USER MOD reduce.3.24.130724 H: found=0, std=0, add=825, rem=0, adj=20 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 Single : A 688 GLN : amide:sc= -4.82! K(o=-4.8!,f=-0.46) USER MOD Single : A 691 TYR OH : rot 13:sc= 0.0655 USER MOD Single : A 698 GLN : amide:sc= 0.505 K(o=0.5,f=-1.9!) USER MOD Single : A 699 LYS NZ :NH3+ -123:sc= 0.0988 (180deg=0) USER MOD Single : A 702 MET CE :methyl 152:sc= -3.78 (180deg=-9.48!) USER MOD Single : B 1 MET CE :methyl 167:sc= -0.0202 (180deg=-0.264) USER MOD Single : B 1 MET N :NH3+ 141:sc= 0.0716 (180deg=-0.0775) USER MOD Single : B 2 GLN : amide:sc= -1.84 X(o=-1.8,f=-2) USER MOD Single : B 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 7 THR OG1 : rot 180:sc= 0.051 USER MOD Single : B 9 THR OG1 : rot 180:sc= 0 USER MOD Single : B 11 LYS NZ :NH3+ -114:sc= 0.634 (180deg=-0.317) USER MOD Single : B 12 THR OG1 : rot 180:sc= 0 USER MOD Single : B 14 THR OG1 : rot 180:sc= 0 USER MOD Single : B 20 SER OG : rot 180:sc= 0 USER MOD Single : B 22 THR OG1 : rot 79:sc= -0.0641 USER MOD Single : B 25 ASN : amide:sc= -0.424 X(o=-0.42,f=-0.34) USER MOD Single : B 27 LYS NZ :NH3+ 172:sc= 1.22 (180deg=1.08) USER MOD Single : B 29 LYS NZ :NH3+ -168:sc= 1.19 (180deg=1.04) USER MOD Single : B 31 GLN : amide:sc= -0.724 K(o=-0.72,f=-1.6) USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 40 GLN : amide:sc= -0.851 K(o=-0.85,f=0) USER MOD Single : B 41 GLN : amide:sc= 0.00465 K(o=0.0046,f=-5.5!) USER MOD Single : B 48 LYS NZ :NH3+ -145:sc= 0.618 (180deg=-0.269) USER MOD Single : B 49 GLN : amide:sc= 0.74 K(o=0.74,f=-7.4!) USER MOD Single : B 55 THR OG1 : rot 180:sc= 0 USER MOD Single : B 57 SER OG : rot 180:sc= 0 USER MOD Single : B 59 TYR OH : rot 150:sc= -2.29 USER MOD Single : B 60 ASN : amide:sc= -0.229 X(o=-0.23,f=-0.34) USER MOD Single : B 62 GLN : amide:sc= 1.14 K(o=1.1,f=-0.12) USER MOD Single : B 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 65 SER OG : rot -120:sc= 0.261 USER MOD Single : B 66 THR OG1 : rot 180:sc= 0 USER MOD Single : B 68 HIS : no HD1:sc= -0.535 X(o=-0.53,f=-0.49) USER MOD ----------------------------------------------------------------- ATOM 63 N LEU A 679 18.609 -2.035 4.692 1.00 0.00 N ATOM 64 CA LEU A 679 17.336 -2.570 4.262 1.00 0.00 C ATOM 65 C LEU A 679 17.388 -2.891 2.760 1.00 0.00 C ATOM 66 O LEU A 679 18.402 -2.613 2.121 1.00 0.00 O ATOM 67 CB LEU A 679 16.260 -1.549 4.628 1.00 0.00 C ATOM 68 CG LEU A 679 16.476 -0.943 6.026 1.00 0.00 C ATOM 69 CD1 LEU A 679 15.293 -0.048 6.375 1.00 0.00 C ATOM 70 CD2 LEU A 679 16.575 -2.025 7.101 1.00 0.00 C ATOM 0 HA LEU A 679 17.098 -3.509 4.761 1.00 0.00 H new ATOM 0 HB2 LEU A 679 16.254 -0.750 3.886 1.00 0.00 H new ATOM 0 HB3 LEU A 679 15.281 -2.027 4.590 1.00 0.00 H new ATOM 0 HG LEU A 679 17.409 -0.380 6.000 1.00 0.00 H new ATOM 0 HD11 LEU A 679 15.443 0.383 7.365 1.00 0.00 H new ATOM 0 HD12 LEU A 679 15.213 0.752 5.639 1.00 0.00 H new ATOM 0 HD13 LEU A 679 14.377 -0.638 6.371 1.00 0.00 H new ATOM 0 HD21 LEU A 679 16.727 -1.558 8.074 1.00 0.00 H new ATOM 0 HD22 LEU A 679 15.653 -2.607 7.118 1.00 0.00 H new ATOM 0 HD23 LEU A 679 17.415 -2.683 6.879 1.00 0.00 H new ATOM 82 N PRO A 680 16.325 -3.474 2.189 1.00 0.00 N ATOM 83 CA PRO A 680 16.235 -3.930 0.804 1.00 0.00 C ATOM 84 C PRO A 680 16.474 -2.883 -0.289 1.00 0.00 C ATOM 85 O PRO A 680 16.178 -3.139 -1.456 1.00 0.00 O ATOM 86 CB PRO A 680 14.837 -4.538 0.664 1.00 0.00 C ATOM 87 CG PRO A 680 14.456 -4.905 2.094 1.00 0.00 C ATOM 88 CD PRO A 680 15.096 -3.775 2.891 1.00 0.00 C ATOM 0 HA PRO A 680 17.051 -4.632 0.636 1.00 0.00 H new ATOM 0 HB2 PRO A 680 14.133 -3.827 0.232 1.00 0.00 H new ATOM 0 HB3 PRO A 680 14.845 -5.413 0.015 1.00 0.00 H new ATOM 0 HG2 PRO A 680 13.375 -4.941 2.232 1.00 0.00 H new ATOM 0 HG3 PRO A 680 14.847 -5.881 2.383 1.00 0.00 H new ATOM 0 HD2 PRO A 680 14.443 -2.904 2.935 1.00 0.00 H new ATOM 0 HD3 PRO A 680 15.293 -4.079 3.919 1.00 0.00 H new ATOM 96 N PHE A 681 17.003 -1.715 0.064 1.00 0.00 N ATOM 97 CA PHE A 681 17.329 -0.658 -0.884 1.00 0.00 C ATOM 98 C PHE A 681 18.486 -1.090 -1.795 1.00 0.00 C ATOM 99 O PHE A 681 19.206 -2.035 -1.469 1.00 0.00 O ATOM 100 CB PHE A 681 17.754 0.588 -0.104 1.00 0.00 C ATOM 101 CG PHE A 681 16.685 1.176 0.790 1.00 0.00 C ATOM 102 CD1 PHE A 681 15.469 1.610 0.244 1.00 0.00 C ATOM 103 CD2 PHE A 681 16.918 1.298 2.168 1.00 0.00 C ATOM 104 CE1 PHE A 681 14.489 2.172 1.074 1.00 0.00 C ATOM 105 CE2 PHE A 681 15.938 1.863 2.996 1.00 0.00 C ATOM 106 CZ PHE A 681 14.723 2.297 2.449 1.00 0.00 C ATOM 0 H PHE A 681 17.220 -1.474 1.031 1.00 0.00 H new ATOM 0 HA PHE A 681 16.453 -0.449 -1.498 1.00 0.00 H new ATOM 0 HB2 PHE A 681 18.621 0.338 0.507 1.00 0.00 H new ATOM 0 HB3 PHE A 681 18.074 1.351 -0.813 1.00 0.00 H new ATOM 0 HD1 PHE A 681 15.287 1.511 -0.816 1.00 0.00 H new ATOM 0 HD2 PHE A 681 17.852 0.957 2.591 1.00 0.00 H new ATOM 0 HE1 PHE A 681 13.553 2.509 0.653 1.00 0.00 H new ATOM 0 HE2 PHE A 681 16.119 1.964 4.056 1.00 0.00 H new ATOM 0 HZ PHE A 681 13.967 2.728 3.088 1.00 0.00 H new ATOM 116 N PRO A 682 18.687 -0.409 -2.934 1.00 0.00 N ATOM 117 CA PRO A 682 17.819 0.615 -3.499 1.00 0.00 C ATOM 118 C PRO A 682 16.677 0.133 -4.421 1.00 0.00 C ATOM 119 O PRO A 682 15.867 0.980 -4.796 1.00 0.00 O ATOM 120 CB PRO A 682 18.779 1.465 -4.329 1.00 0.00 C ATOM 121 CG PRO A 682 19.719 0.411 -4.913 1.00 0.00 C ATOM 122 CD PRO A 682 19.874 -0.575 -3.753 1.00 0.00 C ATOM 0 HA PRO A 682 17.293 1.112 -2.684 1.00 0.00 H new ATOM 0 HB2 PRO A 682 18.259 2.024 -5.108 1.00 0.00 H new ATOM 0 HB3 PRO A 682 19.312 2.192 -3.717 1.00 0.00 H new ATOM 0 HG2 PRO A 682 19.295 -0.066 -5.797 1.00 0.00 H new ATOM 0 HG3 PRO A 682 20.675 0.841 -5.211 1.00 0.00 H new ATOM 0 HD2 PRO A 682 19.958 -1.599 -4.118 1.00 0.00 H new ATOM 0 HD3 PRO A 682 20.777 -0.366 -3.180 1.00 0.00 H new ATOM 130 N PRO A 683 16.543 -1.145 -4.825 1.00 0.00 N ATOM 131 CA PRO A 683 15.525 -1.519 -5.794 1.00 0.00 C ATOM 132 C PRO A 683 14.124 -1.574 -5.183 1.00 0.00 C ATOM 133 O PRO A 683 13.961 -1.600 -3.964 1.00 0.00 O ATOM 134 CB PRO A 683 15.934 -2.903 -6.297 1.00 0.00 C ATOM 135 CG PRO A 683 16.594 -3.515 -5.067 1.00 0.00 C ATOM 136 CD PRO A 683 17.321 -2.318 -4.459 1.00 0.00 C ATOM 0 HA PRO A 683 15.469 -0.778 -6.592 1.00 0.00 H new ATOM 0 HB2 PRO A 683 15.074 -3.485 -6.629 1.00 0.00 H new ATOM 0 HB3 PRO A 683 16.623 -2.842 -7.140 1.00 0.00 H new ATOM 0 HG2 PRO A 683 15.861 -3.938 -4.380 1.00 0.00 H new ATOM 0 HG3 PRO A 683 17.282 -4.318 -5.332 1.00 0.00 H new ATOM 0 HD2 PRO A 683 17.393 -2.415 -3.376 1.00 0.00 H new ATOM 0 HD3 PRO A 683 18.339 -2.245 -4.841 1.00 0.00 H new ATOM 144 N ASP A 684 13.124 -1.594 -6.072 1.00 0.00 N ATOM 145 CA ASP A 684 11.693 -1.704 -5.799 1.00 0.00 C ATOM 146 C ASP A 684 11.080 -0.618 -4.906 1.00 0.00 C ATOM 147 O ASP A 684 9.864 -0.442 -4.950 1.00 0.00 O ATOM 148 CB ASP A 684 11.380 -3.100 -5.248 1.00 0.00 C ATOM 149 CG ASP A 684 11.831 -4.197 -6.208 1.00 0.00 C ATOM 150 OD1 ASP A 684 11.284 -4.241 -7.334 1.00 0.00 O ATOM 151 OD2 ASP A 684 12.718 -4.984 -5.810 1.00 0.00 O ATOM 0 H ASP A 684 13.311 -1.529 -7.073 1.00 0.00 H new ATOM 0 HA ASP A 684 11.213 -1.541 -6.764 1.00 0.00 H new ATOM 0 HB2 ASP A 684 11.875 -3.231 -4.286 1.00 0.00 H new ATOM 0 HB3 ASP A 684 10.308 -3.190 -5.070 1.00 0.00 H new ATOM 156 N ILE A 685 11.869 0.107 -4.110 1.00 0.00 N ATOM 157 CA ILE A 685 11.347 1.145 -3.224 1.00 0.00 C ATOM 158 C ILE A 685 12.387 2.219 -2.937 1.00 0.00 C ATOM 159 O ILE A 685 13.576 2.064 -3.210 1.00 0.00 O ATOM 160 CB ILE A 685 10.856 0.565 -1.881 1.00 0.00 C ATOM 161 CG1 ILE A 685 11.596 -0.692 -1.415 1.00 0.00 C ATOM 162 CG2 ILE A 685 9.356 0.284 -1.948 1.00 0.00 C ATOM 163 CD1 ILE A 685 12.985 -0.335 -0.896 1.00 0.00 C ATOM 0 H ILE A 685 12.881 -0.009 -4.063 1.00 0.00 H new ATOM 0 HA ILE A 685 10.504 1.590 -3.752 1.00 0.00 H new ATOM 0 HB ILE A 685 11.076 1.331 -1.138 1.00 0.00 H new ATOM 0 HG12 ILE A 685 11.025 -1.187 -0.630 1.00 0.00 H new ATOM 0 HG13 ILE A 685 11.681 -1.398 -2.241 1.00 0.00 H new ATOM 0 HG21 ILE A 685 9.020 -0.125 -0.995 1.00 0.00 H new ATOM 0 HG22 ILE A 685 8.821 1.211 -2.154 1.00 0.00 H new ATOM 0 HG23 ILE A 685 9.156 -0.435 -2.743 1.00 0.00 H new ATOM 0 HD11 ILE A 685 13.495 -1.241 -0.569 1.00 0.00 H new ATOM 0 HD12 ILE A 685 13.560 0.139 -1.692 1.00 0.00 H new ATOM 0 HD13 ILE A 685 12.894 0.353 -0.055 1.00 0.00 H new ATOM 175 N ASP A 686 11.902 3.321 -2.364 1.00 0.00 N ATOM 176 CA ASP A 686 12.700 4.426 -1.869 1.00 0.00 C ATOM 177 C ASP A 686 12.021 4.919 -0.600 1.00 0.00 C ATOM 178 O ASP A 686 10.792 4.998 -0.560 1.00 0.00 O ATOM 179 CB ASP A 686 12.770 5.537 -2.913 1.00 0.00 C ATOM 180 CG ASP A 686 13.408 5.070 -4.220 1.00 0.00 C ATOM 181 OD1 ASP A 686 14.657 5.060 -4.281 1.00 0.00 O ATOM 182 OD2 ASP A 686 12.640 4.733 -5.149 1.00 0.00 O ATOM 0 H ASP A 686 10.901 3.467 -2.230 1.00 0.00 H new ATOM 0 HA ASP A 686 13.724 4.114 -1.663 1.00 0.00 H new ATOM 0 HB2 ASP A 686 11.764 5.906 -3.115 1.00 0.00 H new ATOM 0 HB3 ASP A 686 13.342 6.373 -2.511 1.00 0.00 H new ATOM 187 N PRO A 687 12.785 5.247 0.446 1.00 0.00 N ATOM 188 CA PRO A 687 12.209 5.584 1.734 1.00 0.00 C ATOM 189 C PRO A 687 11.389 6.865 1.655 1.00 0.00 C ATOM 190 O PRO A 687 10.522 7.119 2.484 1.00 0.00 O ATOM 191 CB PRO A 687 13.388 5.720 2.697 1.00 0.00 C ATOM 192 CG PRO A 687 14.660 5.725 1.846 1.00 0.00 C ATOM 193 CD PRO A 687 14.235 5.299 0.444 1.00 0.00 C ATOM 0 HA PRO A 687 11.515 4.816 2.075 1.00 0.00 H new ATOM 0 HB2 PRO A 687 13.308 6.639 3.277 1.00 0.00 H new ATOM 0 HB3 PRO A 687 13.403 4.894 3.408 1.00 0.00 H new ATOM 0 HG2 PRO A 687 15.115 6.716 1.831 1.00 0.00 H new ATOM 0 HG3 PRO A 687 15.403 5.039 2.253 1.00 0.00 H new ATOM 0 HD2 PRO A 687 14.596 6.007 -0.302 1.00 0.00 H new ATOM 0 HD3 PRO A 687 14.657 4.326 0.190 1.00 0.00 H new ATOM 201 N GLN A 688 11.675 7.672 0.640 1.00 0.00 N ATOM 202 CA GLN A 688 11.023 8.946 0.382 1.00 0.00 C ATOM 203 C GLN A 688 9.686 8.743 -0.317 1.00 0.00 C ATOM 204 O GLN A 688 9.022 9.718 -0.661 1.00 0.00 O ATOM 205 CB GLN A 688 11.924 9.817 -0.498 1.00 0.00 C ATOM 206 CG GLN A 688 12.667 8.959 -1.524 1.00 0.00 C ATOM 207 CD GLN A 688 14.116 8.747 -1.095 1.00 0.00 C ATOM 208 OE1 GLN A 688 15.038 8.878 -1.895 1.00 0.00 O ATOM 209 NE2 GLN A 688 14.325 8.416 0.180 1.00 0.00 N ATOM 0 H GLN A 688 12.393 7.447 -0.049 1.00 0.00 H new ATOM 0 HA GLN A 688 10.846 9.438 1.338 1.00 0.00 H new ATOM 0 HB2 GLN A 688 11.324 10.568 -1.011 1.00 0.00 H new ATOM 0 HB3 GLN A 688 12.641 10.352 0.124 1.00 0.00 H new ATOM 0 HG2 GLN A 688 12.168 7.996 -1.630 1.00 0.00 H new ATOM 0 HG3 GLN A 688 12.638 9.442 -2.500 1.00 0.00 H new ATOM 0 HE21 GLN A 688 13.535 8.316 0.817 1.00 0.00 H new ATOM 0 HE22 GLN A 688 15.275 8.263 0.518 1.00 0.00 H new ATOM 218 N VAL A 689 9.286 7.486 -0.536 1.00 0.00 N ATOM 219 CA VAL A 689 8.050 7.194 -1.222 1.00 0.00 C ATOM 220 C VAL A 689 7.203 6.269 -0.345 1.00 0.00 C ATOM 221 O VAL A 689 6.098 5.888 -0.722 1.00 0.00 O ATOM 222 CB VAL A 689 8.359 6.605 -2.602 1.00 0.00 C ATOM 223 CG1 VAL A 689 7.090 6.553 -3.449 1.00 0.00 C ATOM 224 CG2 VAL A 689 9.359 7.482 -3.355 1.00 0.00 C ATOM 0 H VAL A 689 9.810 6.662 -0.243 1.00 0.00 H new ATOM 0 HA VAL A 689 7.469 8.100 -1.392 1.00 0.00 H new ATOM 0 HB VAL A 689 8.768 5.607 -2.444 1.00 0.00 H new ATOM 0 HG11 VAL A 689 7.323 6.133 -4.427 1.00 0.00 H new ATOM 0 HG12 VAL A 689 6.347 5.929 -2.953 1.00 0.00 H new ATOM 0 HG13 VAL A 689 6.693 7.561 -3.572 1.00 0.00 H new ATOM 0 HG21 VAL A 689 9.563 7.044 -4.332 1.00 0.00 H new ATOM 0 HG22 VAL A 689 8.942 8.480 -3.485 1.00 0.00 H new ATOM 0 HG23 VAL A 689 10.286 7.548 -2.786 1.00 0.00 H new ATOM 234 N PHE A 690 7.721 5.903 0.838 1.00 0.00 N ATOM 235 CA PHE A 690 6.969 5.096 1.784 1.00 0.00 C ATOM 236 C PHE A 690 7.014 5.670 3.202 1.00 0.00 C ATOM 237 O PHE A 690 6.196 5.282 4.027 1.00 0.00 O ATOM 238 CB PHE A 690 