USER MOD reduce.3.24.130724 H: found=0, std=0, add=783, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 780 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 38 GLN : amide:sc= 0.971 K(o=0.8,f=-0.31) USER MOD Set 1.2: A 77 MET CE :methyl -142:sc= -0.176 (180deg=-2.32!) USER MOD Set 2.1: A 72 TYR OH : rot 180:sc= 0.101 USER MOD Set 2.2: A 75 LYS NZ :NH3+ -177:sc= 0.124 (180deg=0.00866) USER MOD Set 3.1: A 47 MET CE :methyl 174:sc= -0.152 (180deg=-0.139) USER MOD Set 3.2: A 56 HIS : no HD1:sc= 1.42 K(o=1.3,f=-8.3!) USER MOD Set 4.1: A 13 ASN : amide:sc= 1.64 K(o=2.4,f=-0.2) USER MOD Set 4.2: A 17 THR OG1 : rot 69:sc= 0.741 USER MOD Single : A 1 GLY N :NH3+ -140:sc= 0.029 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0.0107 USER MOD Single : A 5 SER OG : rot 124:sc= 0.565 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 14 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ -153:sc= 1.3 (180deg=1.12) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 44 ASN : amide:sc= 0.792 K(o=0.79,f=-0.7) USER MOD Single : A 45 THR OG1 : rot 34:sc= 0 USER MOD Single : A 46 HIS : no HD1:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 49 LYS NZ :NH3+ -154:sc= 2.37 (180deg=1.58) USER MOD Single : A 53 THR OG1 : rot -48:sc= 0.388 USER MOD Single : A 55 GLN : amide:sc= 0.847 K(o=0.85,f=0) USER MOD Single : A 57 GLN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 174:sc= 1.25 (180deg=1.16) USER MOD Single : A 90 ASN : amide:sc= 0.818 K(o=0.82,f=0) USER MOD Single : A 91 LYS NZ :NH3+ -176:sc= 2.44 (180deg=2.3) USER MOD Single : A 93 SER OG : rot 180:sc= 0.31 USER MOD Single : A 95 HIS : no HD1:sc=-0.00143 X(o=-0.0014,f=0) USER MOD Single : A 96 ASN : amide:sc= 0.43 K(o=0.43,f=-5.6!) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 ASN : amide:sc= -0.0258 X(o=-0.026,f=-0.026) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 180:sc= 0.00742 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 25.582 17.415 11.457 1.00 0.00 N ATOM 2 CA GLY A 1 24.868 17.735 10.201 1.00 0.00 C ATOM 3 C GLY A 1 23.950 16.600 9.774 1.00 0.00 C ATOM 4 O GLY A 1 23.396 15.894 10.617 1.00 0.00 O ATOM 0 H1 GLY A 1 25.623 18.262 12.059 1.00 0.00 H new ATOM 0 H2 GLY A 1 25.077 16.657 11.960 1.00 0.00 H new ATOM 0 H3 GLY A 1 26.548 17.100 11.236 1.00 0.00 H new ATOM 0 HA2 GLY A 1 24.284 18.645 10.336 1.00 0.00 H new ATOM 0 HA3 GLY A 1 25.592 17.935 9.411 1.00 0.00 H new ATOM 10 N SER A 2 23.795 16.393 8.462 1.00 0.00 N ATOM 11 CA SER A 2 22.850 15.425 7.860 1.00 0.00 C ATOM 12 C SER A 2 23.132 13.947 8.187 1.00 0.00 C ATOM 13 O SER A 2 22.267 13.092 7.987 1.00 0.00 O ATOM 14 CB SER A 2 22.830 15.602 6.334 1.00 0.00 C ATOM 15 OG SER A 2 22.573 16.958 5.989 1.00 0.00 O ATOM 0 H SER A 2 24.335 16.904 7.764 1.00 0.00 H new ATOM 0 HA SER A 2 21.883 15.653 8.308 1.00 0.00 H new ATOM 0 HB2 SER A 2 23.786 15.290 5.914 1.00 0.00 H new ATOM 0 HB3 SER A 2 22.065 14.959 5.898 1.00 0.00 H new ATOM 0 HG SER A 2 22.566 17.052 5.014 1.00 0.00 H new ATOM 21 N SER A 3 24.319 13.634 8.718 1.00 0.00 N ATOM 22 CA SER A 3 24.705 12.316 9.246 1.00 0.00 C ATOM 23 C SER A 3 24.055 11.959 10.597 1.00 0.00 C ATOM 24 O SER A 3 24.085 10.793 11.001 1.00 0.00 O ATOM 25 CB SER A 3 26.233 12.268 9.378 1.00 0.00 C ATOM 26 OG SER A 3 26.703 13.366 10.151 1.00 0.00 O ATOM 0 H SER A 3 25.070 14.319 8.796 1.00 0.00 H new ATOM 0 HA SER A 3 24.339 11.573 8.537 1.00 0.00 H new ATOM 0 HB2 SER A 3 26.534 11.331 9.847 1.00 0.00 H new ATOM 0 HB3 SER A 3 26.690 12.291 8.389 1.00 0.00 H new ATOM 0 HG SER A 3 27.679 13.319 10.227 1.00 0.00 H new ATOM 32 N GLY A 4 23.459 12.932 11.301 1.00 0.00 N ATOM 33 CA GLY A 4 22.766 12.729 12.580 1.00 0.00 C ATOM 34 C GLY A 4 21.453 11.938 12.461 1.00 0.00 C ATOM 35 O GLY A 4 20.808 11.920 11.408 1.00 0.00 O ATOM 0 H GLY A 4 23.445 13.903 10.990 1.00 0.00 H new ATOM 0 HA2 GLY A 4 23.433 12.205 13.264 1.00 0.00 H new ATOM 0 HA3 GLY A 4 22.554 13.701 13.025 1.00 0.00 H new ATOM 39 N SER A 5 21.050 11.287 13.555 1.00 0.00 N ATOM 40 CA SER A 5 19.848 10.439 13.648 1.00 0.00 C ATOM 41 C SER A 5 19.225 10.450 15.055 1.00 0.00 C ATOM 42 O SER A 5 19.856 10.866 16.033 1.00 0.00 O ATOM 43 CB SER A 5 20.193 8.995 13.249 1.00 0.00 C ATOM 44 OG SER A 5 21.138 8.436 14.148 1.00 0.00 O ATOM 0 H SER A 5 21.566 11.334 14.434 1.00 0.00 H new ATOM 0 HA SER A 5 19.110 10.853 12.961 1.00 0.00 H new ATOM 0 HB2 SER A 5 19.287 8.388 13.243 1.00 0.00 H new ATOM 0 HB3 SER A 5 20.595 8.979 12.236 1.00 0.00 H new ATOM 0 HG SER A 5 20.775 7.611 14.533 1.00 0.00 H new ATOM 50 N SER A 6 17.986 9.960 15.170 1.00 0.00 N ATOM 51 CA SER A 6 17.261 9.813 16.449 1.00 0.00 C ATOM 52 C SER A 6 17.713 8.601 17.287 1.00 0.00 C ATOM 53 O SER A 6 17.310 8.465 18.445 1.00 0.00 O ATOM 54 CB SER A 6 15.751 9.715 16.186 1.00 0.00 C ATOM 55 OG SER A 6 15.296 10.827 15.427 1.00 0.00 O ATOM 0 H SER A 6 17.444 9.647 14.365 1.00 0.00 H new ATOM 0 HA SER A 6 17.497 10.702 17.033 1.00 0.00 H new ATOM 0 HB2 SER A 6 15.530 8.790 15.653 1.00 0.00 H new ATOM 0 HB3 SER A 6 15.215 9.672 17.134 1.00 0.00 H new ATOM 0 HG SER A 6 14.332 10.743 15.270 1.00 0.00 H new ATOM 61 N GLY A 7 18.535 7.711 16.719 1.00 0.00 N ATOM 62 CA GLY A 7 19.036 6.487 17.353 1.00 0.00 C ATOM 63 C GLY A 7 19.773 5.564 16.367 1.00 0.00 C ATOM 64 O GLY A 7 19.949 5.930 15.200 1.00 0.00 O ATOM 0 H GLY A 7 18.883 7.829 15.767 1.00 0.00 H new ATOM 0 HA2 GLY A 7 19.710 6.754 18.167 1.00 0.00 H new ATOM 0 HA3 GLY A 7 18.201 5.945 17.796 1.00 0.00 H new ATOM 68 N PRO A 8 20.185 4.354 16.794 1.00 0.00 N ATOM 69 CA PRO A 8 20.927 3.380 15.982 1.00 0.00 C ATOM 70 C PRO A 8 20.018 2.603 14.998 1.00 0.00 C ATOM 71 O PRO A 8 20.071 1.374 14.902 1.00 0.00 O ATOM 72 CB PRO A 8 21.648 2.500 17.013 1.00 0.00 C ATOM 73 CG PRO A 8 20.644 2.448 18.163 1.00 0.00 C ATOM 74 CD PRO A 8 20.056 3.860 18.162 1.00 0.00 C ATOM 0 HA PRO A 8 21.641 3.852 15.307 1.00 0.00 H new ATOM 0 HB2 PRO A 8 21.865 1.507 16.618 1.00 0.00 H new ATOM 0 HB3 PRO A 8 22.598 2.934 17.323 1.00 0.00 H new ATOM 0 HG2 PRO A 8 19.878 1.691 17.997 1.00 0.00 H new ATOM 0 HG3 PRO A 8 21.127 2.211 19.111 1.00 0.00 H new ATOM 0 HD2 PRO A 8 19.012 3.847 18.474 1.00 0.00 H new ATOM 0 HD3 PRO A 8 20.590 4.504 18.861 1.00 0.00 H new ATOM 82 N ILE A 9 19.146 3.322 14.281 1.00 0.00 N ATOM 83 CA ILE A 9 18.134 2.787 13.355 1.00 0.00 C ATOM 84 C ILE A 9 18.588 2.794 11.883 1.00 0.00 C ATOM 85 O ILE A 9 19.489 3.536 11.489 1.00 0.00 O ATOM 86 CB ILE A 9 16.756 3.445 13.585 1.00 0.00 C ATOM 87 CG1 ILE A 9 16.741 4.978 13.744 1.00 0.00 C ATOM 88 CG2 ILE A 9 16.116 2.839 14.848 1.00 0.00 C ATOM 89 CD1 ILE A 9 17.301 5.781 12.565 1.00 0.00 C ATOM 0 H ILE A 9 19.124 4.341 14.331 1.00 0.00 H new ATOM 0 HA ILE A 9 18.015 1.730 13.592 1.00 0.00 H new ATOM 0 HB ILE A 9 16.203 3.238 12.669 1.00 0.00 H new ATOM 0 HG12 ILE A 9 15.713 5.295 13.918 1.00 0.00 H new ATOM 0 HG13 ILE A 9 17.310 5.236 14.637 1.00 0.00 H new ATOM 0 HG21 ILE A 9 15.142 3.298 15.018 1.00 0.00 H new ATOM 0 HG22 ILE A 9 15.992 1.764 14.713 1.00 0.00 H new ATOM 0 HG23 ILE A 9 16.760 3.025 15.707 1.00 0.00 H new ATOM 0 HD11 ILE A 9 17.240 6.846 12.788 1.00 0.00 H new ATOM 0 HD12 ILE A 9 18.342 5.504 12.398 1.00 0.00 H new ATOM 0 HD13 ILE A 9 16.720 5.564 11.669 1.00 0.00 H new ATOM 101 N SER A 10 17.948 1.957 11.059 1.00 0.00 N ATOM 102 CA SER A 10 18.309 1.717 9.647 1.00 0.00 C ATOM 103 C SER A 10 17.612 2.655 8.642 1.00 0.00 C ATOM 104 O SER A 10 17.652 2.409 7.435 1.00 0.00 O ATOM 105 CB SER A 10 18.072 0.242 9.284 1.00 0.00 C ATOM 106 OG SER A 10 18.739 -0.618 10.197 1.00 0.00 O ATOM 0 H SER A 10 17.141 1.410 11.359 1.00 0.00 H new ATOM 0 HA SER A 10 19.370 1.952 9.562 1.00 0.00 H new ATOM 0 HB2 SER A 10 17.003 0.029 9.292 1.00 0.00 H new ATOM 0 HB3 SER A 10 18.428 0.051 8.272 1.00 0.00 H new ATOM 0 HG SER A 10 18.573 -1.551 9.948 1.00 0.00 H new ATOM 112 N GLU A 11 16.952 3.716 9.123 1.00 0.00 N ATOM 113 CA GLU A 11 16.229 4.728 8.325 1.00 0.00 C ATOM 114 C GLU A 11 15.124 4.139 7.409 1.00 0.00 C ATOM 115 O GLU A 11 14.904 4.593 6.283 1.00 0.00 O ATOM 116 CB GLU A 11 17.241 5.659 7.622 1.00 0.00 C ATOM 117 CG GLU A 11 16.678 7.056 7.328 1.00 0.00 C ATOM 118 CD GLU A 11 17.742 7.947 6.657 1.00 0.00 C ATOM 119 OE1 GLU A 11 17.837 7.954 5.405 1.00 0.00 O ATOM 120 OE2 GLU A 11 18.487 8.657 7.376 1.00 0.00 O ATOM 0 H GLU A 11 16.902 3.906 10.124 1.00 0.00 H new ATOM 0 HA GLU A 11 15.647 5.349 9.006 1.00 0.00 H new ATOM 0 HB2 GLU A 11 18.129 5.757 8.247 1.00 0.00 H new ATOM 0 HB3 GLU A 11 17.559 5.199 6.686 1.00 0.00 H new ATOM 0 HG2 GLU A 11 15.806 6.972 6.679 1.00 0.00 H new ATOM 0 HG3 GLU A 11 16.342 7.520 8.255 1.00 0.00 H new ATOM 127 N ARG A 12 14.430 3.099 7.896 1.00 0.00 N ATOM 128 CA ARG A 12 13.311 2.409 7.217 1.00 0.00 C ATOM 129 C ARG A 12 12.250 1.904 8.202 1.00 0.00 C ATOM 130 O ARG A 12 12.523 1.764 9.396 1.00 0.00 O ATOM 131 CB ARG A 12 13.860 1.297 6.306 1.00 0.00 C ATOM 132 CG ARG A 12 14.493 0.120 7.067 1.00 0.00 C ATOM 133 CD ARG A 12 15.490 -0.638 6.184 1.00 0.00 C ATOM 134 NE ARG A 12 16.701 0.172 5.953 1.00 0.00 N ATOM 135 CZ ARG A 12 17.729 -0.095 5.174 1.00 0.00 C ATOM 136 NH1 ARG A 12 17.799 -1.174 4.448 1.00 0.00 N ATOM 137 NH2 ARG A 12 18.718 0.749 5.130 1.00 0.00 N ATOM 0 H ARG A 12 14.638 2.696 8.810 1.00 0.00 H new ATOM 0 HA ARG A 12 12.791 3.132 6.588 1.00 0.00 H new ATOM 0 HB2 ARG A 12 13.050 0.919 5.682 1.00 0.00 H new ATOM 0 HB3 ARG A 12 14.605 1.725 5.636 1.00 0.00 H new ATOM 0 HG2 ARG A 12 15.000 0.490 7.958 1.00 0.00 H new ATOM 0 HG3 ARG A 12 13.712 -0.561 7.405 1.00 0.00 H new ATOM 0 HD2 ARG A 12 15.762 -1.580 