 -1.148 7.713 1.00 0.00 N ATOM 443 CA MET A 702 10.261 -1.276 8.476 1.00 0.00 C ATOM 444 C MET A 702 10.272 -2.571 9.291 1.00 0.00 C ATOM 445 O MET A 702 11.331 -2.972 9.768 1.00 0.00 O ATOM 446 CB MET A 702 10.417 -0.098 9.442 1.00 0.00 C ATOM 447 CG MET A 702 10.557 1.271 8.773 1.00 0.00 C ATOM 448 SD MET A 702 12.213 1.711 8.181 1.00 0.00 S ATOM 449 CE MET A 702 12.196 0.906 6.563 1.00 0.00 C ATOM 0 H MET A 702 8.420 -0.392 8.030 1.00 0.00 H new ATOM 0 HA MET A 702 11.085 -1.288 7.762 1.00 0.00 H new ATOM 0 HB2 MET A 702 9.553 -0.075 10.106 1.00 0.00 H new ATOM 0 HB3 MET A 702 11.294 -0.272 10.066 1.00 0.00 H new ATOM 0 HG2 MET A 702 9.870 1.310 7.928 1.00 0.00 H new ATOM 0 HG3 MET A 702 10.234 2.033 9.482 1.00 0.00 H new ATOM 0 HE1 MET A 702 12.787 1.491 5.859 1.00 0.00 H new ATOM 0 HE2 MET A 702 12.621 -0.094 6.650 1.00 0.00 H new ATOM 0 HE3 MET A 702 11.170 0.834 6.203 1.00 0.00 H new ATOM 459 N ALA A 703 9.119 -3.227 9.462 1.00 0.00 N ATOM 460 CA ALA A 703 9.034 -4.472 10.216 1.00 0.00 C ATOM 461 C ALA A 703 8.880 -5.660 9.272 1.00 0.00 C ATOM 462 O ALA A 703 9.039 -6.811 9.676 1.00 0.00 O ATOM 463 CB ALA A 703 7.815 -4.407 11.133 1.00 0.00 C ATOM 0 H ALA A 703 8.227 -2.909 9.083 1.00 0.00 H new ATOM 0 HA ALA A 703 9.947 -4.600 10.797 1.00 0.00 H new ATOM 0 HB1 ALA A 703 7.739 -5.333 11.704 1.00 0.00 H new ATOM 0 HB2 ALA A 703 7.920 -3.566 11.818 1.00 0.00 H new ATOM 0 HB3 ALA A 703 6.915 -4.276 10.533 1.00 0.00 H new ATOM 469 N GLU A 704 8.571 -5.379 8.009 1.00 0.00 N ATOM 470 CA GLU A 704 8.319 -6.351 6.987 1.00 0.00 C ATOM 471 C GLU A 704 9.640 -6.727 6.334 1.00 0.00 C ATOM 472 O GLU A 704 9.784 -7.810 5.770 1.00 0.00 O ATOM 473 CB GLU A 704 7.395 -5.651 5.995 1.00 0.00 C ATOM 474 CG GLU A 704 7.167 -6.577 4.833 1.00 0.00 C ATOM 475 CD GLU A 704 5.999 -6.112 3.969 1.00 0.00 C ATOM 476 OE1 GLU A 704 6.123 -5.017 3.378 1.00 0.00 O ATOM 477 OE2 GLU A 704 4.994 -6.857 3.908 1.00 0.00 O ATOM 0 H GLU A 704 8.490 -4.420 7.670 1.00 0.00 H new ATOM 0 HA GLU A 704 7.867 -7.268 7.364 1.00 0.00 H new ATOM 0 HB2 GLU A 704 6.448 -5.398 6.471 1.00 0.00 H new ATOM 0 HB3 GLU A 704 7.841 -4.716 5.655 1.00 0.00 H new ATOM 0 HG2 GLU A 704 8.071 -6.631 4.226 1.00 0.00 H new ATOM 0 HG3 GLU A 704 6.970 -7.584 5.202 1.00 0.00 H new ATOM 484 N TRP A 705 10.605 -5.815 6.423 1.00 0.00 N ATOM 485 CA TRP A 705 11.912 -5.957 5.813 1.00 0.00 C ATOM 486 C TRP A 705 12.865 -6.574 6.820 1.00 0.00 C ATOM 487 O TRP A 705 13.893 -7.136 6.454 1.00 0.00 O ATOM 488 CB TRP A 705 12.370 -4.564 5.403 1.00 0.00 C ATOM 489 CG TRP A 705 11.591 -3.971 4.273 1.00 0.00 C ATOM 490 CD1 TRP A 705 10.730 -4.623 3.460 1.00 0.00 C ATOM 491 CD2 TRP A 705 11.591 -2.590 3.812 1.00 0.00 C ATOM 492 NE1 TRP A 705 10.209 -3.748 2.535 1.00 0.00 N ATOM 493 CE2 TRP A 705 10.708 -2.474 2.702 1.00 0.00 C ATOM 494 CE3 TRP A 705 12.255 -1.428 4.228 1.00 0.00 C ATOM 495 CZ2 TRP A 705 10.501 -1.263 2.031 1.00 0.00 C ATOM 496 CZ3 TRP A 705 12.077 -0.215 3.549 1.00 0.00 C ATOM 497 CH2 TRP A 705 11.213 -0.130 2.450 1.00 0.00 C ATOM 0 H TRP A 705 10.491 -4.940 6.934 1.00 0.00 H new ATOM 0 HA TRP A 705 11.883 -6.607 4.939 1.00 0.00 H new ATOM 0 HB2 TRP A 705 12.299 -3.902 6.266 1.00 0.00 H new ATOM 0 HB3 TRP A 705 13.422 -4.608 5.121 1.00 0.00 H new ATOM 0 HD1 TRP A 705 10.487 -5.673 3.527 1.00 0.00 H new ATOM 0 HE1 TRP A 705 9.536 -4.010 1.814 1.00 0.00 H new ATOM 0 HE3 TRP A 705 12.913 -1.468 5.084 1.00 0.00 H new ATOM 0 HZ2 TRP A 705 9.806 -1.203 1.206 1.00 0.00 H new ATOM 0 HZ3 TRP A 705 12.612 0.664 3.877 1.00 0.00 H new ATOM 0 HH2 TRP A 705 11.095 0.807 1.926 1.00 0.00 H new ATOM 575 N MET B 1 -11.621 12.816 -15.938 1.00 0.00 N ATOM 576 CA MET B 1 -11.438 12.483 -14.511 1.00 0.00 C ATOM 577 C MET B 1 -10.536 11.264 -14.364 1.00 0.00 C ATOM 578 O MET B 1 -10.771 10.267 -15.039 1.00 0.00 O ATOM 579 CB MET B 1 -12.787 12.253 -13.817 1.00 0.00 C ATOM 580 CG MET B 1 -13.573 11.058 -14.372 1.00 0.00 C ATOM 581 SD MET B 1 -14.158 11.220 -16.081 1.00 0.00 S ATOM 582 CE MET B 1 -15.029 9.637 -16.234 1.00 0.00 C ATOM 0 H1 MET B 1 -11.869 13.822 -16.031 1.00 0.00 H new ATOM 0 H2 MET B 1 -10.738 12.628 -16.454 1.00 0.00 H new ATOM 0 H3 MET B 1 -12.385 12.233 -16.335 1.00 0.00 H new ATOM 0 HA MET B 1 -10.957 13.331 -14.023 1.00 0.00 H new ATOM 0 HB2 MET B 1 -12.615 12.100 -12.752 1.00 0.00 H new ATOM 0 HB3 MET B 1 -13.394 13.153 -13.916 1.00 0.00 H new ATOM 0 HG2 MET B 1 -12.943 10.171 -14.307 1.00 0.00 H new ATOM 0 HG3 MET B 1 -14.435 10.884 -13.728 1.00 0.00 H new ATOM 0 HE1 MET B 1 -15.461 9.554 -17.231 1.00 0.00 H new ATOM 0 HE2 MET B 1 -14.327 8.819 -16.074 1.00 0.00 H new ATOM 0 HE3 MET B 1 -15.823 9.585 -15.489 1.00 0.00 H new ATOM 594 N GLN B 2 -9.514 11.334 -13.502 1.00 0.00 N ATOM 595 CA GLN B 2 -8.551 10.248 -13.325 1.00 0.00 C ATOM 596 C GLN B 2 -7.507 10.561 -12.252 1.00 0.00 C ATOM 597 O GLN B 2 -6.695 11.473 -12.408 1.00 0.00 O ATOM 598 CB GLN B 2 -7.854 9.957 -14.654 1.00 0.00 C ATOM 599 CG GLN B 2 -7.459 11.233 -15.400 1.00 0.00 C ATOM 600 CD GLN B 2 -6.513 10.993 -16.573 1.00 0.00 C ATOM 601 OE1 GLN B 2 -5.576 11.759 -16.784 1.00 0.00 O ATOM 602 NE2 GLN B 2 -6.733 9.938 -17.350 1.00 0.00 N ATOM 0 H GLN B 2 -9.334 12.145 -12.910 1.00 0.00 H new ATOM 0 HA GLN B 2 -9.107 9.372 -12.991 1.00 0.00 H new ATOM 0 HB2 GLN B 2 -6.963 9.357 -14.469 1.00 0.00 H new ATOM 0 HB3 GLN B 2 -8.514 9.361 -15.284 1.00 0.00 H new ATOM 0 HG2 GLN B 2 -8.361 11.722 -15.767 1.00 0.00 H new ATOM 0 HG3 GLN B 2 -6.986 11.921 -14.699 1.00 0.00 H new ATOM 0 HE21 GLN B 2 -7.517 9.316 -17.155 1.00 0.00 H new ATOM 0 HE22 GLN B 2 -6.117 9.750 -18.141 1.00 0.00 H new ATOM 611 N ILE B 3 -7.530 9.795 -11.154 1.00 0.00 N ATOM 612 CA ILE B 3 -6.719 10.108 -9.978 1.00 0.00 C ATOM 613 C ILE B 3 -5.282 9.631 -10.158 1.00 0.00 C ATOM 614 O ILE B 3 -5.018 8.688 -10.898 1.00 0.00 O ATOM 615 CB ILE B 3 -7.338 9.563 -8.680 1.00 0.00 C ATOM 616 CG1 ILE B 3 -7.268 8.039 -8.518 1.00 0.00 C ATOM 617 CG2 ILE B 3 -8.782 10.054 -8.558 1.00 0.00 C ATOM 618 CD1 ILE B 3 -7.960 7.258 -9.629 1.00 0.00 C ATOM 0 H ILE B 3 -8.102 8.956 -11.059 1.00 0.00 H new ATOM 0 HA ILE B 3 -6.701 11.194 -9.882 1.00 0.00 H new ATOM 0 HB ILE B 3 -6.727 9.955 -7.867 1.00 0.00 H new ATOM 0 HG12 ILE B 3 -6.221 7.738 -8.475 1.00 0.00 H new ATOM 0 HG13 ILE B 3 -7.718 7.766 -7.563 1.00 0.00 H new ATOM 0 HG21 ILE B 3 -9.221 9.668 -7.638 1.00 0.00 H new ATOM 0 HG22 ILE B 3 -8.795 11.144 -8.537 1.00 0.00 H new ATOM 0 HG23 ILE B 3 -9.360 9.701 -9.412 1.00 0.00 H new ATOM 0 HD11 ILE B 3 -7.863 6.189 -9.437 1.00 0.00 H new ATOM 0 HD12 ILE B 3 -9.016 7.527 -9.660 1.00 0.00 H new ATOM 0 HD13 ILE B 3 -7.496 7.498 -10.586 1.00 0.00 H new ATOM 630 N PHE B 4 -4.360 10.302 -9.463 1.00 0.00 N ATOM 631 CA PHE B 4 -2.930 10.104 -9.628 1.00 0.00 C ATOM 632 C PHE B 4 -2.414 9.216 -8.505 1.00 0.00 C ATOM 633 O PHE B 4 -2.023 9.690 -7.444 1.00 0.00 O ATOM 634 CB PHE B 4 -2.217 11.455 -9.594 1.00 0.00 C ATOM 635 CG PHE B 4 -2.422 12.360 -10.795 1.00 0.00 C ATOM 636 CD1 PHE B 4 -3.630 12.371 -11.507 1.00 0.00 C ATOM 637 CD2 PHE B 4 -1.382 13.206 -11.205 1.00 0.00 C ATOM 638 CE1 PHE B 4 -3.800 13.200 -12.618 1.00 0.00 C ATOM 639 CE2 PHE B 4 -1.545 14.043 -12.322 1.00 0.00 C ATOM 640 CZ PHE B 4 -2.754 14.036 -13.035 1.00 0.00 C ATOM 0 H PHE B 4 -4.595 11.005 -8.763 1.00 0.00 H new ATOM 0 HA PHE B 4 -2.734 9.624 -10.587 1.00 0.00 H new ATOM 0 HB2 PHE B 4 -2.544 11.991 -8.703 1.00 0.00 H new ATOM 0 HB3 PHE B 4 -1.148 11.274 -9.482 1.00 0.00 H new ATOM 0 HD1 PHE B 4 -4.440 11.730 -11.192 1.00 0.00 H new ATOM 0 HD2 PHE B 4 -0.450 13.215 -10.659 1.00 0.00 H new ATOM 0 HE1 PHE B 4 -4.737 13.197 -13.156 1.00 0.00 H new ATOM 0 HE2 PHE B 4 -0.739 14.692 -12.632 1.00 0.00 H new ATOM 0 HZ PHE B 4 -2.878 14.671 -13.900 1.00 0.00 H new ATOM 650 N VAL B 5 -2.424 7.908 -8.741 1.00 0.00 N ATOM 651 CA VAL B 5 -2.010 6.934 -7.744 1.00 0.00 C ATOM 652 C VAL B 5 -0.496 6.707 -7.812 1.00 0.00 C ATOM 653 O VAL B 5 -0.007 6.055 -8.730 1.00 0.00 O ATOM 654 CB VAL B 5 -2.774 5.623 -7.955 1.00 0.00 C ATOM 655 CG1 VAL B 5 -2.642 4.780 -6.693 1.00 0.00 C ATOM 656 CG2 VAL B 5 -4.262 5.867 -8.214 1.00 0.00 C ATOM 0 H VAL B 5 -2.719 7.497 -9.627 1.00 0.00 H new ATOM 0 HA VAL B 5 -2.244 7.316 -6.750 1.00 0.00 H new ATOM 0 HB VAL B 5 -2.352 5.119 -8.824 1.00 0.00 H new ATOM 0 HG11 VAL B 5 -3.180 3.841 -6.824 1.00 0.00 H new ATOM 0 HG12 VAL B 5 -1.589 4.571 -6.504 1.00 0.00 H new ATOM 0 HG13 VAL B 5 -3.062 5.324 -5.847 1.00 0.00 H new ATOM 0 HG21 VAL B 5 -4.768 4.912 -8.358 1.00 0.00 H new ATOM 0 HG22 VAL B 5 -4.700 6.384 -7.360 1.00 0.00 H new ATOM 0 HG23 VAL B 5 -4.380 6.479 -9.108 1.00 0.00 H new ATOM 666 N LYS B 6 0.250 7.244 -6.841 1.00 0.00 N ATOM 667 CA LYS B 6 1.701 7.111 -6.773 1.00 0.00 C ATOM 668 C LYS B 6 2.069 5.710 -6.296 1.00 0.00 C ATOM 669 O LYS B 6 1.536 5.226 -5.301 1.00 0.00 O ATOM 670 CB LYS B 6 2.237 8.160 -5.795 1.00 0.00 C ATOM 671 CG LYS B 6 3.721 7.934 -5.486 1.00 0.00 C ATOM 672 CD LYS B 6 4.653 8.387 -6.606 1.00 0.00 C ATOM 673 CE LYS B 6 4.810 9.900 -6.600 1.00 0.00 C ATOM 674 NZ LYS B 6 5.479 10.376 -5.372 1.00 0.00 N ATOM 0 H LYS B 6 -0.145 7.788 -6.074 1.00 0.00 H new ATOM 0 HA LYS B 6 2.140 7.266 -7.758 1.00 0.00 H new ATOM 0 HB2 LYS B 6 2.100 9.156 -6.217 1.00 0.00 H new ATOM 0 HB3 LYS B 6 1.662 8.124 -4.870 1.00 0.00 H new ATOM 0 HG2 LYS B 6 3.979 8.468 -4.572 1.00 0.00 H new ATOM 0 HG3 LYS B 6 3.886 6.874 -5.293 1.00 0.00 H new ATOM 0 HD2 LYS B 6 5.628 7.915 -6.487 1.00 0.00 H new ATOM 0 HD3 LYS B 6 4.257 8.062 -7.568 1.00 0.00 H new ATOM 0 HE2 LYS B 6 5.387 10.209 -7.472 1.00 0.00 H new ATOM 0 HE3 LYS B 6 3.829 10.368 -6.685 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 5.826 11.345 -5.519 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 4.803 10.366 -4.582 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 6.280 9.752 -5.149 1.00 0.00 H new ATOM 688 N THR B 7 2.987 5.074 -7.021 1.00 0.00 N ATOM 689 CA THR B 7 3.445 3.724 -6.727 1.00 0.00 C ATOM 690 C THR B 7 4.779 3.773 -5.987 1.00 0.00 C ATOM 691 O THR B 7 5.416 4.820 -5.915 1.00 0.00 O ATOM 692 CB THR B 7 3.554 2.938 -8.040 1.00 0.00 C ATOM 693 OG1 THR B 7 3.566 1.560 -7.752 1.00 0.00 O ATOM 694 CG2 THR B 7 4.837 3.287 -8.779 1.00 0.00 C ATOM 0 H THR B 7 3.437 5.489 -7.837 1.00 0.00 H new ATOM 0 HA THR B 7 2.731 3.217 -6.078 1.00 0.00 H new ATOM 0 HB THR B 7 2.701 3.197 -8.668 1.00 0.00 H new ATOM 0 HG1 THR B 7 3.634 1.052 -8.587 1.00 0.00 H new ATOM 0 HG21 THR B 7 4.890 2.716 -9.706 1.00 0.00 H new ATOM 0 HG22 THR B 7 4.847 4.353 -9.008 1.00 0.00 H new ATOM 0 HG23 THR B 7 5.695 3.043 -8.153 1.00 0.00 H new ATOM 702 N LEU B 8 5.195 2.631 -5.437 1.00 0.00 N ATOM 703 CA LEU B 8 6.385 2.472 -4.607 1.00 0.00 C ATOM 704 C LEU B 8 7.710 2.711 -5.346 1.00 0.00 C ATOM 705 O LEU B 8 8.756 2.292 -4.853 1.00 0.00 O ATOM 706 CB LEU B 8 6.350 1.055 -4.025 1.00 0.00 C ATOM 707 CG LEU B 8 5.261 0.872 -2.963 1.00 0.00 C ATOM 708 CD1 LEU B 8 5.320 -0.574 -2.469 1.00 0.00 C ATOM 709 CD2 LEU B 8 5.478 1.804 -1.771 1.00 0.00 C ATOM 0 H LEU B 8 4.688 1.755 -5.565 1.00 0.00 H new ATOM 0 HA LEU B 8 6.357 3.237 -3.831 1.00 0.00 H new ATOM 0 HB2 LEU B 8 6.187 0.340 -4.832 1.00 0.00 H new ATOM 0 HB3 LEU B 8 7.321 0.824 -3.586 1.00 0.00 H new ATOM 0 HG LEU B 8 4.294 1.107 -3.408 1.00 0.00 H new ATOM 0 HD11 LEU B 8 4.553 -0.731 -1.710 1.00 0.00 H new ATOM 0 HD12 LEU B 8 5.147 -1.252 -3.305 1.00 0.00 H new ATOM 0 HD13 LEU B 8 6.302 -0.772 -2.039 1.00 0.00 H new ATOM 0 HD21 LEU B 8 4.687 1.647 -1.038 1.00 0.00 H new ATOM 0 HD22 LEU B 8 6.444 1.591 -1.314 1.00 0.00 H new ATOM 0 HD23 LEU B 8 5.458 2.840 -2.110 1.00 0.00 H new ATOM 721 N THR B 9 7.702 3.372 -6.509 1.00 0.00 N ATOM 722 CA THR B 9 8.929 3.633 -7.261 1.00 0.00 C ATOM 723 C THR B 9 8.998 5.071 -7.774 1.00 0.00 C ATOM 724 O THR B 9 9.920 5.418 -8.511 1.00 0.00 O ATOM 725 CB THR B 9 9.065 2.644 -8.423 1.00 0.00 C ATOM 726 OG1 THR B 9 7.975 2.798 -9.304 1.00 0.00 O ATOM 727 CG2 THR B 9 9.107 1.201 -7.921 1.00 0.00 C ATOM 0 H THR B 9 6.856 3.736 -6.948 1.00 0.00 H new ATOM 0 HA THR B 9 9.764 3.495 -6.574 1.00 0.00 H new ATOM 0 HB THR B 9 10.000 2.856 -8.941 1.00 0.00 H new ATOM 0 HG1 THR B 9 8.064 2.166 -10.048 1.00 0.00 H new ATOM 0 HG21 THR B 9 9.204 0.523 -8.769 1.00 0.00 H new ATOM 0 HG22 THR B 9 9.960 1.072 -7.254 1.00 0.00 H new ATOM 0 HG23 THR B 9 8.187 0.977 -7.381 1.00 0.00 H new ATOM 735 N GLY B 10 8.034 5.916 -7.394 1.00 0.00 N ATOM 736 CA GLY B 10 8.030 7.330 -7.764 1.00 0.00 C ATOM 737 C GLY B 10 7.166 7.605 -8.990 1.00 0.00 C ATOM 738 O GLY B 10 7.041 8.754 -9.407 1.00 0.00 O ATOM 0 H GLY B 10 7.237 5.637 -6.822 1.00 0.00 H new ATOM 0 HA2 GLY B 10 7.665 7.922 -6.925 1.00 0.00 H new ATOM 0 HA3 GLY B 10 9.052 7.654 -7.962 1.00 0.00 H new ATOM 742 N LYS B 11 6.573 6.560 -9.565 1.00 0.00 N ATOM 743 CA LYS B 11 5.752 6.661 -10.755 1.00 0.00 C ATOM 744 C LYS B 11 4.317 6.931 -10.340 1.00 0.00 C ATOM 745 O LYS B 11 3.885 6.506 -9.271 1.00 0.00 O ATOM 746 CB LYS B 11 5.917 5.348 -11.534 1.00 0.00 C ATOM 747 CG LYS B 11 4.945 5.177 -12.699 1.00 0.00 C ATOM 748 CD LYS B 11 3.617 4.532 -12.277 1.00 0.00 C ATOM 749 CE LYS B 11 2.699 4.456 -13.501 1.00 0.00 C ATOM 750 NZ LYS B 11 3.184 3.469 -14.487 1.00 0.00 N ATOM 0 H LYS B 11 6.655 5.609 -9.207 1.00 0.00 H new ATOM 0 HA LYS B 11 6.051 7.485 -11.403 1.00 0.00 H new ATOM 0 HB2 LYS B 11 6.936 5.293 -11.916 1.00 0.00 H new ATOM 0 HB3 LYS B 11 5.789 4.513 -10.845 1.00 0.00 H new ATOM 0 HG2 LYS B 11 4.745 6.151 -13.145 1.00 0.00 H new ATOM 0 HG3 LYS B 11 5.413 4.564 -13.469 1.00 0.00 H new ATOM 0 HD2 LYS B 11 3.792 3.535 -11.873 1.00 0.00 H new ATOM 0 HD3 LYS B 11 3.146 5.117 -11.487 1.00 0.00 H new ATOM 0 HE2 LYS B 11 1.691 4.189 -13.184 1.00 0.00 H new ATOM 0 HE3 LYS B 11 2.636 5.438 -13.970 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 2.538 3.445 -15.301 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 4.136 3.738 -14.808 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 3.221 2.528 -14.047 1.00 0.00 H new ATOM 764 N THR B 12 3.572 7.638 -11.188 1.00 0.00 N ATOM 765 CA THR B 12 2.205 8.022 -10.884 1.00 0.00 C ATOM 766 C THR B 12 1.277 7.406 -11.918 1.00 0.00 C ATOM 767 O THR B 12 1.303 7.774 -13.091 1.00 0.00 O ATOM 768 CB THR B 12 2.101 9.543 -10.875 1.00 0.00 C ATOM 769 OG1 THR B 12 2.863 10.055 -9.800 1.00 0.00 O ATOM 770 CG2 THR B 12 0.650 9.987 -10.704 1.00 0.00 C ATOM 0 H THR B 12 3.902 7.957 -12.099 1.00 0.00 H new ATOM 0 HA THR B 12 1.913 7.657 -9.900 1.00 0.00 H new ATOM 0 HB THR B 12 2.477 9.921 -11.826 1.00 0.00 H new ATOM 0 HG1 THR B 12 2.800 11.033 -9.791 1.00 0.00 H new ATOM 0 HG21 THR B 12 0.601 11.076 -10.701 1.00 0.00 H new ATOM 0 HG22 THR B 12 0.051 9.599 -11.528 1.00 0.00 H new ATOM 0 HG23 THR B 12 0.261 9.603 -9.761 1.00 0.00 H new ATOM 778 N ILE B 13 0.456 6.461 -11.466 1.00 0.00 N ATOM 779 CA ILE B 13 -0.539 5.804 -12.288 1.00 0.00 C ATOM 780 C ILE B 13 -1.724 6.757 -12.377 1.00 0.00 C ATOM 781 O ILE B 13 -1.999 7.491 -11.432 1.00 0.00 O ATOM 782 CB ILE B 13 -0.965 4.485 -11.629 1.00 0.00 C ATOM 783 CG1 ILE B 13 0.219 3.705 -11.034 1.00 0.00 C ATOM 784 CG2 ILE B 13 -1.662 3.613 -12.677 1.00 0.00 C ATOM 785 CD1 ILE B 13 -0.255 2.582 -10.112 1.00 0.00 C ATOM 0 H ILE B 13 0.469 6.130 -10.501 1.00 0.00 H new ATOM 0 HA ILE B 13 -0.150 5.572 -13.279 1.00 0.00 H new ATOM 0 HB ILE B 13 -1.636 4.731 -10.806 1.00 0.00 H new ATOM 0 HG12 ILE B 13 0.821 3.285 -11.840 1.00 0.00 H new ATOM 0 HG13 ILE B 13 0.862 4.387 -10.477 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -1.970 2.672 -12.221 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -2.539 4.135 -13.059 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -0.974 3.410 -13.498 1.00 0.00 H new ATOM 0 HD11 ILE B 13 0.609 2.052 -9.710 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -0.835 3.005 -9.292 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -0.877 1.887 -10.676 1.00 0.00 H new ATOM 797 N THR B 14 -2.427 6.746 -13.504 1.00 0.00 N ATOM 798 CA THR B 14 -3.560 7.636 -13.711 1.00 0.00 C ATOM 799 C THR B 14 -4.651 6.912 -14.488 1.00 0.00 C ATOM 800 O THR B 14 -4.459 6.556 -15.650 1.00 0.00 O ATOM 801 CB THR B 14 -3.101 8.901 -14.435 1.00 0.00 C ATOM 802 OG1 THR B 14 -2.023 9.495 -13.744 1.00 0.00 O ATOM 803 CG2 THR B 14 -4.248 9.904 -14.493 1.00 0.00 C ATOM 0 H THR B 14 -2.230 6.127 -14.291 1.00 0.00 H new ATOM 0 HA THR B 14 -3.975 7.933 -12.748 1.00 0.00 H new ATOM 0 HB THR B 14 -2.787 8.628 -15.442 1.00 0.00 H new ATOM 0 HG1 THR B 14 -1.736 10.304 -14.218 1.00 0.00 H new ATOM 0 HG21 THR B 14 -3.918 10.805 -15.010 1.00 0.00 H new ATOM 0 HG22 THR B 14 -5.088 9.465 -15.030 1.00 0.00 H new ATOM 0 HG23 THR B 14 -4.559 10.160 -13.480 1.00 0.00 H new ATOM 811 N LEU B 15 -5.798 6.696 -13.835 1.00 0.00 N ATOM 812 CA LEU B 15 -6.927 5.970 -14.395 1.00 0.00 C ATOM 813 C LEU B 15 -8.228 6.610 -13.951 1.00 0.00 C ATOM 814 O LEU B 15 -8.313 7.227 -12.891 1.00 0.00 O ATOM 815 CB LEU B 15 -6.850 4.459 -14.074 1.00 0.00 C ATOM 816 CG LEU B 15 -6.488 4.013 -12.645 1.00 0.00 C ATOM 817 CD1 LEU B 15 -5.110 4.470 -12.183 1.00 0.00 C ATOM 818 CD2 LEU B 15 -7.525 4.450 -11.621 1.00 0.00 C ATOM 0 H LEU B 15 -5.964 7.030 -12.886 1.00 0.00 H new ATOM 0 HA LEU B 15 -6.888 6.038 -15.482 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -7.818 4.022 -14.319 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -6.119 4.016 -14.751 1.00 0.00 H new ATOM 0 HG LEU B 15 -6.473 2.925 -12.705 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -4.931 4.116 -11.168 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -4.349 4.063 -12.849 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -5.063 5.559 -12.201 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -7.223 4.111 -10.630 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -7.604 5.537 -11.624 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -8.492 4.015 -11.874 1.00 0.00 H new ATOM 830 N GLU B 16 -9.243 6.452 -14.794 1.00 0.00 N ATOM 831 