7.427 3.635 1.722 1.00 0.00 C ATOM 239 CG PHE A 690 8.548 3.243 2.658 1.00 0.00 C ATOM 240 CD1 PHE A 690 8.275 2.978 4.011 1.00 0.00 C ATOM 241 CD2 PHE A 690 9.856 3.123 2.176 1.00 0.00 C ATOM 242 CE1 PHE A 690 9.314 2.612 4.879 1.00 0.00 C ATOM 243 CE2 PHE A 690 10.892 2.762 3.044 1.00 0.00 C ATOM 244 CZ PHE A 690 10.623 2.517 4.396 1.00 0.00 C ATOM 0 H PHE A 690 8.657 6.158 1.153 1.00 0.00 H new ATOM 0 HA PHE A 690 5.919 5.125 1.492 1.00 0.00 H new ATOM 0 HB2 PHE A 690 6.568 2.998 1.932 1.00 0.00 H new ATOM 0 HB3 PHE A 690 7.742 3.419 0.701 1.00 0.00 H new ATOM 0 HD1 PHE A 690 7.264 3.056 4.383 1.00 0.00 H new ATOM 0 HD2 PHE A 690 10.066 3.309 1.133 1.00 0.00 H new ATOM 0 HE1 PHE A 690 9.104 2.404 5.918 1.00 0.00 H new ATOM 0 HE2 PHE A 690 11.901 2.672 2.670 1.00 0.00 H new ATOM 0 HZ PHE A 690 11.428 2.254 5.067 1.00 0.00 H new ATOM 254 N TYR A 691 7.941 6.584 3.513 1.00 0.00 N ATOM 255 CA TYR A 691 7.888 7.324 4.769 1.00 0.00 C ATOM 256 C TYR A 691 6.834 8.439 4.690 1.00 0.00 C ATOM 257 O TYR A 691 6.626 9.167 5.657 1.00 0.00 O ATOM 258 CB TYR A 691 9.266 7.905 5.109 1.00 0.00 C ATOM 259 CG TYR A 691 10.306 6.887 5.538 1.00 0.00 C ATOM 260 CD1 TYR A 691 9.919 5.741 6.256 1.00 0.00 C ATOM 261 CD2 TYR A 691 11.664 7.094 5.239 1.00 0.00 C ATOM 262 CE1 TYR A 691 10.880 4.828 6.703 1.00 0.00 C ATOM 263 CE2 TYR A 691 12.633 6.188 5.700 1.00 0.00 C ATOM 264 CZ TYR A 691 12.243 5.048 6.433 1.00 0.00 C ATOM 265 OH TYR A 691 13.180 4.162 6.876 1.00 0.00 O ATOM 0 H TYR A 691 8.730 6.824 2.913 1.00 0.00 H new ATOM 0 HA TYR A 691 7.601 6.636 5.564 1.00 0.00 H new ATOM 0 HB2 TYR A 691 9.642 8.441 4.237 1.00 0.00 H new ATOM 0 HB3 TYR A 691 9.147 8.638 5.907 1.00 0.00 H new ATOM 0 HD1 TYR A 691 8.874 5.565 6.463 1.00 0.00 H new ATOM 0 HD2 TYR A 691 11.963 7.951 4.654 1.00 0.00 H new ATOM 0 HE1 TYR A 691 10.575 3.952 7.257 1.00 0.00 H new ATOM 0 HE2 TYR A 691 13.678 6.364 5.493 1.00 0.00 H new ATOM 0 HH TYR A 691 12.738 3.340 7.176 1.00 0.00 H new ATOM 275 N GLU A 692 6.166 8.573 3.540 1.00 0.00 N ATOM 276 CA GLU A 692 5.098 9.542 3.305 1.00 0.00 C ATOM 277 C GLU A 692 3.775 9.047 3.907 1.00 0.00 C ATOM 278 O GLU A 692 2.713 9.220 3.313 1.00 0.00 O ATOM 279 CB GLU A 692 4.950 9.768 1.795 1.00 0.00 C ATOM 280 CG GLU A 692 6.250 10.278 1.171 1.00 0.00 C ATOM 281 CD GLU A 692 6.675 11.617 1.767 1.00 0.00 C ATOM 282 OE1 GLU A 692 6.036 12.633 1.413 1.00 0.00 O ATOM 283 OE2 GLU A 692 7.632 11.619 2.572 1.00 0.00 O ATOM 0 H GLU A 692 6.361 7.992 2.725 1.00 0.00 H new ATOM 0 HA GLU A 692 5.353 10.484 3.790 1.00 0.00 H new ATOM 0 HB2 GLU A 692 4.657 8.835 1.314 1.00 0.00 H new ATOM 0 HB3 GLU A 692 4.151 10.486 1.611 1.00 0.00 H new ATOM 0 HG2 GLU A 692 7.040 9.544 1.326 1.00 0.00 H new ATOM 0 HG3 GLU A 692 6.120 10.384 0.094 1.00 0.00 H new ATOM 290 N LEU A 693 3.845 8.427 5.088 1.00 0.00 N ATOM 291 CA LEU A 693 2.754 7.695 5.708 1.00 0.00 C ATOM 292 C LEU A 693 2.785 7.891 7.224 1.00 0.00 C ATOM 293 O LEU A 693 3.723 8.486 7.749 1.00 0.00 O ATOM 294 CB LEU A 693 3.020 6.204 5.470 1.00 0.00 C ATOM 295 CG LEU A 693 3.131 5.759 4.010 1.00 0.00 C ATOM 296 CD1 LEU A 693 3.527 4.281 3.996 1.00 0.00 C ATOM 297 CD2 LEU A 693 1.804 5.938 3.276 1.00 0.00 C ATOM 0 H LEU A 693 4.695 8.425 5.652 1.00 0.00 H new ATOM 0 HA LEU A 693 1.804 8.037 5.296 1.00 0.00 H new ATOM 0 HB2 LEU A 693 3.945 5.936 5.981 1.00 0.00 H new ATOM 0 HB3 LEU A 693 2.219 5.634 5.941 1.00 0.00 H new ATOM 0 HG LEU A 693 3.878 6.369 3.502 1.00 0.00 H new ATOM 0 HD11 LEU A 693 3.613 3.937 2.965 1.00 0.00 H new ATOM 0 HD12 LEU A 693 4.485 4.156 4.502 1.00 0.00 H new ATOM 0 HD13 LEU A 693 2.766 3.695 4.511 1.00 0.00 H new ATOM 0 HD21 LEU A 693 1.914 5.614 2.241 1.00 0.00 H new ATOM 0 HD22 LEU A 693 1.035 5.340 3.764 1.00 0.00 H new ATOM 0 HD23 LEU A 693 1.515 6.989 3.298 1.00 0.00 H new ATOM 309 N PRO A 694 1.774 7.396 7.945 1.00 0.00 N ATOM 310 CA PRO A 694 1.855 7.183 9.379 1.00 0.00 C ATOM 311 C PRO A 694 2.699 5.939 9.597 1.00 0.00 C ATOM 312 O PRO A 694 2.692 5.018 8.783 1.00 0.00 O ATOM 313 CB PRO A 694 0.414 6.977 9.834 1.00 0.00 C ATOM 314 CG PRO A 694 -0.245 6.340 8.609 1.00 0.00 C ATOM 315 CD PRO A 694 0.477 6.998 7.432 1.00 0.00 C ATOM 0 HA PRO A 694 2.308 8.004 9.934 1.00 0.00 H new ATOM 0 HB2 PRO A 694 0.355 6.328 10.707 1.00 0.00 H new ATOM 0 HB3 PRO A 694 -0.063 7.919 10.105 1.00 0.00 H new ATOM 0 HG2 PRO A 694 -0.119 5.257 8.603 1.00 0.00 H new ATOM 0 HG3 PRO A 694 -1.317 6.536 8.583 1.00 0.00 H new ATOM 0 HD2 PRO A 694 0.581 6.304 6.598 1.00 0.00 H new ATOM 0 HD3 PRO A 694 -0.080 7.859 7.062 1.00 0.00 H new ATOM 323 N GLU A 695 3.427 5.919 10.712 1.00 0.00 N ATOM 324 CA GLU A 695 4.274 4.822 11.090 1.00 0.00 C ATOM 325 C GLU A 695 3.552 3.495 10.928 1.00 0.00 C ATOM 326 O GLU A 695 4.154 2.520 10.515 1.00 0.00 O ATOM 327 CB GLU A 695 4.625 5.050 12.556 1.00 0.00 C ATOM 328 CG GLU A 695 6.136 5.083 12.732 1.00 0.00 C ATOM 329 CD GLU A 695 6.529 5.111 14.208 1.00 0.00 C ATOM 330 OE1 GLU A 695 6.286 4.089 14.890 1.00 0.00 O ATOM 331 OE2 GLU A 695 7.073 6.152 14.643 1.00 0.00 O ATOM 0 H GLU A 695 3.435 6.688 11.382 1.00 0.00 H new ATOM 0 HA GLU A 695 5.162 4.780 10.460 1.00 0.00 H new ATOM 0 HB2 GLU A 695 4.190 5.988 12.901 1.00 0.00 H new ATOM 0 HB3 GLU A 695 4.197 4.256 13.168 1.00 0.00 H new ATOM 0 HG2 GLU A 695 6.578 4.209 12.254 1.00 0.00 H new ATOM 0 HG3 GLU A 695 6.542 5.961 12.230 1.00 0.00 H new ATOM 338 N GLU A 696 2.260 3.461 11.250 1.00 0.00 N ATOM 339 CA GLU A 696 1.388 2.306 11.219 1.00 0.00 C ATOM 340 C GLU A 696 1.475 1.486 9.931 1.00 0.00 C ATOM 341 O GLU A 696 0.978 0.361 9.900 1.00 0.00 O ATOM 342 CB GLU A 696 -0.028 2.815 11.491 1.00 0.00 C ATOM 343 CG GLU A 696 -1.066 1.707 11.373 1.00 0.00 C ATOM 344 CD GLU A 696 -2.438 2.186 11.841 1.00 0.00 C ATOM 345 OE1 GLU A 696 -3.176 2.744 10.997 1.00 0.00 O ATOM 346 OE2 GLU A 696 -2.741 1.992 13.041 1.00 0.00 O ATOM 0 H GLU A 696 1.769 4.300 11.559 1.00 0.00 H new ATOM 0 HA GLU A 696 1.706 1.598 11.984 1.00 0.00 H new ATOM 0 HB2 GLU A 696 -0.072 3.248 12.491 1.00 0.00 H new ATOM 0 HB3 GLU A 696 -0.268 3.613 10.788 1.00 0.00 H new ATOM 0 HG2 GLU A 696 -1.128 1.372 10.338 1.00 0.00 H new ATOM 0 HG3 GLU A 696 -0.755 0.848 11.968 1.00 0.00 H new ATOM 353 N VAL A 697 2.093 2.015 8.873 1.00 0.00 N ATOM 354 CA VAL A 697 2.293 1.250 7.653 1.00 0.00 C ATOM 355 C VAL A 697 3.737 1.360 7.160 1.00 0.00 C ATOM 356 O VAL A 697 4.187 0.498 6.410 1.00 0.00 O ATOM 357 CB VAL A 697 1.252 1.667 6.608 1.00 0.00 C ATOM 358 CG1 VAL A 697 1.277 3.180 6.411 1.00 0.00 C ATOM 359 CG2 VAL A 697 1.489 0.972 5.266 1.00 0.00 C ATOM 0 H VAL A 697 2.460 2.966 8.842 1.00 0.00 H new ATOM 0 HA VAL A 697 2.138 0.190 7.854 1.00 0.00 H new ATOM 0 HB VAL A 697 0.274 1.362 6.981 1.00 0.00 H new ATOM 0 HG11 VAL A 697 0.533 3.462 5.666 1.00 0.00 H new ATOM 0 HG12 VAL A 697 1.050 3.674 7.356 1.00 0.00 H new ATOM 0 HG13 VAL A 697 2.266 3.486 6.070 1.00 0.00 H new ATOM 0 HG21 VAL A 697 0.731 1.293 4.551 1.00 0.00 H new ATOM 0 HG22 VAL A 697 2.478 1.235 4.890 1.00 0.00 H new ATOM 0 HG23 VAL A 697 1.427 -0.108 5.400 1.00 0.00 H new ATOM 369 N GLN A 698 4.483 2.394 7.564 1.00 0.00 N ATOM 370 CA GLN A 698 5.911 2.418 7.267 1.00 0.00 C ATOM 371 C GLN A 698 6.581 1.316 8.082 1.00 0.00 C ATOM 372 O GLN A 698 7.499 0.647 7.622 1.00 0.00 O ATOM 373 CB GLN A 698 6.561 3.712 7.750 1.00 0.00 C ATOM 374 CG GLN A 698 5.903 5.027 7.365 1.00 0.00 C ATOM 375 CD GLN A 698 6.644 6.172 8.047 1.00 0.00 C ATOM 376 OE1 GLN A 698 7.713 5.987 8.623 1.00 0.00 O ATOM 377 NE2 GLN A 698 6.087 7.370 7.990 1.00 0.00 N ATOM 0 H GLN A 698 4.132 3.200 8.081 1.00 0.00 H new ATOM 0 HA GLN A 698 6.028 2.307 6.189 1.00 0.00 H new ATOM 0 HB2 GLN A 698 6.617 3.672 8.838 1.00 0.00 H new ATOM 0 HB3 GLN A 698 7.586 3.730 7.379 1.00 0.00 H new ATOM 0 HG2 GLN A 698 5.925 5.156 6.283 1.00 0.00 H new ATOM 0 HG3 GLN A 698 4.855 5.025 7.665 1.00 0.00 H new ATOM 0 HE21 GLN A 698 5.199 7.497 7.505 1.00 0.00 H new ATOM 0 HE22 GLN A 698 6.546 8.167 8.431 1.00 0.00 H new ATOM 386 N LYS A 699 6.095 1.151 9.313 1.00 0.00 N ATOM 387 CA LYS A 699 6.639 0.275 10.331 1.00 0.00 C ATOM 388 C LYS A 699 6.318 -1.178 10.000 1.00 0.00 C ATOM 389 O LYS A 699 7.011 -2.092 10.439 1.00 0.00 O ATOM 390 CB LYS A 699 6.085 0.725 11.693 1.00 0.00 C ATOM 391 CG LYS A 699 4.691 0.175 12.020 1.00 0.00 C ATOM 392 CD LYS A 699 4.063 0.883 13.224 1.00 0.00 C ATOM 393 CE LYS A 699 5.090 1.202 14.310 1.00 0.00 C ATOM 394 NZ LYS A 699 4.438 1.716 15.530 1.00 0.00 N ATOM 0 H LYS A 699 5.269 1.654 9.635 1.00 0.00 H new ATOM 0 HA LYS A 699 7.726 0.339 10.370 1.00 0.00 H new ATOM 0 HB2 LYS A 699 6.778 0.414 12.475 1.00 0.00 H new ATOM 0 HB3 LYS A 699 6.047 1.814 11.715 1.00 0.00 H new ATOM 0 HG2 LYS A 699 4.042 0.292 11.152 1.00 0.00 H new ATOM 0 HG3 LYS A 699 4.761 -0.893 12.224 1.00 0.00 H new ATOM 0 HD2 LYS A 699 3.589 1.807 12.893 1.00 0.00 H new ATOM 0 HD3 LYS A 699 3.278 0.254 13.643 1.00 0.00 H new ATOM 0 HE2 LYS A 699 5.659 0.304 14.550 1.00 0.00 H new ATOM 0 HE3 LYS A 699 5.800 1.939 13.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 699 4.828 2.651 15.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 699 3.414 1.798 15.368 1.00 0.00 H new ATOM 0 HZ3 LYS A 699 4.612 1.061 16.319 1.00 0.00 H new ATOM 408 N GLU A 700 5.259 -1.383 9.214 1.00 0.00 N ATOM 409 CA GLU A 700 4.896 -2.708 8.755 1.00 0.00 C ATOM 410 C GLU A 700 5.871 -3.099 7.661 1.00 0.00 C ATOM 411 O GLU A 700 6.268 -4.256 7.556 1.00 0.00 O ATOM 412 CB GLU A 700 3.479 -2.697 8.186 1.00 0.00 C ATOM 413 CG GLU A 700 2.447 -2.516 9.299 1.00 0.00 C ATOM 414 CD GLU A 700 1.021 -2.617 8.755 1.00 0.00 C ATOM 415 OE1 GLU A 700 0.771 -2.070 7.659 1.00 0.00 O ATOM 416 OE2 GLU A 700 0.188 -3.245 9.446 1.00 0.00 O ATOM 0 H GLU A 700 4.642 -0.640 8.886 1.00 0.00 H new ATOM 0 HA GLU A 700 4.933 -3.416 9.583 1.00 0.00 H new ATOM 0 HB2 GLU A 700 3.381 -1.891 7.459 1.00 0.00 H new ATOM 0 HB3 GLU A 700 3.288 -3.630 7.656 1.00 0.00 H new ATOM 0 HG2 GLU A 700 2.600 -3.274 10.067 1.00 0.00 H new ATOM 0 HG3 GLU A 700 2.589 -1.546 9.776 1.00 0.00 H new ATOM 423 N LEU A 701 6.259 -2.113 6.846 1.00 0.00 N ATOM 424 CA LEU A 701 7.285 -2.270 5.836 1.00 0.00 C ATOM 425 C LEU A 701 8.635 -2.505 6.515 1.00 0.00 C ATOM 426 O LEU A 701 9.427 -3.319 6.045 1.00 0.00 O ATOM 427 CB LEU A 701 7.302 -0.998 4.985 1.00 0.00 C ATOM 428 CG LEU A 701 6.707 -1.227 3.594 1.00 0.00 C ATOM 429 CD1 LEU A 701 5.231 -1.607 3.689 1.00 0.00 C ATOM 430 CD2 LEU A 701 6.818 0.059 2.773 1.00 0.00 C ATOM 0 H LEU A 701 5.858 -1.176 6.878 1.00 0.00 H new ATOM 0 HA LEU A 701 7.082 -3.129 5.196 1.00 0.00 H new ATOM 0 HB2 LEU A 701 6.741 -0.214 5.494 1.00 0.00 H new ATOM 0 HB3 LEU A 701 8.328 -0.643 4.886 1.00 0.00 H new ATOM 0 HG LEU A 701 7.259 -2.038 3.119 1.00 0.00 H new ATOM 0 HD11 LEU A 701 4.831 -1.765 2.687 1.00 0.00 H new ATOM 0 HD12 LEU A 701 5.128 -2.524 4.269 1.00 0.00 H new ATOM 0 HD13 LEU A 701 4.679 -0.804 4.178 1.00 0.00 H new ATOM 0 HD21 LEU A 701 6.394 -0.104 1.782 1.00 0.00 H new ATOM 0 HD22 LEU A 701 6.272 0.859 3.274 1.00 0.00 H new ATOM 0 HD23 LEU A 701 7.867 0.340 2.677 1.00 0.00 H new ATOM 442 N MET A 702 8.904 -1.798 7.620 1.00 0.00 N ATOM 443 CA MET A 702 10.129 -1.979 8.393 1.00 0.00 C ATOM 444 C MET A 702 10.128 -3.311 9.146 1.00 0.00 C ATOM 445 O MET A 702 11.164 -3.704 9.676 1.00 0.00 O ATOM 446 CB MET A 702 10.287 -0.848 9.413 1.00 0.00 C ATOM 447 CG MET A 702 10.454 0.544 8.803 1.00 0.00 C ATOM 448 SD MET A 702 12.102 0.946 8.168 1.00 0.00 S ATOM 449 CE MET A 702 12.008 0.198 6.526 1.00 0.00 C ATOM 0 H MET A 702 8.278 -1.088 7.999 1.00 0.00 H new ATOM 0 HA MET A 702 10.958 -1.970 7.685 1.00 0.00 H new ATOM 0 HB2 MET A 702 9.414 -0.841 10.066 1.00 0.00 H new ATOM 0 HB3 MET A 702 11.153 -1.061 10.040 1.00 0.00 H new ATOM 0 HG2 MET A 702 9.738 0.649 7.988 1.00 0.00 H new ATOM 0 HG3 MET A 702 10.188 1.283 