6.660 1.00 0.00 H new ATOM 0 HD3 ARG A 12 15.024 -0.885 5.230 1.00 0.00 H new ATOM 0 HE ARG A 12 16.748 1.054 6.463 1.00 0.00 H new ATOM 0 HH11 ARG A 12 17.038 -1.853 4.469 1.00 0.00 H new ATOM 0 HH12 ARG A 12 18.615 -1.340 3.859 1.00 0.00 H new ATOM 0 HH21 ARG A 12 18.688 1.599 5.693 1.00 0.00 H new ATOM 0 HH22 ARG A 12 19.523 0.560 4.533 1.00 0.00 H new ATOM 151 N ASN A 13 11.041 1.648 7.702 1.00 0.00 N ATOM 152 CA ASN A 13 9.852 1.289 8.489 1.00 0.00 C ATOM 153 C ASN A 13 8.950 0.267 7.765 1.00 0.00 C ATOM 154 O ASN A 13 9.047 0.086 6.550 1.00 0.00 O ATOM 155 CB ASN A 13 9.075 2.576 8.831 1.00 0.00 C ATOM 156 CG ASN A 13 8.537 3.281 7.595 1.00 0.00 C ATOM 157 OD1 ASN A 13 7.498 2.928 7.055 1.00 0.00 O ATOM 158 ND2 ASN A 13 9.252 4.267 7.103 1.00 0.00 N ATOM 0 H ASN A 13 10.852 1.685 6.700 1.00 0.00 H new ATOM 0 HA ASN A 13 10.180 0.800 9.406 1.00 0.00 H new ATOM 0 HB2 ASN A 13 8.246 2.330 9.494 1.00 0.00 H new ATOM 0 HB3 ASN A 13 9.729 3.256 9.377 1.00 0.00 H new ATOM 0 HD21 ASN A 13 8.943 4.750 6.259 1.00 0.00 H new ATOM 0 HD22 ASN A 13 10.116 4.550 7.565 1.00 0.00 H new ATOM 165 N GLN A 14 8.059 -0.385 8.522 1.00 0.00 N ATOM 166 CA GLN A 14 7.057 -1.343 8.018 1.00 0.00 C ATOM 167 C GLN A 14 5.650 -1.153 8.635 1.00 0.00 C ATOM 168 O GLN A 14 4.745 -1.952 8.391 1.00 0.00 O ATOM 169 CB GLN A 14 7.572 -2.780 8.221 1.00 0.00 C ATOM 170 CG GLN A 14 8.796 -3.142 7.363 1.00 0.00 C ATOM 171 CD GLN A 14 9.231 -4.604 7.500 1.00 0.00 C ATOM 172 OE1 GLN A 14 8.678 -5.402 8.247 1.00 0.00 O ATOM 173 NE2 GLN A 14 10.253 -5.017 6.780 1.00 0.00 N ATOM 0 H GLN A 14 8.011 -0.259 9.533 1.00 0.00 H new ATOM 0 HA GLN A 14 6.929 -1.147 6.954 1.00 0.00 H new ATOM 0 HB2 GLN A 14 7.827 -2.917 9.272 1.00 0.00 H new ATOM 0 HB3 GLN A 14 6.766 -3.478 7.995 1.00 0.00 H new ATOM 0 HG2 GLN A 14 8.570 -2.936 6.317 1.00 0.00 H new ATOM 0 HG3 GLN A 14 9.629 -2.496 7.642 1.00 0.00 H new ATOM 0 HE21 GLN A 14 10.729 -4.370 6.151 1.00 0.00 H new ATOM 0 HE22 GLN A 14 10.569 -5.984 6.851 1.00 0.00 H new ATOM 182 N ASP A 15 5.447 -0.100 9.431 1.00 0.00 N ATOM 183 CA ASP A 15 4.168 0.291 10.045 1.00 0.00 C ATOM 184 C ASP A 15 3.543 1.521 9.360 1.00 0.00 C ATOM 185 O ASP A 15 2.330 1.560 9.152 1.00 0.00 O ATOM 186 CB ASP A 15 4.375 0.509 11.556 1.00 0.00 C ATOM 187 CG ASP A 15 5.328 1.668 11.921 1.00 0.00 C ATOM 188 OD1 ASP A 15 5.135 2.282 12.995 1.00 0.00 O ATOM 189 OD2 ASP A 15 6.281 1.945 11.153 1.00 0.00 O ATOM 0 H ASP A 15 6.205 0.536 9.679 1.00 0.00 H new ATOM 0 HA ASP A 15 3.451 -0.518 9.902 1.00 0.00 H new ATOM 0 HB2 ASP A 15 3.405 0.696 12.018 1.00 0.00 H new ATOM 0 HB3 ASP A 15 4.763 -0.412 11.991 1.00 0.00 H new ATOM 194 N ALA A 16 4.367 2.489 8.940 1.00 0.00 N ATOM 195 CA ALA A 16 3.970 3.607 8.078 1.00 0.00 C ATOM 196 C ALA A 16 4.039 3.258 6.572 1.00 0.00 C ATOM 197 O ALA A 16 3.640 4.062 5.728 1.00 0.00 O ATOM 198 CB ALA A 16 4.794 4.845 8.454 1.00 0.00 C ATOM 0 H ALA A 16 5.354 2.516 9.197 1.00 0.00 H new ATOM 0 HA ALA A 16 2.917 3.830 8.251 1.00 0.00 H new ATOM 0 HB1 ALA A 16 4.505 5.681 7.818 1.00 0.00 H new ATOM 0 HB2 ALA A 16 4.609 5.102 9.497 1.00 0.00 H new ATOM 0 HB3 ALA A 16 5.854 4.633 8.315 1.00 0.00 H new ATOM 204 N THR A 17 4.493 2.046 6.230 1.00 0.00 N ATOM 205 CA THR A 17 4.415 1.465 4.881 1.00 0.00 C ATOM 206 C THR A 17 3.330 0.390 4.854 1.00 0.00 C ATOM 207 O THR A 17 3.286 -0.476 5.732 1.00 0.00 O ATOM 208 CB THR A 17 5.776 0.916 4.411 1.00 0.00 C ATOM 209 OG1 THR A 17 6.744 1.938 4.448 1.00 0.00 O ATOM 210 CG2 THR A 17 5.763 0.408 2.965 1.00 0.00 C ATOM 0 H THR A 17 4.938 1.423 6.903 1.00 0.00 H new ATOM 0 HA THR A 17 4.147 2.253 4.177 1.00 0.00 H new ATOM 0 HB THR A 17 6.001 0.089 5.085 1.00 0.00 H new ATOM 0 HG1 THR A 17 6.928 2.181 5.379 1.00 0.00 H new ATOM 0 HG21 THR A 17 6.753 0.036 2.701 1.00 0.00 H new ATOM 0 HG22 THR A 17 5.035 -0.398 2.869 1.00 0.00 H new ATOM 0 HG23 THR A 17 5.491 1.224 2.295 1.00 0.00 H new ATOM 218 N VAL A 18 2.455 0.432 3.849 1.00 0.00 N ATOM 219 CA VAL A 18 1.410 -0.574 3.598 1.00 0.00 C ATOM 220 C VAL A 18 1.823 -1.514 2.469 1.00 0.00 C ATOM 221 O VAL A 18 2.530 -1.108 1.548 1.00 0.00 O ATOM 222 CB VAL A 18 0.022 0.051 3.324 1.00 0.00 C ATOM 223 CG1 VAL A 18 -0.357 1.054 4.416 1.00 0.00 C ATOM 224 CG2 VAL A 18 -0.096 0.778 1.981 1.00 0.00 C ATOM 0 H VAL A 18 2.449 1.188 3.164 1.00 0.00 H new ATOM 0 HA VAL A 18 1.308 -1.154 4.516 1.00 0.00 H new ATOM 0 HB VAL A 18 -0.653 -0.805 3.308 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -1.337 1.477 4.197 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -0.388 0.547 5.381 1.00 0.00 H new ATOM 0 HG13 VAL A 18 0.384 1.853 4.449 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -1.102 1.184 1.874 1.00 0.00 H new ATOM 0 HG22 VAL A 18 0.629 1.591 1.942 1.00 0.00 H new ATOM 0 HG23 VAL A 18 0.100 0.077 1.169 1.00 0.00 H new ATOM 234 N TYR A 19 1.353 -2.756 2.527 1.00 0.00 N ATOM 235 CA TYR A 19 1.429 -3.761 1.465 1.00 0.00 C ATOM 236 C TYR A 19 0.124 -3.751 0.656 1.00 0.00 C ATOM 237 O TYR A 19 -0.954 -3.572 1.225 1.00 0.00 O ATOM 238 CB TYR A 19 1.676 -5.133 2.112 1.00 0.00 C ATOM 239 CG TYR A 19 1.415 -6.336 1.220 1.00 0.00 C ATOM 240 CD1 TYR A 19 2.463 -6.924 0.485 1.00 0.00 C ATOM 241 CD2 TYR A 19 0.116 -6.879 1.137 1.00 0.00 C ATOM 242 CE1 TYR A 19 2.218 -8.056 -0.318 1.00 0.00 C ATOM 243 CE2 TYR A 19 -0.137 -7.998 0.324 1.00 0.00 C ATOM 244 CZ TYR A 19 0.915 -8.592 -0.406 1.00 0.00 C ATOM 245 OH TYR A 19 0.667 -9.681 -1.184 1.00 0.00 O ATOM 0 H TYR A 19 0.883 -3.110 3.360 1.00 0.00 H new ATOM 0 HA TYR A 19 2.248 -3.540 0.780 1.00 0.00 H new ATOM 0 HB2 TYR A 19 2.711 -5.173 2.452 1.00 0.00 H new ATOM 0 HB3 TYR A 19 1.046 -5.216 2.997 1.00 0.00 H new ATOM 0 HD1 TYR A 19 3.457 -6.506 0.537 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -0.689 -6.433 1.701 1.00 0.00 H new ATOM 0 HE1 TYR A 19 3.028 -8.514 -0.867 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -1.136 -8.403 0.258 1.00 0.00 H new ATOM 0 HH TYR A 19 -0.283 -9.915 -1.126 1.00 0.00 H new ATOM 255 N VAL A 20 0.220 -3.984 -0.655 1.00 0.00 N ATOM 256 CA VAL A 20 -0.911 -4.121 -1.586 1.00 0.00 C ATOM 257 C VAL A 20 -0.708 -5.366 -2.449 1.00 0.00 C ATOM 258 O VAL A 20 0.202 -5.401 -3.274 1.00 0.00 O ATOM 259 CB VAL A 20 -1.062 -2.880 -2.486 1.00 0.00 C ATOM 260 CG1 VAL A 20 -2.353 -3.013 -3.300 1.00 0.00 C ATOM 261 CG2 VAL A 20 -1.116 -1.565 -1.696 1.00 0.00 C ATOM 0 H VAL A 20 1.122 -4.087 -1.119 1.00 0.00 H new ATOM 0 HA VAL A 20 -1.825 -4.217 -0.999 1.00 0.00 H new ATOM 0 HB VAL A 20 -0.181 -2.840 -3.127 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -2.470 -2.139 -3.941 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -2.304 -3.911 -3.916 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -3.204 -3.083 -2.623 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -1.223 -0.729 -2.388 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -1.967 -1.584 -1.015 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -0.196 -1.447 -1.123 1.00 0.00 H new ATOM 271 N GLY A 21 -1.559 -6.378 -2.291 1.00 0.00 N ATOM 272 CA GLY A 21 -1.526 -7.622 -3.068 1.00 0.00 C ATOM 273 C GLY A 21 -2.687 -7.750 -4.057 1.00 0.00 C ATOM 274 O GLY A 21 -3.788 -7.264 -3.799 1.00 0.00 O ATOM 0 H GLY A 21 -2.311 -6.358 -1.602 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -0.585 -7.676 -3.615 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -1.546 -8.470 -2.384 1.00 0.00 H new ATOM 278 N GLY A 22 -2.447 -8.434 -5.177 1.00 0.00 N ATOM 279 CA GLY A 22 -3.456 -8.743 -6.203 1.00 0.00 C ATOM 280 C GLY A 22 -3.522 -7.712 -7.336 1.00 0.00 C ATOM 281 O GLY A 22 -4.605 -7.407 -7.838 1.00 0.00 O ATOM 0 H GLY A 22 -1.523 -8.800 -5.406 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -3.240 -9.723 -6.628 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -4.435 -8.810 -5.728 1.00 0.00 H new ATOM 285 N LEU A 23 -2.374 -7.139 -7.707 1.00 0.00 N ATOM 286 CA LEU A 23 -2.251 -6.026 -8.647 1.00 0.00 C ATOM 287 C LEU A 23 -2.252 -6.502 -10.104 1.00 0.00 C ATOM 288 O LEU A 23 -1.697 -7.552 -10.436 1.00 0.00 O ATOM 289 CB LEU A 23 -0.977 -5.226 -8.323 1.00 0.00 C ATOM 290 CG LEU A 23 -0.996 -4.545 -6.941 1.00 0.00 C ATOM 291 CD1 LEU A 23 0.311 -3.794 -6.722 1.00 0.00 C ATOM 292 CD2 LEU A 23 -2.155 -3.557 -6.824 1.00 0.00 C ATOM 0 H LEU A 23 -1.472 -7.450 -7.346 1.00 0.00 H new ATOM 0 HA LEU A 23 -3.121 -5.380 -8.533 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -0.118 -5.895 -8.375 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -0.834 -4.464 -9.090 1.00 0.00 H new ATOM 0 HG LEU A 23 -1.120 -5.322 -6.187 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.295 -3.313 -5.744 1.00 0.00 H new ATOM 0 HD12 LEU A 23 1.145 -4.494 -6.769 1.00 0.00 H new ATOM 0 HD13 LEU A 23 0.430 -3.036 -7.497 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -2.140 -3.094 -5.837 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -2.055 -2.786 -7.588 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -3.099 -4.085 -6.963 1.00 0.00 H new ATOM 304 N ASP A 24 -2.847 -5.697 -10.982 1.00 0.00 N ATOM 305 CA ASP A 24 -2.909 -5.960 -12.420 1.00 0.00 C ATOM 306 C ASP A 24 -1.628 -5.515 -13.156 1.00 0.00 C ATOM 307 O ASP A 24 -0.911 -4.625 -12.697 1.00 0.00 O ATOM 308 CB ASP A 24 -4.160 -5.274 -12.991 1.00 0.00 C ATOM 309 CG ASP A 24 -4.341 -5.573 -14.478 1.00 0.00 C ATOM 310 OD1 ASP A 24 -4.826 -6.678 -14.811 1.00 0.00 O ATOM 311 OD2 ASP A 24 -3.958 -4.720 -15.309 1.00 0.00 O ATOM 0 H ASP A 24 -3.308 -4.828 -10.710 1.00 0.00 H new ATOM 0 HA ASP A 24 -2.978 -7.036 -12.578 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -5.041 -5.609 -12.443 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -4.083 -4.197 -12.843 1.00 0.00 H new ATOM 316 N GLU A 25 -1.343 -6.083 -14.331 1.00 0.00 N ATOM 317 CA GLU A 25 -0.173 -5.731 -15.155 1.00 0.00 C ATOM 318 C GLU A 25 -0.101 -4.244 -15.571 1.00 0.00 C ATOM 319 O GLU A 25 0.990 -3.747 -15.864 1.00 0.00 O ATOM 320 CB GLU A 25 -0.107 -6.657 -16.385 1.00 0.00 C ATOM 321 CG GLU A 25 -1.281 -6.495 -17.363 1.00 0.00 C ATOM 322 CD GLU A 25 -1.133 -7.453 -18.560 1.00 0.00 C ATOM 323 OE1 GLU A 25 -1.616 -8.610 -18.484 1.00 0.00 O ATOM 324 OE2 GLU A 25 -0.538 -7.057 -19.593 1.00 0.00 O ATOM 0 H GLU A 25 -1.924 -6.811 -14.747 1.00 0.00 H new ATOM 0 HA GLU A 25 0.702 -5.883 -14.524 1.00 0.00 H new ATOM 0 HB2 GLU A 25 0.824 -6.467 -16.919 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -0.073 -7.692 -16.045 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -2.220 -6.694 -16.847 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -1.324 -5.466 -17.719 1.00 0.00 H new ATOM 331 N LYS A 26 -1.227 -3.512 -15.558 1.00 0.00 N ATOM 332 CA LYS A 26 -1.284 -2.059 -15.818 1.00 0.00 C ATOM 333 C LYS A 26 -0.878 -1.185 -14.617 1.00 0.00 C ATOM 334 O LYS A 26 -0.644 0.012 -14.791 1.00 0.00 O ATOM 335 CB LYS A 26 -2.689 -1.689 -16.326 1.00 0.00 C ATOM 336 CG LYS A 26 -2.982 -2.324 -17.697 1.00 0.00 C ATOM 337 CD LYS A 26 -4.350 -1.919 -18.268 1.00 0.00 C ATOM 338 CE LYS A 26 -5.556 -2.363 -17.426 1.00 0.00 C ATOM 339 NZ LYS A 26 -5.643 -3.840 -17.297 1.00 0.00 N ATOM 0 H LYS A 26 -2.142 -3.919 -15.363 1.00 0.00 H new ATOM 0 HA LYS A 26 -0.538 -1.844 -16.583 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -3.436 -2.020 -15.604 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -2.776 -0.605 -16.401 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -2.201 -2.034 -18.400 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -2.940 -3.409 -17.605 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -4.378 -0.834 -18.373 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -4.449 -2.339 -19.269 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -5.486 -1.918 -16.434 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -6.472 -1.986 -17.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -6.634 -4.118 -17.148 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -5.285 -4.286 -18.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -5.071 -4.152 -16.487 1.00 0.00 H new ATOM 353 N VAL A 27 -0.776 -1.753 -13.411 1.00 0.00 N ATOM 354 CA VAL A 27 -0.388 -1.035 -12.180 1.00 0.00 C ATOM 355 C VAL A 27 1.120 -0.749 -12.153 1.00 0.00 C ATOM 356 O VAL A 27 1.926 -1.620 -12.488 1.00 0.00 O ATOM 357 CB VAL A 27 -0.817 -1.821 -10.922 1.00 0.00 C ATOM 358 CG1 VAL A 27 -0.441 -1.090 -9.630 1.00 0.00 C ATOM 359 CG2 VAL A 27 -2.335 -2.043 -10.896 1.00 0.00 C ATOM 0 H VAL A 27 -0.963 -2.743 -13.254 1.00 0.00 H new ATOM 0 HA VAL A 27 -0.911 -0.078 -12.179 1.00 0.00 H new ATOM 0 HB VAL A 27 -0.290 -2.774 -10.974 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -0.762 -1.680 -8.772 1.00 0.00 H new ATOM 0 HG12 VAL A 27 0.640 -0.952 -9.591 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -0.932 -0.117 -9.606 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -2.606 -2.599 -9.999 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -2.844 -1.079 -10.893 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -2.635 -2.609 -11.778 1.00 0.00 H new ATOM 369 N SER A 28 1.509 0.453 -11.713 1.00 0.00 N ATOM 370 CA SER A 28 2.917 0.833 -11.489 1.00 0.00 C ATOM 371 C SER A 28 3.080 1.766 -10.278 1.00 0.00 C ATOM 372 O SER A 28 2.103 2.310 -9.767 1.00 0.00 O ATOM 373 CB SER A 28 3.480 1.466 -12.768 1.00 0.00 C ATOM 374 OG SER A 28 4.892 1.572 -12.685 1.00 0.00 O ATOM 0 H SER A 28 0.850 1.202 -11.499 1.00 0.00 H new ATOM 0 HA SER A 28 3.486 -0.067 -11.255 1.00 0.00 H new ATOM 0 HB2 SER A 28 3.204 0.862 -13.632 1.00 0.00 H new ATOM 0 HB3 SER A 28 3.043 2.453 -12.916 1.00 0.00 H new ATOM 0 HG SER A 28 5.239 1.976 -13.508 1.00 0.00 H new ATOM 380 N GLU A 29 4.309 1.977 -9.807 1.00 0.00 N ATOM 381 CA GLU A 29 4.620 2.831 -8.646 1.00 0.00 C ATOM 382 C GLU A 29 4.060 4.271 -8.751 1.00 0.00 C ATOM 383 O GLU A 29 3.447 4.721 -7.777 1.00 0.00 O ATOM 384 CB GLU A 29 6.148 2.847 -8.423 1.00 0.00 C ATOM 385 CG GLU A 29 6.643 1.607 -7.671 1.00 0.00 C ATOM 386 CD GLU A 29 8.048 1.169 -8.128 1.00 0.00 C ATOM 387 OE1 GLU A 29 8.179 0.599 -9.240 1.00 0.00 O ATOM 388 OE2 GLU A 29 9.023 1.351 -7.364 1.00 0.00 O ATOM 0 H GLU A 29 5.137 1.554 -10.226 1.00 0.00 H new ATOM 0 HA GLU A 29 4.115 2.394 -7.785 1.00 0.00 H new ATOM 0 HB2 GLU A 29 6.652 2.909 -9.387 1.00 0.00 H new ATOM 0 HB3 GLU A 29 6.421 3.741 -7.863 1.00 0.00 H new ATOM 0 HG2 GLU A 29 6.660 1.816 -6.601 1.00 0.00 H new ATOM 0 HG3 GLU A 29 5.941 0.787 -7.825 1.00 0.00 H new ATOM 395 N PRO A 30 4.152 4.985 -9.897 1.00 0.00 N ATOM 396 CA PRO A 30 3.544 6.311 -10.043 1.00 0.00 C ATOM 397 C PRO A 30 2.014 6.299 -9.918 1.00 0.00 C ATOM 398 O PRO A 30 1.437 7.274 -9.432 1.00 0.00 O ATOM 399 CB PRO A 30 3.978 6.827 -11.420 1.00 0.00 C ATOM 400 CG PRO A 30 5.258 6.047 -11.707 1.00 0.00 C ATOM 401 CD PRO A 30 4.946 4.691 -11.083 1.00 0.00 C ATOM 0 HA PRO A 30 3.881 6.960 -9.235 1.00 0.00 H new ATOM 0 HB2 PRO A 30 3.216 6.640 -12.177 1.00 0.00 H new ATOM 0 HB3 PRO A 30 4.158 7.902 -11.407 1.00 0.00 H new ATOM 0 HG2 PRO A 30 5.458 5.969 -12.776 1.00 0.00 H new ATOM 0 HG3 PRO A 30 6.132 6.514 -11.253 1.00 0.00 H new ATOM 0 HD2 PRO A 30 4.395 4.056 -11.777 1.00 0.00 H new ATOM 0 HD3 PRO A 30 5.861 4.159 -10.822 1.00 0.00 H new ATOM 409 N LEU A 31 1.354 5.194 -10.302 1.00 0.00 N ATOM 410 CA LEU A 31 -0.083 5.017 -10.088 1.00 0.00 C ATOM 411 C LEU A 31 -0.370 4.896 -8.596 1.00 0.00 C ATOM 412 O LEU A 31 -1.167 5.667 -8.071 1.00 0.00 O ATOM 413 CB LEU A 31 -0.608 3.776 -10.834 1.00 0.00 C ATOM 414 CG LEU A 31 -2.136 3.598 -10.731 1.00 0.00 C ATOM 415 CD1 LEU A 31 -2.844 4.597 -11.635 1.00 0.00 C ATOM 416 CD2 LEU A 31 -2.503 2.194 -11.197 1.00 0.00 C ATOM 0 H LEU A 31 1.803 4.405 -10.767 1.00 0.00 H new ATOM 0 HA LEU A 31 -0.600 5.890 -10.486 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -0.329 3.848 -11.885 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -0.119 2.888 -10.435 1.00 0.00 H new ATOM 0 HG LEU A 31 -2.441 3.758 -9.697 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -3.922 4.461 -11.553 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -2.582 5.611 -11.332 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -2.535 4.436 -12.668 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -3.582 2.058 -11.128 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -2.186 2.059 -12.231 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -2.004 1.459 -10.566 1.00 0.00 H new ATOM 428 N LEU A 32 0.298 3.957 -7.912 1.00 0.00 N ATOM 429 CA LEU A 32 0.056 3.690 -6.494 1.00 0.00 C ATOM 430 C LEU A 32 0.230 4.947 -5.644 1.00 0.00 C ATOM 431 O LEU A 32 -0.600 5.216 -4.783 1.00 0.00 O ATOM 432 CB LEU A 32 0.992 2.591 -5.960 1.00 0.00 C ATOM 433 CG LEU A 32 0.845 1.206 -6.601 1.00 0.00 C ATOM 434 CD1 LEU A 32 1.606 0.169 -5.778 1.00 0.00 C ATOM 435 CD2 LEU A 32 -0.612 0.763 -6.666 1.00 0.00 C ATOM 0 H LEU A 32 1.018 3.365 -8.327 1.00 0.00 H new ATOM 0 HA LEU A 32 -0.977 3.351 -6.417 1.00 0.00 H new ATOM 0 HB2 LEU A 32 2.022 2.923 -6.094 1.00 0.00 H new ATOM 0 HB3 LEU A 32 0.826 2.491 -4.887 1.00 0.00 H new ATOM 0 HG LEU A 32 1.245 1.279 -7.612 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.497 -0.813 -6.239 1.00 0.00 H new ATOM 0 HD12 LEU A 32 2.662 0.437 -5.741 1.00 0.00 H new ATOM 0 HD13 LEU A 32 1.203 0.141 -4.766 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -0.672 -0.223 -7.127 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -1.024 0.718 -5.658 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -1.183 1.477 -7.260 1.00 0.00 H new ATOM 447 N TRP A 33 1.261 5.744 -5.922 1.00 0.00 N ATOM 448 CA TRP A 33 1.529 6.985 -5.202 1.00 0.00 C ATOM 449 C TRP A 33 0.340 7.944 -5.287 1.00 0.00 C ATOM 450 O TRP A 33 -0.286 8.257 -4.275 1.00 0.00 O ATOM 451 CB TRP A 33 2.810 7.611 -5.766 1.00 0.00 C ATOM 452 CG TRP A 33 3.472 8.672 -4.945 1.00 0.00 C ATOM 453 CD1 TRP A 33 2.887 9.691 -4.271 1.00 0.00 C ATOM 454 CD2 TRP A 33 4.901 8.823 -4.724 1.00 0.00 C ATOM 455 NE1 TRP A 33 3.859 10.442 -3.633 1.00 0.00 N ATOM 456 CE2 TRP A 33 5.124 9.958 -3.891 1.00 0.00 C ATOM 457 CE3 TRP A 33 6.030 8.103 -5.161 1.00 0.00 C ATOM 458 CZ2 TRP A 33 6.412 10.361 -3.511 1.00 0.00 C ATOM 459 CZ3 TRP A 33 7.330 8.497 -4.788 1.00 0.00 C ATOM 460 CH2 TRP A 33 7.521 9.625 -3.967 1.00 0.00 C ATOM 0 H TRP A 33 1.938 5.544 -6.659 1.00 0.00 H new ATOM 0 HA TRP A 33 1.674 6.771 -4.143 1.00 0.00 H new ATOM 0 HB2 TRP A 33 3.532 6.812 -5.931 1.00 0.00 H new ATOM 0 HB3 TRP A 33 2.577 8.036 -6.742 1.00 0.00 H new ATOM 0 HD1 TRP A 33 1.826 9.887 -4.237 1.00 0.00 H new ATOM 0 HE1 TRP A 33 3.664 11.252 -3.045 1.00 0.00 H new ATOM 0 HE3 TRP A 33 5.897 7.236 -5.791 1.00 0.00 H new ATOM 0 HZ2 TRP A 33 6.551 11.224 -2.877 1.00 0.00 H new ATOM 0 HZ3 TRP A 33 8.183 7.932 -5.133 1.00 0.00 H new ATOM 0 HH2 TRP A 33 8.520 9.925 -3.687 1.00 0.00 H new ATOM 471 N GLU A 34 -0.009 8.373 -6.501 1.00 0.00 N ATOM 472 CA GLU A 34 -1.098 9.331 -6.742 1.00 0.00 C ATOM 473 C GLU A 34 -2.487 8.798 -6.353 1.00 0.00 C ATOM 474 O GLU A 34 -3.350 9.571 -5.935 1.00 0.00 O ATOM 475 CB GLU A 34 -1.097 9.759 -8.217 1.00 0.00 C ATOM 476 CG GLU A 34 0.157 10.568 -8.565 1.00 0.00 C ATOM 477 CD GLU A 34 0.010 11.268 -9.930 1.00 0.00 C ATOM 478 OE1 GLU A 34 -0.459 12.433 -9.970 1.00 