CA GLU B 16 -10.485 7.178 -14.670 1.00 0.00 C ATOM 832 C GLU B 16 -11.397 6.534 -13.643 1.00 0.00 C ATOM 833 O GLU B 16 -11.379 5.322 -13.451 1.00 0.00 O ATOM 834 CB GLU B 16 -11.179 7.193 -16.026 1.00 0.00 C ATOM 835 CG GLU B 16 -10.282 7.799 -17.106 1.00 0.00 C ATOM 836 CD GLU B 16 -9.089 6.919 -17.477 1.00 0.00 C ATOM 837 OE1 GLU B 16 -9.294 5.700 -17.662 1.00 0.00 O ATOM 838 OE2 GLU B 16 -7.975 7.479 -17.569 1.00 0.00 O ATOM 0 H GLU B 16 -9.219 5.810 -15.586 1.00 0.00 H new ATOM 0 HA GLU B 16 -10.267 8.193 -14.339 1.00 0.00 H new ATOM 0 HB2 GLU B 16 -11.453 6.176 -16.307 1.00 0.00 H new ATOM 0 HB3 GLU B 16 -12.104 7.765 -15.956 1.00 0.00 H new ATOM 0 HG2 GLU B 16 -10.878 7.984 -18.000 1.00 0.00 H new ATOM 0 HG3 GLU B 16 -9.916 8.766 -16.762 1.00 0.00 H new ATOM 845 N VAL B 17 -12.198 7.367 -12.985 1.00 0.00 N ATOM 846 CA VAL B 17 -13.065 6.943 -11.892 1.00 0.00 C ATOM 847 C VAL B 17 -14.256 7.884 -11.762 1.00 0.00 C ATOM 848 O VAL B 17 -14.323 8.897 -12.451 1.00 0.00 O ATOM 849 CB VAL B 17 -12.297 6.944 -10.561 1.00 0.00 C ATOM 850 CG1 VAL B 17 -11.172 5.912 -10.541 1.00 0.00 C ATOM 851 CG2 VAL B 17 -11.708 8.327 -10.273 1.00 0.00 C ATOM 0 H VAL B 17 -12.264 8.362 -13.197 1.00 0.00 H new ATOM 0 HA VAL B 17 -13.412 5.934 -12.116 1.00 0.00 H new ATOM 0 HB VAL B 17 -13.019 6.680 -9.789 1.00 0.00 H new ATOM 0 HG11 VAL B 17 -10.659 5.951 -9.580 1.00 0.00 H new ATOM 0 HG12 VAL B 17 -11.589 4.916 -10.689 1.00 0.00 H new ATOM 0 HG13 VAL B 17 -10.463 6.131 -11.340 1.00 0.00 H new ATOM 0 HG21 VAL B 17 -11.169 8.303 -9.326 1.00 0.00 H new ATOM 0 HG22 VAL B 17 -11.022 8.604 -11.074 1.00 0.00 H new ATOM 0 HG23 VAL B 17 -12.513 9.060 -10.214 1.00 0.00 H new ATOM 861 N GLU B 18 -15.193 7.545 -10.875 1.00 0.00 N ATOM 862 CA GLU B 18 -16.388 8.344 -10.644 1.00 0.00 C ATOM 863 C GLU B 18 -16.784 8.260 -9.171 1.00 0.00 C ATOM 864 O GLU B 18 -16.361 7.341 -8.470 1.00 0.00 O ATOM 865 CB GLU B 18 -17.528 7.817 -11.524 1.00 0.00 C ATOM 866 CG GLU B 18 -17.146 7.882 -13.003 1.00 0.00 C ATOM 867 CD GLU B 18 -18.326 7.516 -13.899 1.00 0.00 C ATOM 868 OE1 GLU B 18 -19.277 8.329 -13.963 1.00 0.00 O ATOM 869 OE2 GLU B 18 -18.272 6.427 -14.515 1.00 0.00 O ATOM 0 H GLU B 18 -15.140 6.706 -10.297 1.00 0.00 H new ATOM 0 HA GLU B 18 -16.188 9.385 -10.899 1.00 0.00 H new ATOM 0 HB2 GLU B 18 -17.760 6.788 -11.249 1.00 0.00 H new ATOM 0 HB3 GLU B 18 -18.429 8.405 -11.350 1.00 0.00 H new ATOM 0 HG2 GLU B 18 -16.799 8.886 -13.247 1.00 0.00 H new ATOM 0 HG3 GLU B 18 -16.316 7.203 -13.196 1.00 0.00 H new ATOM 876 N PRO B 19 -17.596 9.207 -8.684 1.00 0.00 N ATOM 877 CA PRO B 19 -18.109 9.199 -7.324 1.00 0.00 C ATOM 878 C PRO B 19 -19.132 8.080 -7.129 1.00 0.00 C ATOM 879 O PRO B 19 -19.762 7.997 -6.077 1.00 0.00 O ATOM 880 CB PRO B 19 -18.736 10.572 -7.111 1.00 0.00 C ATOM 881 CG PRO B 19 -19.110 11.024 -8.522 1.00 0.00 C ATOM 882 CD PRO B 19 -18.070 10.360 -9.422 1.00 0.00 C ATOM 0 HA PRO B 19 -17.318 9.010 -6.598 1.00 0.00 H new ATOM 0 HB2 PRO B 19 -19.611 10.516 -6.464 1.00 0.00 H new ATOM 0 HB3 PRO B 19 -18.036 11.263 -6.642 1.00 0.00 H new ATOM 0 HG2 PRO B 19 -20.121 10.711 -8.785 1.00 0.00 H new ATOM 0 HG3 PRO B 19 -19.079 12.110 -8.613 1.00 0.00 H new ATOM 0 HD2 PRO B 19 -18.508 10.063 -10.375 1.00 0.00 H new ATOM 0 HD3 PRO B 19 -17.252 11.045 -9.647 1.00 0.00 H new ATOM 890 N SER B 20 -19.290 7.227 -8.143 1.00 0.00 N ATOM 891 CA SER B 20 -20.175 6.074 -8.082 1.00 0.00 C ATOM 892 C SER B 20 -19.361 4.798 -8.258 1.00 0.00 C ATOM 893 O SER B 20 -19.908 3.699 -8.174 1.00 0.00 O ATOM 894 CB SER B 20 -21.268 6.181 -9.138 1.00 0.00 C ATOM 895 OG SER B 20 -21.980 7.392 -8.985 1.00 0.00 O ATOM 0 H SER B 20 -18.802 7.322 -9.033 1.00 0.00 H new ATOM 0 HA SER B 20 -20.662 6.045 -7.107 1.00 0.00 H new ATOM 0 HB2 SER B 20 -20.827 6.134 -10.134 1.00 0.00 H new ATOM 0 HB3 SER B 20 -21.951 5.336 -9.051 1.00 0.00 H new ATOM 0 HG SER B 20 -22.678 7.450 -9.670 1.00 0.00 H new ATOM 901 N ASP B 21 -18.052 4.934 -8.499 1.00 0.00 N ATOM 902 CA ASP B 21 -17.143 3.820 -8.432 1.00 0.00 C ATOM 903 C ASP B 21 -16.839 3.640 -6.959 1.00 0.00 C ATOM 904 O ASP B 21 -17.208 4.454 -6.112 1.00 0.00 O ATOM 905 CB ASP B 21 -15.845 4.093 -9.199 1.00 0.00 C ATOM 906 CG ASP B 21 -16.035 4.141 -10.712 1.00 0.00 C ATOM 907 OD1 ASP B 21 -17.186 4.319 -11.167 1.00 0.00 O ATOM 908 OD2 ASP B 21 -15.003 3.993 -11.403 1.00 0.00 O ATOM 0 H ASP B 21 -17.610 5.820 -8.743 1.00 0.00 H new ATOM 0 HA ASP B 21 -17.586 2.933 -8.885 1.00 0.00 H new ATOM 0 HB2 ASP B 21 -15.425 5.041 -8.863 1.00 0.00 H new ATOM 0 HB3 ASP B 21 -15.118 3.318 -8.956 1.00 0.00 H new ATOM 913 N THR B 22 -16.155 2.553 -6.671 1.00 0.00 N ATOM 914 CA THR B 22 -15.834 2.120 -5.327 1.00 0.00 C ATOM 915 C THR B 22 -14.335 1.903 -5.229 1.00 0.00 C ATOM 916 O THR B 22 -13.643 1.855 -6.243 1.00 0.00 O ATOM 917 CB THR B 22 -16.635 0.854 -4.992 1.00 0.00 C ATOM 918 OG1 THR B 22 -16.141 0.255 -3.815 1.00 0.00 O ATOM 919 CG2 THR B 22 -16.549 -0.174 -6.114 1.00 0.00 C ATOM 0 H THR B 22 -15.795 1.925 -7.390 1.00 0.00 H new ATOM 0 HA THR B 22 -16.111 2.879 -4.595 1.00 0.00 H new ATOM 0 HB THR B 22 -17.672 1.161 -4.858 1.00 0.00 H new ATOM 0 HG1 THR B 22 -16.419 0.783 -3.038 1.00 0.00 H new ATOM 0 HG21 THR B 22 -17.127 -1.057 -5.843 1.00 0.00 H new ATOM 0 HG22 THR B 22 -16.950 0.255 -7.032 1.00 0.00 H new ATOM 0 HG23 THR B 22 -15.508 -0.456 -6.270 1.00 0.00 H new ATOM 927 N ILE B 23 -13.827 1.770 -4.006 1.00 0.00 N ATOM 928 CA ILE B 23 -12.416 1.539 -3.776 1.00 0.00 C ATOM 929 C ILE B 23 -12.035 0.193 -4.400 1.00 0.00 C ATOM 930 O ILE B 23 -10.864 -0.057 -4.689 1.00 0.00 O ATOM 931 CB ILE B 23 -12.143 1.609 -2.266 1.00 0.00 C ATOM 932 CG1 ILE B 23 -12.701 2.919 -1.676 1.00 0.00 C ATOM 933 CG2 ILE B 23 -10.638 1.495 -2.038 1.00 0.00 C ATOM 934 CD1 ILE B 23 -12.049 4.150 -2.296 1.00 0.00 C ATOM 0 H ILE B 23 -14.385 1.820 -3.154 1.00 0.00 H new ATOM 0 HA ILE B 23 -11.796 2.301 -4.248 1.00 0.00 H new ATOM 0 HB ILE B 23 -12.646 0.786 -1.758 1.00 0.00 H new ATOM 0 HG12 ILE B 23 -13.778 2.959 -1.838 1.00 0.00 H new ATOM 0 HG13 ILE B 23 -12.540 2.928 -0.598 1.00 0.00 H new ATOM 0 HG21 ILE B 23 -10.427 1.543 -0.970 1.00 0.00 H new ATOM 0 HG22 ILE B 23 -10.281 0.545 -2.436 1.00 0.00 H new ATOM 0 HG23 ILE B 23 -10.130 2.315 -2.545 1.00 0.00 H new ATOM 0 HD11 ILE B 23 -12.473 5.050 -1.850 1.00 0.00 H new ATOM 0 HD12 ILE B 23 -10.975 4.125 -2.111 1.00 0.00 H new ATOM 0 HD13 ILE B 23 -12.232 4.157 -3.370 1.00 0.00 H new ATOM 946 N GLU B 24 -13.031 -0.674 -4.613 1.00 0.00 N ATOM 947 CA GLU B 24 -12.852 -1.939 -5.305 1.00 0.00 C ATOM 948 C GLU B 24 -12.613 -1.719 -6.802 1.00 0.00 C ATOM 949 O GLU B 24 -11.962 -2.532 -7.458 1.00 0.00 O ATOM 950 CB GLU B 24 -14.100 -2.799 -5.083 1.00 0.00 C ATOM 951 CG GLU B 24 -14.097 -4.012 -6.009 1.00 0.00 C ATOM 952 CD GLU B 24 -15.128 -5.049 -5.571 1.00 0.00 C ATOM 953 OE1 GLU B 24 -16.336 -4.795 -5.784 1.00 0.00 O ATOM 954 OE2 GLU B 24 -14.703 -6.094 -5.024 1.00 0.00 O ATOM 0 H GLU B 24 -13.989 -0.509 -4.304 1.00 0.00 H new ATOM 0 HA GLU B 24 -11.974 -2.447 -4.905 1.00 0.00 H new ATOM 0 HB2 GLU B 24 -14.139 -3.129 -4.045 1.00 0.00 H new ATOM 0 HB3 GLU B 24 -14.994 -2.202 -5.262 1.00 0.00 H new ATOM 0 HG2 GLU B 24 -14.310 -3.693 -7.029 1.00 0.00 H new ATOM 0 HG3 GLU B 24 -13.105 -4.464 -6.017 1.00 0.00 H new ATOM 961 N ASN B 25 -13.137 -0.620 -7.347 1.00 0.00 N ATOM 962 CA ASN B 25 -12.969 -0.283 -8.752 1.00 0.00 C ATOM 963 C ASN B 25 -11.593 0.335 -8.977 1.00 0.00 C ATOM 964 O ASN B 25 -10.973 0.102 -10.013 1.00 0.00 O ATOM 965 CB ASN B 25 -14.053 0.710 -9.188 1.00 0.00 C ATOM 966 CG ASN B 25 -14.830 0.218 -10.401 1.00 0.00 C ATOM 967 OD1 ASN B 25 -15.069 -0.975 -10.560 1.00 0.00 O ATOM 968 ND2 ASN B 25 -15.236 1.143 -11.264 1.00 0.00 N ATOM 0 H ASN B 25 -13.689 0.058 -6.822 1.00 0.00 H new ATOM 0 HA ASN B 25 -13.058 -1.194 -9.344 1.00 0.00 H new ATOM 0 HB2 ASN B 25 -14.743 0.879 -8.361 1.00 0.00 H new ATOM 0 HB3 ASN B 25 -13.592 1.670 -9.419 1.00 0.00 H new ATOM 0 HD21 ASN B 25 -15.765 0.870 -12.092 1.00 0.00 H new ATOM 0 HD22 ASN B 25 -15.018 2.126 -11.098 1.00 0.00 H new ATOM 975 N VAL B 26 -11.110 1.123 -8.012 1.00 0.00 N ATOM 976 CA VAL B 26 -9.823 1.789 -8.136 1.00 0.00 C ATOM 977 C VAL B 26 -8.700 0.758 -8.145 1.00 0.00 C ATOM 978 O VAL B 26 -7.771 0.874 -8.938 1.00 0.00 O ATOM 979 CB VAL B 26 -9.651 2.793 -6.991 1.00 0.00 C ATOM 980 CG1 VAL B 26 -8.313 3.521 -7.108 1.00 0.00 C ATOM 981 CG2 VAL B 26 -10.775 3.832 -7.047 1.00 0.00 C ATOM 0 H VAL B 26 -11.597 1.312 -7.136 1.00 0.00 H new ATOM 0 HA VAL B 26 -9.782 2.335 -9.078 1.00 0.00 H new ATOM 0 HB VAL B 26 -9.684 2.246 -6.049 1.00 0.00 H new ATOM 0 HG11 VAL B 26 -8.211 4.229 -6.286 1.00 0.00 H new ATOM 0 HG12 VAL B 26 -7.500 2.796 -7.066 1.00 0.00 H new ATOM 0 HG13 VAL B 26 -8.272 4.058 -8.056 1.00 0.00 H new ATOM 0 HG21 VAL B 26 -10.652 4.546 -6.232 1.00 0.00 H new ATOM 0 HG22 VAL B 26 -10.736 4.359 -8.000 1.00 0.00 H new ATOM 0 HG23 VAL B 26 -11.738 3.332 -6.948 1.00 0.00 H