9.558 1.00 0.00 H new ATOM 0 HE1 MET A 702 12.667 0.735 5.843 1.00 0.00 H new ATOM 0 HE2 MET A 702 12.318 -0.846 6.583 1.00 0.00 H new ATOM 0 HE3 MET A 702 10.983 0.253 6.159 1.00 0.00 H new ATOM 459 N ALA A 703 8.990 -4.009 9.204 1.00 0.00 N ATOM 460 CA ALA A 703 8.903 -5.299 9.872 1.00 0.00 C ATOM 461 C ALA A 703 8.793 -6.418 8.845 1.00 0.00 C ATOM 462 O ALA A 703 8.971 -7.591 9.167 1.00 0.00 O ATOM 463 CB ALA A 703 7.667 -5.317 10.764 1.00 0.00 C ATOM 0 H ALA A 703 8.112 -3.694 8.791 1.00 0.00 H new ATOM 0 HA ALA A 703 9.801 -5.452 10.470 1.00 0.00 H new ATOM 0 HB1 ALA A 703 7.596 -6.281 11.268 1.00 0.00 H new ATOM 0 HB2 ALA A 703 7.743 -4.524 11.508 1.00 0.00 H new ATOM 0 HB3 ALA A 703 6.777 -5.159 10.155 1.00 0.00 H new ATOM 469 N GLU A 704 8.496 -6.053 7.599 1.00 0.00 N ATOM 470 CA GLU A 704 8.287 -6.979 6.532 1.00 0.00 C ATOM 471 C GLU A 704 9.615 -7.243 5.835 1.00 0.00 C ATOM 472 O GLU A 704 9.798 -8.269 5.186 1.00 0.00 O ATOM 473 CB GLU A 704 7.279 -6.328 5.593 1.00 0.00 C ATOM 474 CG GLU A 704 7.205 -7.214 4.376 1.00 0.00 C ATOM 475 CD GLU A 704 5.894 -7.053 3.618 1.00 0.00 C ATOM 476 OE1 GLU A 704 5.573 -5.900 3.254 1.00 0.00 O ATOM 477 OE2 GLU A 704 5.233 -8.097 3.415 1.00 0.00 O ATOM 0 H GLU A 704 8.396 -5.078 7.316 1.00 0.00 H new ATOM 0 HA GLU A 704 7.907 -7.940 6.880 1.00 0.00 H new ATOM 0 HB2 GLU A 704 6.303 -6.240 6.070 1.00 0.00 H new ATOM 0 HB3 GLU A 704 7.594 -5.320 5.322 1.00 0.00 H new ATOM 0 HG2 GLU A 704 8.037 -6.983 3.711 1.00 0.00 H new ATOM 0 HG3 GLU A 704 7.320 -8.254 4.680 1.00 0.00 H new ATOM 484 N TRP A 705 10.550 -6.305 5.975 1.00 0.00 N ATOM 485 CA TRP A 705 11.860 -6.385 5.364 1.00 0.00 C ATOM 486 C TRP A 705 12.810 -7.074 6.323 1.00 0.00 C ATOM 487 O TRP A 705 13.834 -7.625 5.923 1.00 0.00 O ATOM 488 CB TRP A 705 12.308 -4.961 5.075 1.00 0.00 C ATOM 489 CG TRP A 705 11.522 -4.272 4.010 1.00 0.00 C ATOM 490 CD1 TRP A 705 10.581 -4.837 3.221 1.00 0.00 C ATOM 491 CD2 TRP A 705 11.596 -2.877 3.595 1.00 0.00 C ATOM 492 NE1 TRP A 705 10.075 -3.893 2.357 1.00 0.00 N ATOM 493 CE2 TRP A 705 10.664 -2.662 2.544 1.00 0.00 C ATOM 494 CE3 TRP A 705 12.364 -1.780 4.011 1.00 0.00 C ATOM 495 CZ2 TRP A 705 10.502 -1.415 1.932 1.00 0.00 C ATOM 496 CZ3 TRP A 705 12.233 -0.529 3.385 1.00 0.00 C ATOM 497 CH2 TRP A 705 11.307 -0.347 2.346 1.00 0.00 C ATOM 0 H TRP A 705 10.409 -5.458 6.526 1.00 0.00 H new ATOM 0 HA TRP A 705 11.842 -6.960 4.438 1.00 0.00 H new ATOM 0 HB2 TRP A 705 12.241 -4.378 5.994 1.00 0.00 H new ATOM 0 HB3 TRP A 705 13.358 -4.976 4.783 1.00 0.00 H new ATOM 0 HD1 TRP A 705 10.273 -5.871 3.262 1.00 0.00 H new ATOM 0 HE1 TRP A 705 9.352 -4.082 1.663 1.00 0.00 H new ATOM 0 HE3 TRP A 705 13.066 -1.898 4.823 1.00 0.00 H new ATOM 0 HZ2 TRP A 705 9.767 -1.278 1.152 1.00 0.00 H new ATOM 0 HZ3 TRP A 705 12.849 0.298 3.705 1.00 0.00 H new ATOM 0 HH2 TRP A 705 11.216 0.616 1.866 1.00 0.00 H new ATOM 575 N MET B 1 -12.707 11.549 -16.377 1.00 0.00 N ATOM 576 CA MET B 1 -11.981 11.767 -15.110 1.00 0.00 C ATOM 577 C MET B 1 -11.001 10.636 -14.839 1.00 0.00 C ATOM 578 O MET B 1 -11.223 9.526 -15.301 1.00 0.00 O ATOM 579 CB MET B 1 -12.951 11.845 -13.933 1.00 0.00 C ATOM 580 CG MET B 1 -13.686 10.513 -13.728 1.00 0.00 C ATOM 581 SD MET B 1 -14.674 10.494 -12.205 1.00 0.00 S ATOM 582 CE MET B 1 -15.905 11.758 -12.617 1.00 0.00 C ATOM 0 H1 MET B 1 -13.699 11.841 -16.263 1.00 0.00 H new ATOM 0 H2 MET B 1 -12.265 12.112 -17.132 1.00 0.00 H new ATOM 0 H3 MET B 1 -12.669 10.541 -16.630 1.00 0.00 H new ATOM 0 HA MET B 1 -11.441 12.708 -15.212 1.00 0.00 H new ATOM 0 HB2 MET B 1 -12.406 12.105 -13.026 1.00 0.00 H new ATOM 0 HB3 MET B 1 -13.676 12.640 -14.108 1.00 0.00 H new ATOM 0 HG2 MET B 1 -14.337 10.325 -14.582 1.00 0.00 H new ATOM 0 HG3 MET B 1 -12.959 9.701 -13.696 1.00 0.00 H new ATOM 0 HE1 MET B 1 -16.723 11.717 -11.898 1.00 0.00 H new ATOM 0 HE2 MET B 1 -15.440 12.743 -12.582 1.00 0.00 H new ATOM 0 HE3 MET B 1 -16.293 11.575 -13.619 1.00 0.00 H new ATOM 594 N GLN B 2 -9.926 10.910 -14.094 1.00 0.00 N ATOM 595 CA GLN B 2 -8.967 9.904 -13.673 1.00 0.00 C ATOM 596 C GLN B 2 -8.121 10.429 -12.512 1.00 0.00 C ATOM 597 O GLN B 2 -7.845 11.628 -12.447 1.00 0.00 O ATOM 598 CB GLN B 2 -8.101 9.541 -14.882 1.00 0.00 C ATOM 599 CG GLN B 2 -7.601 10.801 -15.591 1.00 0.00 C ATOM 600 CD GLN B 2 -6.719 10.523 -16.803 1.00 0.00 C ATOM 601 OE1 GLN B 2 -5.826 11.310 -17.108 1.00 0.00 O ATOM 602 NE2 GLN B 2 -6.944 9.416 -17.508 1.00 0.00 N ATOM 0 H GLN B 2 -9.701 11.850 -13.766 1.00 0.00 H new ATOM 0 HA GLN B 2 -9.479 9.011 -13.315 1.00 0.00 H new ATOM 0 HB2 GLN B 2 -7.252 8.939 -14.559 1.00 0.00 H new ATOM 0 HB3 GLN B 2 -8.677 8.931 -15.578 1.00 0.00 H new ATOM 0 HG2 GLN B 2 -8.460 11.392 -15.908 1.00 0.00 H new ATOM 0 HG3 GLN B 2 -7.042 11.408 -14.879 1.00 0.00 H new ATOM 0 HE21 GLN B 2 -7.692 8.779 -17.233 1.00 0.00 H new ATOM 0 HE22 GLN B 2 -6.368 9.205 -18.323 1.00 0.00 H new ATOM 611 N ILE B 3 -7.709 9.540 -11.605 1.00 0.00 N ATOM 612 CA ILE B 3 -6.865 9.922 -10.473 1.00 0.00 C ATOM 613 C ILE B 3 -5.408 9.582 -10.762 1.00 0.00 C ATOM 614 O ILE B 3 -5.118 8.816 -11.677 1.00 0.00 O ATOM 615 CB ILE B 3 -7.324 9.266 -9.158 1.00 0.00 C ATOM 616 CG1 ILE B 3 -7.130 7.743 -9.125 1.00 0.00 C ATOM 617 CG2 ILE B 3 -8.775 9.618 -8.816 1.00 0.00 C ATOM 618 CD1 ILE B 3 -8.257 6.952 -9.786 1.00 0.00 C ATOM 0 H ILE B 3 -7.948 8.549 -11.634 1.00 0.00 H new ATOM 0 HA ILE B 3 -6.961 11.000 -10.343 1.00 0.00 H new ATOM 0 HB ILE B 3 -6.669 9.687 -8.395 1.00 0.00 H new ATOM 0 HG12 ILE B 3 -6.190 7.497 -9.620 1.00 0.00 H new ATOM 0 HG13 ILE B 3 -7.037 7.423 -8.087 1.00 0.00 H new ATOM 0 HG21 ILE B 3 -9.056 9.134 -7.881 1.00 0.00 H new ATOM 0 HG22 ILE B 3 -8.872 10.698 -8.709 1.00 0.00 H new ATOM 0 HG23 ILE B 3 -9.431 9.273 -9.615 1.00 0.00 H new ATOM 0 HD11 ILE B 3 -8.041 5.886 -9.719 1.00 0.00 H new ATOM 0 HD12 ILE B 3 -9.197 7.165 -9.278 1.00 0.00 H new ATOM 0 HD13 ILE B 3 -8.338 7.240 -10.834 1.00 0.00 H new ATOM 630 N PHE B 4 -4.494 10.158 -9.975 1.00 0.00 N ATOM 631 CA PHE B 4 -3.059 9.988 -10.144 1.00 0.00 C ATOM 632 C PHE B 4 -2.513 9.255 -8.926 1.00 0.00 C ATOM 633 O PHE B 4 -2.061 9.872 -7.965 1.00 0.00 O ATOM 634 CB PHE B 4 -2.363 11.342 -10.265 1.00 0.00 C ATOM 635 CG PHE B 4 -2.516 12.081 -11.577 1.00 0.00 C ATOM 636 CD1 PHE B 4 -3.735 12.086 -12.267 1.00 0.00 C ATOM 637 CD2 PHE B 4 -1.420 12.774 -12.113 1.00 0.00 C ATOM 638 CE1 PHE B 4 -3.854 12.756 -13.488 1.00 0.00 C ATOM 639 CE2 PHE B 4 -1.538 13.452 -13.334 1.00 0.00 C ATOM 640 CZ PHE B 4 -2.758 13.441 -14.027 1.00 0.00 C ATOM 0 H PHE B 4 -4.741 10.764 -9.192 1.00 0.00 H new ATOM 0 HA PHE B 4 -2.872 9.420 -11.055 1.00 0.00 H new ATOM 0 HB2 PHE B 4 -2.735 11.986 -9.468 1.00 0.00 H new ATOM 0 HB3 PHE B 4 -1.299 11.193 -10.083 1.00 0.00 H new ATOM 0 HD1 PHE B 4 -4.588 11.569 -11.853 1.00 0.00 H new ATOM 0 HD2 PHE B 4 -0.480 12.785 -11.582 1.00 0.00 H new ATOM 0 HE1 PHE B 4 -4.795 12.745 -14.018 1.00 0.00 H new ATOM 0 HE2 PHE B 4 -0.690 13.983 -13.741 1.00 0.00 H new ATOM 0 HZ PHE B 4 -2.851 13.958 -14.971 1.00 0.00 H new ATOM 650 N VAL B 5 -2.558 7.928 -8.957 1.00 0.00 N ATOM 651 CA VAL B 5 -2.098 7.126 -7.832 1.00 0.00 C ATOM 652 C VAL B 5 -0.579 6.981 -7.906 1.00 0.00 C ATOM 653 O VAL B 5 -0.066 6.292 -8.786 1.00 0.00 O ATOM 654 CB VAL B 5 -2.774 5.754 -7.833 1.00 0.00 C ATOM 655 CG1 VAL B 5 -2.642 5.173 -6.431 1.00 0.00 C ATOM 656 CG2 VAL B 5 -4.262 5.843 -8.182 1.00 0.00 C ATOM 0 H VAL B 5 -2.908 7.387 -9.748 1.00 0.00 H new ATOM 0 HA VAL B 5 -2.366 7.626 -6.901 1.00 0.00 H new ATOM 0 HB VAL B 5 -2.292 5.130 -8.586 1.00 0.00 H new ATOM 0 HG11 VAL B 5 -3.115 4.192 -6.398 1.00 0.00 H new ATOM 0 HG12 VAL B 5 -1.587 5.076 -6.175 1.00 0.00 H new ATOM 0 HG13 VAL B 5 -3.129 5.835 -5.715 1.00 0.00 H new ATOM 0 HG21 VAL B 5 -4.699 4.844 -8.170 1.00 0.00 H new ATOM 0 HG22 VAL B 5 -4.771 6.470 -7.450 1.00 0.00 H new ATOM 0 HG23 VAL B 5 -4.377 6.278 -9.175 1.00 0.00 H new ATOM 666 N LYS B 6 0.151 7.623 -6.988 1.00 0.00 N ATOM 667 CA LYS B 6 1.604 7.577 -6.971 1.00 0.00 C ATOM 668 C LYS B 6 2.082 6.328 -6.247 1.00 0.00 C ATOM 669 O LYS B 6 1.780 6.120 -5.072 1.00 0.00 O ATOM 670 CB LYS B 6 2.147 8.849 -6.331 1.00 0.00 C ATOM 671 CG LYS B 6 3.634 8.977 -6.664 1.00 0.00 C ATOM 672 CD LYS B 6 4.231 10.233 -6.032 1.00 0.00 C ATOM 673 CE LYS B 6 4.449 10.000 -4.540 1.00 0.00 C ATOM 674 NZ LYS B 6 5.061 11.181 -3.898 1.00 0.00 N ATOM 0 H LYS B 6 -0.254 8.186 -6.240 1.00 0.00 H new ATOM 0 HA LYS B 6 1.983 7.525 -7.992 1.00 0.00 H new ATOM 0 HB2 LYS B 6 1.602 9.718 -6.700 1.00 0.00 H new ATOM 0 HB3 LYS B 6 2.004 8.818 -5.251 1.00 0.00 H new ATOM 0 HG2 LYS B 6 4.168 8.097 -6.306 1.00 0.00 H new ATOM 0 HG3 LYS B 6 3.766 9.012 -7.745 1.00 0.00 H new ATOM 0 HD2 LYS B 6 5.177 10.481 -6.514 1.00 0.00 H new ATOM 0 HD3 LYS B 6 3.564 11.081 -6.184 1.00 0.00 H new ATOM 0 HE2 LYS B 6 3.496 9.776 -4.061 1.00 0.00 H new ATOM 0 HE3 LYS B 6 5.091 9.131 -4.395 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 5.197 10.993 -2.884 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 5.981 11.379 -4.340 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 4.436 12.004 -4.017 1.00 0.00 H new ATOM 688 N THR B 7 2.831 5.500 -6.967 1.00 0.00 N ATOM 689 CA THR B 7 3.316 4.222 -6.471 1.00 0.00 C ATOM 690 C THR B 7 4.577 4.390 -5.631 1.00 0.00 C ATOM 691 O THR B 7 5.128 5.483 -5.516 1.00 0.00 O ATOM 692 CB THR B 7 3.536 3.285 -7.660 1.00 0.00 C ATOM 693 OG1 THR B 7 3.584 1.956 -7.191 1.00 0.00 O ATOM 694 CG2 THR B 7 4.839 3.593 -8.389 1.00 0.00 C ATOM 0 H THR B 7 3.121 5.702 -7.924 1.00 0.00 H new ATOM 0 HA THR B 7 2.571 3.782 -5.808 1.00 0.00 H new ATOM 0 HB THR B 7 2.712 3.427 -8.359 1.00 0.00 H new ATOM 0 HG1 THR B 7 3.723 1.347 -7.946 1.00 0.00 H new ATOM 0 HG21 THR B 7 4.958 2.906 -9.227 1.00 0.00 H new ATOM 0 HG22 THR B 7 4.815 4.617 -8.761 1.00 0.00 H new ATOM 0 HG23 THR B 7 5.677 3.476 -7.702 1.00 0.00 H new ATOM 702 N LEU B 8 5.017 3.272 -5.049 1.00 0.00 N ATOM 703 CA LEU B 8 6.156 3.161 -4.141 1.00 0.00 C ATOM 704 C LEU B 8 7.509 3.518 -4.773 1.00 0.00 C ATOM 705 O LEU B 8 8.549 3.233 -4.181 1.00 0.00 O ATOM 706 CB LEU B 8 6.173 1.728 -3.615 1.00 0.00 C ATOM 707 CG LEU B 8 5.010 1.412 -2.668 1.00 0.00 C ATOM 708 CD1 LEU B 8 5.185 -0.010 -2.139 1.00 0.00 C ATOM 709 CD2 LEU B 8 4.984 2.373 -1.480 1.00 0.00 C ATOM 0 H LEU B 8 4.562 2.373 -5.208 1.00 0.00 H new ATOM 0 HA LEU B 8 6.025 3.892 -3.343 1.00 0.00 H new ATOM 0 HB2 LEU B 8 6.142 1.039 -4.459 1.00 0.00 H new ATOM 0 HB3 LEU B 8 7.114 1.551 -3.094 1.00 0.00 H new ATOM 0 HG LEU B 8 4.076 1.517 -3.220 1.00 0.00 H new ATOM 0 HD11 LEU B 8 4.364 -0.250 -1.463 1.00 0.00 H new ATOM 0 HD12 LEU B 8 5.185 -0.711 -2.973 1.00 0.00 H new ATOM 0 HD13 LEU B 8 6.131 -0.085 -1.603 1.00 0.00 H new ATOM 0 HD21 LEU B 8 4.148 2.122 -0.827 1.00 0.00 H new ATOM 0 HD22 LEU B 8 5.917 2.288 -0.923 1.00 0.00 H new ATOM 0 HD23 LEU B 8 4.869 3.395 -1.841 1.00 0.00 H new ATOM 721 N THR B 9 7.525 4.135 -5.958 1.00 0.00 N ATOM 722 CA THR B 9 8.766 4.529 -6.624 1.00 0.00 C ATOM 723 C THR B 9 8.695 5.968 -7.138 1.00 0.00 C ATOM 724 O THR B 9 9.629 6.438 -7.785 1.00 0.00 O ATOM 725 CB THR B 9 9.078 3.573 -7.778 1.00 0.00 C ATOM 726 OG1 THR B 9 8.042 3.637 -8.734 1.00 0.00 O ATOM 727 CG2 THR B 9 9.212 2.135 -7.282 1.00 0.00 C ATOM 0 H THR B 9 6.681 4.374 -6.479 1.00 0.00 H new ATOM 0 HA THR B 9 9.568 4.475 -5.888 1.00 0.00 H new ATOM 0 HB THR B 9 10.025 3.876 -8.225 1.00 0.00 H new ATOM 0 HG1 THR B 9 8.242 3.027 -9.474 1.00 0.00 H new ATOM 0 HG21 THR B 9 9.434 1.479 -8.124 1.00 0.00 H new ATOM 0 HG22 THR B 9 10.020 2.075 -6.553 1.00 0.00 H new ATOM 0 HG23 THR B 9 8.278 1.823 -6.815 1.00 0.00 H new ATOM 735 N GLY B 10 7.595 6.677 -6.854 1.00 0.00 N ATOM 736 CA GLY B 10 7.419 8.064 -7.260 1.00 0.00 C ATOM 737 C GLY B 10 6.754 8.174 -8.628 1.00 0.00 C ATOM 738 O GLY B 10 6.497 9.276 -9.109 1.00 