0.00 O ATOM 479 OE2 GLU A 34 0.365 10.671 -10.976 1.00 0.00 O ATOM 0 H GLU A 34 0.458 8.065 -7.354 1.00 0.00 H new ATOM 0 HA GLU A 34 -0.905 10.187 -6.095 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -1.150 8.876 -8.853 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -1.985 10.355 -8.425 1.00 0.00 H new ATOM 0 HG2 GLU A 34 0.339 11.312 -7.790 1.00 0.00 H new ATOM 0 HG3 GLU A 34 1.025 9.908 -8.584 1.00 0.00 H new ATOM 486 N LEU A 35 -2.702 7.482 -6.439 1.00 0.00 N ATOM 487 CA LEU A 35 -3.947 6.825 -6.026 1.00 0.00 C ATOM 488 C LEU A 35 -4.119 6.821 -4.495 1.00 0.00 C ATOM 489 O LEU A 35 -5.236 6.979 -4.004 1.00 0.00 O ATOM 490 CB LEU A 35 -3.964 5.390 -6.592 1.00 0.00 C ATOM 491 CG LEU A 35 -5.358 4.754 -6.661 1.00 0.00 C ATOM 492 CD1 LEU A 35 -6.152 5.244 -7.872 1.00 0.00 C ATOM 493 CD2 LEU A 35 -5.250 3.232 -6.707 1.00 0.00 C ATOM 0 H LEU A 35 -2.005 6.832 -6.803 1.00 0.00 H new ATOM 0 HA LEU A 35 -4.790 7.388 -6.427 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -3.533 5.402 -7.593 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -3.321 4.761 -5.976 1.00 0.00 H new ATOM 0 HG LEU A 35 -5.891 5.057 -5.760 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -7.132 4.768 -7.881 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -6.274 6.326 -7.814 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -5.616 4.988 -8.786 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -6.249 2.798 -6.756 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -4.681 2.934 -7.588 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -4.743 2.876 -5.810 1.00 0.00 H new ATOM 505 N PHE A 36 -3.032 6.666 -3.732 1.00 0.00 N ATOM 506 CA PHE A 36 -3.042 6.551 -2.266 1.00 0.00 C ATOM 507 C PHE A 36 -2.952 7.907 -1.543 1.00 0.00 C ATOM 508 O PHE A 36 -3.258 7.978 -0.352 1.00 0.00 O ATOM 509 CB PHE A 36 -1.950 5.565 -1.827 1.00 0.00 C ATOM 510 CG PHE A 36 -2.352 4.093 -1.861 1.00 0.00 C ATOM 511 CD1 PHE A 36 -2.418 3.349 -0.667 1.00 0.00 C ATOM 512 CD2 PHE A 36 -2.648 3.449 -3.079 1.00 0.00 C ATOM 513 CE1 PHE A 36 -2.807 1.997 -0.686 1.00 0.00 C ATOM 514 CE2 PHE A 36 -3.011 2.091 -3.106 1.00 0.00 C ATOM 515 CZ PHE A 36 -3.112 1.370 -1.905 1.00 0.00 C ATOM 0 H PHE A 36 -2.093 6.615 -4.127 1.00 0.00 H new ATOM 0 HA PHE A 36 -4.012 6.155 -1.965 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -1.080 5.702 -2.469 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -1.641 5.818 -0.813 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -2.168 3.821 0.272 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -2.595 4.005 -4.003 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -2.871 1.441 0.238 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -3.212 1.603 -4.048 1.00 0.00 H new ATOM 0 HZ PHE A 36 -3.423 0.336 -1.919 1.00 0.00 H new ATOM 525 N LEU A 37 -2.654 9.000 -2.262 1.00 0.00 N ATOM 526 CA LEU A 37 -2.754 10.383 -1.756 1.00 0.00 C ATOM 527 C LEU A 37 -4.138 10.739 -1.166 1.00 0.00 C ATOM 528 O LEU A 37 -4.257 11.666 -0.365 1.00 0.00 O ATOM 529 CB LEU A 37 -2.420 11.365 -2.897 1.00 0.00 C ATOM 530 CG LEU A 37 -0.931 11.525 -3.243 1.00 0.00 C ATOM 531 CD1 LEU A 37 -0.769 12.565 -4.351 1.00 0.00 C ATOM 532 CD2 LEU A 37 -0.101 11.979 -2.044 1.00 0.00 C ATOM 0 H LEU A 37 -2.331 8.950 -3.228 1.00 0.00 H new ATOM 0 HA LEU A 37 -2.040 10.465 -0.936 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -2.947 11.039 -3.794 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -2.817 12.345 -2.632 1.00 0.00 H new ATOM 0 HG LEU A 37 -0.573 10.546 -3.562 1.00 0.00 H new ATOM 0 HD11 LEU A 37 0.288 12.676 -4.594 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -1.313 12.240 -5.238 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -1.166 13.522 -4.013 1.00 0.00 H new ATOM 0 HD21 LEU A 37 0.943 12.077 -2.341 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -0.470 12.942 -1.690 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -0.184 11.243 -1.245 1.00 0.00 H new ATOM 544 N GLN A 38 -5.179 9.990 -1.540 1.00 0.00 N ATOM 545 CA GLN A 38 -6.547 10.111 -1.011 1.00 0.00 C ATOM 546 C GLN A 38 -6.636 9.776 0.486 1.00 0.00 C ATOM 547 O GLN A 38 -7.457 10.353 1.202 1.00 0.00 O ATOM 548 CB GLN A 38 -7.491 9.173 -1.784 1.00 0.00 C ATOM 549 CG GLN A 38 -7.436 9.412 -3.296 1.00 0.00 C ATOM 550 CD GLN A 38 -8.432 8.537 -4.052 1.00 0.00 C ATOM 551 OE1 GLN A 38 -9.588 8.886 -4.254 1.00 0.00 O ATOM 552 NE2 GLN A 38 -8.026 7.363 -4.485 1.00 0.00 N ATOM 0 H GLN A 38 -5.093 9.256 -2.243 1.00 0.00 H new ATOM 0 HA GLN A 38 -6.843 11.152 -1.140 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -7.225 8.137 -1.572 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -8.512 9.318 -1.432 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -7.645 10.461 -3.505 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -6.428 9.209 -3.658 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -7.065 7.064 -4.321 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -8.672 6.752 -4.984 1.00 0.00 H new ATOM 561 N ALA A 39 -5.794 8.853 0.962 1.00 0.00 N ATOM 562 CA ALA A 39 -5.722 8.476 2.375 1.00 0.00 C ATOM 563 C ALA A 39 -4.915 9.479 3.216 1.00 0.00 C ATOM 564 O ALA A 39 -5.338 9.863 4.308 1.00 0.00 O ATOM 565 CB ALA A 39 -5.107 7.081 2.476 1.00 0.00 C ATOM 0 H ALA A 39 -5.138 8.343 0.371 1.00 0.00 H new ATOM 0 HA ALA A 39 -6.734 8.480 2.781 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -5.046 6.785 3.523 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.729 6.369 1.933 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -4.107 7.092 2.044 1.00 0.00 H new ATOM 571 N GLY A 40 -3.760 9.906 2.700 1.00 0.00 N ATOM 572 CA GLY A 40 -2.857 10.849 3.359 1.00 0.00 C ATOM 573 C GLY A 40 -1.596 11.151 2.535 1.00 0.00 C ATOM 574 O GLY A 40 -1.491 10.714 1.388 1.00 0.00 O ATOM 0 H GLY A 40 -3.420 9.597 1.789 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -3.390 11.780 3.551 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -2.563 10.445 4.328 1.00 0.00 H new ATOM 578 N PRO A 41 -0.622 11.887 3.097 1.00 0.00 N ATOM 579 CA PRO A 41 0.614 12.257 2.410 1.00 0.00 C ATOM 580 C PRO A 41 1.507 11.033 2.150 1.00 0.00 C ATOM 581 O PRO A 41 2.104 10.466 3.071 1.00 0.00 O ATOM 582 CB PRO A 41 1.281 13.301 3.315 1.00 0.00 C ATOM 583 CG PRO A 41 0.755 12.952 4.707 1.00 0.00 C ATOM 584 CD PRO A 41 -0.665 12.465 4.429 1.00 0.00 C ATOM 0 HA PRO A 41 0.425 12.668 1.418 1.00 0.00 H new ATOM 0 HB2 PRO A 41 2.368 13.237 3.269 1.00 0.00 H new ATOM 0 HB3 PRO A 41 1.009 14.316 3.026 1.00 0.00 H new ATOM 0 HG2 PRO A 41 1.359 12.181 5.185 1.00 0.00 H new ATOM 0 HG3 PRO A 41 0.762 13.818 5.369 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -0.979 11.727 5.167 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -1.379 13.287 4.477 1.00 0.00 H new ATOM 592 N VAL A 42 1.610 10.642 0.876 1.00 0.00 N ATOM 593 CA VAL A 42 2.502 9.577 0.392 1.00 0.00 C ATOM 594 C VAL A 42 3.900 10.147 0.138 1.00 0.00 C ATOM 595 O VAL A 42 4.057 11.202 -0.482 1.00 0.00 O ATOM 596 CB VAL A 42 1.948 8.887 -0.870 1.00 0.00 C ATOM 597 CG1 VAL A 42 2.894 7.788 -1.371 1.00 0.00 C ATOM 598 CG2 VAL A 42 0.583 8.237 -0.613 1.00 0.00 C ATOM 0 H VAL A 42 1.061 11.068 0.130 1.00 0.00 H new ATOM 0 HA VAL A 42 2.564 8.812 1.166 1.00 0.00 H new ATOM 0 HB VAL A 42 1.850 9.673 -1.619 1.00 0.00 H new ATOM 0 HG11 VAL A 42 2.472 7.323 -2.262 1.00 0.00 H new ATOM 0 HG12 VAL A 42 3.863 8.225 -1.614 1.00 0.00 H new ATOM 0 HG13 VAL A 42 3.020 7.035 -0.594 1.00 0.00 H new ATOM 0 HG21 VAL A 42 0.228 7.762 -1.528 1.00 0.00 H new ATOM 0 HG22 VAL A 42 0.679 7.487 0.172 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -0.130 9.000 -0.300 1.00 0.00 H new ATOM 608 N VAL A 43 4.914 9.431 0.620 1.00 0.00 N ATOM 609 CA VAL A 43 6.330 9.844 0.660 1.00 0.00 C ATOM 610 C VAL A 43 7.188 9.044 -0.324 1.00 0.00 C ATOM 611 O VAL A 43 8.168 9.563 -0.860 1.00 0.00 O ATOM 612 CB VAL A 43 6.889 9.657 2.090 1.00 0.00 C ATOM 613 CG1 VAL A 43 8.224 10.377 2.302 1.00 0.00 C ATOM 614 CG2 VAL A 43 5.939 10.183 3.167 1.00 0.00 C ATOM 0 H VAL A 43 4.772 8.501 1.014 1.00 0.00 H new ATOM 0 HA VAL A 43 6.373 10.894 0.370 1.00 0.00 H new ATOM 0 HB VAL A 43 7.017 8.579 2.184 1.00 0.00 H new ATOM 0 HG11 VAL A 43 8.569 10.211 3.323 1.00 0.00 H new ATOM 0 HG12 VAL A 43 8.963 9.987 1.602 1.00 0.00 H new ATOM 0 HG13 VAL A 43 8.092 11.446 2.133 1.00 0.00 H new ATOM 0 HG21 VAL A 43 6.382 10.026 4.151 1.00 0.00 H new ATOM 0 HG22 VAL A 43 5.767 11.248 3.012 1.00 0.00 H new ATOM 0 HG23 VAL A 43 4.990 9.650 3.107 1.00 0.00 H new ATOM 624 N ASN A 44 6.841 7.769 -0.529 1.00 0.00 N ATOM 625 CA ASN A 44 7.588 6.791 -1.325 1.00 0.00 C ATOM 626 C ASN A 44 6.681 5.604 -1.737 1.00 0.00 C ATOM 627 O ASN A 44 5.621 5.379 -1.147 1.00 0.00 O ATOM 628 CB ASN A 44 8.812 6.377 -0.473 1.00 0.00 C ATOM 629 CG ASN A 44 9.604 5.204 -1.019 1.00 0.00 C ATOM 630 OD1 ASN A 44 10.010 5.187 -2.172 1.00 0.00 O ATOM 631 ND2 ASN A 44 9.836 4.194 -0.213 1.00 0.00 N ATOM 0 H ASN A 44 5.992 7.373 -0.125 1.00 0.00 H new ATOM 0 HA ASN A 44 7.935 7.209 -2.270 1.00 0.00 H new ATOM 0 HB2 ASN A 44 9.478 7.235 -0.380 1.00 0.00 H new ATOM 0 HB3 ASN A 44 8.470 6.129 0.532 1.00 0.00 H new ATOM 0 HD21 ASN A 44 10.360 3.385 -0.547 1.00 0.00 H new ATOM 0 HD22 ASN A 44 9.493 4.218 0.747 1.00 0.00 H new ATOM 638 N THR A 45 7.105 4.820 -2.730 1.00 0.00 N ATOM 639 CA THR A 45 6.448 3.589 -3.219 1.00 0.00 C ATOM 640 C THR A 45 7.478 2.503 -3.553 1.00 0.00 C ATOM 641 O THR A 45 8.632 2.809 -3.858 1.00 0.00 O ATOM 642 CB THR A 45 5.605 3.838 -4.485 1.00 0.00 C ATOM 643 OG1 THR A 45 6.265 4.695 -5.394 1.00 0.00 O ATOM 