new ATOM 991 N LYS B 27 -8.773 -0.255 -7.274 1.00 0.00 N ATOM 992 CA LYS B 27 -7.751 -1.293 -7.247 1.00 0.00 C ATOM 993 C LYS B 27 -7.835 -2.171 -8.497 1.00 0.00 C ATOM 994 O LYS B 27 -6.850 -2.800 -8.871 1.00 0.00 O ATOM 995 CB LYS B 27 -7.868 -2.117 -5.958 1.00 0.00 C ATOM 996 CG LYS B 27 -9.185 -2.888 -5.898 1.00 0.00 C ATOM 997 CD LYS B 27 -9.342 -3.591 -4.549 1.00 0.00 C ATOM 998 CE LYS B 27 -10.461 -4.629 -4.638 1.00 0.00 C ATOM 999 NZ LYS B 27 -10.787 -5.199 -3.317 1.00 0.00 N ATOM 0 H LYS B 27 -9.520 -0.373 -6.590 1.00 0.00 H new ATOM 0 HA LYS B 27 -6.768 -0.822 -7.252 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -7.034 -2.816 -5.896 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -7.794 -1.455 -5.095 1.00 0.00 H new ATOM 0 HG2 LYS B 27 -10.019 -2.204 -6.056 1.00 0.00 H new ATOM 0 HG3 LYS B 27 -9.218 -3.623 -6.702 1.00 0.00 H new ATOM 0 HD2 LYS B 27 -8.406 -4.074 -4.268 1.00 0.00 H new ATOM 0 HD3 LYS B 27 -9.570 -2.862 -3.772 1.00 0.00 H new ATOM 0 HE2 LYS B 27 -11.352 -4.167 -5.064 1.00 0.00 H new ATOM 0 HE3 LYS B 27 -10.161 -5.429 -5.315 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 -10.945 -6.223 -3.410 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 -9.998 -5.028 -2.661 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 -11.648 -4.748 -2.947 1.00 0.00 H new ATOM 1013 N ALA B 28 -9.002 -2.216 -9.146 1.00 0.00 N ATOM 1014 CA ALA B 28 -9.184 -2.985 -10.368 1.00 0.00 C ATOM 1015 C ALA B 28 -8.664 -2.215 -11.583 1.00 0.00 C ATOM 1016 O ALA B 28 -8.188 -2.825 -12.539 1.00 0.00 O ATOM 1017 CB ALA B 28 -10.677 -3.282 -10.525 1.00 0.00 C ATOM 0 H ALA B 28 -9.839 -1.722 -8.837 1.00 0.00 H new ATOM 0 HA ALA B 28 -8.618 -3.914 -10.305 1.00 0.00 H new ATOM 0 HB1 ALA B 28 -10.839 -3.859 -11.436 1.00 0.00 H new ATOM 0 HB2 ALA B 28 -11.026 -3.854 -9.666 1.00 0.00 H new ATOM 0 HB3 ALA B 28 -11.230 -2.345 -10.586 1.00 0.00 H new ATOM 1023 N LYS B 29 -8.748 -0.882 -11.556 1.00 0.00 N ATOM 1024 CA LYS B 29 -8.186 -0.050 -12.612 1.00 0.00 C ATOM 1025 C LYS B 29 -6.664 -0.039 -12.491 1.00 0.00 C ATOM 1026 O LYS B 29 -5.961 0.045 -13.495 1.00 0.00 O ATOM 1027 CB LYS B 29 -8.737 1.369 -12.493 1.00 0.00 C ATOM 1028 CG LYS B 29 -10.228 1.413 -12.816 1.00 0.00 C ATOM 1029 CD LYS B 29 -10.911 2.502 -11.989 1.00 0.00 C ATOM 1030 CE LYS B 29 -12.430 2.448 -12.161 1.00 0.00 C ATOM 1031 NZ LYS B 29 -12.843 2.971 -13.477 1.00 0.00 N ATOM 0 H LYS B 29 -9.203 -0.358 -10.808 1.00 0.00 H new ATOM 0 HA LYS B 29 -8.462 -0.454 -13.586 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -8.570 1.743 -11.483 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -8.196 2.030 -13.171 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -10.373 1.608 -13.879 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -10.683 0.445 -12.604 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -10.656 2.378 -10.937 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -10.541 3.481 -12.294 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -12.773 1.419 -12.053 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -12.908 3.028 -11.371 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -13.880 2.952 -13.548 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -12.507 3.949 -13.583 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -12.434 2.381 -14.229 1.00 0.00 H new ATOM 1045 N ILE B 30 -6.150 -0.129 -11.263 1.00 0.00 N ATOM 1046 CA ILE B 30 -4.716 -0.236 -11.023 1.00 0.00 C ATOM 1047 C ILE B 30 -4.238 -1.629 -11.424 1.00 0.00 C ATOM 1048 O ILE B 30 -3.094 -1.798 -11.840 1.00 0.00 O ATOM 1049 CB ILE B 30 -4.435 0.046 -9.545 1.00 0.00 C ATOM 1050 CG1 ILE B 30 -4.721 1.528 -9.278 1.00 0.00 C ATOM 1051 CG2 ILE B 30 -2.980 -0.283 -9.188 1.00 0.00 C ATOM 1052 CD1 ILE B 30 -4.818 1.794 -7.780 1.00 0.00 C ATOM 0 H ILE B 30 -6.715 -0.130 -10.414 1.00 0.00 H new ATOM 0 HA ILE B 30 -4.173 0.494 -11.623 1.00 0.00 H new ATOM 0 HB ILE B 30 -5.075 -0.583 -8.927 1.00 0.00 H new ATOM 0 HG12 ILE B 30 -3.930 2.140 -9.711 1.00 0.00 H new ATOM 0 HG13 ILE B 30 -5.652 1.818 -9.765 1.00 0.00 H new ATOM 0 HG21 ILE B 30 -2.808 -0.073 -8.132 1.00 0.00 H new ATOM 0 HG22 ILE B 30 -2.787 -1.338 -9.385 1.00 0.00 H new ATOM 0 HG23 ILE B 30 -2.310 0.328 -9.793 1.00 0.00 H new ATOM 0 HD11 ILE B 30 -5.021 2.851 -7.611 1.00 0.00 H new ATOM 0 HD12 ILE B 30 -5.625 1.197 -7.356 1.00 0.00 H new ATOM 0 HD13 ILE B 30 -3.877 1.524 -7.301 1.00 0.00 H new ATOM 1064 N GLN B 31 -5.113 -2.635 -11.307 1.00 0.00 N ATOM 1065 CA GLN B 31 -4.792 -3.977 -11.757 1.00 0.00 C ATOM 1066 C GLN B 31 -4.738 -4.028 -13.286 1.00 0.00 C ATOM 1067 O GLN B 31 -4.273 -4.996 -13.881 1.00 0.00 O ATOM 1068 CB GLN B 31 -5.809 -4.969 -11.191 1.00 0.00 C ATOM 1069 CG GLN B 31 -5.353 -6.347 -11.645 1.00 0.00 C ATOM 1070 CD GLN B 31 -5.907 -7.504 -10.836 1.00 0.00 C ATOM 1071 OE1 GLN B 31 -7.034 -7.466 -10.355 1.00 0.00 O ATOM 1072 NE2 GLN B 31 -5.094 -8.547 -10.691 1.00 0.00 N ATOM 0 H GLN B 31 -6.045 -2.536 -10.904 1.00 0.00 H new ATOM 0 HA GLN B 31 -3.806 -4.258 -11.388 1.00 0.00 H new ATOM 0 HB2 GLN B 31 -5.847 -4.910 -10.103 1.00 0.00 H new ATOM 0 HB3 GLN B 31 -6.812 -4.750 -11.557 1.00 0.00 H new ATOM 0 HG2 GLN B 31 -5.639 -6.483 -12.688 1.00 0.00 H new ATOM 0 HG3 GLN B 31 -4.264 -6.384 -11.606 1.00 0.00 H new ATOM 0 HE21 GLN B 31 -4.164 -8.531 -11.111 1.00 0.00 H new ATOM 0 HE22 GLN B 31 -5.400 -9.362 -10.160 1.00 0.00 H new ATOM 1081 N ASP B 32 -5.219 -2.971 -13.931 1.00 0.00 N ATOM 1082 CA ASP B 32 -5.193 -2.848 -15.380 1.00 0.00 C ATOM 1083 C ASP B 32 -3.932 -2.114 -15.814 1.00 0.00 C ATOM 1084 O ASP B 32 -3.308 -2.452 -16.819 1.00 0.00 O ATOM 1085 CB ASP B 32 -6.398 -2.019 -15.812 1.00 0.00 C ATOM 1086 CG ASP B 32 -6.894 -2.422 -17.199 1.00 0.00 C ATOM 1087 OD1 ASP B 32 -7.566 -3.475 -17.289 1.00 0.00 O ATOM 1088 OD2 ASP B 32 -6.599 -1.676 -18.159 1.00 0.00 O ATOM 0 H ASP B 32 -5.640 -2.171 -13.458 1.00 0.00 H new ATOM 0 HA ASP B 32 -5.214 -3.840 -15.831 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -7.203 -2.143 -15.088 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -6.131 -0.962 -15.814 1.00 0.00 H new ATOM 1093 N LYS B 33 -3.573 -1.099 -15.028 1.00 0.00 N ATOM 1094 CA LYS B 33 -2.439 -0.229 -15.289 1.00 0.00 C ATOM 1095 C LYS B 33 -1.104 -0.862 -14.914 1.00 0.00 C ATOM 1096 O LYS B 33 -0.086 -0.545 -15.526 1.00 0.00 O ATOM 1097 CB LYS B 33 -2.634 1.036 -14.456 1.00 0.00 C ATOM 1098 CG LYS B 33 -3.718 1.957 -15.020 1.00 0.00 C ATOM 1099 CD LYS B 33 -3.279 2.560 -16.351 1.00 0.00 C ATOM 1100 CE LYS B 33 -4.213 3.717 -16.693 1.00 0.00 C ATOM 1101 NZ LYS B 33 -3.945 4.254 -18.042 1.00 0.00 N ATOM 0 H LYS B 33 -4.077 -0.858 -14.175 1.00 0.00 H new ATOM 0 HA LYS B 33 -2.403 -0.024 -16.359 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -2.896 0.757 -13.436 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -1.691 1.581 -14.405 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -4.643 1.396 -15.157 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -3.931 2.754 -14.307 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -2.249 2.912 -16.286 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -3.309 1.805 -17.137 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -5.248 3.379 -16.635 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -4.095 4.511 -15.955 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -4.599 5.039 -18.240 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -2.965 4.599 -18.090 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -4.082 3.503 -18.748 1.00 0.00 H new ATOM 1115 N GLU B 34 -1.099 -1.749 -13.920 1.00 0.00 N ATOM 1116 CA GLU B 34 0.130 -2.371 -13.445 1.00 0.00 C ATOM 1117 C GLU B 34 0.015 -3.886 -13.270 1.00 0.00 C ATOM 1118 O GLU B 34 1.028 -4.567 -13.115 1.00 0.00 O ATOM 1119 CB GLU B 34 0.494 -1.753 -12.100 1.00 0.00 C ATOM 1120 CG GLU B 34 0.913 -0.283 -12.217 1.00 0.00 C ATOM 1121 CD GLU B 34 2.220 -0.101 -12.987 1.00 0.00 C ATOM 1122 OE1 GLU B 34 3.019 -1.064 -13.032 1.00 0.00 O ATOM 1123 OE2 GLU B 34 2.416 1.009 -13.531 1.00 0.00 O ATOM 0 H GLU B 34 -1.939 -2.053 -13.427 1.00 0.00 H new ATOM 0 HA GLU B 34 0.895 -2.193 -14.200 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -0.360 -1.831 -11.427 1.00 0.00 H new ATOM 0 HB3 GLU B 34 1.307 -2.323 -11.651 1.00 0.00 H new ATOM 0 HG2 GLU B 34 0.122 0.277 -12.715 1.00 0.00 H new ATOM 0 HG3 GLU B 34 1.023 0.140 -11.218 1.00 0.00 H new ATOM 1130 N GLY B 35 -1.206 -4.424 -13.294 1.00 0.00 N ATOM 1131 CA GLY B 35 -1.418 -5.863 -13.132 1.00 0.00 C ATOM 1132 C GLY B 35 -1.247 -6.288 -11.681 1.00 0.00 C ATOM 1133 O GLY B 35 -1.085 -7.474 -11.399 1.00 0.00 O ATOM 0 H GLY B 35 -2.062 -3.885 -13.424 1.00 0.00 H new ATOM 0 HA2 GLY B 35 -2.419 -6.126 -13.474 1.00 0.00 H new ATOM 0 HA3 GLY B 35 -0.713 -6.409 -13.759 1.00 0.00 H new ATOM 1137 N ILE B 36 -1.286 -5.325 -10.757 1.00 0.00 N ATOM 1138 CA ILE B 36 -1.102 -5.604 -9.341 1.00 0.00 C ATOM 1139 C ILE B 36 -2.387 -6.217 -8.806 1.00 0.00 C ATOM 1140 