0.00 O ATOM 0 H GLY B 10 6.804 6.297 -6.334 1.00 0.00 H new ATOM 0 HA2 GLY B 10 6.814 8.586 -6.519 1.00 0.00 H new ATOM 0 HA3 GLY B 10 8.389 8.561 -7.286 1.00 0.00 H new ATOM 742 N LYS B 11 6.472 7.027 -9.250 1.00 0.00 N ATOM 743 CA LYS B 11 5.781 6.942 -10.524 1.00 0.00 C ATOM 744 C LYS B 11 4.288 7.089 -10.258 1.00 0.00 C ATOM 745 O LYS B 11 3.834 6.851 -9.142 1.00 0.00 O ATOM 746 CB LYS B 11 6.166 5.601 -11.161 1.00 0.00 C ATOM 747 CG LYS B 11 5.292 5.162 -12.335 1.00 0.00 C ATOM 748 CD LYS B 11 4.118 4.289 -11.870 1.00 0.00 C ATOM 749 CE LYS B 11 3.258 3.892 -13.070 1.00 0.00 C ATOM 750 NZ LYS B 11 4.013 3.067 -14.031 1.00 0.00 N ATOM 0 H LYS B 11 6.726 6.116 -8.868 1.00 0.00 H new ATOM 0 HA LYS B 11 6.059 7.731 -11.223 1.00 0.00 H new ATOM 0 HB2 LYS B 11 7.200 5.663 -11.502 1.00 0.00 H new ATOM 0 HB3 LYS B 11 6.129 4.829 -10.393 1.00 0.00 H new ATOM 0 HG2 LYS B 11 4.909 6.041 -12.853 1.00 0.00 H new ATOM 0 HG3 LYS B 11 5.897 4.607 -13.052 1.00 0.00 H new ATOM 0 HD2 LYS B 11 4.493 3.397 -11.369 1.00 0.00 H new ATOM 0 HD3 LYS B 11 3.515 4.833 -11.143 1.00 0.00 H new ATOM 0 HE2 LYS B 11 2.383 3.340 -12.725 1.00 0.00 H new ATOM 0 HE3 LYS B 11 2.892 4.790 -13.569 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 4.129 3.590 -14.922 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 4.949 2.844 -13.637 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 3.495 2.184 -14.213 1.00 0.00 H new ATOM 764 N THR B 12 3.519 7.479 -11.272 1.00 0.00 N ATOM 765 CA THR B 12 2.101 7.745 -11.109 1.00 0.00 C ATOM 766 C THR B 12 1.307 6.914 -12.103 1.00 0.00 C ATOM 767 O THR B 12 1.712 6.736 -13.251 1.00 0.00 O ATOM 768 CB THR B 12 1.863 9.243 -11.319 1.00 0.00 C ATOM 769 OG1 THR B 12 2.525 9.962 -10.298 1.00 0.00 O ATOM 770 CG2 THR B 12 0.376 9.590 -11.269 1.00 0.00 C ATOM 0 H THR B 12 3.863 7.617 -12.222 1.00 0.00 H new ATOM 0 HA THR B 12 1.770 7.470 -10.108 1.00 0.00 H new ATOM 0 HB THR B 12 2.248 9.510 -12.303 1.00 0.00 H new ATOM 0 HG1 THR B 12 2.379 10.922 -10.427 1.00 0.00 H new ATOM 0 HG21 THR B 12 0.247 10.661 -11.422 1.00 0.00 H new ATOM 0 HG22 THR B 12 -0.151 9.046 -12.052 1.00 0.00 H new ATOM 0 HG23 THR B 12 -0.030 9.311 -10.297 1.00 0.00 H new ATOM 778 N ILE B 13 0.168 6.404 -11.637 1.00 0.00 N ATOM 779 CA ILE B 13 -0.746 5.607 -12.431 1.00 0.00 C ATOM 780 C ILE B 13 -1.984 6.463 -12.645 1.00 0.00 C ATOM 781 O ILE B 13 -2.459 7.097 -11.702 1.00 0.00 O ATOM 782 CB ILE B 13 -1.109 4.325 -11.667 1.00 0.00 C ATOM 783 CG1 ILE B 13 0.150 3.598 -11.171 1.00 0.00 C ATOM 784 CG2 ILE B 13 -1.916 3.401 -12.585 1.00 0.00 C ATOM 785 CD1 ILE B 13 -0.203 2.523 -10.142 1.00 0.00 C ATOM 0 H ILE B 13 -0.145 6.540 -10.676 1.00 0.00 H new ATOM 0 HA ILE B 13 -0.304 5.314 -13.383 1.00 0.00 H new ATOM 0 HB ILE B 13 -1.705 4.597 -10.796 1.00 0.00 H new ATOM 0 HG12 ILE B 13 0.666 3.142 -12.015 1.00 0.00 H new ATOM 0 HG13 ILE B 13 0.838 4.318 -10.728 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -2.176 2.490 -12.047 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -2.828 3.908 -12.901 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -1.319 3.147 -13.461 1.00 0.00 H new ATOM 0 HD11 ILE B 13 0.708 2.025 -9.809 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -0.697 2.985 -9.288 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -0.872 1.791 -10.595 1.00 0.00 H new ATOM 797 N THR B 14 -2.511 6.485 -13.869 1.00 0.00 N ATOM 798 CA THR B 14 -3.634 7.351 -14.191 1.00 0.00 C ATOM 799 C THR B 14 -4.693 6.562 -14.944 1.00 0.00 C ATOM 800 O THR B 14 -4.467 6.094 -16.057 1.00 0.00 O ATOM 801 CB THR B 14 -3.168 8.578 -14.972 1.00 0.00 C ATOM 802 OG1 THR B 14 -2.020 9.139 -14.369 1.00 0.00 O ATOM 803 CG2 THR B 14 -4.280 9.622 -14.954 1.00 0.00 C ATOM 0 H THR B 14 -2.178 5.915 -14.646 1.00 0.00 H new ATOM 0 HA THR B 14 -4.082 7.717 -13.267 1.00 0.00 H new ATOM 0 HB THR B 14 -2.930 8.279 -15.993 1.00 0.00 H new ATOM 0 HG1 THR B 14 -1.732 9.923 -14.881 1.00 0.00 H new ATOM 0 HG21 THR B 14 -3.960 10.504 -15.509 1.00 0.00 H new ATOM 0 HG22 THR B 14 -5.176 9.208 -15.417 1.00 0.00 H new ATOM 0 HG23 THR B 14 -4.500 9.901 -13.924 1.00 0.00 H new ATOM 811 N LEU B 15 -5.852 6.424 -14.302 1.00 0.00 N ATOM 812 CA LEU B 15 -6.949 5.563 -14.716 1.00 0.00 C ATOM 813 C LEU B 15 -8.250 6.186 -14.244 1.00 0.00 C ATOM 814 O LEU B 15 -8.296 6.870 -13.225 1.00 0.00 O ATOM 815 CB LEU B 15 -6.730 4.146 -14.140 1.00 0.00 C ATOM 816 CG LEU B 15 -5.862 4.129 -12.866 1.00 0.00 C ATOM 817 CD1 LEU B 15 -6.510 4.849 -11.684 1.00 0.00 C ATOM 818 CD2 LEU B 15 -5.591 2.700 -12.424 1.00 0.00 C ATOM 0 H LEU B 15 -6.057 6.933 -13.442 1.00 0.00 H new ATOM 0 HA LEU B 15 -6.992 5.467 -15.801 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -7.699 3.699 -13.916 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -6.259 3.522 -14.900 1.00 0.00 H new ATOM 0 HG LEU B 15 -4.943 4.649 -13.136 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -5.847 4.800 -10.820 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -6.688 5.892 -11.946 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -7.458 4.369 -11.441 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -4.977 2.708 -11.523 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -6.536 2.199 -12.215 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -5.066 2.167 -13.217 1.00 0.00 H new ATOM 830 N GLU B 16 -9.317 5.950 -15.002 1.00 0.00 N ATOM 831 CA GLU B 16 -10.563 6.644 -14.797 1.00 0.00 C ATOM 832 C GLU B 16 -11.415 5.927 -13.767 1.00 0.00 C ATOM 833 O GLU B 16 -11.268 4.724 -13.547 1.00 0.00 O ATOM 834 CB GLU B 16 -11.331 6.717 -16.111 1.00 0.00 C ATOM 835 CG GLU B 16 -10.475 7.284 -17.249 1.00 0.00 C ATOM 836 CD GLU B 16 -9.320 6.375 -17.668 1.00 0.00 C ATOM 837 OE1 GLU B 16 -9.570 5.162 -17.852 1.00 0.00 O ATOM 838 OE2 GLU B 16 -8.195 6.905 -17.799 1.00 0.00 O ATOM 0 H GLU B 16 -9.333 5.276 -15.767 1.00 0.00 H new ATOM 0 HA GLU B 16 -10.340 7.648 -14.436 1.00 0.00 H new ATOM 0 HB2 GLU B 16 -11.680 5.721 -16.382 1.00 0.00 H new ATOM 0 HB3 GLU B 16 -12.216 7.339 -15.979 1.00 0.00 H new ATOM 0 HG2 GLU B 16 -11.113 7.466 -18.114 1.00 0.00 H new ATOM 0 HG3 GLU B 16 -10.072 8.249 -16.941 1.00 0.00 H new ATOM 845 N VAL B 17 -12.309 6.680 -13.138 1.00 0.00 N ATOM 846 CA VAL B 17 -13.143 6.177 -12.054 1.00 0.00 C ATOM 847 C VAL B 17 -14.491 6.879 -12.040 1.00 0.00 C ATOM 848 O VAL B 17 -14.791 7.666 -12.933 1.00 0.00 O ATOM 849 CB VAL B 17 -12.429 6.386 -10.711 1.00 0.00 C ATOM 850 CG1 VAL B 17 -11.206 5.483 -10.588 1.00 0.00 C ATOM 851 CG2 VAL B 17 -11.989 7.844 -10.551 1.00 0.00 C ATOM 0 H VAL B 17 -12.476 7.660 -13.366 1.00 0.00 H new ATOM 0 HA VAL B 17 -13.313 5.112 -12.212 1.00 0.00 H new ATOM 0 HB VAL B 17 -13.140 6.131 -9.925 1.00 0.00 H new ATOM 0 HG11 VAL B 17 -10.722 5.655 -9.626 1.00 0.00 H new ATOM 0 HG12 VAL B 17 -11.515 4.440 -10.658 1.00 0.00 H new ATOM 0 HG13 VAL B 17 -10.505 5.708 -11.392 1.00 0.00 H new ATOM 0 HG21 VAL B 17 -11.485 7.969 -9.592 1.00 0.00 H new ATOM 0 HG22 VAL B 17 -11.305 8.108 -11.357 1.00 0.00 H new ATOM 0 HG23 VAL B 17 -12.863 8.494 -10.589 1.00 0.00 H new ATOM 861 N GLU B 18 -15.303 6.590 -11.017 1.00 0.00 N ATOM 862 CA GLU B 18 -16.602 7.219 -10.834 1.00 0.00 C ATOM 863 C GLU B 18 -16.898 7.355 -9.343 1.00 0.00 C ATOM 864 O GLU B 18 -16.317 6.636 -8.530 1.00 0.00 O ATOM 865 CB GLU B 18 -17.682 6.352 -11.491 1.00 0.00 C ATOM 866 CG GLU B 18 -17.422 6.186 -12.985 1.00 0.00 C ATOM 867 CD GLU B 18 -18.582 5.471 -13.677 1.00 0.00 C ATOM 868 OE1 GLU B 18 -19.682 6.068 -13.733 1.00 0.00 O ATOM 869 OE2 GLU B 18 -18.366 4.333 -14.147 1.00 0.00 O ATOM 0 H GLU B 18 -15.070 5.910 -10.294 1.00 0.00 H new ATOM 0 HA GLU B 18 -16.596 8.207 -11.294 1.00 0.00 H new ATOM 0 HB2 GLU B 18 -17.707 5.373 -11.012 1.00 0.00 H new ATOM 0 HB3 GLU B 18 -18.661 6.807 -11.338 1.00 0.00 H new ATOM 0 HG2 GLU B 18 -17.272 7.165 -13.441 1.00 0.00 H new ATOM 0 HG3 GLU B 18 -16.502 5.620 -13.135 1.00 0.00 H new ATOM 876 N PRO B 19 -17.797 8.270 -8.962 1.00 0.00 N ATOM 877 CA PRO B 19 -18.220 8.447 -7.584 1.00 0.00 C ATOM 878 C PRO B 19 -19.088 7.280 -7.118 1.00 0.00 C ATOM 879 O PRO B 19 -19.611 7.308 -6.006 1.00 0.00 O ATOM 880 CB PRO B 19 -19.000 9.757 -7.553 1.00 0.00 C ATOM 881 CG PRO B 19 -19.517 9.905 -8.983 1.00 0.00 C ATOM 882 CD PRO B 19 -18.475 9.199 -9.848 1.00 0.00 C ATOM 0 HA PRO B 19 -17.365 8.476 -6.908 1.00 0.00 H new ATOM 0 HB2 PRO B 19 -19.818 9.719 -6.833 1.00 0.00 H new ATOM 0 HB3 PRO B 19 -18.364 10.595 -7.268 1.00 0.00 H new ATOM 0 HG2 PRO B 19 -20.501 9.450 -9.097 1.00 0.00 H new ATOM 0 HG3 PRO B 19 -19.617 10.954 -9.261 1.00 0.00 H new ATOM 0 HD2 PRO B 19 -18.946 8.675 -10.680 1.00 0.00 H new ATOM 0 HD3 PRO B 19 -17.773 9.914 -10.278 1.00 0.00 H new ATOM 890 N SER B 20 -19.235 6.260 -7.967 1.00 0.00 N ATOM 891 CA SER B 20 -20.001 5.066 -7.652 1.00 0.00 C ATOM 892 C SER B 20 -19.089 3.844 -7.701 1.00 0.00 C ATOM 893 O SER B 20 -19.532 2.729 -7.428 1.00 0.00 O ATOM 894 CB SER B 20 -21.179 4.922 -8.609 1.00 0.00 C ATOM 895 OG SER B 20 -21.992 6.075 -8.552 1.00 0.00 O ATOM 0 H SER B 20 -18.820 6.246 -8.899 1.00 0.00 H new ATOM 0 HA SER B 20 -20.406 5.151 -6.644 1.00 0.00 H new ATOM 0 HB2 SER B 20 -20.816 4.773 -9.626 1.00 0.00 H new ATOM 0 HB3 SER B 20 -21.765 4.041 -8.348 1.00 0.00 H new ATOM 0 HG SER B 20 -22.745 5.975 -9.171 1.00 0.00 H new ATOM 901 N ASP B 21 -17.813 4.045 -8.049 1.00 0.00 N ATOM 902 CA ASP B 21 -16.803 3.034 -7.903 1.00 0.00 C ATOM 903 C ASP B 21 -16.372 3.087 -6.445 1.00 0.00 C ATOM 904 O ASP B 21 -16.784 3.952 -5.674 1.00 0.00 O ATOM 905 CB ASP B 21 -15.610 3.307 -8.823 1.00 0.00 C ATOM 906 CG ASP B 21 -15.937 3.138 -10.304 1.00 0.00 C ATOM 907 OD1 ASP B 21 -17.020 2.592 -10.610 1.00 0.00 O ATOM 908 OD2 ASP B 21 -15.088 3.559 -11.121 1.00 0.00 O ATOM 0 H ASP B 21 -17.468 4.922 -8.439 1.00 0.00 H new ATOM 0 HA ASP B 21 -17.188 2.052 -8.177 1.00 0.00 H new ATOM 0 HB2 ASP B 21 -15.252 4.322 -8.651 1.00 0.00 H new ATOM 0 HB3 ASP B 21 -14.795 2.633 -8.559 1.00 0.00 H new ATOM 913 N THR B 22 -15.529 2.137 -6.086 1.00 0.00 N ATOM 914 CA THR B 22 -15.088 1.894 -4.724 1.00 0.00 C ATOM 915 C THR B 22 -13.586 1.658 -4.729 1.00 0.00 C ATOM 916 O THR B 22 -12.983 1.522 -5.790 1.00 0.00 O ATOM 917 CB THR B 22 -15.854 0.700 -4.145 1.00 0.00 C ATOM 918 OG1 THR B 22 -15.322 0.327 -2.895 1.00 0.00 O ATOM 919 CG2 THR B 22 -15.783 -0.513 -5.069 1.00 0.00 C ATOM 0 H THR B 22 -15.117 1.490 -6.758 1.00 0.00 H new ATOM 0 HA THR B 22 -15.295 2.757 -4.091 1.00 0.00 H new ATOM 0 HB THR B 22 -16.892 1.015 -4.037 1.00 0.00 H new ATOM 0 HG1 THR B 22 -15.652 0.938 -2.204 1.00 0.00 H new ATOM 0 HG21 THR B 22 -16.337 -1.341 -4.626 1.00 0.00 H new ATOM 0 HG22 THR B 22 -16.219 -0.260 -6.035 1.00 0.00 H new ATOM 0 HG23 THR B 22 -14.742 -0.806 -5.206 1.00 0.00 H new ATOM 927 N ILE B 23 -12.969 1.605 -3.551 1.00 0.00 N ATOM 928 CA ILE B 23 -11.543 1.374 -3.463 1.00 0.00 C ATOM 929 C ILE B 23 -11.178 0.059 -4.152 1.00 0.00 C ATOM 930 O ILE B 23 -10.096 -0.063 -4.718 1.00 0.00 O ATOM 931 CB ILE B 23 -11.142 1.368 -1.986 1.00 0.00 C ATOM 932 CG1 ILE B 23 -11.567 2.661 -1.279 1.00 0.00 C ATOM 933 CG2 ILE B 23 -9.633 1.182 -1.864 1.00 0.00 C ATOM 934 CD1 ILE B 23 -11.143 3.946 -2.002 1.00 0.00 C ATOM 0 H ILE B 23 -13.438 1.719 -2.652 1.00 0.00 H new ATOM 0 HA ILE B 23 -10.997 2.167 -3.974 1.00 0.00 H new ATOM 0 HB ILE B 23 -11.657 0.539 -1.501 1.00 0.00 H new ATOM 0 HG12 ILE B 23 -12.651 2.661 -1.169 1.00 0.00 H new ATOM 0 HG13 ILE B 23 -11.145 2.667 -0.274 1.00 0.00 H new ATOM 0 HG21 ILE B 23 -9.351 1.178 -0.811 1.00 0.00 H new ATOM 0 HG22 ILE B 23 -9.345 0.235 -2.320 1.00 0.00 H new ATOM 0 HG23 ILE B 23 -9.123 2.000 -2.373 1.00 0.00 H new ATOM 0 HD11 ILE B 23 -11.483 4.812 -1.434 1.00 0.00 H new ATOM 0 HD12 ILE B 23 -10.057 3.973 -2.089 1.00 0.00 H new ATOM 0 HD13 ILE B 23 -11.587 3.967 -2.997 1.00 0.00 H new ATOM 946 N