644 CG2 THR A 45 4.241 4.444 -4.182 1.00 0.00 C ATOM 0 H THR A 45 7.959 5.030 -3.247 1.00 0.00 H new ATOM 0 HA THR A 45 5.797 3.262 -2.408 1.00 0.00 H new ATOM 0 HB THR A 45 5.466 2.851 -4.926 1.00 0.00 H new ATOM 0 HG1 THR A 45 7.231 4.534 -5.353 1.00 0.00 H new ATOM 0 HG21 THR A 45 3.695 4.596 -5.113 1.00 0.00 H new ATOM 0 HG22 THR A 45 3.678 3.769 -3.537 1.00 0.00 H new ATOM 0 HG23 THR A 45 4.372 5.402 -3.678 1.00 0.00 H new ATOM 652 N HIS A 46 7.059 1.234 -3.546 1.00 0.00 N ATOM 653 CA HIS A 46 7.873 0.101 -4.008 1.00 0.00 C ATOM 654 C HIS A 46 7.016 -0.925 -4.758 1.00 0.00 C ATOM 655 O HIS A 46 5.887 -1.194 -4.356 1.00 0.00 O ATOM 656 CB HIS A 46 8.584 -0.551 -2.808 1.00 0.00 C ATOM 657 CG HIS A 46 9.591 -1.611 -3.192 1.00 0.00 C ATOM 658 ND1 HIS A 46 10.325 -1.656 -4.383 1.00 0.00 N ATOM 659 CD2 HIS A 46 9.928 -2.691 -2.430 1.00 0.00 C ATOM 660 CE1 HIS A 46 11.090 -2.757 -4.306 1.00 0.00 C ATOM 661 NE2 HIS A 46 10.876 -3.395 -3.142 1.00 0.00 N ATOM 0 H HIS A 46 6.134 0.959 -3.216 1.00 0.00 H new ATOM 0 HA HIS A 46 8.624 0.472 -4.705 1.00 0.00 H new ATOM 0 HB2 HIS A 46 9.090 0.225 -2.233 1.00 0.00 H new ATOM 0 HB3 HIS A 46 7.835 -0.996 -2.153 1.00 0.00 H new ATOM 0 HD2 HIS A 46 9.530 -2.945 -1.459 1.00 0.00 H new ATOM 0 HE1 HIS A 46 11.779 -3.084 -5.071 1.00 0.00 H new ATOM 0 HE2 HIS A 46 11.336 -4.253 -2.838 1.00 0.00 H new ATOM 669 N MET A 47 7.546 -1.530 -5.819 1.00 0.00 N ATOM 670 CA MET A 47 6.945 -2.665 -6.533 1.00 0.00 C ATOM 671 C MET A 47 8.062 -3.652 -6.899 1.00 0.00 C ATOM 672 O MET A 47 8.806 -3.380 -7.846 1.00 0.00 O ATOM 673 CB MET A 47 6.209 -2.181 -7.799 1.00 0.00 C ATOM 674 CG MET A 47 4.828 -1.579 -7.506 1.00 0.00 C ATOM 675 SD MET A 47 3.489 -2.782 -7.447 1.00 0.00 S ATOM 676 CE MET A 47 3.064 -2.837 -9.196 1.00 0.00 C ATOM 0 H MET A 47 8.436 -1.237 -6.222 1.00 0.00 H new ATOM 0 HA MET A 47 6.211 -3.158 -5.895 1.00 0.00 H new ATOM 0 HB2 MET A 47 6.823 -1.436 -8.305 1.00 0.00 H new ATOM 0 HB3 MET A 47 6.094 -3.019 -8.487 1.00 0.00 H new ATOM 0 HG2 MET A 47 4.870 -1.053 -6.552 1.00 0.00 H new ATOM 0 HG3 MET A 47 4.599 -0.836 -8.270 1.00 0.00 H new ATOM 0 HE1 MET A 47 2.319 -3.614 -9.365 1.00 0.00 H new ATOM 0 HE2 MET A 47 2.658 -1.873 -9.502 1.00 0.00 H new ATOM 0 HE3 MET A 47 3.957 -3.057 -9.781 1.00 0.00 H new ATOM 686 N PRO A 48 8.220 -4.780 -6.180 1.00 0.00 N ATOM 687 CA PRO A 48 9.221 -5.798 -6.500 1.00 0.00 C ATOM 688 C PRO A 48 9.087 -6.331 -7.935 1.00 0.00 C ATOM 689 O PRO A 48 7.982 -6.657 -8.383 1.00 0.00 O ATOM 690 CB PRO A 48 9.035 -6.897 -5.450 1.00 0.00 C ATOM 691 CG PRO A 48 8.496 -6.124 -4.249 1.00 0.00 C ATOM 692 CD PRO A 48 7.589 -5.085 -4.904 1.00 0.00 C ATOM 0 HA PRO A 48 10.228 -5.382 -6.467 1.00 0.00 H new ATOM 0 HB2 PRO A 48 8.336 -7.664 -5.785 1.00 0.00 H new ATOM 0 HB3 PRO A 48 9.974 -7.400 -5.220 1.00 0.00 H new ATOM 0 HG2 PRO A 48 7.945 -6.770 -3.565 1.00 0.00 H new ATOM 0 HG3 PRO A 48 9.296 -5.659 -3.674 1.00 0.00 H new ATOM 0 HD2 PRO A 48 6.581 -5.475 -5.046 1.00 0.00 H new ATOM 0 HD3 PRO A 48 7.501 -4.192 -4.285 1.00 0.00 H new ATOM 700 N LYS A 49 10.212 -6.401 -8.660 1.00 0.00 N ATOM 701 CA LYS A 49 10.284 -6.831 -10.068 1.00 0.00 C ATOM 702 C LYS A 49 10.849 -8.249 -10.199 1.00 0.00 C ATOM 703 O LYS A 49 11.788 -8.630 -9.498 1.00 0.00 O ATOM 704 CB LYS A 49 11.104 -5.842 -10.922 1.00 0.00 C ATOM 705 CG LYS A 49 10.710 -4.355 -10.826 1.00 0.00 C ATOM 706 CD LYS A 49 9.233 -4.063 -11.145 1.00 0.00 C ATOM 707 CE LYS A 49 8.925 -2.558 -11.273 1.00 0.00 C ATOM 708 NZ LYS A 49 9.351 -1.780 -10.081 1.00 0.00 N ATOM 0 H LYS A 49 11.124 -6.154 -8.275 1.00 0.00 H new ATOM 0 HA LYS A 49 9.262 -6.840 -10.447 1.00 0.00 H new ATOM 0 HB2 LYS A 49 12.152 -5.935 -10.639 1.00 0.00 H new ATOM 0 HB3 LYS A 49 11.027 -6.148 -11.965 1.00 0.00 H new ATOM 0 HG2 LYS A 49 10.928 -3.999 -9.819 1.00 0.00 H new ATOM 0 HG3 LYS A 49 11.336 -3.782 -11.510 1.00 0.00 H new ATOM 0 HD2 LYS A 49 8.963 -4.563 -12.075 1.00 0.00 H new ATOM 0 HD3 LYS A 49 8.607 -4.490 -10.361 1.00 0.00 H new ATOM 0 HE2 LYS A 49 9.426 -2.163 -12.157 1.00 0.00 H new ATOM 0 HE3 LYS A 49 7.854 -2.423 -11.426 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 8.768 -0.923 -10.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 9.233 -2.361 -9.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 10.351 -1.511 -10.181 1.00 0.00 H new ATOM 722 N ASP A 50 10.294 -9.018 -11.129 1.00 0.00 N ATOM 723 CA ASP A 50 10.714 -10.381 -11.458 1.00 0.00 C ATOM 724 C ASP A 50 12.094 -10.417 -12.149 1.00 0.00 C ATOM 725 O ASP A 50 12.386 -9.592 -13.018 1.00 0.00 O ATOM 726 CB ASP A 50 9.636 -11.012 -12.346 1.00 0.00 C ATOM 727 CG ASP A 50 9.996 -12.460 -12.683 1.00 0.00 C ATOM 728 OD1 ASP A 50 9.696 -13.370 -11.876 1.00 0.00 O ATOM 729 OD2 ASP A 50 10.635 -12.659 -13.741 1.00 0.00 O ATOM 0 H ASP A 50 9.509 -8.700 -11.698 1.00 0.00 H new ATOM 0 HA ASP A 50 10.825 -10.951 -10.536 1.00 0.00 H new ATOM 0 HB2 ASP A 50 8.673 -10.980 -11.836 1.00 0.00 H new ATOM 0 HB3 ASP A 50 9.530 -10.435 -13.264 1.00 0.00 H new ATOM 734 N ARG A 51 12.938 -11.398 -11.803 1.00 0.00 N ATOM 735 CA ARG A 51 14.339 -11.495 -12.270 1.00 0.00 C ATOM 736 C ARG A 51 14.545 -12.156 -13.646 1.00 0.00 C ATOM 737 O ARG A 51 15.692 -12.379 -14.038 1.00 0.00 O ATOM 738 CB ARG A 51 15.215 -12.111 -11.159 1.00 0.00 C ATOM 739 CG ARG A 51 14.943 -13.601 -10.899 1.00 0.00 C ATOM 740 CD ARG A 51 15.817 -14.122 -9.751 1.00 0.00 C ATOM 741 NE ARG A 51 15.568 -15.553 -9.485 1.00 0.00 N ATOM 742 CZ ARG A 51 16.128 -16.592 -10.085 1.00 0.00 C ATOM 743 NH1 ARG A 51 17.006 -16.458 -11.039 1.00 0.00 N ATOM 744 NH2 ARG A 51 15.808 -17.804 -9.730 1.00 0.00 N ATOM 0 H ARG A 51 12.669 -12.161 -11.182 1.00 0.00 H new ATOM 0 HA ARG A 51 14.667 -10.473 -12.461 1.00 0.00 H new ATOM 0 HB2 ARG A 51 16.264 -11.986 -11.427 1.00 0.00 H new ATOM 0 HB3 ARG A 51 15.054 -11.557 -10.235 1.00 0.00 H new ATOM 0 HG2 ARG A 51 13.891 -13.746 -10.655 1.00 0.00 H new ATOM 0 HG3 ARG A 51 15.143 -14.175 -11.804 1.00 0.00 H new ATOM 0 HD2 ARG A 51 16.868 -13.975 -9.998 1.00 0.00 H new ATOM 0 HD3 ARG A 51 15.617 -13.543 -8.849 1.00 0.00 H new ATOM 0 HE ARG A 51 14.887 -15.765 -8.756 1.00 0.00 H new ATOM 0 HH11 ARG A 51 17.285 -15.527 -11.349 1.00 0.00 H new ATOM 0 HH12 ARG A 51 17.414 -17.284 -11.476 1.00 0.00 H new ATOM 0 HH21 ARG A 51 15.124 -17.954 -8.988 1.00 0.00 H new ATOM 0 HH22 ARG A 51 16.241 -18.602 -10.194 1.00 0.00 H new ATOM 758 N VAL A 52 13.472 -12.480 -14.377 1.00 0.00 N ATOM 759 CA VAL A 52 13.511 -13.208 -15.666 1.00 0.00 C ATOM 760 C VAL A 52 12.640 -12.520 -16.724 1.00 0.00 C ATOM 761 O VAL A 52 13.024 -12.441 -17.893 1.00 0.00 O ATOM 762 CB VAL A 52 13.055 -14.677 -15.484 1.00 0.00 C ATOM 763 CG1 VAL A 52 13.246 -15.496 -16.768 1.00 0.00 C ATOM 764 CG2 VAL A 52 13.826 -15.400 -14.368 1.00 0.00 C ATOM 0 H VAL A 52 12.524 -12.240 -14.087 1.00 0.00 H new ATOM 0 HA VAL A 52 14.544 -13.199 -16.012 1.00 0.00 H new ATOM 0 HB VAL A 52 11.999 -14.613 -15.222 1.00 0.00 H new ATOM 0 HG11 VAL A 52 12.914 -16.520 -16.599 1.00 0.00 H new ATOM 0 HG12 VAL A 52 12.659 -15.053 -17.573 1.00 0.00 H new ATOM 0 HG13 VAL A 52 14.300 -15.497 -17.046 1.00 0.00 H new ATOM 0 HG21 VAL A 52 13.467 -16.426 -14.283 1.00 0.00 H new ATOM 0 HG22 VAL A 52 14.890 -15.407 -14.606 1.00 0.00 H new ATOM 0 HG23 VAL A 52 13.669 -14.881 -13.422 1.00 0.00 H new ATOM 774 N THR A 53 11.488 -11.984 -16.314 1.00 0.00 N ATOM 775 CA THR A 53 10.485 -11.327 -17.169 1.00 0.00 C ATOM 776 C THR A 53 10.443 -9.811 -16.968 1.00 0.00 C ATOM 777 O THR A 53 9.982 -9.080 -17.846 1.00 0.00 O ATOM 778 CB THR A 53 9.079 -11.905 -16.929 1.00 0.00 C ATOM 779 OG1 THR A 53 8.701 -11.768 -15.577 1.00 0.00 O ATOM 780 CG2 THR A 53 8.983 -13.387 -17.294 1.00 0.00 C ATOM 0 H THR A 53 11.212 -11.994 -15.332 1.00 0.00 H new ATOM 0 HA THR A 53 10.792 -11.527 -18.195 1.00 0.00 H new ATOM 0 HB THR A 53 8.411 -11.336 -17.575 1.00 0.00 H new ATOM 0 HG1 THR A 53 9.428 -12.084 -15.001 1.00 0.00 H new ATOM 0 HG21 THR A 53 7.970 -13.743 -17.105 1.00 0.00 H new ATOM 0 HG22 THR A 53 9.223 -13.518 -18.349 1.00 0.00 H new ATOM 0 HG23 THR A 53 9.687 -13.957 -16.688 1.00 0.00 H new ATOM 788 N GLY A 54 10.945 -9.326 -15.827 1.00 0.00 N ATOM 789 CA GLY A 54 11.123 -7.906 -15.525 1.00 0.00 C ATOM 790 C GLY A 54 9.840 -7.118 -15.206 1.00 0.00 C ATOM 791 O GLY A 54 9.914 -5.914 -14.953 1.00 0.00 O ATOM 0 H GLY A 54 11.248 -9.933 -15.065 1.00 0.00 H new ATOM 0 HA2 GLY A 54 11.800 -7.818 -14.676 1.00 0.00 H new ATOM 0 HA3 GLY A 54 11.614 -7.433 -16.375 1.00 0.00 H new ATOM 795 N GLN A 55 8.675 -7.775 -15.188 1.00 0.00 N ATOM 796 CA GLN A 55 7.405 -7.197 -14.721 1.00 0.00 C ATOM 797 C GLN A 55 7.329 -7.182 -13.186 1.00 0.00 C ATOM 798 O GLN A 55 8.139 -7.824 -12.513 1.00 0.00 O ATOM 799 CB GLN A 55 6.212 -7.948 -15.343 1.00 0.00 C ATOM 800 CG GLN A 55 6.232 -9.470 -15.113 1.00 0.00 C ATOM 801 CD GLN A 55 4.829 -10.073 -15.127 1.00 0.00 C ATOM 802 OE1 GLN A 55 4.359 -10.609 -16.125 1.00 0.00 O ATOM 803 NE2 GLN A 55 4.095 -9.996 -14.036 1.00 0.00 N ATOM 0 H GLN A 55 8.584 -8.741 -15.503 1.00 0.00 H new ATOM 0 HA GLN A 55 7.358 -6.160 -15.052 1.00 0.00 H new ATOM 0 HB2 GLN A 55 5.288 -7.542 -14.931 1.00 0.00 H new ATOM 0 HB3 GLN A 55 6.195 -7.755 -16.416 1.00 0.00 H new ATOM 0 HG2 GLN A 55 6.838 -9.945 -15.885 1.00 0.00 H new ATOM 0 HG3 GLN A 55 6.709 -9.685 -14.157 1.00 0.00 H new ATOM 0 HE21 GLN A 55 4.472 -9.553 -13.198 1.00 0.00 H new ATOM 0 HE22 GLN A 55 3.150 -10.379 -14.029 1.00 0.00 H new ATOM 812 N HIS A 56 6.345 -6.490 -12.604 1.00 0.00 N ATOM 813 CA HIS A 56 6.084 -6.590 -11.161 1.00 0.00 C ATOM 814 C