O ILE B 36 -3.471 -5.700 -9.071 1.00 0.00 O ATOM 1141 CB ILE B 36 -0.778 -4.306 -8.599 1.00 0.00 C ATOM 1142 CG1 ILE B 36 0.592 -3.793 -9.053 1.00 0.00 C ATOM 1143 CG2 ILE B 36 -0.753 -4.531 -7.086 1.00 0.00 C ATOM 1144 CD1 ILE B 36 0.743 -2.308 -8.731 1.00 0.00 C ATOM 0 H ILE B 36 -1.445 -4.341 -10.972 1.00 0.00 H new ATOM 0 HA ILE B 36 -0.275 -6.298 -9.192 1.00 0.00 H new ATOM 0 HB ILE B 36 -1.552 -3.574 -8.829 1.00 0.00 H new ATOM 0 HG12 ILE B 36 1.381 -4.360 -8.559 1.00 0.00 H new ATOM 0 HG13 ILE B 36 0.709 -3.952 -10.125 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -0.520 -3.593 -6.582 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -1.728 -4.888 -6.755 1.00 0.00 H new ATOM 0 HG23 ILE B 36 0.007 -5.272 -6.841 1.00 0.00 H new ATOM 0 HD11 ILE B 36 1.723 -1.962 -9.061 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -0.034 -1.743 -9.246 1.00 0.00 H new ATOM 0 HD13 ILE B 36 0.648 -2.157 -7.656 1.00 0.00 H new ATOM 1156 N PRO B 37 -2.294 -7.314 -8.050 1.00 0.00 N ATOM 1157 CA PRO B 37 -3.461 -7.981 -7.519 1.00 0.00 C ATOM 1158 C PRO B 37 -4.071 -7.157 -6.396 1.00 0.00 C ATOM 1159 O PRO B 37 -3.349 -6.683 -5.518 1.00 0.00 O ATOM 1160 CB PRO B 37 -2.956 -9.320 -6.987 1.00 0.00 C ATOM 1161 CG PRO B 37 -1.487 -9.057 -6.664 1.00 0.00 C ATOM 1162 CD PRO B 37 -1.067 -7.983 -7.663 1.00 0.00 C ATOM 0 HA PRO B 37 -4.235 -8.114 -8.275 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -3.510 -9.633 -6.102 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -3.067 -10.112 -7.728 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -1.361 -8.716 -5.637 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -0.887 -9.960 -6.776 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -0.363 -7.283 -7.214 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -0.571 -8.424 -8.528 1.00 0.00 H new ATOM 1170 N PRO B 38 -5.395 -6.981 -6.402 1.00 0.00 N ATOM 1171 CA PRO B 38 -6.125 -6.404 -5.287 1.00 0.00 C ATOM 1172 C PRO B 38 -5.858 -7.172 -3.994 1.00 0.00 C ATOM 1173 O PRO B 38 -6.048 -6.633 -2.906 1.00 0.00 O ATOM 1174 CB PRO B 38 -7.600 -6.467 -5.691 1.00 0.00 C ATOM 1175 CG PRO B 38 -7.645 -7.499 -6.816 1.00 0.00 C ATOM 1176 CD PRO B 38 -6.293 -7.322 -7.485 1.00 0.00 C ATOM 0 HA PRO B 38 -5.813 -5.379 -5.085 1.00 0.00 H new ATOM 0 HB2 PRO B 38 -8.229 -6.766 -4.852 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -7.961 -5.496 -6.029 1.00 0.00 H new ATOM 0 HG2 PRO B 38 -7.778 -8.511 -6.433 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -8.467 -7.310 -7.507 1.00 0.00 H new ATOM 0 HD2 PRO B 38 -5.977 -8.235 -7.990 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -6.323 -6.535 -8.239 1.00 0.00 H new ATOM 1184 N ASP B 39 -5.417 -8.427 -4.113 1.00 0.00 N ATOM 1185 CA ASP B 39 -5.015 -9.249 -2.979 1.00 0.00 C ATOM 1186 C ASP B 39 -3.740 -8.724 -2.311 1.00 0.00 C ATOM 1187 O ASP B 39 -3.390 -9.174 -1.218 1.00 0.00 O ATOM 1188 CB ASP B 39 -4.824 -10.685 -3.456 1.00 0.00 C ATOM 1189 CG ASP B 39 -4.512 -11.636 -2.304 1.00 0.00 C ATOM 1190 OD1 ASP B 39 -5.389 -11.785 -1.423 1.00 0.00 O ATOM 1191 OD2 ASP B 39 -3.398 -12.207 -2.314 1.00 0.00 O ATOM 0 H ASP B 39 -5.330 -8.902 -5.011 1.00 0.00 H new ATOM 0 HA ASP B 39 -5.800 -9.209 -2.224 1.00 0.00 H new ATOM 0 HB2 ASP B 39 -5.726 -11.020 -3.967 1.00 0.00 H new ATOM 0 HB3 ASP B 39 -4.013 -10.720 -4.184 1.00 0.00 H new ATOM 1196 N GLN B 40 -3.038 -7.780 -2.947 1.00 0.00 N ATOM 1197 CA GLN B 40 -1.850 -7.161 -2.360 1.00 0.00 C ATOM 1198 C GLN B 40 -1.946 -5.642 -2.282 1.00 0.00 C ATOM 1199 O GLN B 40 -1.072 -5.021 -1.684 1.00 0.00 O ATOM 1200 CB GLN B 40 -0.613 -7.516 -3.182 1.00 0.00 C ATOM 1201 CG GLN B 40 -0.295 -9.000 -3.052 1.00 0.00 C ATOM 1202 CD GLN B 40 0.716 -9.464 -4.092 1.00 0.00 C ATOM 1203 OE1 GLN B 40 0.601 -10.559 -4.635 1.00 0.00 O ATOM 1204 NE2 GLN B 40 1.719 -8.646 -4.390 1.00 0.00 N ATOM 0 H GLN B 40 -3.276 -7.428 -3.874 1.00 0.00 H new ATOM 0 HA GLN B 40 -1.775 -7.551 -1.345 1.00 0.00 H new ATOM 0 HB2 GLN B 40 -0.780 -7.264 -4.229 1.00 0.00 H new ATOM 0 HB3 GLN B 40 0.238 -6.925 -2.844 1.00 0.00 H new ATOM 0 HG2 GLN B 40 0.095 -9.200 -2.054 1.00 0.00 H new ATOM 0 HG3 GLN B 40 -1.213 -9.577 -3.157 1.00 0.00 H new ATOM 0 HE21 GLN B 40 1.794 -7.741 -3.926 1.00 0.00 H new ATOM 0 HE22 GLN B 40 2.414 -8.923 -5.083 1.00 0.00 H new ATOM 1213 N GLN B 41 -2.969 -5.021 -2.868 1.00 0.00 N ATOM 1214 CA GLN B 41 -3.067 -3.572 -2.813 1.00 0.00 C ATOM 1215 C GLN B 41 -3.489 -3.082 -1.433 1.00 0.00 C ATOM 1216 O GLN B 41 -4.271 -3.723 -0.734 1.00 0.00 O ATOM 1217 CB GLN B 41 -4.039 -3.051 -3.873 1.00 0.00 C ATOM 1218 CG GLN B 41 -3.434 -3.239 -5.265 1.00 0.00 C ATOM 1219 CD GLN B 41 -4.288 -2.592 -6.347 1.00 0.00 C ATOM 1220 OE1 GLN B 41 -4.754 -1.468 -6.192 1.00 0.00 O ATOM 1221 NE2 GLN B 41 -4.498 -3.296 -7.454 1.00 0.00 N ATOM 0 H GLN B 41 -3.722 -5.488 -3.373 1.00 0.00 H new ATOM 0 HA GLN B 41 -2.072 -3.178 -3.019 1.00 0.00 H new ATOM 0 HB2 GLN B 41 -4.988 -3.583 -3.803 1.00 0.00 H new ATOM 0 HB3 GLN B 41 -4.252 -1.996 -3.698 1.00 0.00 H new ATOM 0 HG2 GLN B 41 -2.433 -2.809 -5.287 1.00 0.00 H new ATOM 0 HG3 GLN B 41 -3.328 -4.303 -5.474 1.00 0.00 H new ATOM 0 HE21 GLN B 41 -4.095 -4.228 -7.550 1.00 0.00 H new ATOM 0 HE22 GLN B 41 -5.062 -2.904 -8.208 1.00 0.00 H new ATOM 1230 N ARG B 42 -2.948 -1.919 -1.065 1.00 0.00 N ATOM 1231 CA ARG B 42 -3.309 -1.163 0.127 1.00 0.00 C ATOM 1232 C ARG B 42 -3.407 0.305 -0.258 1.00 0.00 C ATOM 1233 O ARG B 42 -2.518 1.099 0.049 1.00 0.00 O ATOM 1234 CB ARG B 42 -2.264 -1.331 1.227 1.00 0.00 C ATOM 1235 CG ARG B 42 -2.224 -2.745 1.801 1.00 0.00 C ATOM 1236 CD ARG B 42 -1.209 -2.801 2.945 1.00 0.00 C ATOM 1237 NE ARG B 42 -1.580 -1.894 4.043 1.00 0.00 N ATOM 1238 CZ ARG B 42 -0.887 -1.786 5.182 1.00 0.00 C ATOM 1239 NH1 ARG B 42 0.212 -2.506 5.388 1.00 0.00 N ATOM 1240 NH2 ARG B 42 -1.283 -0.951 6.140 1.00 0.00 N ATOM 0 H ARG B 42 -2.218 -1.464 -1.613 1.00 0.00 H new ATOM 0 HA ARG B 42 -4.260 -1.532 0.511 1.00 0.00 H new ATOM 0 HB2 ARG B 42 -1.281 -1.079 0.829 1.00 0.00 H new ATOM 0 HB3 ARG B 42 -2.473 -0.625 2.030 1.00 0.00 H new ATOM 0 HG2 ARG B 42 -3.212 -3.031 2.162 1.00 0.00 H new ATOM 0 HG3 ARG B 42 -1.951 -3.458 1.023 1.00 0.00 H new ATOM 0 HD2 ARG B 42 -1.141 -3.821 3.322 1.00 0.00 H new ATOM 0 HD3 ARG B 42 -0.221 -2.534 2.569 1.00 0.00 H new ATOM 0 HE ARG B 42 -2.412 -1.315 3.929 1.00 0.00 H new ATOM 0 HH11 ARG B 42 0.539 -3.154 4.671 1.00 0.00 H new ATOM 0 HH12 ARG B 42 0.728 -2.410 6.263 1.00 0.00 H new ATOM 0 HH21 ARG B 42 -2.122 -0.386 6.009 1.00 0.00 H new ATOM 0 HH22 ARG B 42 -0.747 -0.876 7.005 1.00 0.00 H new ATOM 1254 N LEU B 43 -4.491 0.661 -0.941 1.00 0.00 N ATOM 1255 CA LEU B 43 -4.726 2.035 -1.359 1.00 0.00 C ATOM 1256 C LEU B 43 -4.837 2.948 -0.143 1.00 0.00 C ATOM 1257 O LEU B 43 -5.339 2.546 0.908 1.00 0.00 O ATOM 1258 CB LEU B 43 -6.000 2.118 -2.205 1.00 0.00 C ATOM 1259 CG LEU B 43 -5.879 1.264 -3.468 1.00 0.00 C ATOM 1260 CD1 LEU B 43 -7.202 1.269 -4.230 1.00 0.00 C ATOM 1261 CD2 LEU B 43 -4.778 1.776 -4.392 1.00 0.00 C ATOM 0 H LEU B 43 -5.225 0.009 -1.218 1.00 0.00 H new ATOM 0 HA LEU B 43 -3.882 2.366 -1.964 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -6.854 1.783 -1.616 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -6.190 3.155 -2.481 1.00 0.00 H new ATOM 0 HG LEU B 43 -5.626 0.252 -3.153 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -7.107 0.659 -5.128 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -7.989 0.861 -3.595 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -7.456 2.291 -4.511 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -4.723 1.143 -5.278 1.00 0.00 H new ATOM 0 HD22 LEU B 43 -5.001 2.800 -4.691 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -3.822 1.751 -3.868 1.00 0.00 H new ATOM 1273 N ILE B 44 -4.361 4.180 -0.303 1.00 0.00 N ATOM 1274 CA ILE B 44 -4.322 5.164 0.770 1.00 0.00 C ATOM 1275 C ILE B 44 -4.563 6.569 0.227 1.00 0.00 C ATOM 1276 O ILE B 44 -4.221 6.877 -0.912 1.00 0.00 O ATOM 1277 CB ILE B 44 -2.959 5.090 1.485 1.00 0.00 C ATOM 1278 CG1 ILE B 44 -2.843 3.758 2.242 1.00 0.00 C ATOM 1279 CG2 ILE B 44 -2.791 6.267 2.450 1.00 0.00 C ATOM 1280 CD1 ILE B 44 -1.643 3.713 3.184 1.00 0.00 C ATOM 0 H ILE B 44 -3.989 4.524 -1.188 1.00 0.00 H new ATOM 0 HA ILE B 44 -5.116 4.940 1.483 1.00 0.00 H new ATOM 0 HB ILE B 44 -2.167 5.147 0.739 1.00 0.00 H new ATOM 0 HG12 ILE B 44 -3.755 3.591 2.815 1.00 0.00 H new ATOM 0 HG13 ILE B 44 -2.765 2.943 1.523 1.00 0.00 H new ATOM 0 HG21 ILE B 44 -1.822 6.196 2.945 1.00 0.00 H new ATOM 0 HG22 ILE B 44 -2.848 7.203 1.895 1.00 0.00 H new ATOM 0 HG23 ILE B 44 -3.583 6.240 3.198 1.00 0.00 H new ATOM 0 HD11 ILE B 44 -1.614 2.748 3.690 1.00 0.00 H new ATOM 0 HD12 ILE B 44 -0.726 3.850 2.611 1.00 0.00 H new ATOM 0 HD13 ILE B 44 -1.731 4.508 3.924 1.00 0.00 H new ATOM 1292 N PHE B 45 -5.154 7.415 1.075 1.00 0.00 N ATOM 1293 CA PHE B 45 -5.356 8.829 0.823 1.00 0.00 C ATOM 1294 C PHE B 45 -5.251 9.542 2.165 1.00 0.00 C ATOM 1295 