GLU B 24 -12.080 -0.927 -4.113 1.00 0.00 N ATOM 947 CA GLU B 24 -11.859 -2.211 -4.762 1.00 0.00 C ATOM 948 C GLU B 24 -11.777 -2.058 -6.282 1.00 0.00 C ATOM 949 O GLU B 24 -11.059 -2.802 -6.943 1.00 0.00 O ATOM 950 CB GLU B 24 -12.993 -3.162 -4.365 1.00 0.00 C ATOM 951 CG GLU B 24 -12.947 -4.435 -5.204 1.00 0.00 C ATOM 952 CD GLU B 24 -13.836 -5.522 -4.603 1.00 0.00 C ATOM 953 OE1 GLU B 24 -15.050 -5.503 -4.903 1.00 0.00 O ATOM 954 OE2 GLU B 24 -13.298 -6.361 -3.849 1.00 0.00 O ATOM 0 H GLU B 24 -12.977 -0.853 -3.632 1.00 0.00 H new ATOM 0 HA GLU B 24 -10.905 -2.623 -4.433 1.00 0.00 H new ATOM 0 HB2 GLU B 24 -12.910 -3.414 -3.308 1.00 0.00 H new ATOM 0 HB3 GLU B 24 -13.954 -2.666 -4.500 1.00 0.00 H new ATOM 0 HG2 GLU B 24 -13.272 -4.216 -6.221 1.00 0.00 H new ATOM 0 HG3 GLU B 24 -11.920 -4.795 -5.268 1.00 0.00 H new ATOM 961 N ASN B 25 -12.511 -1.094 -6.842 1.00 0.00 N ATOM 962 CA ASN B 25 -12.513 -0.830 -8.263 1.00 0.00 C ATOM 963 C ASN B 25 -11.234 -0.101 -8.655 1.00 0.00 C ATOM 964 O ASN B 25 -10.698 -0.345 -9.733 1.00 0.00 O ATOM 965 CB ASN B 25 -13.708 0.061 -8.572 1.00 0.00 C ATOM 966 CG ASN B 25 -14.978 -0.726 -8.823 1.00 0.00 C ATOM 967 OD1 ASN B 25 -15.207 -1.782 -8.239 1.00 0.00 O ATOM 968 ND2 ASN B 25 -15.819 -0.201 -9.703 1.00 0.00 N ATOM 0 H ASN B 25 -13.122 -0.476 -6.309 1.00 0.00 H new ATOM 0 HA ASN B 25 -12.572 -1.766 -8.818 1.00 0.00 H new ATOM 0 HB2 ASN B 25 -13.869 0.746 -7.740 1.00 0.00 H new ATOM 0 HB3 ASN B 25 -13.484 0.670 -9.448 1.00 0.00 H new ATOM 0 HD21 ASN B 25 -16.695 -0.677 -9.917 1.00 0.00 H new ATOM 0 HD22 ASN B 25 -15.590 0.679 -10.166 1.00 0.00 H new ATOM 975 N VAL B 26 -10.737 0.785 -7.789 1.00 0.00 N ATOM 976 CA VAL B 26 -9.498 1.489 -8.060 1.00 0.00 C ATOM 977 C VAL B 26 -8.353 0.482 -8.064 1.00 0.00 C ATOM 978 O VAL B 26 -7.414 0.617 -8.846 1.00 0.00 O ATOM 979 CB VAL B 26 -9.288 2.599 -7.028 1.00 0.00 C ATOM 980 CG1 VAL B 26 -8.002 3.369 -7.333 1.00 0.00 C ATOM 981 CG2 VAL B 26 -10.456 3.587 -7.069 1.00 0.00 C ATOM 0 H VAL B 26 -11.177 1.026 -6.901 1.00 0.00 H new ATOM 0 HA VAL B 26 -9.537 1.968 -9.038 1.00 0.00 H new ATOM 0 HB VAL B 26 -9.223 2.136 -6.043 1.00 0.00 H new ATOM 0 HG11 VAL B 26 -7.864 4.156 -6.591 1.00 0.00 H new ATOM 0 HG12 VAL B 26 -7.153 2.687 -7.300 1.00 0.00 H new ATOM 0 HG13 VAL B 26 -8.071 3.814 -8.326 1.00 0.00 H new ATOM 0 HG21 VAL B 26 -10.295 4.372 -6.330 1.00 0.00 H new ATOM 0 HG22 VAL B 26 -10.522 4.031 -8.062 1.00 0.00 H new ATOM 0 HG23 VAL B 26 -11.385 3.062 -6.844 1.00 0.00 H new ATOM 991 N LYS B 27 -8.425 -0.531 -7.197 1.00 0.00 N ATOM 992 CA LYS B 27 -7.440 -1.603 -7.193 1.00 0.00 C ATOM 993 C LYS B 27 -7.556 -2.439 -8.468 1.00 0.00 C ATOM 994 O LYS B 27 -6.550 -2.919 -8.981 1.00 0.00 O ATOM 995 CB LYS B 27 -7.642 -2.495 -5.965 1.00 0.00 C ATOM 996 CG LYS B 27 -7.311 -1.751 -4.671 1.00 0.00 C ATOM 997 CD LYS B 27 -7.685 -2.613 -3.467 1.00 0.00 C ATOM 998 CE LYS B 27 -7.293 -1.907 -2.165 1.00 0.00 C ATOM 999 NZ LYS B 27 -7.690 -2.703 -0.987 1.00 0.00 N ATOM 0 H LYS B 27 -9.156 -0.627 -6.492 1.00 0.00 H new ATOM 0 HA LYS B 27 -6.445 -1.161 -7.154 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -8.675 -2.842 -5.932 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -7.011 -3.380 -6.049 1.00 0.00 H new ATOM 0 HG2 LYS B 27 -6.248 -1.510 -4.641 1.00 0.00 H new ATOM 0 HG3 LYS B 27 -7.853 -0.806 -4.635 1.00 0.00 H new ATOM 0 HD2 LYS B 27 -8.757 -2.812 -3.472 1.00 0.00 H new ATOM 0 HD3 LYS B 27 -7.182 -3.578 -3.531 1.00 0.00 H new ATOM 0 HE2 LYS B 27 -6.216 -1.740 -2.149 1.00 0.00 H new ATOM 0 HE3 LYS B 27 -7.768 -0.927 -2.122 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 -7.295 -2.271 -0.127 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 -8.727 -2.727 -0.918 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 -7.328 -3.673 -1.085 1.00 0.00 H new ATOM 1013 N ALA B 28 -8.774 -2.616 -8.987 1.00 0.00 N ATOM 1014 CA ALA B 28 -8.994 -3.379 -10.207 1.00 0.00 C ATOM 1015 C ALA B 28 -8.486 -2.617 -11.435 1.00 0.00 C ATOM 1016 O ALA B 28 -8.059 -3.236 -12.408 1.00 0.00 O ATOM 1017 CB ALA B 28 -10.494 -3.667 -10.332 1.00 0.00 C ATOM 0 H ALA B 28 -9.625 -2.236 -8.573 1.00 0.00 H new ATOM 0 HA ALA B 28 -8.437 -4.315 -10.156 1.00 0.00 H new ATOM 0 HB1 ALA B 28 -10.680 -4.239 -11.241 1.00 0.00 H new ATOM 0 HB2 ALA B 28 -10.828 -4.241 -9.468 1.00 0.00 H new ATOM 0 HB3 ALA B 28 -11.043 -2.726 -10.376 1.00 0.00 H new ATOM 1023 N LYS B 29 -8.527 -1.280 -11.398 1.00 0.00 N ATOM 1024 CA LYS B 29 -7.990 -0.463 -12.478 1.00 0.00 C ATOM 1025 C LYS B 29 -6.467 -0.434 -12.397 1.00 0.00 C ATOM 1026 O LYS B 29 -5.796 -0.427 -13.425 1.00 0.00 O ATOM 1027 CB LYS B 29 -8.568 0.949 -12.376 1.00 0.00 C ATOM 1028 CG LYS B 29 -10.066 0.937 -12.682 1.00 0.00 C ATOM 1029 CD LYS B 29 -10.775 2.017 -11.866 1.00 0.00 C ATOM 1030 CE LYS B 29 -12.293 1.904 -12.027 1.00 0.00 C ATOM 1031 NZ LYS B 29 -12.727 2.330 -13.371 1.00 0.00 N ATOM 0 H LYS B 29 -8.929 -0.746 -10.628 1.00 0.00 H new ATOM 0 HA LYS B 29 -8.272 -0.890 -13.441 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -8.398 1.347 -11.375 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -8.054 1.610 -13.073 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -10.230 1.108 -13.746 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -10.486 -0.041 -12.448 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -10.507 1.920 -10.814 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -10.442 3.003 -12.190 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -12.603 0.874 -11.853 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -12.787 2.517 -11.273 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -13.761 2.436 -13.384 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -12.282 3.240 -13.607 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -12.444 1.614 -14.070 1.00 0.00 H new ATOM 1045 N ILE B 30 -5.908 -0.422 -11.183 1.00 0.00 N ATOM 1046 CA ILE B 30 -4.467 -0.516 -10.996 1.00 0.00 C ATOM 1047 C ILE B 30 -3.994 -1.909 -11.394 1.00 0.00 C ATOM 1048 O ILE B 30 -2.862 -2.073 -11.846 1.00 0.00 O ATOM 1049 CB ILE B 30 -4.124 -0.212 -9.534 1.00 0.00 C ATOM 1050 CG1 ILE B 30 -4.377 1.273 -9.265 1.00 0.00 C ATOM 1051 CG2 ILE B 30 -2.661 -0.550 -9.231 1.00 0.00 C ATOM 1052 CD1 ILE B 30 -4.412 1.559 -7.764 1.00 0.00 C ATOM 0 H ILE B 30 -6.439 -0.348 -10.315 1.00 0.00 H new ATOM 0 HA ILE B 30 -3.958 0.212 -11.627 1.00 0.00 H new ATOM 0 HB ILE B 30 -4.753 -0.825 -8.889 1.00 0.00 H new ATOM 0 HG12 ILE B 30 -3.595 1.870 -9.734 1.00 0.00 H new ATOM 0 HG13 ILE B 30 -5.322 1.573 -9.718 1.00 0.00 H new ATOM 0 HG21 ILE B 30 -2.444 -0.325 -8.187 1.00 0.00 H new ATOM 0 HG22 ILE B 30 -2.486 -1.610 -9.417 1.00 0.00 H new ATOM 0 HG23 ILE B 30 -2.010 0.044 -9.873 1.00 0.00 H new ATOM 0 HD11 ILE B 30 -4.593 2.621 -7.600 1.00 0.00 H new ATOM 0 HD12 ILE B 30 -5.211 0.979 -7.302 1.00 0.00 H new ATOM 0 HD13 ILE B 30 -3.457 1.281 -7.318 1.00 0.00 H new ATOM 1064 N GLN B 31 -4.853 -2.920 -11.237 1.00 0.00 N ATOM 1065 CA GLN B 31 -4.534 -4.267 -11.671 1.00 0.00 C ATOM 1066 C GLN B 31 -4.495 -4.336 -13.201 1.00 0.00 C ATOM 1067 O GLN B 31 -4.008 -5.299 -13.791 1.00 0.00 O ATOM 1068 CB GLN B 31 -5.550 -5.250 -11.084 1.00 0.00 C ATOM 1069 CG GLN B 31 -5.089 -6.636 -11.515 1.00 0.00 C ATOM 1070 CD GLN B 31 -5.643 -7.779 -10.689 1.00 0.00 C ATOM 1071 OE1 GLN B 31 -6.796 -7.765 -10.269 1.00 0.00 O ATOM 1072 NE2 GLN B 31 -4.804 -8.784 -10.458 1.00 0.00 N ATOM 0 H GLN B 31 -5.775 -2.822 -10.811 1.00 0.00 H new ATOM 0 HA GLN B 31 -3.545 -4.545 -11.307 1.00 0.00 H new ATOM 0 HB2 GLN B 31 -5.587 -5.171 -9.997 1.00 0.00 H new ATOM 0 HB3 GLN B 31 -6.554 -5.040 -11.453 1.00 0.00 H new ATOM 0 HG2 GLN B 31 -5.372 -6.789 -12.556 1.00 0.00 H new ATOM 0 HG3 GLN B 31 -4.000 -6.670 -11.472 1.00 0.00 H new ATOM 0 HE21 GLN B 31 -3.854 -8.751 -10.828 1.00 0.00 H new ATOM 0 HE22 GLN B 31 -5.110 -9.588 -9.911 1.00 0.00 H new ATOM 1081 N ASP B 32 -5.012 -3.302 -13.855 1.00 0.00 N ATOM 1082 CA ASP B 32 -5.017 -3.202 -15.306 1.00 0.00 C ATOM 1083 C ASP B 32 -3.773 -2.466 -15.777 1.00 0.00 C ATOM 1084 O ASP B 32 -3.171 -2.817 -16.791 1.00 0.00 O ATOM 1085 CB ASP B 32 -6.234 -2.387 -15.727 1.00 0.00 C ATOM 1086 CG ASP B 32 -6.761 -2.837 -17.087 1.00 0.00 C ATOM 1087 OD1 ASP B 32 -7.410 -3.908 -17.133 1.00 0.00 O ATOM 1088 OD2 ASP B 32 -6.511 -2.111 -18.073 1.00 0.00 O ATOM 0 H ASP B 32 -5.442 -2.504 -13.387 1.00 0.00 H new ATOM 0 HA ASP B 32 -5.041 -4.202 -15.739 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -7.020 -2.490 -14.978 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -5.970 -1.330 -15.769 1.00 0.00 H new ATOM 1093 N LYS B 33 -3.402 -1.434 -15.015 1.00 0.00 N ATOM 1094 CA LYS B 33 -2.278 -0.565 -15.323 1.00 0.00 C ATOM 1095 C LYS B 33 -0.937 -1.161 -14.899 1.00 0.00 C ATOM 1096 O LYS B 33 0.078 -0.880 -15.532 1.00 0.00 O ATOM 1097 CB LYS B 33 -2.489 0.750 -14.579 1.00 0.00 C ATOM 1098 CG LYS B 33 -3.618 1.604 -15.162 1.00 0.00 C ATOM 1099 CD LYS B 33 -3.332 2.019 -16.600 1.00 0.00 C ATOM 1100 CE LYS B 33 -4.227 3.206 -16.951 1.00 0.00 C ATOM 1101 NZ LYS B 33 -4.125 3.550 -18.383 1.00 0.00 N ATOM 0 H LYS B 33 -3.886 -1.180 -14.154 1.00 0.00 H new ATOM 0 HA LYS B 33 -2.241 -0.426 -16.403 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -2.708 0.536 -13.533 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -1.562 1.323 -14.599 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -4.553 1.045 -15.125 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -3.754 2.494 -14.548 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -2.282 2.290 -16.714 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -3.522 1.188 -17.279 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -5.262 2.969 -16.705 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -3.945 4.068 -16.347 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -4.744 4.360 -18.591 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -3.141 3.799 -18.611 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -4.418 2.734 -18.958 1.00 0.00 H new ATOM 1115 N GLU B 34 -0.927 -1.974 -13.842 1.00 0.00 N ATOM 1116 CA GLU B 34 0.303 -2.549 -13.309 1.00 0.00 C ATOM 1117 C GLU B 34 0.220 -4.061 -13.088 1.00 0.00 C ATOM 1118 O GLU B 34 1.250 -4.709 -12.898 1.00 0.00 O ATOM 1119 CB GLU B 34 0.603 -1.880 -11.971 1.00 0.00 C ATOM 1120 CG GLU B 34 0.968 -0.401 -12.125 1.00 0.00 C ATOM 1121 CD GLU B 34 2.245 -0.196 -12.941 1.00 0.00 C ATOM 1122 OE1 GLU B 34 3.191 -0.996 -12.765 1.00 0.00 O ATOM 1123 OE2 GLU B 34 2.268 0.769 -13.737 1.00 0.00 O ATOM 0 H GLU B 34 -1.768 -2.250 -13.335 1.00 0.00 H new ATOM 0 HA GLU B 34 1.089 -2.375 -14.044 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -0.266 -1.971 -11.320 1.00 0.00 H new ATOM 0 HB3 GLU B 34 1.424 -2.405 -11.482 1.00 0.00 H new ATOM 0 HG2 GLU B 34 0.144 0.125 -12.607 1.00 0.00 H new ATOM 0 HG3 GLU B 34 1.096 0.043 -11.138 1.00 0.00 H new ATOM 1130 N GLY B 35 -0.987 -4.631 -13.109 1.00 0.00 N ATOM 1131 CA GLY B 35 -1.162 -6.070 -12.918 1.00 0.00 C ATOM 1132 C GLY B 35 -0.964 -6.476 -11.461 1.00 0.00 C ATOM 1133 O GLY B 35 -0.734 -7.650 -11.173 1.00 0.00 O ATOM 0 H GLY B 35 -1.856 -4.118 -13.256 1.00 0.00 H new ATOM 0 HA2 GLY B 35 -2.160 -6.361 -13.244 1.00 0.00 H new ATOM 0 HA3 GLY B 35 -0.452 -6.609 -13.545 1.00 0.00 H new ATOM 1137 N ILE B 36 -1.054 -5.514 -10.542 1.00 0.00 N ATOM 1138 CA ILE B 36 -0.854 -5.775 -9.123 1.00 0.00 C ATOM 1139 C ILE B 36 -2.122 -6.418 -8.574 1.00 0.00 C ATOM 1140 O ILE B 36 -3.223 -5.979 -8.911 1.00 0.00 O ATOM 1141 CB ILE B 36 -0.565 -4.457 -8.400 1.00 0.00 C ATOM 1142 CG1 ILE B 36 0.791 -3.911 -8.854 1.00 0.00 C ATOM 1143 CG2 ILE B 36 -0.519 -4.650 -6.883 1.00 0.00 C ATOM 1144 CD1 ILE B 36 0.899 -2.411 -8.577 1.00 0.00 C ATOM 0 H ILE B 36 -1.266 -4.541 -10.761 1.00 0.00 H new ATOM 0 HA ILE B 36 -0.008 -6.445 -8.969 1.00 