HIS A 56 5.558 -7.982 -10.764 1.00 0.00 C ATOM 815 O HIS A 56 5.003 -8.715 -11.590 1.00 0.00 O ATOM 816 CB HIS A 56 5.182 -5.445 -10.679 1.00 0.00 C ATOM 817 CG HIS A 56 3.722 -5.585 -11.034 1.00 0.00 C ATOM 818 ND1 HIS A 56 2.822 -6.441 -10.393 1.00 0.00 N ATOM 819 CD2 HIS A 56 3.039 -4.824 -11.938 1.00 0.00 C ATOM 820 CE1 HIS A 56 1.620 -6.182 -10.932 1.00 0.00 C ATOM 821 NE2 HIS A 56 1.720 -5.211 -11.852 1.00 0.00 N ATOM 0 H HIS A 56 5.719 -5.858 -13.104 1.00 0.00 H new ATOM 0 HA HIS A 56 7.036 -6.476 -10.642 1.00 0.00 H new ATOM 0 HB2 HIS A 56 5.270 -5.366 -9.595 1.00 0.00 H new ATOM 0 HB3 HIS A 56 5.553 -4.510 -11.098 1.00 0.00 H new ATOM 0 HD2 HIS A 56 3.451 -4.069 -12.591 1.00 0.00 H new ATOM 0 HE1 HIS A 56 0.703 -6.684 -10.663 1.00 0.00 H new ATOM 0 HE2 HIS A 56 0.949 -4.824 -12.396 1.00 0.00 H new ATOM 829 N GLN A 57 5.749 -8.357 -9.498 1.00 0.00 N ATOM 830 CA GLN A 57 5.470 -9.705 -8.976 1.00 0.00 C ATOM 831 C GLN A 57 4.016 -9.914 -8.480 1.00 0.00 C ATOM 832 O GLN A 57 3.737 -10.865 -7.749 1.00 0.00 O ATOM 833 CB GLN A 57 6.535 -10.067 -7.922 1.00 0.00 C ATOM 834 CG GLN A 57 7.938 -10.189 -8.541 1.00 0.00 C ATOM 835 CD GLN A 57 8.993 -10.551 -7.498 1.00 0.00 C ATOM 836 OE1 GLN A 57 9.742 -9.715 -7.013 1.00 0.00 O ATOM 837 NE2 GLN A 57 9.097 -11.805 -7.109 1.00 0.00 N ATOM 0 H GLN A 57 6.110 -7.721 -8.787 1.00 0.00 H new ATOM 0 HA GLN A 57 5.544 -10.405 -9.808 1.00 0.00 H new ATOM 0 HB2 GLN A 57 6.547 -9.305 -7.142 1.00 0.00 H new ATOM 0 HB3 GLN A 57 6.266 -11.009 -7.443 1.00 0.00 H new ATOM 0 HG2 GLN A 57 7.925 -10.949 -9.322 1.00 0.00 H new ATOM 0 HG3 GLN A 57 8.207 -9.246 -9.017 1.00 0.00 H new ATOM 0 HE21 GLN A 57 8.480 -12.514 -7.504 1.00 0.00 H new ATOM 0 HE22 GLN A 57 9.795 -12.067 -6.413 1.00 0.00 H new ATOM 846 N GLY A 58 3.077 -9.041 -8.865 1.00 0.00 N ATOM 847 CA GLY A 58 1.656 -9.096 -8.479 1.00 0.00 C ATOM 848 C GLY A 58 1.310 -8.369 -7.171 1.00 0.00 C ATOM 849 O GLY A 58 0.148 -8.366 -6.759 1.00 0.00 O ATOM 0 H GLY A 58 3.289 -8.250 -9.473 1.00 0.00 H new ATOM 0 HA2 GLY A 58 1.059 -8.667 -9.284 1.00 0.00 H new ATOM 0 HA3 GLY A 58 1.361 -10.141 -8.385 1.00 0.00 H new ATOM 853 N TYR A 59 2.295 -7.744 -6.521 1.00 0.00 N ATOM 854 CA TYR A 59 2.137 -6.972 -5.284 1.00 0.00 C ATOM 855 C TYR A 59 3.091 -5.765 -5.226 1.00 0.00 C ATOM 856 O TYR A 59 4.140 -5.748 -5.875 1.00 0.00 O ATOM 857 CB TYR A 59 2.318 -7.886 -4.063 1.00 0.00 C ATOM 858 CG TYR A 59 3.706 -8.473 -3.883 1.00 0.00 C ATOM 859 CD1 TYR A 59 4.070 -9.642 -4.581 1.00 0.00 C ATOM 860 CD2 TYR A 59 4.625 -7.868 -3.000 1.00 0.00 C ATOM 861 CE1 TYR A 59 5.352 -10.198 -4.410 1.00 0.00 C ATOM 862 CE2 TYR A 59 5.896 -8.441 -2.804 1.00 0.00 C ATOM 863 CZ TYR A 59 6.268 -9.601 -3.519 1.00 0.00 C ATOM 864 OH TYR A 59 7.502 -10.154 -3.348 1.00 0.00 O ATOM 0 H TYR A 59 3.259 -7.762 -6.853 1.00 0.00 H new ATOM 0 HA TYR A 59 1.125 -6.568 -5.271 1.00 0.00 H new ATOM 0 HB2 TYR A 59 2.064 -7.320 -3.167 1.00 0.00 H new ATOM 0 HB3 TYR A 59 1.603 -8.706 -4.136 1.00 0.00 H new ATOM 0 HD1 TYR A 59 3.364 -10.113 -5.249 1.00 0.00 H new ATOM 0 HD2 TYR A 59 4.353 -6.965 -2.474 1.00 0.00 H new ATOM 0 HE1 TYR A 59 5.634 -11.083 -4.962 1.00 0.00 H new ATOM 0 HE2 TYR A 59 6.588 -7.993 -2.106 1.00 0.00 H new ATOM 0 HH TYR A 59 8.012 -9.622 -2.702 1.00 0.00 H new ATOM 874 N GLY A 60 2.708 -4.763 -4.433 1.00 0.00 N ATOM 875 CA GLY A 60 3.392 -3.483 -4.246 1.00 0.00 C ATOM 876 C GLY A 60 3.323 -2.980 -2.801 1.00 0.00 C ATOM 877 O GLY A 60 2.741 -3.626 -1.926 1.00 0.00 O ATOM 0 H GLY A 60 1.860 -4.828 -3.870 1.00 0.00 H new ATOM 0 HA2 GLY A 60 4.436 -3.588 -4.540 1.00 0.00 H new ATOM 0 HA3 GLY A 60 2.948 -2.739 -4.907 1.00 0.00 H new ATOM 881 N PHE A 61 3.891 -1.801 -2.559 1.00 0.00 N ATOM 882 CA PHE A 61 3.898 -1.105 -1.273 1.00 0.00 C ATOM 883 C PHE A 61 3.789 0.417 -1.445 1.00 0.00 C ATOM 884 O PHE A 61 4.273 0.979 -2.434 1.00 0.00 O ATOM 885 CB PHE A 61 5.183 -1.409 -0.487 1.00 0.00 C ATOM 886 CG PHE A 61 5.501 -2.869 -0.222 1.00 0.00 C ATOM 887 CD1 PHE A 61 6.207 -3.624 -1.179 1.00 0.00 C ATOM 888 CD2 PHE A 61 5.141 -3.459 1.005 1.00 0.00 C ATOM 889 CE1 PHE A 61 6.543 -4.963 -0.914 1.00 0.00 C ATOM 890 CE2 PHE A 61 5.487 -4.795 1.275 1.00 0.00 C ATOM 891 CZ PHE A 61 6.185 -5.549 0.315 1.00 0.00 C ATOM 0 H PHE A 61 4.381 -1.281 -3.286 1.00 0.00 H new ATOM 0 HA PHE A 61 3.029 -1.468 -0.724 1.00 0.00 H new ATOM 0 HB2 PHE A 61 6.022 -0.973 -1.029 1.00 0.00 H new ATOM 0 HB3 PHE A 61 5.122 -0.896 0.473 1.00 0.00 H new ATOM 0 HD1 PHE A 61 6.491 -3.173 -2.118 1.00 0.00 H new ATOM 0 HD2 PHE A 61 4.598 -2.884 1.740 1.00 0.00 H new ATOM 0 HE1 PHE A 61 7.076 -5.542 -1.653 1.00 0.00 H new ATOM 0 HE2 PHE A 61 5.217 -5.242 2.220 1.00 0.00 H new ATOM 0 HZ PHE A 61 6.446 -6.577 0.520 1.00 0.00 H new ATOM 901 N VAL A 62 3.217 1.092 -0.443 1.00 0.00 N ATOM 902 CA VAL A 62 3.086 2.560 -0.386 1.00 0.00 C ATOM 903 C VAL A 62 3.474 3.069 1.001 1.00 0.00 C ATOM 904 O VAL A 62 3.018 2.533 2.009 1.00 0.00 O ATOM 905 CB VAL A 62 1.657 3.021 -0.749 1.00 0.00 C ATOM 906 CG1 VAL A 62 1.617 4.544 -0.897 1.00 0.00 C ATOM 907 CG2 VAL A 62 1.155 2.397 -2.058 1.00 0.00 C ATOM 0 H VAL A 62 2.821 0.626 0.373 1.00 0.00 H new ATOM 0 HA VAL A 62 3.765 2.984 -1.126 1.00 0.00 H new ATOM 0 HB VAL A 62 1.008 2.692 0.062 1.00 0.00 H new ATOM 0 HG11 VAL A 62 0.605 4.858 -1.153 1.00 0.00 H new ATOM 0 HG12 VAL A 62 1.915 5.009 0.043 1.00 0.00 H new ATOM 0 HG13 VAL A 62 2.303 4.851 -1.687 1.00 0.00 H new ATOM 0 HG21 VAL A 62 0.146 2.753 -2.268 1.00 0.00 H new ATOM 0 HG22 VAL A 62 1.818 2.683 -2.875 1.00 0.00 H new ATOM 0 HG23 VAL A 62 1.144 1.311 -1.963 1.00 0.00 H new ATOM 917 N GLU A 63 4.315 4.100 1.071 1.00 0.00 N ATOM 918 CA GLU A 63 4.840 4.668 2.317 1.00 0.00 C ATOM 919 C GLU A 63 4.227 6.039 2.614 1.00 0.00 C ATOM 920 O GLU A 63 4.285 6.949 1.785 1.00 0.00 O ATOM 921 CB GLU A 63 6.365 4.751 2.222 1.00 0.00 C ATOM 922 CG GLU A 63 7.019 5.207 3.532 1.00 0.00 C ATOM 923 CD GLU A 63 8.555 5.064 3.527 1.00 0.00 C ATOM 924 OE1 GLU A 63 9.158 4.617 2.519 1.00 0.00 O ATOM 925 OE2 GLU A 63 9.175 5.431 4.554 1.00 0.00 O ATOM 0 H GLU A 63 4.661 4.579 0.240 1.00 0.00 H new ATOM 0 HA GLU A 63 4.565 4.017 3.147 1.00 0.00 H new ATOM 0 HB2 GLU A 63 6.761 3.774 1.945 1.00 0.00 H new ATOM 0 HB3 GLU A 63 6.638 5.443 1.425 1.00 0.00 H new ATOM 0 HG2 GLU A 63 6.758 6.249 3.717 1.00 0.00 H new ATOM 0 HG3 GLU A 63 6.609 4.624 4.357 1.00 0.00 H new ATOM 932 N PHE A 64 3.684 6.199 3.817 1.00 0.00 N ATOM 933 CA PHE A 64 3.068 7.430 4.307 1.00 0.00 C ATOM 934 C PHE A 64 3.968 8.184 5.289 1.00 0.00 C ATOM 935 O PHE A 64 4.881 7.616 5.894 1.00 0.00 O ATOM 936 CB PHE A 64 1.717 7.098 4.945 1.00 0.00 C ATOM 937 CG PHE A 64 0.666 6.730 3.924 1.00 0.00 C ATOM 938 CD1 PHE A 64 0.508 5.396 3.504 1.00 0.00 C ATOM 939 CD2 PHE A 64 -0.126 7.746 3.362 1.00 0.00 C ATOM 940 CE1 PHE A 64 -0.466 5.076 2.541 1.00 0.00 C ATOM 941 CE2 PHE A 64 -1.097 7.426 2.402 1.00 0.00 C ATOM 942 CZ PHE A 64 -1.272 6.093 2.000 1.00 0.00 C ATOM 0 H PHE A 64 3.660 5.446 4.505 1.00 0.00 H new ATOM 0 HA PHE A 64 2.919 8.096 3.457 1.00 0.00 H new ATOM 0 HB2 PHE A 64 1.843 6.272 5.645 1.00 0.00 H new ATOM 0 HB3 PHE A 64 1.372 7.955 5.523 1.00 0.00 H new ATOM 0 HD1 PHE A 64 1.133 4.620 3.920 1.00 0.00 H new ATOM 0 HD2 PHE A 64 0.013 8.772 3.669 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -0.594 4.053 2.219 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -1.710 8.205 1.972 1.00 0.00 H new ATOM 0 HZ PHE A 64 -2.030 5.847 1.271 1.00 0.00 H new ATOM 952 N LEU A 65 3.680 9.476 5.472 1.00 0.00 N ATOM 953 CA LEU A 65 4.412 10.341 6.401 1.00 0.00 C ATOM 954 C LEU A 65 4.297 9.864 7.861 1.00 0.00 C ATOM 955 O LEU A 65 5.248 10.009 8.633 1.00 0.00 O ATOM 956 CB LEU A 65 3.877 11.774 6.243 1.00 0.00 C ATOM 957 CG LEU A 65 4.774 12.848 6.877 1.00 0.00 C ATOM 958 CD1 LEU A 65 6.034 13.092 6.044 1.00 0.00 C ATOM 959 CD2 LEU A 65 4.011 14.171 6.968 1.00 0.00 C ATOM 0 H LEU A 65 2.927 9.954 4.976 1.00 0.00 H new ATOM 0 HA LEU A 65 5.474 10.304 6.158 1.00 0.00 H new ATOM 0 HB2 LEU A 65 3.760 11.993 5.182 1.00 0.00 H new ATOM 0 HB3 LEU A 65 2.885 11.832 6.691 1.00 0.00 H new ATOM 0 HG LEU A 65 5.059 12.490 7.866 1.00 0.00 H new ATOM 0 HD11 LEU A 65 6.644 13.858 6.523 1.00 0.00 H new ATOM 0 HD12 LEU A 65 6.605 12.167 5.969 1.00 0.00 H new ATOM 0 HD13 LEU A 65 5.751 13.426 5.046 1.00 0.00 H new ATOM 0 HD21 LEU A 65 4.651 14.930 7.418 1.00 0.00 H new ATOM 0 HD22 LEU A 65 3.717 14.491 5.968 1.00 0.00 H new ATOM 0 HD23 LEU A 65 3.121 14.036 7.582 1.00 0.00 H new ATOM 971 N SER A 66 3.155 9.268 8.222 1.00 0.00 N ATOM 972 CA SER A 66 2.876 8.766 9.573 1.00 0.00 C ATOM 973 C SER A 66 2.053 7.472 9.543 1.00 0.00 C ATOM 974 O SER A 66 1.302 7.205 8.603 1.00 0.00 O ATOM 975 CB SER A 66 2.146 9.831 10.409 1.00 0.00 C ATOM 976 OG SER A 66 2.811 11.089 10.394 1.00 0.00 O ATOM 0 H SER A 66 2.384 9.118 7.571 1.00 0.00 H new ATOM 0 HA SER A 66 3.837 8.543 10.037 1.00 0.00 H new ATOM 0 HB2 SER A 66 1.133 9.955 10.027 1.00 0.00 H new ATOM 0 HB3 SER A 66 2.059 9.483 11.438 1.00 0.00 H new ATOM 0 HG SER A 66 2.308 11.731 10.937 1.00 0.00 H new ATOM 982 N GLU A 67 2.163 6.668 10.600 1.00 0.00 N ATOM 983 CA GLU A 67 1.479 5.371 10.733 1.00 0.00 C ATOM 984 C GLU A 67 -0.054 5.492 10.741 1.00 0.00 C ATOM 985 O GLU A 67 -0.736 4.628 10.197 1.00 0.00 O ATOM 986 CB GLU A 67 2.025 4.700 12.000 1.00 0.00 C ATOM 987 CG GLU A 67 1.429 3.325 12.352 1.00 0.00 C ATOM 988 CD GLU A 67 0.125 3.355 13.182 1.00 0.00 C ATOM 989 OE1 GLU A 67 -0.193 4.374 13.840 1.00 0.00 O ATOM 990 OE2 GLU A 67 -0.567 2.309 13.218 1.00 0.00 O ATOM 0 H GLU