O PHE B 45 -6.017 9.237 3.074 1.00 0.00 O ATOM 1296 CB PHE B 45 -6.743 9.040 0.214 1.00 0.00 C ATOM 1297 CG PHE B 45 -7.104 10.497 0.036 1.00 0.00 C ATOM 1298 CD1 PHE B 45 -6.547 11.228 -1.019 1.00 0.00 C ATOM 1299 CD2 PHE B 45 -7.993 11.117 0.923 1.00 0.00 C ATOM 1300 CE1 PHE B 45 -6.878 12.579 -1.187 1.00 0.00 C ATOM 1301 CE2 PHE B 45 -8.331 12.469 0.752 1.00 0.00 C ATOM 1302 CZ PHE B 45 -7.772 13.200 -0.305 1.00 0.00 C ATOM 0 H PHE B 45 -5.513 7.117 1.982 1.00 0.00 H new ATOM 0 HA PHE B 45 -4.615 9.220 0.126 1.00 0.00 H new ATOM 0 HB2 PHE B 45 -6.786 8.541 -0.754 1.00 0.00 H new ATOM 0 HB3 PHE B 45 -7.488 8.564 0.851 1.00 0.00 H new ATOM 0 HD1 PHE B 45 -5.862 10.751 -1.704 1.00 0.00 H new ATOM 0 HD2 PHE B 45 -8.419 10.554 1.740 1.00 0.00 H new ATOM 0 HE1 PHE B 45 -6.443 13.143 -1.999 1.00 0.00 H new ATOM 0 HE2 PHE B 45 -9.020 12.945 1.434 1.00 0.00 H new ATOM 0 HZ PHE B 45 -8.030 14.240 -0.439 1.00 0.00 H new ATOM 1312 N ALA B 46 -4.314 10.483 2.303 1.00 0.00 N ATOM 1313 CA ALA B 46 -4.085 11.189 3.556 1.00 0.00 C ATOM 1314 C ALA B 46 -3.838 10.222 4.721 1.00 0.00 C ATOM 1315 O ALA B 46 -3.937 10.610 5.883 1.00 0.00 O ATOM 1316 CB ALA B 46 -5.247 12.148 3.820 1.00 0.00 C ATOM 0 H ALA B 46 -3.695 10.774 1.546 1.00 0.00 H new ATOM 0 HA ALA B 46 -3.172 11.778 3.469 1.00 0.00 H new ATOM 0 HB1 ALA B 46 -5.076 12.677 4.758 1.00 0.00 H new ATOM 0 HB2 ALA B 46 -5.317 12.868 3.005 1.00 0.00 H new ATOM 0 HB3 ALA B 46 -6.177 11.583 3.886 1.00 0.00 H new ATOM 1322 N GLY B 47 -3.514 8.961 4.408 1.00 0.00 N ATOM 1323 CA GLY B 47 -3.248 7.934 5.403 1.00 0.00 C ATOM 1324 C GLY B 47 -4.520 7.371 6.035 1.00 0.00 C ATOM 1325 O GLY B 47 -4.435 6.632 7.017 1.00 0.00 O ATOM 0 H GLY B 47 -3.430 8.630 3.447 1.00 0.00 H new ATOM 0 HA2 GLY B 47 -2.690 7.121 4.938 1.00 0.00 H new ATOM 0 HA3 GLY B 47 -2.613 8.350 6.186 1.00 0.00 H new ATOM 1329 N LYS B 48 -5.694 7.707 5.490 1.00 0.00 N ATOM 1330 CA LYS B 48 -6.972 7.213 6.000 1.00 0.00 C ATOM 1331 C LYS B 48 -7.269 5.824 5.445 1.00 0.00 C ATOM 1332 O LYS B 48 -8.418 5.500 5.160 1.00 0.00 O ATOM 1333 CB LYS B 48 -8.099 8.207 5.712 1.00 0.00 C ATOM 1334 CG LYS B 48 -8.494 8.338 4.235 1.00 0.00 C ATOM 1335 CD LYS B 48 -9.973 8.009 4.035 1.00 0.00 C ATOM 1336 CE LYS B 48 -10.494 8.753 2.812 1.00 0.00 C ATOM 1337 NZ LYS B 48 -10.696 10.189 3.094 1.00 0.00 N ATOM 0 H LYS B 48 -5.782 8.327 4.685 1.00 0.00 H new ATOM 0 HA LYS B 48 -6.903 7.121 7.084 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -8.979 7.909 6.282 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -7.799 9.188 6.080 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -8.293 9.352 3.889 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -7.883 7.668 3.630 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -10.104 6.935 3.904 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -10.544 8.294 4.919 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -9.789 8.639 1.989 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -11.436 8.309 2.489 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -10.310 10.754 2.311 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -11.713 10.384 3.193 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -10.208 10.441 3.977 1.00 0.00 H new ATOM 1351 N GLN B 49 -6.199 5.040 5.306 1.00 0.00 N ATOM 1352 CA GLN B 49 -6.124 3.745 4.645 1.00 0.00 C ATOM 1353 C GLN B 49 -7.494 3.185 4.279 1.00 0.00 C ATOM 1354 O GLN B 49 -8.250 2.737 5.142 1.00 0.00 O ATOM 1355 CB GLN B 49 -5.300 2.771 5.489 1.00 0.00 C ATOM 1356 CG GLN B 49 -4.057 3.456 6.070 1.00 0.00 C ATOM 1357 CD GLN B 49 -3.003 2.447 6.512 1.00 0.00 C ATOM 1358 OE1 GLN B 49 -3.233 1.240 6.520 1.00 0.00 O ATOM 1359 NE2 GLN B 49 -1.825 2.937 6.885 1.00 0.00 N ATOM 0 H GLN B 49 -5.294 5.320 5.684 1.00 0.00 H new ATOM 0 HA GLN B 49 -5.612 3.887 3.693 1.00 0.00 H new ATOM 0 HB2 GLN B 49 -5.914 2.378 6.299 1.00 0.00 H new ATOM 0 HB3 GLN B 49 -4.998 1.921 4.877 1.00 0.00 H new ATOM 0 HG2 GLN B 49 -3.629 4.124 5.323 1.00 0.00 H new ATOM 0 HG3 GLN B 49 -4.347 4.073 6.920 1.00 0.00 H new ATOM 0 HE21 GLN B 49 -1.663 3.944 6.868 1.00 0.00 H new ATOM 0 HE22 GLN B 49 -1.083 2.306 7.188 1.00 0.00 H new ATOM 1368 N LEU B 50 -7.791 3.232 2.977 1.00 0.00 N ATOM 1369 CA LEU B 50 -9.107 2.977 2.417 1.00 0.00 C ATOM 1370 C LEU B 50 -9.629 1.568 2.705 1.00 0.00 C ATOM 1371 O LEU B 50 -8.935 0.722 3.272 1.00 0.00 O ATOM 1372 CB LEU B 50 -9.054 3.267 0.912 1.00 0.00 C ATOM 1373 CG LEU B 50 -8.338 4.589 0.603 1.00 0.00 C ATOM 1374 CD1 LEU B 50 -8.436 4.913 -0.882 1.00 0.00 C ATOM 1375 CD2 LEU B 50 -8.933 5.758 1.382 1.00 0.00 C ATOM 0 H LEU B 50 -7.094 3.457 2.267 1.00 0.00 H new ATOM 0 HA LEU B 50 -9.822 3.641 2.903 1.00 0.00 H new ATOM 0 HB2 LEU B 50 -8.541 2.450 0.404 1.00 0.00 H new ATOM 0 HB3 LEU B 50 -10.068 3.303 0.514 1.00 0.00 H new ATOM 0 HG LEU B 50 -7.298 4.456 0.900 1.00 0.00 H new ATOM 0 HD11 LEU B 50 -7.923 5.853 -1.084 1.00 0.00 H new ATOM 0 HD12 LEU B 50 -7.971 4.115 -1.460 1.00 0.00 H new ATOM 0 HD13 LEU B 50 -9.484 5.003 -1.166 1.00 0.00 H new ATOM 0 HD21 LEU B 50 -8.396 6.673 1.132 1.00 0.00 H new ATOM 0 HD22 LEU B 50 -9.985 5.872 1.120 1.00 0.00 H new ATOM 0 HD23 LEU B 50 -8.844 5.566 2.451 1.00 0.00 H new ATOM 1387 N GLU B 51 -10.877 1.332 2.298 1.00 0.00 N ATOM 1388 CA GLU B 51 -11.615 0.105 2.550 1.00 0.00 C ATOM 1389 C GLU B 51 -12.168 -0.430 1.238 1.00 0.00 C ATOM 1390 O GLU B 51 -11.538 -0.312 0.191 1.00 0.00 O ATOM 1391 CB GLU B 51 -12.743 0.360 3.562 1.00 0.00 C ATOM 1392 CG GLU B 51 -12.174 0.985 4.833 1.00 0.00 C ATOM 1393 CD GLU B 51 -13.204 1.063 5.964 1.00 0.00 C ATOM 1394 OE1 GLU B 51 -14.107 0.197 5.995 1.00 0.00 O ATOM 1395 OE2 GLU B 51 -13.087 1.992 6.793 1.00 0.00 O ATOM 0 H GLU B 51 -11.415 2.016 1.766 1.00 0.00 H new ATOM 0 HA GLU B 51 -10.946 -0.641 2.978 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -13.491 1.021 3.125 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -13.246 -0.577 3.802 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -11.316 0.402 5.168 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -11.810 1.988 4.609 1.00 0.00 H new ATOM 1402 N ASP B 52 -13.356 -1.022 1.306 1.00 0.00 N ATOM 1403 CA ASP B 52 -14.013 -1.585 0.140 1.00 0.00 C ATOM 1404 C ASP B 52 -15.529 -1.417 0.269 1.00 0.00 C ATOM 1405 O ASP B 52 -16.063 -1.400 1.377 1.00 0.00 O ATOM 1406 CB ASP B 52 -13.611 -3.060 0.049 1.00 0.00 C ATOM 1407 CG ASP B 52 -13.840 -3.642 -1.341 1.00 0.00 C ATOM 1408 OD1 ASP B 52 -15.015 -3.915 -1.670 1.00 0.00 O ATOM 1409 OD2 ASP B 52 -12.829 -3.808 -2.060 1.00 0.00 O ATOM 0 H ASP B 52 -13.887 -1.123 2.171 1.00 0.00 H new ATOM 0 HA ASP B 52 -13.709 -1.072 -0.772 1.00 0.00 H new ATOM 0 HB2 ASP B 52 -12.559 -3.164 0.314 1.00 0.00 H new ATOM 0 HB3 ASP B 52 -14.182 -3.635 0.779 1.00 0.00 H new ATOM 1414 N GLY B 53 -16.222 -1.285 -0.868 1.00 0.00 N ATOM 1415 CA GLY B 53 -17.665 -1.080 -0.897 1.00 0.00 C ATOM 1416 C GLY B 53 -18.031 0.402 -0.790 1.00 0.00 C ATOM 1417 O GLY B 53 -19.197 0.765 -0.949 1.00 0.00 O ATOM 0 H GLY B 53 -15.792 -1.318 -1.792 1.00 0.00 H new ATOM 0 HA2 GLY B 53 -18.072 -1.489 -1.822 1.00 0.00 H new ATOM 0 HA3 GLY B 53 -18.127 -1.629 -0.076 1.00 0.00 H new ATOM 1421 N ARG B 54 -17.035 1.255 -0.524 1.00 0.00 N ATOM 1422 CA ARG B 54 -17.178 2.701 -0.431 1.00 0.00 C ATOM 1423 C ARG B 54 -17.366 3.337 -1.804 1.00 0.00 C ATOM 1424 O ARG B 54 -17.627 2.653 -2.789 1.00 0.00 O ATOM 1425 CB ARG B 54 -15.881 3.240 0.170 1.00 0.00 C ATOM 1426 CG ARG B 54 -15.691 2.788 1.608 1.00 0.00 C ATOM 1427 CD ARG B 54 -16.667 3.542 2.497 1.00 0.00 C ATOM 1428 NE ARG B 54 -15.983 4.064 3.678 1.00 0.00 N ATOM 1429 CZ ARG B 54 -15.649 3.327 4.742 1.00 0.00 C ATOM 1430 NH1 ARG B 54 -15.949 2.030 4.788 1.00 0.00 N ATOM 1431 NH2 ARG B 54 -15.011 3.879 5.770 1.00 0.00 N ATOM 0 H ARG B 54 -16.078 0.941 -0.363 1.00 0.00 H new ATOM 0 HA ARG B 54 -18.052 2.938 0.175 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -15.036 2.904 -0.431 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -15.888 4.329 0.130 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -15.859 1.714 1.690 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -14.667 2.976 1.929 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -17.118 4.362 1.938 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -17.477 2.880 2.802 1.00 0.00 H new ATOM 0 HE ARG B 54 -15.745 5.056 3.691 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -16.437 1.592 4.007 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -15.690 1.475 5.604 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -14.773 4.871 5.750 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -14.759 3.311 6.579 1.00 0.00 H new ATOM 1445 N THR B 55 -17.228 4.662 -1.852 1.00 0.00 N ATOM 1446 CA THR B 55 -17.144 5.416 -3.094 1.00 0.00 C ATOM 1447 C THR B 55 -16.155 6.551 -2.901 1.00 0.00 C ATOM 1448 O THR B 55 -15.773 6.866 -1.775 1.00 0.00 O ATOM 1449 CB THR B 55 -18.498 5.984 -3.530 1.00 0.00 C ATOM 1450 