0.00 H new ATOM 0 HB ILE B 36 -1.367 -3.761 -8.646 1.00 0.00 H new ATOM 0 HG12 ILE B 36 1.591 -4.439 -8.335 1.00 0.00 H new ATOM 0 HG13 ILE B 36 0.924 -4.098 -9.920 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -0.312 -3.695 -6.401 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -1.479 -5.031 -6.535 1.00 0.00 H new ATOM 0 HG23 ILE B 36 0.267 -5.362 -6.630 1.00 0.00 H new ATOM 0 HD11 ILE B 36 1.872 -2.049 -8.909 1.00 0.00 H new ATOM 0 HD12 ILE B 36 0.112 -1.884 -9.116 1.00 0.00 H new ATOM 0 HD13 ILE B 36 0.790 -2.230 -7.508 1.00 0.00 H new ATOM 1156 N PRO B 37 -1.995 -7.449 -7.732 1.00 0.00 N ATOM 1157 CA PRO B 37 -3.137 -8.136 -7.164 1.00 0.00 C ATOM 1158 C PRO B 37 -3.838 -7.237 -6.155 1.00 0.00 C ATOM 1159 O PRO B 37 -3.191 -6.726 -5.243 1.00 0.00 O ATOM 1160 CB PRO B 37 -2.561 -9.373 -6.475 1.00 0.00 C ATOM 1161 CG PRO B 37 -1.118 -8.991 -6.158 1.00 0.00 C ATOM 1162 CD PRO B 37 -0.743 -8.023 -7.278 1.00 0.00 C ATOM 0 HA PRO B 37 -3.875 -8.404 -7.920 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -3.116 -9.618 -5.569 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -2.608 -10.248 -7.124 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -1.035 -8.521 -5.178 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -0.466 -9.864 -6.149 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -0.065 -7.250 -6.917 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -0.232 -8.541 -8.090 1.00 0.00 H new ATOM 1170 N PRO B 38 -5.154 -7.036 -6.299 1.00 0.00 N ATOM 1171 CA PRO B 38 -5.972 -6.343 -5.315 1.00 0.00 C ATOM 1172 C PRO B 38 -5.859 -6.988 -3.934 1.00 0.00 C ATOM 1173 O PRO B 38 -6.147 -6.347 -2.928 1.00 0.00 O ATOM 1174 CB PRO B 38 -7.406 -6.407 -5.847 1.00 0.00 C ATOM 1175 CG PRO B 38 -7.375 -7.538 -6.880 1.00 0.00 C ATOM 1176 CD PRO B 38 -5.961 -7.455 -7.425 1.00 0.00 C ATOM 0 HA PRO B 38 -5.642 -5.312 -5.183 1.00 0.00 H new ATOM 0 HB2 PRO B 38 -8.118 -6.617 -5.049 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -7.705 -5.462 -6.300 1.00 0.00 H new ATOM 0 HG2 PRO B 38 -7.577 -8.508 -6.425 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -8.120 -7.392 -7.663 1.00 0.00 H new ATOM 0 HD2 PRO B 38 -5.629 -8.418 -7.812 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -5.895 -6.741 -8.246 1.00 0.00 H new ATOM 1184 N ASP B 39 -5.433 -8.255 -3.882 1.00 0.00 N ATOM 1185 CA ASP B 39 -5.167 -8.954 -2.633 1.00 0.00 C ATOM 1186 C ASP B 39 -3.962 -8.358 -1.895 1.00 0.00 C ATOM 1187 O ASP B 39 -3.772 -8.633 -0.710 1.00 0.00 O ATOM 1188 CB ASP B 39 -4.943 -10.437 -2.926 1.00 0.00 C ATOM 1189 CG ASP B 39 -4.832 -11.263 -1.644 1.00 0.00 C ATOM 1190 OD1 ASP B 39 -5.794 -11.219 -0.844 1.00 0.00 O ATOM 1191 OD2 ASP B 39 -3.787 -11.931 -1.472 1.00 0.00 O ATOM 0 H ASP B 39 -5.264 -8.822 -4.713 1.00 0.00 H new ATOM 0 HA ASP B 39 -6.030 -8.837 -1.978 1.00 0.00 H new ATOM 0 HB2 ASP B 39 -5.767 -10.816 -3.531 1.00 0.00 H new ATOM 0 HB3 ASP B 39 -4.034 -10.557 -3.515 1.00 0.00 H new ATOM 1196 N GLN B 40 -3.147 -7.542 -2.575 1.00 0.00 N ATOM 1197 CA GLN B 40 -2.013 -6.874 -1.943 1.00 0.00 C ATOM 1198 C GLN B 40 -2.117 -5.358 -1.997 1.00 0.00 C ATOM 1199 O GLN B 40 -1.359 -4.682 -1.306 1.00 0.00 O ATOM 1200 CB GLN B 40 -0.702 -7.284 -2.612 1.00 0.00 C ATOM 1201 CG GLN B 40 -0.459 -8.769 -2.370 1.00 0.00 C ATOM 1202 CD GLN B 40 0.855 -9.281 -2.954 1.00 0.00 C ATOM 1203 OE1 GLN B 40 0.997 -10.477 -3.193 1.00 0.00 O ATOM 1204 NE2 GLN B 40 1.823 -8.398 -3.189 1.00 0.00 N ATOM 0 H GLN B 40 -3.256 -7.331 -3.567 1.00 0.00 H new ATOM 0 HA GLN B 40 -2.028 -7.186 -0.899 1.00 0.00 H new ATOM 0 HB2 GLN B 40 -0.746 -7.080 -3.682 1.00 0.00 H new ATOM 0 HB3 GLN B 40 0.124 -6.698 -2.210 1.00 0.00 H new ATOM 0 HG2 GLN B 40 -0.467 -8.959 -1.297 1.00 0.00 H new ATOM 0 HG3 GLN B 40 -1.283 -9.338 -2.801 1.00 0.00 H new ATOM 0 HE21 GLN B 40 1.675 -7.411 -2.980 1.00 0.00 H new ATOM 0 HE22 GLN B 40 2.713 -8.709 -3.578 1.00 0.00 H new ATOM 1213 N GLN B 41 -3.026 -4.804 -2.795 1.00 0.00 N ATOM 1214 CA GLN B 41 -3.110 -3.360 -2.887 1.00 0.00 C ATOM 1215 C GLN B 41 -3.716 -2.741 -1.635 1.00 0.00 C ATOM 1216 O GLN B 41 -4.602 -3.309 -0.996 1.00 0.00 O ATOM 1217 CB GLN B 41 -3.935 -2.944 -4.101 1.00 0.00 C ATOM 1218 CG GLN B 41 -3.204 -3.289 -5.392 1.00 0.00 C ATOM 1219 CD GLN B 41 -3.918 -2.698 -6.594 1.00 0.00 C ATOM 1220 OE1 GLN B 41 -4.252 -1.518 -6.594 1.00 0.00 O ATOM 1221 NE2 GLN B 41 -4.161 -3.502 -7.622 1.00 0.00 N ATOM 0 H GLN B 41 -3.694 -5.319 -3.369 1.00 0.00 H new ATOM 0 HA GLN B 41 -2.089 -2.993 -2.991 1.00 0.00 H new ATOM 0 HB2 GLN B 41 -4.902 -3.446 -4.079 1.00 0.00 H new ATOM 0 HB3 GLN B 41 -4.132 -1.873 -4.064 1.00 0.00 H new ATOM 0 HG2 GLN B 41 -2.183 -2.911 -5.348 1.00 0.00 H new ATOM 0 HG3 GLN B 41 -3.138 -4.372 -5.499 1.00 0.00 H new ATOM 0 HE21 GLN B 41 -3.868 -4.478 -7.586 1.00 0.00 H new ATOM 0 HE22 GLN B 41 -4.640 -3.143 -8.448 1.00 0.00 H new ATOM 1230 N ARG B 42 -3.210 -1.550 -1.310 1.00 0.00 N ATOM 1231 CA ARG B 42 -3.749 -0.657 -0.296 1.00 0.00 C ATOM 1232 C ARG B 42 -3.716 0.743 -0.898 1.00 0.00 C ATOM 1233 O ARG B 42 -2.830 1.039 -1.697 1.00 0.00 O ATOM 1234 CB ARG B 42 -2.885 -0.715 0.967 1.00 0.00 C ATOM 1235 CG ARG B 42 -2.936 -2.098 1.622 1.00 0.00 C ATOM 1236 CD ARG B 42 -1.910 -2.206 2.753 1.00 0.00 C ATOM 1237 NE ARG B 42 -2.162 -1.245 3.836 1.00 0.00 N ATOM 1238 CZ ARG B 42 -1.499 -1.258 4.997 1.00 0.00 C ATOM 1239 NH1 ARG B 42 -0.548 -2.160 5.226 1.00 0.00 N ATOM 1240 NH2 ARG B 42 -1.784 -0.368 5.943 1.00 0.00 N ATOM 0 H ARG B 42 -2.381 -1.171 -1.767 1.00 0.00 H new ATOM 0 HA ARG B 42 -4.763 -0.940 -0.013 1.00 0.00 H new ATOM 0 HB2 ARG B 42 -1.854 -0.469 0.714 1.00 0.00 H new ATOM 0 HB3 ARG B 42 -3.227 0.038 1.677 1.00 0.00 H new ATOM 0 HG2 ARG B 42 -3.936 -2.282 2.014 1.00 0.00 H new ATOM 0 HG3 ARG B 42 -2.741 -2.866 0.874 1.00 0.00 H new ATOM 0 HD2 ARG B 42 -1.926 -3.218 3.158 1.00 0.00 H new ATOM 0 HD3 ARG B 42 -0.911 -2.040 2.350 1.00 0.00 H new ATOM 0 HE ARG B 42 -2.878 -0.533 3.695 1.00 0.00 H new ATOM 0 HH11 ARG B 42 -0.318 -2.851 4.512 1.00 0.00 H new ATOM 0 HH12 ARG B 42 -0.049 -2.160 6.116 1.00 0.00 H new ATOM 0 HH21 ARG B 42 -2.512 0.329 5.785 1.00 0.00 H new ATOM 0 HH22 ARG B 42 -1.275 -0.383 6.827 1.00 0.00 H new ATOM 1254 N LEU B 43 -4.664 1.599 -0.521 1.00 0.00 N ATOM 1255 CA LEU B 43 -4.771 2.934 -1.088 1.00 0.00 C ATOM 1256 C LEU B 43 -5.010 3.942 0.025 1.00 0.00 C ATOM 1257 O LEU B 43 -5.599 3.619 1.056 1.00 0.00 O ATOM 1258 CB LEU B 43 -5.909 2.964 -2.113 1.00 0.00 C ATOM 1259 CG LEU B 43 -5.569 2.167 -3.376 1.00 0.00 C ATOM 1260 CD1 LEU B 43 -6.792 2.085 -4.283 1.00 0.00 C ATOM 1261 CD2 LEU B 43 -4.439 2.833 -4.158 1.00 0.00 C ATOM 0 H LEU B 43 -5.373 1.385 0.181 1.00 0.00 H new ATOM 0 HA LEU B 43 -3.844 3.198 -1.596 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -6.814 2.558 -1.661 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -6.125 3.997 -2.384 1.00 0.00 H new ATOM 0 HG LEU B 43 -5.255 1.171 -3.064 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -6.543 1.517 -5.179 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -7.605 1.589 -3.753 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -7.103 3.091 -4.566 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -4.218 2.246 -5.050 1.00 0.00 H new ATOM 0 HD22 LEU B 43 -4.743 3.838 -4.451 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -3.548 2.891 -3.532 1.00 0.00 H new ATOM 1273 N ILE B 44 -4.540 5.170 -0.194 1.00 0.00 N ATOM 1274 CA ILE B 44 -4.521 6.200 0.831 1.00 0.00 C ATOM 1275 C ILE B 44 -4.777 7.569 0.207 1.00 0.00 C ATOM 1276 O ILE B 44 -4.435 7.791 -0.954 1.00 0.00 O ATOM 1277 CB ILE B 44 -3.155 6.153 1.532 1.00 0.00 C ATOM 1278 CG1 ILE B 44 -2.925 4.768 2.156 1.00 0.00 C ATOM 1279 CG2 ILE B 44 -3.066 7.245 2.595 1.00 0.00 C ATOM 1280 CD1 ILE B 44 -1.670 4.717 3.026 1.00 0.00 C ATOM 0 H ILE B 44 -4.162 5.474 -1.091 1.00 0.00 H new ATOM 0 HA ILE B 44 -5.309 6.025 1.563 1.00 0.00 H new ATOM 0 HB ILE B 44 -2.375 6.331 0.792 1.00 0.00 H new ATOM 0 HG12 ILE B 44 -3.792 4.497 2.759 1.00 0.00 H new ATOM 0 HG13 ILE B 44 -2.843 4.025 1.363 1.00 0.00 H new ATOM 0 HG21 ILE B 44 -2.092 7.199 3.083 1.00 0.00 H new ATOM 0 HG22 ILE B 44 -3.191 8.221 2.126 1.00 0.00 H new ATOM 0 HG23 ILE B 44 -3.851 7.096 3.336 1.00 0.00 H new ATOM 0 HD11 ILE B 44 -1.556 3.716 3.442 1.00 0.00 H new ATOM 0 HD12 ILE B 44 -0.797 4.960 2.420 1.00 0.00 H new ATOM 0 HD13 ILE B 44 -1.760 5.439 3.838 1.00 0.00 H new ATOM 1292 N PHE B 45 -5.378 8.486 0.977 1.00 0.00 N ATOM 1293 CA PHE B 45 -5.699 9.827 0.503 1.00 0.00 C ATOM 1294 C PHE B 45 -5.606 10.826 1.657 1.00 0.00 C ATOM 1295 O PHE B 45 -6.526 11.615 1.857 1.00 0.00 O ATOM 1296 CB PHE B 45 -7.082 9.813 -0.153 1.00 0.00 C ATOM 1297 CG PHE B 45 -7.540 11.140 -0.722 1.00 0.00 C ATOM 1298 CD1 PHE B 45 -6.713 11.853 -1.600 1.00 0.00 C ATOM 1299 CD2 PHE B 45 -8.795 11.658 -0.371 1.00 0.00 C ATOM 1300 CE1 PHE B 45 -7.139 13.086 -2.120 1.00 0.00 C ATOM 1301 CE2 PHE B 45 -9.215 12.896 -0.881 1.00 0.00 C ATOM 1302 CZ PHE B 45 -8.386 13.609 -1.757 1.00 0.00 C ATOM 0 H PHE B 45 -5.653 8.313 1.944 1.00 0.00 H new ATOM 0 HA PHE B 45 -4.979 10.146 -0.250 1.00 0.00 H new ATOM 0 HB2 PHE B 45 -7.079 9.074 -0.954 1.00 0.00 H new ATOM 0 HB3 PHE B 45 -7.813 9.480 0.584 1.00 0.00 H new ATOM 0 HD1 PHE B 45 -5.748 11.454 -1.877 1.00 0.00 H new ATOM 0 HD2 PHE B 45 -9.440 11.103 0.294 1.00 0.00 H new ATOM 0 HE1 PHE B 45 -6.503 13.632 -2.801 1.00 0.00 H new ATOM 0 HE2 PHE B 45 -10.176 13.299 -0.599 1.00 0.00 H new ATOM 0 HZ PHE B 45 -8.709 14.561 -2.152 1.00 0.00 H new ATOM 1312 N ALA B 46 -4.485 10.759 2.395 1.00 0.00 N ATOM 1313 CA ALA B 46 -4.091 11.608 3.525 1.00 0.00 C ATOM 1314 C ALA B 46 -3.689 10.778 4.750 1.00 0.00 C ATOM 1315 O ALA B 46 -3.488 11.322 5.834 1.00 0.00 O ATOM 1316 CB ALA B 46 -5.175 12.624 3.879 1.00 0.00 C ATOM 0 H ALA B 46 -3.776 10.052 2.198 1.00 0.00 H new ATOM 0 HA ALA B 46 -3.211 12.167 3.205 1.00 0.00 H new ATOM 0 HB1 ALA B 46 -4.843 13.232 4.720 1.00 0.00 H new ATOM 0 HB2 ALA B 46 -5.366 13.267 3.020 1.00 0.00 H new ATOM 0 HB3 ALA B 46 -6.091 12.099 4.150 1.00 0.00 H new ATOM 1322 N GLY B 47 -3.573 9.459 4.581 1.00 0.00 N ATOM 1323 CA GLY B 47 -3.262 8.519 5.652 1.00 0.00 C ATOM 1324 C GLY B 47 -4.540 7.944 6.258 1.00 0.00 C ATOM 1325 O GLY B 47 -4.486 7.075 7.129 1.00 0.00 O ATOM 0 H GLY B 47 -3.696 9.008 3.674 1.00 0.00 H new ATOM 0 HA2 GLY B 47 -2.643 7.710 5.264 1.00 0.00 H new ATOM 0 HA3 GLY B 47 -2.682 9.022 6.426 1.00 0.00 H new ATOM 1329 N LYS B 48 -5.690 8.433 5.788 1.00 0.00 N ATOM 1330 CA LYS B 48 -7.011 7.976 6.192 1.00 0.00 C ATOM 1331 C LYS B 48 -7.387 6.694 5.461 1.00 0.00 C ATOM 1332 O LYS B 48 -8.532 6.526 5.048 1.00 0.00 O ATOM 1333 CB LYS B 48 -8.037 9.074 5.926 1.00 0.00 C ATOM 1334 CG LYS B 48 -8.136 9.441 4.446 1.00 0.00 C ATOM 1335 CD LYS B 48 -9.614 9.601 4.097 1.00 0.00 C ATOM 1336 CE LYS B 48 -9.800 10.386 2.797 1.00 0.00 C ATOM 1337 NZ LYS B 48 -9.294 11.767 2.919 1.00 0.00 N ATOM 0 H LYS B 48 -5.723 9.181 5.095 1.00 0.00 H new ATOM 0 HA LYS B 48 -6.998 7.756 7.260 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -9.014 8.747 6.281 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -7.770 9.962 6.499 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -7.595 10.366 4.246 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -7.681 8.666 3.830 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -10.075 8.618 3.999 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -10.128 10.114 4.910 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -9.279 9.877 1.986 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -10.857 10.407 2.532 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -9.896 12.408 2.363 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -9.311 12.056 3.918 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -8.318 11.812 2.562 1.00 0.00 H new