A 67 2.741 6.900 11.408 1.00 0.00 H new ATOM 0 HA GLU A 67 1.687 4.754 9.859 1.00 0.00 H new ATOM 0 HB2 GLU A 67 3.104 4.588 11.891 1.00 0.00 H new ATOM 0 HB3 GLU A 67 1.858 5.371 12.842 1.00 0.00 H new ATOM 0 HG2 GLU A 67 1.236 2.784 11.425 1.00 0.00 H new ATOM 0 HG3 GLU A 67 2.177 2.755 12.904 1.00 0.00 H new ATOM 997 N GLU A 68 -0.605 6.589 11.269 1.00 0.00 N ATOM 998 CA GLU A 68 -2.054 6.842 11.262 1.00 0.00 C ATOM 999 C GLU A 68 -2.617 7.131 9.856 1.00 0.00 C ATOM 1000 O GLU A 68 -3.786 6.853 9.590 1.00 0.00 O ATOM 1001 CB GLU A 68 -2.399 7.963 12.258 1.00 0.00 C ATOM 1002 CG GLU A 68 -1.807 9.335 11.900 1.00 0.00 C ATOM 1003 CD GLU A 68 -2.153 10.379 12.980 1.00 0.00 C ATOM 1004 OE1 GLU A 68 -1.337 10.590 13.910 1.00 0.00 O ATOM 1005 OE2 GLU A 68 -3.243 10.999 12.907 1.00 0.00 O ATOM 0 H GLU A 68 -0.061 7.328 11.714 1.00 0.00 H new ATOM 0 HA GLU A 68 -2.543 5.922 11.583 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -3.483 8.054 12.322 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -2.044 7.675 13.248 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -0.725 9.254 11.800 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -2.193 9.662 10.935 1.00 0.00 H new ATOM 1012 N ASP A 69 -1.784 7.627 8.933 1.00 0.00 N ATOM 1013 CA ASP A 69 -2.145 7.818 7.524 1.00 0.00 C ATOM 1014 C ASP A 69 -2.065 6.497 6.738 1.00 0.00 C ATOM 1015 O ASP A 69 -2.895 6.251 5.859 1.00 0.00 O ATOM 1016 CB ASP A 69 -1.247 8.898 6.906 1.00 0.00 C ATOM 1017 CG ASP A 69 -1.549 10.292 7.477 1.00 0.00 C ATOM 1018 OD1 ASP A 69 -0.655 10.886 8.124 1.00 0.00 O ATOM 1019 OD2 ASP A 69 -2.669 10.808 7.254 1.00 0.00 O ATOM 0 H ASP A 69 -0.828 7.911 9.147 1.00 0.00 H new ATOM 0 HA ASP A 69 -3.181 8.152 7.469 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -0.202 8.649 7.090 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -1.386 8.911 5.825 1.00 0.00 H new ATOM 1024 N ALA A 70 -1.139 5.602 7.107 1.00 0.00 N ATOM 1025 CA ALA A 70 -1.064 4.255 6.541 1.00 0.00 C ATOM 1026 C ALA A 70 -2.250 3.389 7.002 1.00 0.00 C ATOM 1027 O ALA A 70 -2.894 2.722 6.191 1.00 0.00 O ATOM 1028 CB ALA A 70 0.284 3.648 6.948 1.00 0.00 C ATOM 0 H ALA A 70 -0.422 5.795 7.807 1.00 0.00 H new ATOM 0 HA ALA A 70 -1.129 4.298 5.454 1.00 0.00 H new ATOM 0 HB1 ALA A 70 0.368 2.641 6.539 1.00 0.00 H new ATOM 0 HB2 ALA A 70 1.093 4.266 6.560 1.00 0.00 H new ATOM 0 HB3 ALA A 70 0.350 3.605 8.035 1.00 0.00 H new ATOM 1034 N ASP A 71 -2.607 3.466 8.287 1.00 0.00 N ATOM 1035 CA ASP A 71 -3.765 2.768 8.859 1.00 0.00 C ATOM 1036 C ASP A 71 -5.101 3.219 8.233 1.00 0.00 C ATOM 1037 O ASP A 71 -6.043 2.431 8.133 1.00 0.00 O ATOM 1038 CB ASP A 71 -3.754 2.952 10.383 1.00 0.00 C ATOM 1039 CG ASP A 71 -4.421 1.765 11.090 1.00 0.00 C ATOM 1040 OD1 ASP A 71 -5.562 1.908 11.591 1.00 0.00 O ATOM 1041 OD2 ASP A 71 -3.773 0.693 11.161 1.00 0.00 O ATOM 0 H ASP A 71 -2.093 4.023 8.970 1.00 0.00 H new ATOM 0 HA ASP A 71 -3.681 1.707 8.623 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -2.727 3.056 10.732 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -4.274 3.873 10.644 1.00 0.00 H new ATOM 1046 N TYR A 72 -5.163 4.458 7.726 1.00 0.00 N ATOM 1047 CA TYR A 72 -6.315 4.976 6.984 1.00 0.00 C ATOM 1048 C TYR A 72 -6.356 4.486 5.528 1.00 0.00 C ATOM 1049 O TYR A 72 -7.430 4.204 4.999 1.00 0.00 O ATOM 1050 CB TYR A 72 -6.336 6.508 7.044 1.00 0.00 C ATOM 1051 CG TYR A 72 -7.690 7.059 6.646 1.00 0.00 C ATOM 1052 CD1 TYR A 72 -8.689 7.239 7.622 1.00 0.00 C ATOM 1053 CD2 TYR A 72 -7.986 7.291 5.289 1.00 0.00 C ATOM 1054 CE1 TYR A 72 -9.989 7.622 7.238 1.00 0.00 C ATOM 1055 CE2 TYR A 72 -9.283 7.669 4.898 1.00 0.00 C ATOM 1056 CZ TYR A 72 -10.294 7.818 5.874 1.00 0.00 C ATOM 1057 OH TYR A 72 -11.576 8.101 5.514 1.00 0.00 O ATOM 0 H TYR A 72 -4.405 5.134 7.822 1.00 0.00 H new ATOM 0 HA TYR A 72 -7.210 4.584 7.466 1.00 0.00 H new ATOM 0 HB2 TYR A 72 -6.090 6.837 8.054 1.00 0.00 H new ATOM 0 HB3 TYR A 72 -5.569 6.910 6.382 1.00 0.00 H new ATOM 0 HD1 TYR A 72 -8.458 7.083 8.666 1.00 0.00 H new ATOM 0 HD2 TYR A 72 -7.212 7.178 4.544 1.00 0.00 H new ATOM 0 HE1 TYR A 72 -10.753 7.766 7.988 1.00 0.00 H new ATOM 0 HE2 TYR A 72 -9.505 7.845 3.856 1.00 0.00 H new ATOM 0 HH TYR A 72 -11.626 8.210 4.541 1.00 0.00 H new ATOM 1067 N ALA A 73 -5.207 4.306 4.870 1.00 0.00 N ATOM 1068 CA ALA A 73 -5.166 3.746 3.519 1.00 0.00 C ATOM 1069 C ALA A 73 -5.647 2.287 3.509 1.00 0.00 C ATOM 1070 O ALA A 73 -6.361 1.874 2.600 1.00 0.00 O ATOM 1071 CB ALA A 73 -3.745 3.913 2.982 1.00 0.00 C ATOM 0 H ALA A 73 -4.292 4.541 5.254 1.00 0.00 H new ATOM 0 HA ALA A 73 -5.852 4.279 2.860 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -3.686 3.503 1.974 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -3.487 4.972 2.959 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -3.047 3.384 3.630 1.00 0.00 H new ATOM 1077 N ILE A 74 -5.361 1.541 4.579 1.00 0.00 N ATOM 1078 CA ILE A 74 -5.860 0.177 4.803 1.00 0.00 C ATOM 1079 C ILE A 74 -7.390 0.155 4.987 1.00 0.00 C ATOM 1080 O ILE A 74 -8.051 -0.773 4.516 1.00 0.00 O ATOM 1081 CB ILE A 74 -5.106 -0.434 6.006 1.00 0.00 C ATOM 1082 CG1 ILE A 74 -3.602 -0.550 5.670 1.00 0.00 C ATOM 1083 CG2 ILE A 74 -5.674 -1.813 6.384 1.00 0.00 C ATOM 1084 CD1 ILE A 74 -2.701 -0.672 6.891 1.00 0.00 C ATOM 0 H ILE A 74 -4.761 1.875 5.334 1.00 0.00 H new ATOM 0 HA ILE A 74 -5.665 -0.435 3.923 1.00 0.00 H new ATOM 0 HB ILE A 74 -5.239 0.225 6.864 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -3.449 -1.419 5.031 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -3.300 0.325 5.095 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -5.121 -2.214 7.233 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -6.726 -1.712 6.651 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -5.578 -2.491 5.536 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -1.662 -0.749 6.570 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -2.822 0.209 7.522 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -2.973 -1.563 7.456 1.00 0.00 H new ATOM 1096 N LYS A 75 -7.975 1.197 5.597 1.00 0.00 N ATOM 1097 CA LYS A 75 -9.433 1.363 5.738 1.00 0.00 C ATOM 1098 C LYS A 75 -10.126 1.546 4.381 1.00 0.00 C ATOM 1099 O LYS A 75 -11.184 0.947 4.175 1.00 0.00 O ATOM 1100 CB LYS A 75 -9.723 2.517 6.721 1.00 0.00 C ATOM 1101 CG LYS A 75 -11.196 2.955 6.802 1.00 0.00 C ATOM 1102 CD LYS A 75 -11.347 4.126 7.787 1.00 0.00 C ATOM 1103 CE LYS A 75 -12.764 4.720 7.811 1.00 0.00 C ATOM 1104 NZ LYS A 75 -13.083 5.502 6.584 1.00 0.00 N ATOM 0 H LYS A 75 -7.442 1.961 6.013 1.00 0.00 H new ATOM 0 HA LYS A 75 -9.857 0.449 6.154 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -9.395 2.216 7.716 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -9.120 3.378 6.433 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -11.550 3.252 5.815 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -11.815 2.117 7.123 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -11.086 3.785 8.789 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -10.637 4.909 7.522 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -13.489 3.914 7.921 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -12.868 5.364 8.684 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -14.030 5.921 6.676 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -12.380 6.259 6.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -13.062 4.873 5.756 1.00 0.00 H new ATOM 1118 N ILE A 76 -9.558 2.335 3.459 1.00 0.00 N ATOM 1119 CA ILE A 76 -10.218 2.658 2.184 1.00 0.00 C ATOM 1120 C ILE A 76 -9.839 1.739 1.010 1.00 0.00 C ATOM 1121 O ILE A 76 -10.714 1.407 0.216 1.00 0.00 O ATOM 1122 CB ILE A 76 -10.048 4.149 1.821 1.00 0.00 C ATOM 1123 CG1 ILE A 76 -8.583 4.608 1.691 1.00 0.00 C ATOM 1124 CG2 ILE A 76 -10.778 5.024 2.854 1.00 0.00 C ATOM 1125 CD1 ILE A 76 -8.458 5.896 0.876 1.00 0.00 C ATOM 0 H ILE A 76 -8.639 2.763 3.572 1.00 0.00 H new ATOM 0 HA ILE A 76 -11.276 2.462 2.357 1.00 0.00 H new ATOM 0 HB ILE A 76 -10.489 4.268 0.831 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -8.162 4.765 2.684 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -7.997 3.821 1.217 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -10.655 6.075 2.593 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -11.839 4.773 2.858 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -10.359 4.845 3.844 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -7.409 6.184 0.809 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -8.854 5.732 -0.126 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -9.022 6.691 1.363 1.00 0.00 H new ATOM 1137 N MET A 77 -8.579 1.304 0.891 1.00 0.00 N ATOM 1138 CA MET A 77 -8.057 0.604 -0.303 1.00 0.00 C ATOM 1139 C MET A 77 -8.179 -0.921 -0.262 1.00 0.00 C ATOM 1140 O MET A 77 -7.832 -1.604 -1.222 1.00 0.00 O ATOM 1141 CB MET A 77 -6.627 1.057 -0.617 1.00 0.00 C ATOM 1142 CG MET A 77 -6.562 2.493 -1.137 1.00 0.00 C ATOM 1143 SD MET A 77 -6.964 2.643 -2.896 1.00 0.00 S ATOM 1144 CE MET A 77 -6.466 4.362 -3.142 1.00 0.00 C ATOM 0 H MET A 77 -7.881 1.426 1.625 1.00 0.00 H new ATOM 0 HA MET A 77 -8.710 0.901 -1.124 1.00 0.00 H new ATOM 0 HB2 MET A 77 -6.018 0.973 0.283 1.00 0.00 H new ATOM 0 HB3 MET A 77 -6.193 0.387 -1.359 1.00 0.00 H new ATOM 0 HG2 MET A 77 -7.251 3.111 -0.561 1.00 0.00 H new ATOM 0 HG3 MET A 77 -5.560 2.888 -0.966 1.00 0.00 H new ATOM 0 HE1 MET A 77 -7.166 4.850 -3.821 1.00 0.00 H new ATOM 0 HE2 MET A 77 -6.467 4.882 -2.184 1.00 0.00 H new ATOM 0 HE3 MET A 77 -5.464 4.393 -3.570 1.00 0.00 H new ATOM 1154 N ASP A 78 -8.704 -1.482 0.820 1.00 0.00 N ATOM 