OG1 THR B 55 -19.061 6.745 -2.486 1.00 0.00 O ATOM 1451 CG2 THR B 55 -19.476 4.888 -3.940 1.00 0.00 C ATOM 0 H THR B 55 -17.171 5.245 -1.017 1.00 0.00 H new ATOM 0 HA THR B 55 -16.816 4.737 -3.881 1.00 0.00 H new ATOM 0 HB THR B 55 -18.318 6.616 -4.400 1.00 0.00 H new ATOM 0 HG1 THR B 55 -19.926 7.106 -2.774 1.00 0.00 H new ATOM 0 HG21 THR B 55 -20.422 5.338 -4.241 1.00 0.00 H new ATOM 0 HG22 THR B 55 -19.061 4.324 -4.775 1.00 0.00 H new ATOM 0 HG23 THR B 55 -19.645 4.218 -3.097 1.00 0.00 H new ATOM 1459 N LEU B 56 -15.731 7.178 -3.996 1.00 0.00 N ATOM 1460 CA LEU B 56 -14.795 8.287 -3.898 1.00 0.00 C ATOM 1461 C LEU B 56 -15.493 9.495 -3.286 1.00 0.00 C ATOM 1462 O LEU B 56 -14.868 10.306 -2.605 1.00 0.00 O ATOM 1463 CB LEU B 56 -14.240 8.601 -5.289 1.00 0.00 C ATOM 1464 CG LEU B 56 -13.616 7.353 -5.921 1.00 0.00 C ATOM 1465 CD1 LEU B 56 -12.987 7.714 -7.260 1.00 0.00 C ATOM 1466 CD2 LEU B 56 -12.535 6.747 -5.031 1.00 0.00 C ATOM 0 H LEU B 56 -16.017 6.940 -4.946 1.00 0.00 H new ATOM 0 HA LEU B 56 -13.961 8.021 -3.249 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -15.039 8.977 -5.928 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -13.492 9.390 -5.217 1.00 0.00 H new ATOM 0 HG LEU B 56 -14.414 6.622 -6.051 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -12.544 6.823 -7.706 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -13.753 8.111 -7.926 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -12.213 8.466 -7.107 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -12.118 5.864 -5.515 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -11.744 7.480 -4.869 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -12.970 6.464 -4.072 1.00 0.00 H new ATOM 1478 N SER B 57 -16.802 9.611 -3.523 1.00 0.00 N ATOM 1479 CA SER B 57 -17.629 10.640 -2.914 1.00 0.00 C ATOM 1480 C SER B 57 -17.711 10.433 -1.403 1.00 0.00 C ATOM 1481 O SER B 57 -17.780 11.402 -0.649 1.00 0.00 O ATOM 1482 CB SER B 57 -19.026 10.562 -3.529 1.00 0.00 C ATOM 1483 OG SER B 57 -19.829 11.618 -3.046 1.00 0.00 O ATOM 0 H SER B 57 -17.315 8.988 -4.147 1.00 0.00 H new ATOM 0 HA SER B 57 -17.191 11.621 -3.098 1.00 0.00 H new ATOM 0 HB2 SER B 57 -18.957 10.615 -4.616 1.00 0.00 H new ATOM 0 HB3 SER B 57 -19.486 9.604 -3.285 1.00 0.00 H new ATOM 0 HG SER B 57 -20.721 11.560 -3.447 1.00 0.00 H new ATOM 1489 N ASP B 58 -17.706 9.172 -0.958 1.00 0.00 N ATOM 1490 CA ASP B 58 -17.757 8.849 0.464 1.00 0.00 C ATOM 1491 C ASP B 58 -16.492 9.307 1.194 1.00 0.00 C ATOM 1492 O ASP B 58 -16.484 9.398 2.421 1.00 0.00 O ATOM 1493 CB ASP B 58 -17.954 7.347 0.662 1.00 0.00 C ATOM 1494 CG ASP B 58 -18.312 7.029 2.112 1.00 0.00 C ATOM 1495 OD1 ASP B 58 -19.506 7.188 2.456 1.00 0.00 O ATOM 1496 OD2 ASP B 58 -17.398 6.627 2.866 1.00 0.00 O ATOM 0 H ASP B 58 -17.667 8.357 -1.570 1.00 0.00 H new ATOM 0 HA ASP B 58 -18.605 9.385 0.890 1.00 0.00 H new ATOM 0 HB2 ASP B 58 -18.744 6.990 0.002 1.00 0.00 H new ATOM 0 HB3 ASP B 58 -17.043 6.817 0.384 1.00 0.00 H new ATOM 1501 N TYR B 59 -15.422 9.599 0.449 1.00 0.00 N ATOM 1502 CA TYR B 59 -14.140 9.986 1.010 1.00 0.00 C ATOM 1503 C TYR B 59 -13.746 11.399 0.576 1.00 0.00 C ATOM 1504 O TYR B 59 -12.598 11.798 0.771 1.00 0.00 O ATOM 1505 CB TYR B 59 -13.088 8.965 0.588 1.00 0.00 C ATOM 1506 CG TYR B 59 -13.142 7.621 1.295 1.00 0.00 C ATOM 1507 CD1 TYR B 59 -13.757 7.436 2.542 1.00 0.00 C ATOM 1508 CD2 TYR B 59 -12.526 6.536 0.671 1.00 0.00 C ATOM 1509 CE1 TYR B 59 -13.706 6.177 3.155 1.00 0.00 C ATOM 1510 CE2 TYR B 59 -12.520 5.261 1.251 1.00 0.00 C ATOM 1511 CZ TYR B 59 -13.065 5.096 2.531 1.00 0.00 C ATOM 1512 OH TYR B 59 -12.973 3.898 3.175 1.00 0.00 O ATOM 0 H TYR B 59 -15.429 9.571 -0.571 1.00 0.00 H new ATOM 0 HA TYR B 59 -14.214 10.000 2.097 1.00 0.00 H new ATOM 0 HB2 TYR B 59 -13.187 8.793 -0.484 1.00 0.00 H new ATOM 0 HB3 TYR B 59 -12.102 9.400 0.752 1.00 0.00 H new ATOM 0 HD1 TYR B 59 -14.266 8.257 3.026 1.00 0.00 H new ATOM 0 HD2 TYR B 59 -12.042 6.683 -0.283 1.00 0.00 H new ATOM 0 HE1 TYR B 59 -14.167 6.037 4.122 1.00 0.00 H new ATOM 0 HE2 TYR B 59 -12.102 4.419 0.720 1.00 0.00 H new ATOM 0 HH TYR B 59 -12.938 4.049 4.143 1.00 0.00 H new ATOM 1522 N ASN B 60 -14.687 12.149 -0.010 1.00 0.00 N ATOM 1523 CA ASN B 60 -14.430 13.461 -0.589 1.00 0.00 C ATOM 1524 C ASN B 60 -13.152 13.459 -1.419 1.00 0.00 C ATOM 1525 O ASN B 60 -12.236 14.249 -1.191 1.00 0.00 O ATOM 1526 CB ASN B 60 -14.444 14.548 0.484 1.00 0.00 C ATOM 1527 CG ASN B 60 -14.397 15.928 -0.153 1.00 0.00 C ATOM 1528 OD1 ASN B 60 -15.268 16.283 -0.944 1.00 0.00 O ATOM 1529 ND2 ASN B 60 -13.384 16.725 0.180 1.00 0.00 N ATOM 0 H ASN B 60 -15.659 11.852 -0.093 1.00 0.00 H new ATOM 0 HA ASN B 60 -15.241 13.697 -1.278 1.00 0.00 H new ATOM 0 HB2 ASN B 60 -15.342 14.453 1.094 1.00 0.00 H new ATOM 0 HB3 ASN B 60 -13.591 14.420 1.151 1.00 0.00 H new ATOM 0 HD21 ASN B 60 -13.316 17.659 -0.224 1.00 0.00 H new ATOM 0 HD22 ASN B 60 -12.676 16.402 0.840 1.00 0.00 H new ATOM 1536 N ILE B 61 -13.115 12.547 -2.388 1.00 0.00 N ATOM 1537 CA ILE B 61 -12.008 12.373 -3.312 1.00 0.00 C ATOM 1538 C ILE B 61 -12.423 12.860 -4.699 1.00 0.00 C ATOM 1539 O ILE B 61 -13.371 12.350 -5.293 1.00 0.00 O ATOM 1540 CB ILE B 61 -11.615 10.893 -3.300 1.00 0.00 C ATOM 1541 CG1 ILE B 61 -10.728 10.649 -2.072 1.00 0.00 C ATOM 1542 CG2 ILE B 61 -10.914 10.470 -4.592 1.00 0.00 C ATOM 1543 CD1 ILE B 61 -10.372 9.173 -1.896 1.00 0.00 C ATOM 0 H ILE B 61 -13.879 11.892 -2.553 1.00 0.00 H new ATOM 0 HA ILE B 61 -11.140 12.963 -3.017 1.00 0.00 H new ATOM 0 HB ILE B 61 -12.515 10.280 -3.240 1.00 0.00 H new ATOM 0 HG12 ILE B 61 -9.812 11.232 -2.167 1.00 0.00 H new ATOM 0 HG13 ILE B 61 -11.242 11.005 -1.179 1.00 0.00 H new ATOM 0 HG21 ILE B 61 -10.655 9.413 -4.536 1.00 0.00 H new ATOM 0 HG22 ILE B 61 -11.580 10.636 -5.439 1.00 0.00 H new ATOM 0 HG23 ILE B 61 -10.007 11.060 -4.723 1.00 0.00 H new ATOM 0 HD11 ILE B 61 -9.743 9.053 -1.014 1.00 0.00 H new ATOM 0 HD12 ILE B 61 -11.285 8.591 -1.773 1.00 0.00 H new ATOM 0 HD13 ILE B 61 -9.833 8.821 -2.776 1.00 0.00 H new ATOM 1555 N GLN B 62 -11.694 13.856 -5.210 1.00 0.00 N ATOM 1556 CA GLN B 62 -11.874 14.421 -6.536 1.00 0.00 C ATOM 1557 C GLN B 62 -11.024 13.660 -7.564 1.00 0.00 C ATOM 1558 O GLN B 62 -10.358 12.681 -7.232 1.00 0.00 O ATOM 1559 CB GLN B 62 -11.502 15.908 -6.515 1.00 0.00 C ATOM 1560 CG GLN B 62 -12.314 16.699 -5.482 1.00 0.00 C ATOM 1561 CD GLN B 62 -11.906 16.413 -4.042 1.00 0.00 C ATOM 1562 OE1 GLN B 62 -10.734 16.509 -3.688 1.00 0.00 O ATOM 1563 NE2 GLN B 62 -12.866 16.058 -3.193 1.00 0.00 N ATOM 0 H GLN B 62 -10.939 14.301 -4.689 1.00 0.00 H new ATOM 0 HA GLN B 62 -12.920 14.324 -6.828 1.00 0.00 H new ATOM 0 HB2 GLN B 62 -10.440 16.011 -6.294 1.00 0.00 H new ATOM 0 HB3 GLN B 62 -11.665 16.334 -7.505 1.00 0.00 H new ATOM 0 HG2 GLN B 62 -12.199 17.765 -5.679 1.00 0.00 H new ATOM 0 HG3 GLN B 62 -13.371 16.465 -5.605 1.00 0.00 H new ATOM 0 HE21 GLN B 62 -13.831 15.986 -3.515 1.00 0.00 H new ATOM 0 HE22 GLN B 62 -12.637 15.857 -2.219 1.00 0.00 H new ATOM 1572 N LYS B 63 -11.059 14.119 -8.818 1.00 0.00 N ATOM 1573 CA LYS B 63 -10.489 13.411 -9.959 1.00 0.00 C ATOM 1574 C LYS B 63 -8.982 13.431 -10.091 1.00 0.00 C ATOM 1575 O LYS B 63 -8.440 12.692 -10.900 1.00 0.00 O ATOM 1576 CB LYS B 63 -11.061 14.005 -11.230 1.00 0.00 C ATOM 1577 CG LYS B 63 -10.622 15.459 -11.408 1.00 0.00 C ATOM 1578 CD LYS B 63 -11.442 16.094 -12.525 1.00 0.00 C ATOM 1579 CE LYS B 63 -12.859 16.398 -12.031 1.00 0.00 C ATOM 1580 NZ LYS B 63 -13.653 17.084 -13.071 1.00 0.00 N ATOM 0 H LYS B 63 -11.492 15.008 -9.069 1.00 0.00 H new ATOM 0 HA LYS B 63 -10.756 12.368 -9.790 1.00 0.00 H new ATOM 0 HB2 LYS B 63 -10.736 13.417 -12.088 1.00 0.00 H new ATOM 0 HB3 LYS B 63 -12.149 13.952 -11.201 1.00 0.00 H new ATOM 0 HG2 LYS B 63 -10.762 16.011 -10.478 1.00 0.00 H new ATOM 0 HG3 LYS B 63 -9.560 15.504 -11.649 1.00 0.00 H new ATOM 0 HD2 LYS B 63 -10.961 17.012 -12.862 1.00 0.00 H new ATOM 0 HD3 LYS B 63 -11.484 15.423 -13.383 1.00 0.00 H new ATOM 0 HE2 LYS B 63 -13.354 15.470 -11.745 1.00 0.00 H new ATOM 0 HE3 LYS B 63 -12.810 17.021 -11.138 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 -14.608 17.277 -12.708 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 -13.191 17.981 -13.325 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 -13.719 16.478 -13.914 1.00 0.00 H new ATOM 1594 N GLU B 64 -8.309 14.263 -9.320 1.00 0.00 N ATOM 1595 CA GLU B 64 -6.853 14.357 -9.346 1.00 0.00 C ATOM 1596 C GLU B 64 -6.327 14.508 -7.923 1.00 0.00 C ATOM 1597 O GLU B 64 -5.218 14.995 -7.711 1.00 0.00 O ATOM 1598 CB GLU B 64 -6.423 15.508 -10.258 1.00 0.00 C ATOM 1599 CG GLU B 64 -6.968 16.842 -9.756 1.00 0.00 C ATOM 1600 CD GLU B 64 -6.548 17.987 -10.676 1.00 0.00 C ATOM 1601 OE1 GLU B 64 -7.276 18.230 -11.663 1.00 0.00 O ATOM 1602 OE2 GLU B 64 -5.501 18.607 -10.386 1.00 0.00 O ATOM 0 H GLU B 64 -8.753 14.896 -8.655 1.00 0.00 H new ATOM 0 HA GLU B 64 -6.422 13.445 -9.758 1.00 0.00 H new ATOM 0 HB2 