ATOM 1351 N GLN B 49 -6.398 5.813 5.311 1.00 0.00 N ATOM 1352 CA GLN B 49 -6.431 4.627 4.463 1.00 0.00 C ATOM 1353 C GLN B 49 -7.856 4.124 4.225 1.00 0.00 C ATOM 1354 O GLN B 49 -8.528 3.657 5.146 1.00 0.00 O ATOM 1355 CB GLN B 49 -5.505 3.548 5.028 1.00 0.00 C ATOM 1356 CG GLN B 49 -4.253 4.162 5.677 1.00 0.00 C ATOM 1357 CD GLN B 49 -3.159 3.127 5.904 1.00 0.00 C ATOM 1358 OE1 GLN B 49 -3.318 1.948 5.589 1.00 0.00 O ATOM 1359 NE2 GLN B 49 -2.028 3.557 6.455 1.00 0.00 N ATOM 0 H GLN B 49 -5.510 5.914 5.803 1.00 0.00 H new ATOM 0 HA GLN B 49 -6.055 4.901 3.477 1.00 0.00 H new ATOM 0 HB2 GLN B 49 -6.044 2.954 5.766 1.00 0.00 H new ATOM 0 HB3 GLN B 49 -5.206 2.869 4.229 1.00 0.00 H new ATOM 0 HG2 GLN B 49 -3.870 4.960 5.041 1.00 0.00 H new ATOM 0 HG3 GLN B 49 -4.525 4.616 6.630 1.00 0.00 H new ATOM 0 HE21 GLN B 49 -1.925 4.540 6.706 1.00 0.00 H new ATOM 0 HE22 GLN B 49 -1.264 2.904 6.627 1.00 0.00 H new ATOM 1368 N LEU B 50 -8.296 4.235 2.969 1.00 0.00 N ATOM 1369 CA LEU B 50 -9.681 4.042 2.572 1.00 0.00 C ATOM 1370 C LEU B 50 -10.156 2.598 2.768 1.00 0.00 C ATOM 1371 O LEU B 50 -9.357 1.698 3.027 1.00 0.00 O ATOM 1372 CB LEU B 50 -9.855 4.462 1.106 1.00 0.00 C ATOM 1373 CG LEU B 50 -9.382 5.874 0.733 1.00 0.00 C ATOM 1374 CD1 LEU B 50 -9.790 6.911 1.771 1.00 0.00 C ATOM 1375 CD2 LEU B 50 -7.872 5.961 0.524 1.00 0.00 C ATOM 0 H LEU B 50 -7.682 4.467 2.188 1.00 0.00 H new ATOM 0 HA LEU B 50 -10.298 4.666 3.218 1.00 0.00 H new ATOM 0 HB2 LEU B 50 -9.319 3.747 0.481 1.00 0.00 H new ATOM 0 HB3 LEU B 50 -10.911 4.379 0.851 1.00 0.00 H new ATOM 0 HG LEU B 50 -9.878 6.092 -0.213 1.00 0.00 H new ATOM 0 HD11 LEU B 50 -9.433 7.894 1.463 1.00 0.00 H new ATOM 0 HD12 LEU B 50 -10.876 6.930 1.858 1.00 0.00 H new ATOM 0 HD13 LEU B 50 -9.353 6.652 2.735 1.00 0.00 H new ATOM 0 HD21 LEU B 50 -7.599 6.983 0.263 1.00 0.00 H new ATOM 0 HD22 LEU B 50 -7.360 5.672 1.442 1.00 0.00 H new ATOM 0 HD23 LEU B 50 -7.577 5.289 -0.282 1.00 0.00 H new ATOM 1387 N GLU B 51 -11.469 2.385 2.636 1.00 0.00 N ATOM 1388 CA GLU B 51 -12.094 1.082 2.808 1.00 0.00 C ATOM 1389 C GLU B 51 -12.810 0.589 1.578 1.00 0.00 C ATOM 1390 O GLU B 51 -13.306 1.331 0.732 1.00 0.00 O ATOM 1391 CB GLU B 51 -13.073 1.126 3.981 1.00 0.00 C ATOM 1392 CG GLU B 51 -12.243 1.359 5.233 1.00 0.00 C ATOM 1393 CD GLU B 51 -13.102 1.363 6.493 1.00 0.00 C ATOM 1394 OE1 GLU B 51 -13.284 0.269 7.069 1.00 0.00 O ATOM 1395 OE2 GLU B 51 -13.573 2.459 6.872 1.00 0.00 O ATOM 0 H GLU B 51 -12.131 3.126 2.404 1.00 0.00 H new ATOM 0 HA GLU B 51 -11.285 0.379 3.005 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -13.803 1.924 3.846 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -13.631 0.193 4.055 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -11.483 0.582 5.314 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -11.718 2.311 5.149 1.00 0.00 H new ATOM 1402 N ASP B 52 -12.823 -0.733 1.553 1.00 0.00 N ATOM 1403 CA ASP B 52 -13.227 -1.562 0.439 1.00 0.00 C ATOM 1404 C ASP B 52 -14.748 -1.674 0.301 1.00 0.00 C ATOM 1405 O ASP B 52 -15.244 -2.606 -0.332 1.00 0.00 O ATOM 1406 CB ASP B 52 -12.578 -2.924 0.657 1.00 0.00 C ATOM 1407 CG ASP B 52 -11.062 -2.807 0.790 1.00 0.00 C ATOM 1408 OD1 ASP B 52 -10.390 -2.731 -0.262 1.00 0.00 O ATOM 1409 OD2 ASP B 52 -10.584 -2.793 1.946 1.00 0.00 O ATOM 0 H ASP B 52 -12.534 -1.285 2.360 1.00 0.00 H new ATOM 0 HA ASP B 52 -12.899 -1.114 -0.499 1.00 0.00 H new ATOM 0 HB2 ASP B 52 -12.989 -3.384 1.556 1.00 0.00 H new ATOM 0 HB3 ASP B 52 -12.821 -3.582 -0.177 1.00 0.00 H new ATOM 1414 N GLY B 53 -15.490 -0.730 0.887 1.00 0.00 N ATOM 1415 CA GLY B 53 -16.947 -0.708 0.841 1.00 0.00 C ATOM 1416 C GLY B 53 -17.481 0.719 0.751 1.00 0.00 C ATOM 1417 O GLY B 53 -18.678 0.946 0.928 1.00 0.00 O ATOM 0 H GLY B 53 -15.088 0.047 1.411 1.00 0.00 H new ATOM 0 HA2 GLY B 53 -17.294 -1.283 -0.018 1.00 0.00 H new ATOM 0 HA3 GLY B 53 -17.348 -1.192 1.731 1.00 0.00 H new ATOM 1421 N ARG B 54 -16.592 1.676 0.477 1.00 0.00 N ATOM 1422 CA ARG B 54 -16.896 3.093 0.357 1.00 0.00 C ATOM 1423 C ARG B 54 -16.891 3.507 -1.112 1.00 0.00 C ATOM 1424 O ARG B 54 -16.925 2.652 -1.995 1.00 0.00 O ATOM 1425 CB ARG B 54 -15.803 3.836 1.112 1.00 0.00 C ATOM 1426 CG ARG B 54 -15.911 3.657 2.619 1.00 0.00 C ATOM 1427 CD ARG B 54 -17.203 4.303 3.109 1.00 0.00 C ATOM 1428 NE ARG B 54 -17.016 4.935 4.416 1.00 0.00 N ATOM 1429 CZ ARG B 54 -17.057 4.297 5.589 1.00 0.00 C ATOM 1430 NH1 ARG B 54 -17.284 2.986 5.647 1.00 0.00 N ATOM 1431 NH2 ARG B 54 -16.869 4.972 6.717 1.00 0.00 N ATOM 0 H ARG B 54 -15.604 1.471 0.328 1.00 0.00 H new ATOM 0 HA ARG B 54 -17.881 3.321 0.764 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -14.829 3.481 0.776 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -15.856 4.898 0.871 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -15.901 2.597 2.873 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -15.053 4.111 3.114 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -17.537 5.048 2.387 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -17.987 3.549 3.176 1.00 0.00 H new ATOM 0 HE ARG B 54 -16.841 5.940 4.432 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -17.429 2.455 4.788 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -17.312 2.513 6.550 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -16.694 5.976 6.687 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -16.900 4.486 7.613 1.00 0.00 H new ATOM 1445 N THR B 55 -16.847 4.817 -1.380 1.00 0.00 N ATOM 1446 CA THR B 55 -16.788 5.319 -2.752 1.00 0.00 C ATOM 1447 C THR B 55 -15.961 6.588 -2.819 1.00 0.00 C ATOM 1448 O THR B 55 -15.771 7.252 -1.804 1.00 0.00 O ATOM 1449 CB THR B 55 -18.186 5.630 -3.293 1.00 0.00 C ATOM 1450 OG1 THR B 55 -18.866 6.500 -2.417 1.00 0.00 O ATOM 1451 CG2 THR B 55 -19.002 4.359 -3.478 1.00 0.00 C ATOM 0 H THR B 55 -16.851 5.545 -0.665 1.00 0.00 H new ATOM 0 HA THR B 55 -16.330 4.537 -3.359 1.00 0.00 H new ATOM 0 HB THR B 55 -18.066 6.109 -4.264 1.00 0.00 H new ATOM 0 HG1 THR B 55 -19.758 6.693 -2.774 1.00 0.00 H new ATOM 0 HG21 THR B 55 -19.989 4.613 -3.863 1.00 0.00 H new ATOM 0 HG22 THR B 55 -18.495 3.701 -4.184 1.00 0.00 H new ATOM 0 HG23 THR B 55 -19.106 3.851 -2.519 1.00 0.00 H new ATOM 1459 N LEU B 56 -15.467 6.933 -4.011 1.00 0.00 N ATOM 1460 CA LEU B 56 -14.612 8.106 -4.166 1.00 0.00 C ATOM 1461 C LEU B 56 -15.352 9.371 -3.735 1.00 0.00 C ATOM 1462 O LEU B 56 -14.754 10.297 -3.191 1.00 0.00 O ATOM 1463 CB LEU B 56 -14.151 8.213 -5.617 1.00 0.00 C ATOM 1464 CG LEU B 56 -13.333 6.992 -6.048 1.00 0.00 C ATOM 1465 CD1 LEU B 56 -12.876 7.204 -7.482 1.00 0.00 C ATOM 1466 CD2 LEU B 56 -12.091 6.801 -5.180 1.00 0.00 C ATOM 0 H LEU B 56 -15.644 6.420 -4.874 1.00 0.00 H new ATOM 0 HA LEU B 56 -13.737 7.998 -3.525 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -15.020 8.316 -6.267 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -13.551 9.114 -5.742 1.00 0.00 H new ATOM 0 HG LEU B 56 -13.964 6.109 -5.946 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -12.291 6.344 -7.808 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -13.746 7.317 -8.128 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -12.262 8.103 -7.539 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -11.540 5.924 -5.521 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -11.454 7.682 -5.257 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -12.391 6.660 -4.142 1.00 0.00 H new ATOM 1478 N SER B 57 -16.660 9.400 -3.981 1.00 0.00 N ATOM 1479 CA SER B 57 -17.517 10.497 -3.571 1.00 0.00 C ATOM 1480 C SER B 57 -17.565 10.609 -2.051 1.00 0.00 C ATOM 1481 O SER B 57 -17.726 11.701 -1.509 1.00 0.00 O ATOM 1482 CB SER B 57 -18.917 10.233 -4.117 1.00 0.00 C ATOM 1483 OG SER B 57 -19.705 11.402 -4.044 1.00 0.00 O ATOM 0 H SER B 57 -17.153 8.655 -4.474 1.00 0.00 H new ATOM 0 HA SER B 57 -17.124 11.435 -3.962 1.00 0.00 H new ATOM 0 HB2 SER B 57 -18.853 9.895 -5.151 1.00 0.00 H new ATOM 0 HB3 SER B 57 -19.390 9.432 -3.549 1.00 0.00 H new ATOM 0 HG SER B 57 -20.599 11.216 -4.399 1.00 0.00 H new ATOM 1489 N ASP B 58 -17.422 9.472 -1.359 1.00 0.00 N ATOM 1490 CA ASP B 58 -17.450 9.432 0.098 1.00 0.00 C ATOM 1491 C ASP B 58 -16.284 10.198 0.727 1.00 0.00 C ATOM 1492 O ASP B 58 -16.353 10.549 1.904 1.00 0.00 O ATOM 1493 CB ASP B 58 -17.444 7.983 0.587 1.00 0.00 C ATOM 1494 CG ASP B 58 -17.817 7.904 2.066 1.00 0.00 C ATOM 1495 OD1 ASP B 58 -18.996 8.184 2.380 1.00 0.00 O ATOM 1496 OD2 ASP B 58 -16.923 7.564 2.875 1.00 0.00 O ATOM 0 H ASP B 58 -17.285 8.561 -1.796 1.00 0.00 H new ATOM 0 HA ASP B 58 -18.370 9.924 0.413 1.00 0.00 H new ATOM 0 HB2 ASP B 58 -18.147 7.394 -0.001 1.00 0.00 H new ATOM 0 HB3 ASP B 58 -16.457 7.547 0.433 1.00 0.00 H new ATOM 1501 N TYR B 59 -15.215 10.466 -0.035 1.00 0.00 N ATOM 1502 CA TYR B 59 -14.080 11.221 0.474 1.00 0.00 C ATOM 1503 C TYR B 59 -13.909 12.537 -0.288 1.00 0.00 C ATOM 1504 O TYR B 59 -12.873 13.189 -0.169 1.00 0.00 O ATOM 1505 CB TYR B 59 -12.804 10.384 0.388 1.00 0.00 C ATOM 1506 CG TYR B 59 -12.979 8.892 0.228 1.00 0.00 C ATOM 1507 CD1 TYR B 59 -13.112 8.054 1.341 1.00 0.00 C ATOM 1508 CD2 TYR B 59 -12.993 8.347 -1.060 1.00 0.00 C ATOM 1509 CE1 TYR B 59 -13.256 6.672 1.174 1.00 0.00 C ATOM 1510 CE2 TYR B 59 -13.117 6.968 -1.238 1.00 0.00 C ATOM 1511 CZ TYR B 59 -13.264 6.129 -0.123 1.00 0.00 C ATOM 1512 OH TYR B 59 -13.413 4.794 -0.302 1.00 0.00 O ATOM 0 H TYR B 59 -15.120 10.168 -1.006 1.00 0.00 H new ATOM 0 HA TYR B 59 -14.273 11.460 1.520 1.00 0.00 H new ATOM 0 HB2 TYR B 59 -12.214 10.749 -0.453 1.00 0.00 H new ATOM 0 HB3 TYR B 59 -12.219 10.563 1.290 1.00 0.00 H new ATOM 0 HD1 TYR B 59 -13.103 8.476 2.335 1.00 0.00 H new ATOM 0 HD2 TYR B 59 -12.908 8.995 -1.920 1.00 0.00 H new ATOM 0 HE1 TYR B 59 -13.360 6.028 2.034 1.00 0.00 H new ATOM 0 HE2 TYR B 59 -13.100 6.547 -2.233 1.00 0.00 H new ATOM 0 HH TYR B 59 -13.862 4.627 -1.157 1.00 0.00 H new ATOM 1522 N ASN B 60 -14.925 12.921 -1.069 1.00 0.00 N ATOM 1523 CA ASN B 60 -14.897 14.088 -1.933 1.00 0.00 C ATOM 1524 C ASN B 60 -13.668 14.092 -2.845 1.00 0.00 C ATOM 1525 O ASN B 60 -13.182 15.149 -3.244 1.00 0.00 O ATOM 1526 CB ASN B 60 -15.031 15.351 -1.085 1.00 0.00 C ATOM 1527 CG ASN B 60 -15.360 16.564 -1.943 1.00 0.00 C ATOM 1528 OD1 ASN B 60 -16.317 16.556 -2.711 1.00 0.00 O ATOM 1529 ND2 ASN B 60 -14.565 17.625 -1.824 1.00 0.00 N ATOM 0 H ASN B 60 -15.807 12.411 -1.113 1.00 0.00 H new ATOM 0 HA ASN B 60 -15.749 14.056 -2.612 1.00 0.00 H new ATOM 0 HB2 ASN B 60 -15.813 15.209 -0.339 1.00 0.00 H new ATOM 0 HB3 ASN B 60 -14.102 15.528 -0.544 1.00 0.00 H new ATOM 0 HD21 ASN B 60 -14.744 18.461 -2.380 1.00 0.00 H new ATOM 0 HD22 ASN B 60 -13.777 17.602 -1.177 1.00 0.00 H new ATOM 1536 N ILE B 61 -13.167 12.901 -3.172 1.00 0.00 N ATOM 1537 CA ILE B 61 -12.080 12.733 -4.126 1.00 0.00 C ATOM 1538 C ILE B 61 -12.532 13.222 -5.501 1.00 0.00 C ATOM 1539 O ILE B 61 -13.573 12.800 -6.008 1.00 0.00 O ATOM 1540 CB ILE B 61 -11.670 11.255 -4.156 1.00 0.00 C ATOM 1541 CG1 ILE B 61 -10.668 11.009 -3.027 1.00 0.00 C ATOM 1542 CG2 ILE B 61 -11.066 10.843 -5.500 1.00 0.00 C ATOM 1543 CD1 ILE B 61 -10.272 9.537 -2.912 1.00 0.00 C ATOM 0 H ILE B 61 -13.508 12.024 -2.779 1.00 0.00 H new ATOM 0 HA ILE B 61 -11.213 13.324 -3.830 1.00 0.00 H new ATOM 0 HB ILE B 61 -12.564 10.646 -4.018 1.00 0.00 H new ATOM 0 HG12 ILE B 61 -9.775 11.610 -3.199 1.00 0.00 H new ATOM 0 HG13 ILE B 61 -11.099 11.342 -2.083 1.00 0.00 H new ATOM 0 HG21 ILE B 61 -10.793 9.788 -5.468 1.00 0.00 H new ATOM 0 HG22 ILE B 61 -11.797 11.005 -6.292 1.00 0.00 H new ATOM 0 HG23 ILE B 61 -10.177 11.442 -5.698 1.00 0.00 H new ATOM 0 HD11 ILE B 61 -9.559 9.415 -2.096 1.00 0.00 H new ATOM 0 HD12 ILE B 61 -11.159 8.936 -2.712 1.00 0.00 H new ATOM 0 HD13 ILE B 61 -9.815 9.209 -3.846 1.00 0.00 H new ATOM 1555 N GLN B 62 -11.742 14.115 -6.101 1.00 0.00 N ATOM 1556 CA GLN B 62 -11.931 14.566 -7.469 1.00 0.00 C ATOM 1557 C GLN B 62 -10.966 13.798 -8.376 1.00 0.00 C ATOM 1558 O GLN B 62 -10.352 12.830 -7.933 1.00 0.00 O ATOM 1559 CB GLN B 62 -11.709 16.073 -7.548 1.00 0.00 C ATOM 1560 CG GLN B 62 -12.489 16.776 -6.439 1.00 0.00 C ATOM 1561 CD GLN B 62 -13.986 16.492 -6.497 1.00 0.00 C ATOM 1562 OE1 GLN B 62 -14.603 16.559 -7.554 1.00 0.00 O ATOM 1563 NE2 GLN B 62 -14.578 16.174 -5.348 1.00 0.00 N ATOM 0 H GLN B 62 -10.943 14.548 -5.638 1.00 0.00 H new ATOM 0 HA GLN B 62 -12.949 14.368 -7.803 1.00 0.00 H new ATOM 0 HB2 GLN B 62 -10.646 16.297 -7.455 1.00 0.00 H new ATOM 0 HB3 GLN B 62 -12.029 16.445 -8.521 1.00 0.00 H new ATOM 0 HG2 GLN B 62 -12.101 16.459 -5.471 1.00 0.00 H new ATOM 0 HG3 GLN B 62 -12.325 17.851 -6.511 1.00 0.00 H new ATOM 0 HE21 GLN B 62 -14.031 16.128 -4.488 1.00 0.00 H new ATOM 0 HE22 GLN B 62 -15.578 15.976 -5.327 1.00 0.00 H new ATOM 1572 N LYS B 63 -10.826 14.213 -9.638 1.00 0.00 N ATOM 1573 CA LYS B 63 -9.963 13.522 -10.590 1.00 0.00 C ATOM 1574 C LYS B 63 -8.489 13.538 -10.165 1.00 0.00 C ATOM 1575 O LYS B 63 -8.047 12.643 -9.454 1.00 0.00 O ATOM 1576 CB LYS B 63 -10.244 14.037 -12.007 1.00 0.00 C ATOM 1577 CG LYS B 63 -9.993 15.532 -12.226 1.00 0.00 C ATOM 1578 CD LYS B 63 -10.786 16.001 -13.440 1.00 0.00 C ATOM 1579 CE LYS B 63 -12.259 16.179 -13.074 1.00 0.00 C ATOM 1580 NZ LYS B 63 -13.037 16.683 -14.220 1.00 0.00 N ATOM 0 H LYS B 63 -11.303 15.029 -10.022 1.00 0.00 H new ATOM 0 HA LYS B 63 -10.204 12.459 -10.597 1.00 0.00 H new ATOM 0 HB2 LYS B 63 -9.626 13.476 -12.708 1.00 0.00 H new ATOM 0 HB3 LYS B 63 -11.283 13.821 -12.254 1.00 0.00 H new ATOM 0 HG2 LYS B 63 -10.291 16.096 -11.342 1.00 0.00 H new ATOM 0 HG3 LYS B 63 -8.929 15.716 -12.378 1.00 0.00 H new ATOM 0 HD2 LYS B 63 -10.379 16.943 -13.807 1.00 0.00 H new ATOM 0 HD3 LYS B 63 -10.690 15.276 -14.248 1.00 0.00 H new ATOM 0 HE2 LYS B 63 -12.671 15.226 -12.742 1.00 0.00 H new ATOM 0 HE3 LYS B 63 -12.347 16.873 -12.238 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 -14.033 16.794 -13.942 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 -12.657 17.603 -14.520 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 -12.971 16.008 -15.008 1.00 0.00 H new ATOM 1594 N GLU B 64 -7.711 14.533 -10.584 1.00 0.00 N ATOM 1595 CA GLU B 64 -6.288 14.650 -10.298 1.00 0.00 C ATOM 1596 C GLU B 64 -5.989 14.908 -8.812 1.00 0.00 C ATOM 1597 O GLU B 64 -4.907 15.398 -8.486 1.00 0.00 O ATOM 1598 CB GLU B 64 -5.688 15.744 -11.182 1.00 0.00 C ATOM 1599 CG GLU B 64 -6.362 17.091 -10.922 1.00 0.00 C ATOM 1600 CD GLU B 64 -5.741 18.189 -11.784 1.00 0.00 C ATOM 1601 OE1 GLU B 64 -4.762 18.812 -11.315 1.00 0.00 O ATOM 1602 OE2 GLU B 64 -6.252 18.399 -12.907 1.00 0.00 O ATOM 0 H GLU B 64 -8.067 15.303 -11.150 1.00 0.00 H new ATOM 0 HA GLU B 64 -5.822 13.692 -10.527 1.00 0.00 H new ATOM 0 HB2 GLU B 64 -4.618 15.826 -10.990 1.00 0.00 H new ATOM 0 HB3 GLU B 64 -5.803 15.472 -12.231 1.00 0.00 H new ATOM 0 HG2 GLU B 64 -7.428 17.015 -11.135 1.00 0.00 H new ATOM 0 HG3 GLU B 64 -6.266 17.353 -9.868 1.00 0.00 H new ATOM 1609 N SER B 65 -6.921 14.595 -7.906 1.00 0.00 N ATOM 1610 CA SER B 65 -6.715 14.773 -6.469 1.00 0.00 C ATOM 1611 C SER B 65 -5.497 13.999 -5.965 1.00 0.00 C ATOM 1612 O SER B 65 -5.021 14.273 -4.864 1.00 0.00 O ATOM 1613 CB SER B 65 -7.956 14.315 -5.711 1.00 0.00 C ATOM 1614 OG SER B 65 -9.029 15.191 -5.970 1.00 0.00 O ATOM 0 H SER B 65 -7.835 14.213 -8.149 1.00 0.00 H new ATOM 0 HA SER B 65 -6.535 15.833 -6.291 1.00 0.00 H new ATOM 0 HB2 SER B 65 -8.222 13.302 -6.011 1.00 0.00 H new ATOM 0 HB3 SER B 65 -7.749 14.286 -4.641 1.00 0.00 H new ATOM 0 HG SER B 65 -9.335 15.591 -5.129 1.00 0.00 H new ATOM 1620 N THR B 66 -5.001 13.044 -6.763 1.00 0.00 N ATOM 1621 CA THR B 66 -3.836 12.219 -6.468 1.00 0.00 C ATOM 1622 C THR B 66 -4.066 11.294 -5.266 1.00 0.00 C ATOM 1623 O THR B 66 -4.845 11.600 -4.364 1.00 0.00 O ATOM 1624 CB THR B 66 -2.613 13.125 -6.265 1.00 0.00 C ATOM 1625 OG1 THR B 66 -2.480 13.982 -7.380 1.00 0.00 O ATOM 1626 CG2 THR B 66 -1.303 12.351 -6.124 1.00 0.00 C ATOM 0 H THR B 66 -5.421 12.821 -7.665 1.00 0.00 H new ATOM 0 HA THR B 66 -3.654 11.561 -7.317 1.00 0.00 H new ATOM 0 HB THR B 66 -2.786 13.672 -5.338 1.00 0.00 H new ATOM 0 HG1 THR B 66 -1.701 14.564 -7.254 1.00 0.00 H new ATOM 0 HG21 THR B 66 -0.480 13.052 -5.983 1.00 0.00 H new ATOM 0 HG22 THR B 66 -1.364 11.686 -5.263 1.00 0.00 H new ATOM 0 HG23 THR B 66 -1.129 11.763 -7.025 1.00 0.00 H new ATOM 1634 N LEU B 67 -3.379 10.149 -5.258 1.00 0.00 N ATOM 1635 CA LEU B 67 -3.464 9.136 -4.208 1.00 0.00 C ATOM 1636 C LEU B 67 -2.116 8.430 -4.111 1.00 0.00 C ATOM 1637 O LEU B 67 -1.174 8.794 -4.814 1.00 0.00 O ATOM 1638 CB LEU B 67 -4.559 8.106 -4.526 1.00 0.00 C ATOM 1639 CG LEU B 67 -5.955 8.577 -4.097 1.00 0.00 C ATOM 1640 CD1 LEU B 67 -6.729 9.158 -5.279 1.00 0.00 C ATOM 1641 CD2 LEU B 67 -6.757 7.393 -3.552 1.00 0.00 C ATOM 0 H LEU B 67 -2.731 9.896 -6.004 1.00 0.00 H new ATOM 0 HA LEU B 67 -3.716 9.618 -3.264 1.00 0.00 H new ATOM 0 HB2 LEU B 67 -4.561 7.903 -5.597 1.00 0.00 H new ATOM 0 HB3 LEU B 67 -4.326 7.167 -4.024 1.00 0.00 H new ATOM 0 HG LEU B 67 -5.823 9.344 -3.334 1.00 0.00 H new ATOM 0 HD11 LEU B 67 -7.714 9.483 -4.944 1.00 0.00 H new ATOM 0 HD12 LEU B 67 -6.185 10.010 -5.687 1.00 0.00 H new ATOM 0 HD13 LEU B 67 -6.841 8.396 -6.050 1.00 0.00 H new ATOM 0 HD21 LEU B 67 -7.747 7.733 -3.249 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -6.856 6.633 -4.327 1.00 0.00 H new ATOM 0 HD23 LEU B 67 -6.240 6.969 -2.691 1.00 0.00 H new ATOM 1653 N HIS B 68 -2.017 7.418 -3.245 1.00 0.00 N ATOM 1654 CA HIS B 68 -0.811 6.631 -3.105 1.00 0.00 C ATOM 1655 C HIS B 68 -1.190 5.165 -2.967 1.00 0.00 C ATOM 1656 O HIS B 68 -2.307 4.847 -2.564 1.00 0.00 O ATOM 1657 CB HIS B 68 -0.058 7.085 -1.855 1.00 0.00 C ATOM 1658 CG HIS B 68 0.391 8.518 -1.915 1.00 0.00 C ATOM 1659 ND1 HIS B 68 -0.332 9.611 -1.425 1.00 0.00 N ATOM 1660 CD2 HIS B 68 1.568 8.958 -2.448 1.00 0.00 C ATOM 1661 CE1 HIS B 68 0.435 10.685 -1.680 1.00 0.00 C ATOM 1662 NE2 HIS B 68 1.577 10.324 -2.287 1.00 0.00 N ATOM 0 H HIS B 68 -2.775 7.130 -2.627 1.00 0.00 H new ATOM 0 HA HIS B 68 -0.175 6.764 -3.980 1.00 0.00 H new ATOM 0 HB2 HIS B 68 -0.700 6.949 -0.984 1.00 0.00 H new ATOM 0 HB3 HIS B 68 0.813 6.445 -1.712 1.00 0.00 H new ATOM 0 HD2 HIS B 68 2.338 8.354 -2.905 1.00 0.00 H new ATOM 0 HE1 HIS B 68 0.169 11.701 -1.430 1.00 0.00 H new ATOM 0 HE2 HIS B 68 2.324 10.955 -2.579 1.00 0.00 H new ATOM 1670 N LEU B 69 -0.253 4.276 -3.302 1.00 0.00 N ATOM 1671 CA LEU B 69 -0.424 2.854 -3.050 1.00 0.00 C ATOM 1672 C LEU B 69 0.784 2.323 -2.295 1.00 0.00 C ATOM 1673 O LEU B 69 1.896 2.825 -2.440 1.00 0.00 O ATOM 1674 CB LEU B 69 -0.717 2.041 -4.315 1.00 0.00 C ATOM 1675 CG LEU B 69 0.351 2.127 -5.406 1.00 0.00 C ATOM 1676 CD1 LEU B 69 0.243 0.894 -6.295 1.00 0.00 C ATOM 1677 CD2 LEU B 69 0.096 3.349 -6.277 1.00 0.00 C ATOM 0 H LEU B 69 0.631 4.521 -3.748 1.00 0.00 H new ATOM 0 HA LEU B 69 -1.313 2.733 -2.431 1.00 0.00 H new ATOM 0 HB2 LEU B 69 -0.844 0.995 -4.034 1.00 0.00 H new ATOM 0 HB3 LEU B 69 -1.667 2.377 -4.731 1.00 0.00 H new ATOM 0 HG LEU B 69 1.335 2.193 -4.942 1.00 0.00 H new ATOM 0 HD11 LEU B 69 1.000 0.943 -7.078 1.00 0.00 H new ATOM 0 HD12 LEU B 69 0.399 -0.002 -5.695 1.00 0.00 H new ATOM 0 HD13 LEU B 69 -0.747 0.858 -6.749 1.00 0.00 H new ATOM 0 HD21 LEU B 69 0.859 3.408 -7.054 1.00 0.00 H new ATOM 0 HD22 LEU B 69 -0.888 3.267 -6.740 1.00 0.00 H new ATOM 0 HD23 LEU B 69 0.134 4.248 -5.662 1.00 0.00 H new ATOM 1689 N VAL B 70 0.539 1.296 -1.484 1.00 0.00 N ATOM 1690 CA VAL B 70 1.529 0.727 -0.585 1.00 0.00 C ATOM 1691 C VAL B 70 1.183 -0.745 -0.375 1.00 0.00 C ATOM 1692 O VAL B 70 0.474 -1.114 0.559 1.00 0.00 O ATOM 1693 CB VAL B 70 1.600 1.568 0.701 1.00 0.00 C ATOM 1694 CG1 VAL B 70 0.217 1.911 1.268 1.00 0.00 C ATOM 1695 CG2 VAL B 70 2.464 0.884 1.761 1.00 0.00 C ATOM 0 H VAL B 70 -0.368 0.832 -1.436 1.00 0.00 H new ATOM 0 HA VAL B 70 2.536 0.757 -1.000 1.00 0.00 H new ATOM 0 HB VAL B 70 2.069 2.512 0.423 1.00 0.00 H new ATOM 0 HG11 VAL B 70 0.333 2.505 2.175 1.00 0.00 H new ATOM 0 HG12 VAL B 70 -0.348 2.481 0.530 1.00 0.00 H new ATOM 0 HG13 VAL B 70 -0.318 0.991 1.503 1.00 0.00 H new ATOM 0 HG21 VAL B 70 2.496 1.502 2.659 1.00 0.00 H new ATOM 0 HG22 VAL B 70 2.038 -0.089 2.005 1.00 0.00 H new ATOM 0 HG23 VAL B 70 3.475 0.751 1.376 1.00 0.00 H new ATOM 1705 N LEU B 71 1.696 -1.587 -1.277 1.00 0.00 N ATOM 1706 CA LEU B 71 1.355 -2.997 -1.365 1.00 0.00 C ATOM 1707 C LEU B 71 1.673 -3.778 -0.091 1.00 0.00 C ATOM 1708 O LEU B 71 2.424 -3.314 0.768 1.00 0.00 O ATOM 1709 CB LEU B 71 2.087 -3.609 -2.563 1.00 0.00 C ATOM 1710 CG LEU B 71 1.868 -2.815 -3.857 1.00 0.00 C ATOM 1711 CD1 LEU B 71 2.494 -3.576 -5.023 1.00 0.00 C ATOM 1712 CD2 LEU B 71 0.379 -2.613 -4.126 1.00 0.00 C ATOM 0 H LEU B 71 2.375 -1.294 -1.979 1.00 0.00 H new ATOM 0 HA LEU B 71 0.275 -3.067 -1.497 1.00 0.00 H new ATOM 0 HB2 LEU B 71 3.154 -3.656 -2.346 1.00 0.00 H new ATOM 0 HB3 LEU B 71 1.745 -4.634 -2.708 1.00 0.00 H new ATOM 0 HG LEU B 71 2.336 -1.836 -3.750 1.00 0.00 H new ATOM 0 HD11 LEU B 71 2.342 -3.017 -5.946 1.00 0.00 H new ATOM 0 HD12 LEU B 71 3.562 -3.699 -4.845 1.00 0.00 H new ATOM 0 HD13 LEU B 71 2.025 -4.556 -5.111 1.00 0.00 H new ATOM 0 HD21 LEU B 71 0.249 -2.047 -5.049 1.00 0.00 H new ATOM 0 HD22 LEU B 71 -0.108 -3.583 -4.224 1.00 0.00 H new ATOM 0 HD23 LEU B 71 -0.069 -2.064 -3.298 1.00 0.00 H new ATOM 1724 N ARG B 72 1.092 -4.977 0.022 1.00 0.00 N ATOM 1725 CA ARG B 72 1.325 -5.878 1.146 1.00 0.00 C ATOM 1726 C ARG B 72 2.546 -6.772 0.926 1.00 0.00 C ATOM 1727 O ARG B 72 2.888 -7.528 1.827 1.00 0.00 O ATOM 1728 CB ARG B 72 0.083 -6.749 1.348 1.00 0.00 C ATOM 1729 CG ARG B 72 -1.091 -5.906 1.841 1.00 0.00 C ATOM 1730 CD ARG B 72 -2.346 -6.761 2.015 1.00 0.00 C ATOM 1731 NE ARG B 72 -2.144 -7.827 3.006 1.00 0.00 N ATOM 1732 CZ ARG B 72 -2.891 -8.933 3.080 1.00 0.00 C ATOM 1733 NH1 ARG B 72 -3.865 -9.163 2.204 1.00 0.00 N ATOM 1734 NH2 ARG B 72 -2.663 -9.824 4.041 1.00 0.00 N ATOM 0 H ARG B 72 0.443 -5.348 -0.671 1.00 0.00 H new ATOM 0 HA ARG B 72 1.520 -5.272 2.030 1.00 0.00 H new ATOM 0 HB2 ARG B 72 -0.182 -7.237 0.410 1.00 0.00 H new ATOM 0 HB3 ARG B 72 0.299 -7.538 2.068 1.00 0.00 H new ATOM 0 HG2 ARG B 72 -0.833 -5.436 2.790 1.00 0.00 H new ATOM 0 HG3 ARG B 72 -1.290 -5.103 1.131 1.00 0.00 H new ATOM 0 HD2 ARG B 72 -3.177 -6.128 2.326 1.00 0.00 H new ATOM 0 HD3 ARG B 72 -2.622 -7.202 1.057 1.00 0.00 H new ATOM 0 HE ARG B 72 -1.386 -7.716 3.680 1.00 0.00 H new ATOM 0 HH11 ARG B 72 -4.052 -8.490 1.461 1.00 0.00 H new ATOM 0 HH12 ARG B 72 -4.425 -10.012 2.276 1.00 0.00 H new ATOM 0 HH21 ARG B 72 -1.919 -9.663 4.720 1.00 0.00 H new ATOM 0 HH22 ARG B 72 -3.232 -10.668 4.099 1.00 0.00 H new ATOM 1748 N LEU B 73 3.181 -6.674 -0.250 1.00 0.00 N ATOM 1749 CA LEU B 73 4.305 -7.483 -0.736 1.00 0.00 C ATOM 1750 C LEU B 73 4.214 -8.986 -0.435 1.00 0.00 C ATOM 1751 O LEU B 73 3.996 -9.771 -1.358 1.00 0.00 O ATOM 1752 CB LEU B 73 5.639 -6.936 -0.208 1.00 0.00 C ATOM 1753 CG LEU B 73 6.092 -5.578 -0.769 1.00 0.00 C ATOM 1754 CD1 LEU B 73 6.043 -5.553 -2.295 1.00 0.00 C ATOM 1755 CD2 LEU B 73 5.272 -4.411 -0.229 1.00 0.00 C ATOM 0 H LEU B 73 2.901 -5.974 -0.937 1.00 0.00 H new ATOM 0 HA LEU B 73 4.251 -7.394 -1.821 1.00 0.00 H new ATOM 0 HB2 LEU B 73 5.568 -6.851 0.876 1.00 0.00 H new ATOM 0 HB3 LEU B 73 6.417 -7.670 -0.420 1.00 0.00 H new ATOM 0 HG LEU B 73 7.122 -5.457 -0.435 1.00 0.00 H new ATOM 0 HD11 LEU B 73 6.370 -4.577 -2.654 1.00 0.00 H new ATOM 0 HD12 LEU B 73 6.701 -6.325 -2.693 1.00 0.00 H new ATOM 0 HD13 LEU B 73 5.022 -5.739 -2.629 1.00 0.00 H new ATOM 0 HD21 LEU B 73 5.638 -3.479 -0.660 1.00 0.00 H new ATOM 0 HD22 LEU B 73 4.224 -4.548 -0.496 1.00 0.00 H new ATOM 0 HD23 LEU B 73 5.367 -4.371 0.856 1.00 0.00 H new