GLU B 64 -5.335 15.551 -10.305 1.00 0.00 H new ATOM 0 HB3 GLU B 64 -6.779 15.325 -11.272 1.00 0.00 H new ATOM 0 HG2 GLU B 64 -8.056 16.796 -9.700 1.00 0.00 H new ATOM 0 HG3 GLU B 64 -6.604 17.030 -8.746 1.00 0.00 H new ATOM 1609 N SER B 65 -7.134 14.083 -6.947 1.00 0.00 N ATOM 1610 CA SER B 65 -6.794 14.218 -5.532 1.00 0.00 C ATOM 1611 C SER B 65 -5.492 13.514 -5.143 1.00 0.00 C ATOM 1612 O SER B 65 -4.979 13.759 -4.052 1.00 0.00 O ATOM 1613 CB SER B 65 -7.927 13.673 -4.669 1.00 0.00 C ATOM 1614 OG SER B 65 -9.058 14.492 -4.832 1.00 0.00 O ATOM 0 H SER B 65 -8.036 13.638 -7.116 1.00 0.00 H new ATOM 0 HA SER B 65 -6.648 15.284 -5.358 1.00 0.00 H new ATOM 0 HB2 SER B 65 -8.160 12.648 -4.956 1.00 0.00 H new ATOM 0 HB3 SER B 65 -7.626 13.650 -3.622 1.00 0.00 H new ATOM 0 HG SER B 65 -9.168 15.060 -4.041 1.00 0.00 H new ATOM 1620 N THR B 66 -4.967 12.657 -6.024 1.00 0.00 N ATOM 1621 CA THR B 66 -3.760 11.860 -5.806 1.00 0.00 C ATOM 1622 C THR B 66 -3.954 10.841 -4.684 1.00 0.00 C ATOM 1623 O THR B 66 -4.647 11.094 -3.702 1.00 0.00 O ATOM 1624 CB THR B 66 -2.561 12.782 -5.532 1.00 0.00 C ATOM 1625 OG1 THR B 66 -2.429 13.708 -6.590 1.00 0.00 O ATOM 1626 CG2 THR B 66 -1.247 12.010 -5.413 1.00 0.00 C ATOM 0 H THR B 66 -5.387 12.495 -6.939 1.00 0.00 H new ATOM 0 HA THR B 66 -3.555 11.292 -6.714 1.00 0.00 H new ATOM 0 HB THR B 66 -2.754 13.283 -4.584 1.00 0.00 H new ATOM 0 HG1 THR B 66 -1.666 14.298 -6.415 1.00 0.00 H new ATOM 0 HG21 THR B 66 -0.432 12.707 -5.220 1.00 0.00 H new ATOM 0 HG22 THR B 66 -1.317 11.297 -4.592 1.00 0.00 H new ATOM 0 HG23 THR B 66 -1.054 11.475 -6.343 1.00 0.00 H new ATOM 1634 N LEU B 67 -3.330 9.670 -4.837 1.00 0.00 N ATOM 1635 CA LEU B 67 -3.364 8.586 -3.860 1.00 0.00 C ATOM 1636 C LEU B 67 -2.008 7.888 -3.855 1.00 0.00 C ATOM 1637 O LEU B 67 -1.110 8.267 -4.608 1.00 0.00 O ATOM 1638 CB LEU B 67 -4.459 7.564 -4.205 1.00 0.00 C ATOM 1639 CG LEU B 67 -5.855 8.011 -3.762 1.00 0.00 C ATOM 1640 CD1 LEU B 67 -6.597 8.731 -4.888 1.00 0.00 C ATOM 1641 CD2 LEU B 67 -6.678 6.780 -3.381 1.00 0.00 C ATOM 0 H LEU B 67 -2.775 9.447 -5.664 1.00 0.00 H new ATOM 0 HA LEU B 67 -3.585 9.005 -2.878 1.00 0.00 H new ATOM 0 HB2 LEU B 67 -4.463 7.393 -5.282 1.00 0.00 H new ATOM 0 HB3 LEU B 67 -4.221 6.611 -3.732 1.00 0.00 H new ATOM 0 HG LEU B 67 -5.733 8.691 -2.919 1.00 0.00 H new ATOM 0 HD11 LEU B 67 -7.584 9.034 -4.538 1.00 0.00 H new ATOM 0 HD12 LEU B 67 -6.032 9.613 -5.190 1.00 0.00 H new ATOM 0 HD13 LEU B 67 -6.705 8.060 -5.740 1.00 0.00 H new ATOM 0 HD21 LEU B 67 -7.673 7.092 -3.065 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -6.762 6.118 -4.243 1.00 0.00 H new ATOM 0 HD23 LEU B 67 -6.186 6.252 -2.564 1.00 0.00 H new ATOM 1653 N HIS B 68 -1.853 6.865 -3.012 1.00 0.00 N ATOM 1654 CA HIS B 68 -0.638 6.085 -2.953 1.00 0.00 C ATOM 1655 C HIS B 68 -0.990 4.612 -2.831 1.00 0.00 C ATOM 1656 O HIS B 68 -2.093 4.265 -2.404 1.00 0.00 O ATOM 1657 CB HIS B 68 0.163 6.511 -1.720 1.00 0.00 C ATOM 1658 CG HIS B 68 0.626 7.943 -1.758 1.00 0.00 C ATOM 1659 ND1 HIS B 68 -0.100 9.051 -1.307 1.00 0.00 N ATOM 1660 CD2 HIS B 68 1.830 8.362 -2.243 1.00 0.00 C ATOM 1661 CE1 HIS B 68 0.696 10.110 -1.530 1.00 0.00 C ATOM 1662 NE2 HIS B 68 1.858 9.728 -2.091 1.00 0.00 N ATOM 0 H HIS B 68 -2.573 6.562 -2.355 1.00 0.00 H new ATOM 0 HA HIS B 68 -0.051 6.247 -3.857 1.00 0.00 H new ATOM 0 HB2 HIS B 68 -0.450 6.361 -0.831 1.00 0.00 H new ATOM 0 HB3 HIS B 68 1.032 5.861 -1.621 1.00 0.00 H new ATOM 0 HD2 HIS B 68 2.608 7.742 -2.664 1.00 0.00 H new ATOM 0 HE1 HIS B 68 0.438 11.131 -1.291 1.00 0.00 H new ATOM 0 HE2 HIS B 68 2.626 10.345 -2.357 1.00 0.00 H new ATOM 1670 N LEU B 69 -0.045 3.751 -3.204 1.00 0.00 N ATOM 1671 CA LEU B 69 -0.152 2.330 -2.923 1.00 0.00 C ATOM 1672 C LEU B 69 1.102 1.874 -2.193 1.00 0.00 C ATOM 1673 O LEU B 69 2.190 2.412 -2.385 1.00 0.00 O ATOM 1674 CB LEU B 69 -0.432 1.476 -4.166 1.00 0.00 C ATOM 1675 CG LEU B 69 0.557 1.677 -5.312 1.00 0.00 C ATOM 1676 CD1 LEU B 69 0.667 0.390 -6.123 1.00 0.00 C ATOM 1677 CD2 LEU B 69 0.021 2.768 -6.220 1.00 0.00 C ATOM 0 H LEU B 69 0.804 4.019 -3.703 1.00 0.00 H new ATOM 0 HA LEU B 69 -1.023 2.182 -2.285 1.00 0.00 H new ATOM 0 HB2 LEU B 69 -0.425 0.425 -3.878 1.00 0.00 H new ATOM 0 HB3 LEU B 69 -1.436 1.701 -4.526 1.00 0.00 H new ATOM 0 HG LEU B 69 1.535 1.947 -4.912 1.00 0.00 H new ATOM 0 HD11 LEU B 69 1.373 0.534 -6.941 1.00 0.00 H new ATOM 0 HD12 LEU B 69 1.017 -0.417 -5.479 1.00 0.00 H new ATOM 0 HD13 LEU B 69 -0.311 0.131 -6.529 1.00 0.00 H new ATOM 0 HD21 LEU B 69 0.714 2.927 -7.046 1.00 0.00 H new ATOM 0 HD22 LEU B 69 -0.950 2.469 -6.614 1.00 0.00 H new ATOM 0 HD23 LEU B 69 -0.086 3.693 -5.653 1.00 0.00 H new ATOM 1689 N VAL B 70 0.919 0.863 -1.347 1.00 0.00 N ATOM 1690 CA VAL B 70 1.949 0.325 -0.480 1.00 0.00 C ATOM 1691 C VAL B 70 1.637 -1.155 -0.289 1.00 0.00 C ATOM 1692 O VAL B 70 1.129 -1.586 0.744 1.00 0.00 O ATOM 1693 CB VAL B 70 2.033 1.164 0.806 1.00 0.00 C ATOM 1694 CG1 VAL B 70 0.663 1.430 1.445 1.00 0.00 C ATOM 1695 CG2 VAL B 70 2.992 0.538 1.813 1.00 0.00 C ATOM 0 H VAL B 70 0.023 0.386 -1.248 1.00 0.00 H new ATOM 0 HA VAL B 70 2.951 0.388 -0.904 1.00 0.00 H new ATOM 0 HB VAL B 70 2.428 2.135 0.508 1.00 0.00 H new ATOM 0 HG11 VAL B 70 0.792 2.027 2.348 1.00 0.00 H new ATOM 0 HG12 VAL B 70 0.032 1.971 0.740 1.00 0.00 H new ATOM 0 HG13 VAL B 70 0.191 0.482 1.701 1.00 0.00 H new ATOM 0 HG21 VAL B 70 3.030 1.154 2.711 1.00 0.00 H new ATOM 0 HG22 VAL B 70 2.645 -0.462 2.073 1.00 0.00 H new ATOM 0 HG23 VAL B 70 3.988 0.474 1.375 1.00 0.00 H new ATOM 1705 N LEU B 71 1.955 -1.923 -1.336 1.00 0.00 N ATOM 1706 CA LEU B 71 1.577 -3.316 -1.500 1.00 0.00 C ATOM 1707 C LEU B 71 1.982 -4.212 -0.334 1.00 0.00 C ATOM 1708 O LEU B 71 2.800 -3.844 0.504 1.00 0.00 O ATOM 1709 CB LEU B 71 2.172 -3.843 -2.810 1.00 0.00 C ATOM 1710 CG LEU B 71 1.800 -2.971 -4.015 1.00 0.00 C ATOM 1711 CD1 LEU B 71 2.324 -3.627 -5.290 1.00 0.00 C ATOM 1712 CD2 LEU B 71 0.287 -2.804 -4.128 1.00 0.00 C ATOM 0 H LEU B 71 2.505 -1.570 -2.119 1.00 0.00 H new ATOM 0 HA LEU B 71 0.488 -3.349 -1.527 1.00 0.00 H new ATOM 0 HB2 LEU B 71 3.257 -3.889 -2.720 1.00 0.00 H new ATOM 0 HB3 LEU B 71 1.823 -4.861 -2.981 1.00 0.00 H new ATOM 0 HG LEU B 71 2.249 -1.987 -3.879 1.00 0.00 H new ATOM 0 HD11 LEU B 71 2.062 -3.011 -6.150 1.00 0.00 H new ATOM 0 HD12 LEU B 71 3.408 -3.725 -5.230 1.00 0.00 H new ATOM 0 HD13 LEU B 71 1.877 -4.615 -5.401 1.00 0.00 H new ATOM 0 HD21 LEU B 71 0.053 -2.181 -4.991 1.00 0.00 H new ATOM 0 HD22 LEU B 71 -0.179 -3.782 -4.249 1.00 0.00 H new ATOM 0 HD23 LEU B 71 -0.095 -2.330 -3.224 1.00 0.00 H new ATOM 1724 N ARG B 72 1.389 -5.411 -0.297 1.00 0.00 N ATOM 1725 CA ARG B 72 1.644 -6.402 0.738 1.00 0.00 C ATOM 1726 C ARG B 72 2.909 -7.233 0.483 1.00 0.00 C ATOM 1727 O ARG B 72 3.193 -8.153 1.249 1.00 0.00 O ATOM 1728 CB ARG B 72 0.402 -7.288 0.882 1.00 0.00 C ATOM 1729 CG ARG B 72 -0.786 -6.440 1.344 1.00 0.00 C ATOM 1730 CD ARG B 72 -2.017 -7.293 1.629 1.00 0.00 C ATOM 1731 NE ARG B 72 -1.804 -8.177 2.784 1.00 0.00 N ATOM 1732 CZ ARG B 72 -2.749 -8.972 3.298 1.00 0.00 C ATOM 1733 NH1 ARG B 72 -3.970 -9.008 2.769 1.00 0.00 N ATOM 1734 NH2 ARG B 72 -2.472 -9.739 4.348 1.00 0.00 N ATOM 0 H ARG B 72 0.712 -5.717 -0.996 1.00 0.00 H new ATOM 0 HA ARG B 72 1.837 -5.878 1.674 1.00 0.00 H new ATOM 0 HB2 ARG B 72 0.172 -7.766 -0.070 1.00 0.00 H new ATOM 0 HB3 ARG B 72 0.593 -8.085 1.600 1.00 0.00 H new ATOM 0 HG2 ARG B 72 -0.511 -5.888 2.243 1.00 0.00 H new ATOM 0 HG3 ARG B 72 -1.025 -5.702 0.578 1.00 0.00 H new ATOM 0 HD2 ARG B 72 -2.874 -6.646 1.818 1.00 0.00 H new ATOM 0 HD3 ARG B 72 -2.257 -7.892 0.751 1.00 0.00 H new ATOM 0 HE ARG B 72 -0.881 -8.185 3.219 1.00 0.00 H new ATOM 0 HH11 ARG B 72 -4.194 -8.425 1.962 1.00 0.00 H new ATOM 0 HH12 ARG B 72 -4.682 -9.619 3.170 1.00 0.00 H new ATOM 0 HH21 ARG B 72 -1.540 -9.721 4.761 1.00 0.00 H new ATOM 0 HH22 ARG B 72 -3.192 -10.346 4.741 1.00 0.00 H new ATOM 1748 N LEU B 73 3.659 -6.921 -0.580 1.00 0.00 N ATOM 1749 CA LEU B 73 4.950 -7.518 -0.939 1.00 0.00 C ATOM 1750 C LEU B 73 4.941 -9.023 -1.229 1.00 0.00 C ATOM 1751 O LEU B 73 5.888 -9.507 -1.851 1.00 0.00 O ATOM 1752 CB LEU B 73 5.981 -7.236 0.156 1.00 0.00 C ATOM 1753 CG LEU B 73 6.672 -5.867 0.073 1.00 0.00 C ATOM 1754 CD1 LEU B 73 7.547 -5.776 -1.178 1.00 0.00 C ATOM 1755 CD2 LEU B 73 5.685 -4.706 0.064 1.00 0.00 C ATOM 0 H LEU B 73 3.366 -6.208 -1.248 1.00 0.00 H new ATOM 0 HA LEU B 73 5.210 -7.040 -1.883 1.00 0.00 H new ATOM 0 HB2 LEU B 73 5.488 -7.317 1.125 1.00 0.00 H new ATOM 0 HB3 LEU B 73 6.745 -8.013 0.121 1.00 0.00 H new ATOM 0 HG LEU B 73 7.285 -5.785 0.971 1.00 0.00 H new ATOM 0 HD11 LEU B 73 8.027 -4.798 -1.216 1.00 0.00 H new ATOM 0 HD12 LEU B 73 8.310 -6.553 -1.145 1.00 0.00 H new ATOM 0 HD13 LEU B 73 6.929 -5.912 -2.065 1.00 0.00 H new ATOM 0 HD21 LEU B 73 6.231 -3.765 0.004 1.00 0.00 H new ATOM 0 HD22 LEU B 73 5.024 -4.797 -0.798 1.00 0.00 H new ATOM 0 HD23 LEU B 73 5.093 -4.725 0.979 1.00 0.00 H new