1155 CA ASP A 78 -8.882 -2.930 0.942 1.00 0.00 C ATOM 1156 C ASP A 78 -10.154 -3.414 0.222 1.00 0.00 C ATOM 1157 O ASP A 78 -11.193 -2.753 0.266 1.00 0.00 O ATOM 1158 CB ASP A 78 -8.807 -3.358 2.413 1.00 0.00 C ATOM 1159 CG ASP A 78 -8.751 -4.885 2.556 1.00 0.00 C ATOM 1160 OD1 ASP A 78 -9.576 -5.455 3.309 1.00 0.00 O ATOM 1161 OD2 ASP A 78 -7.877 -5.505 1.907 1.00 0.00 O ATOM 0 H ASP A 78 -9.018 -0.954 1.634 1.00 0.00 H new ATOM 0 HA ASP A 78 -8.058 -3.427 0.429 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -7.925 -2.916 2.876 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -9.675 -2.974 2.949 1.00 0.00 H new ATOM 1166 N MET A 79 -10.060 -4.556 -0.471 1.00 0.00 N ATOM 1167 CA MET A 79 -11.074 -5.110 -1.391 1.00 0.00 C ATOM 1168 C MET A 79 -11.410 -4.227 -2.615 1.00 0.00 C ATOM 1169 O MET A 79 -12.296 -4.575 -3.400 1.00 0.00 O ATOM 1170 CB MET A 79 -12.342 -5.569 -0.638 1.00 0.00 C ATOM 1171 CG MET A 79 -12.048 -6.573 0.480 1.00 0.00 C ATOM 1172 SD MET A 79 -11.368 -8.154 -0.090 1.00 0.00 S ATOM 1173 CE MET A 79 -10.808 -8.792 1.508 1.00 0.00 C ATOM 0 H MET A 79 -9.235 -5.152 -0.405 1.00 0.00 H new ATOM 0 HA MET A 79 -10.597 -5.990 -1.823 1.00 0.00 H new ATOM 0 HB2 MET A 79 -12.840 -4.697 -0.213 1.00 0.00 H new ATOM 0 HB3 MET A 79 -13.036 -6.018 -1.348 1.00 0.00 H new ATOM 0 HG2 MET A 79 -11.346 -6.122 1.181 1.00 0.00 H new ATOM 0 HG3 MET A 79 -12.969 -6.765 1.030 1.00 0.00 H new ATOM 0 HE1 MET A 79 -10.353 -9.773 1.369 1.00 0.00 H new ATOM 0 HE2 MET A 79 -10.074 -8.109 1.936 1.00 0.00 H new ATOM 0 HE3 MET A 79 -11.659 -8.880 2.183 1.00 0.00 H new ATOM 1183 N ILE A 80 -10.705 -3.106 -2.822 1.00 0.00 N ATOM 1184 CA ILE A 80 -10.906 -2.196 -3.960 1.00 0.00 C ATOM 1185 C ILE A 80 -10.476 -2.835 -5.286 1.00 0.00 C ATOM 1186 O ILE A 80 -9.479 -3.554 -5.365 1.00 0.00 O ATOM 1187 CB ILE A 80 -10.250 -0.820 -3.676 1.00 0.00 C ATOM 1188 CG1 ILE A 80 -11.292 0.110 -3.013 1.00 0.00 C ATOM 1189 CG2 ILE A 80 -9.583 -0.170 -4.896 1.00 0.00 C ATOM 1190 CD1 ILE A 80 -10.866 1.578 -2.873 1.00 0.00 C ATOM 0 H ILE A 80 -9.964 -2.800 -2.191 1.00 0.00 H new ATOM 0 HA ILE A 80 -11.973 -2.008 -4.077 1.00 0.00 H new ATOM 0 HB ILE A 80 -9.421 -0.992 -2.989 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -12.213 0.070 -3.595 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -11.524 -0.280 -2.022 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -9.150 0.788 -4.607 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -8.797 -0.824 -5.273 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -10.327 -0.011 -5.676 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -11.666 2.145 -2.397 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -9.965 1.639 -2.263 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -10.664 1.994 -3.860 1.00 0.00 H new ATOM 1202 N LYS A 81 -11.231 -2.556 -6.352 1.00 0.00 N ATOM 1203 CA LYS A 81 -11.103 -3.199 -7.667 1.00 0.00 C ATOM 1204 C LYS A 81 -10.288 -2.355 -8.651 1.00 0.00 C ATOM 1205 O LYS A 81 -10.801 -1.897 -9.673 1.00 0.00 O ATOM 1206 CB LYS A 81 -12.499 -3.559 -8.191 1.00 0.00 C ATOM 1207 CG LYS A 81 -13.212 -4.578 -7.286 1.00 0.00 C ATOM 1208 CD LYS A 81 -14.527 -5.097 -7.884 1.00 0.00 C ATOM 1209 CE LYS A 81 -14.270 -6.182 -8.939 1.00 0.00 C ATOM 1210 NZ LYS A 81 -15.519 -6.572 -9.645 1.00 0.00 N ATOM 0 H LYS A 81 -11.972 -1.855 -6.325 1.00 0.00 H new ATOM 0 HA LYS A 81 -10.534 -4.122 -7.558 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -13.103 -2.654 -8.264 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -12.414 -3.967 -9.198 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -12.546 -5.421 -7.102 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -13.416 -4.117 -6.320 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -15.156 -5.500 -7.090 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -15.075 -4.270 -8.336 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -13.541 -5.819 -9.664 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -13.834 -7.059 -8.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -15.305 -7.307 -10.349 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -16.206 -6.942 -8.957 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -15.922 -5.741 -10.123 1.00 0.00 H new ATOM 1224 N LEU A 82 -9.004 -2.164 -8.349 1.00 0.00 N ATOM 1225 CA LEU A 82 -8.056 -1.485 -9.244 1.00 0.00 C ATOM 1226 C LEU A 82 -7.983 -2.252 -10.580 1.00 0.00 C ATOM 1227 O LEU A 82 -7.757 -3.464 -10.574 1.00 0.00 O ATOM 1228 CB LEU A 82 -6.692 -1.363 -8.533 1.00 0.00 C ATOM 1229 CG LEU A 82 -5.645 -0.505 -9.266 1.00 0.00 C ATOM 1230 CD1 LEU A 82 -6.158 0.904 -9.575 1.00 0.00 C ATOM 1231 CD2 LEU A 82 -4.402 -0.375 -8.384 1.00 0.00 C ATOM 0 H LEU A 82 -8.586 -2.476 -7.473 1.00 0.00 H new ATOM 0 HA LEU A 82 -8.385 -0.473 -9.478 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -6.854 -0.941 -7.541 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -6.283 -2.364 -8.391 1.00 0.00 H new ATOM 0 HG LEU A 82 -5.420 -1.002 -10.210 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -5.382 1.468 -10.092 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -7.042 0.838 -10.209 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -6.415 1.410 -8.644 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -3.655 0.232 -8.896 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -4.673 0.101 -7.442 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -3.992 -1.365 -8.185 1.00 0.00 H new ATOM 1243 N TYR A 83 -8.247 -1.581 -11.710 1.00 0.00 N ATOM 1244 CA TYR A 83 -8.463 -2.242 -13.017 1.00 0.00 C ATOM 1245 C TYR A 83 -9.402 -3.490 -13.002 1.00 0.00 C ATOM 1246 O TYR A 83 -9.224 -4.413 -13.802 1.00 0.00 O ATOM 1247 CB TYR A 83 -7.114 -2.511 -13.708 1.00 0.00 C ATOM 1248 CG TYR A 83 -6.260 -1.278 -13.942 1.00 0.00 C ATOM 1249 CD1 TYR A 83 -5.037 -1.128 -13.263 1.00 0.00 C ATOM 1250 CD2 TYR A 83 -6.678 -0.295 -14.861 1.00 0.00 C ATOM 1251 CE1 TYR A 83 -4.225 -0.005 -13.510 1.00 0.00 C ATOM 1252 CE2 TYR A 83 -5.870 0.834 -15.108 1.00 0.00 C ATOM 1253 CZ TYR A 83 -4.639 0.981 -14.431 1.00 0.00 C ATOM 1254 OH TYR A 83 -3.848 2.063 -14.666 1.00 0.00 O ATOM 0 H TYR A 83 -8.318 -0.564 -11.750 1.00 0.00 H new ATOM 0 HA TYR A 83 -9.031 -1.530 -13.616 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -6.547 -3.219 -13.103 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -7.303 -2.992 -14.668 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -4.721 -1.876 -12.551 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -7.620 -0.407 -15.378 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -3.283 0.102 -12.993 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -6.192 1.585 -15.814 1.00 0.00 H new ATOM 0 HH TYR A 83 -4.278 2.645 -15.327 1.00 0.00 H new ATOM 1264 N GLY A 84 -10.411 -3.544 -12.117 1.00 0.00 N ATOM 1265 CA GLY A 84 -11.449 -4.593 -12.096 1.00 0.00 C ATOM 1266 C GLY A 84 -11.111 -5.899 -11.349 1.00 0.00 C ATOM 1267 O GLY A 84 -11.849 -6.878 -11.484 1.00 0.00 O ATOM 0 H GLY A 84 -10.532 -2.848 -11.382 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -12.349 -4.170 -11.649 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -11.695 -4.847 -13.127 1.00 0.00 H new ATOM 1271 N LYS A 85 -10.034 -5.933 -10.553 1.00 0.00 N ATOM 1272 CA LYS A 85 -9.513 -7.074 -9.788 1.00 0.00 C ATOM 1273 C LYS A 85 -9.343 -6.641 -8.320 1.00 0.00 C ATOM 1274 O LYS A 85 -8.601 -5.692 -8.062 1.00 0.00 O ATOM 1275 CB LYS A 85 -8.172 -7.530 -10.392 1.00 0.00 C ATOM 1276 CG LYS A 85 -8.371 -8.230 -11.746 1.00 0.00 C ATOM 1277 CD LYS A 85 -7.034 -8.445 -12.466 1.00 0.00 C ATOM 1278 CE LYS A 85 -7.275 -9.073 -13.844 1.00 0.00 C ATOM 1279 NZ LYS A 85 -6.013 -9.179 -14.619 1.00 0.00 N ATOM 0 H LYS A 85 -9.461 -5.100 -10.417 1.00 0.00 H new ATOM 0 HA LYS A 85 -10.205 -7.915 -9.833 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -7.518 -6.668 -10.520 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -7.673 -8.209 -9.701 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -8.862 -9.191 -11.592 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -9.032 -7.632 -12.373 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -6.514 -7.493 -12.577 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -6.391 -9.092 -11.870 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -7.713 -10.064 -13.723 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -7.995 -8.472 -14.399 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -6.191 -9.698 -15.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -5.662 -8.226 -14.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -5.301 -9.687 -14.056 1.00 0.00 H new ATOM 1293 N PRO A 86 -10.054 -7.261 -7.361 1.00 0.00 N ATOM 1294 CA PRO A 86 -10.100 -6.813 -5.970 1.00 0.00 C ATOM 1295 C PRO A 86 -8.776 -7.085 -5.240 1.00 0.00 C ATOM 1296 O PRO A 86 -8.348 -8.236 -5.135 1.00 0.00 O ATOM 1297 CB PRO A 86 -11.303 -7.534 -5.346 1.00 0.00 C ATOM 1298 CG PRO A 86 -11.478 -8.782 -6.209 1.00 0.00 C ATOM 1299 CD PRO A 86 -11.015 -8.322 -7.590 1.00 0.00 C ATOM 0 HA PRO A 86 -10.224 -5.733 -5.891 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -11.116 -7.793 -4.304 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -12.196 -6.909 -5.364 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -10.878 -9.614 -5.840 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -12.515 -9.119 -6.224 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -10.562 -9.145 -8.143 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -11.856 -7.964 -8.184 1.00 0.00 H new ATOM 1307 N ILE A 87 -8.149 -6.032 -4.709 1.00 0.00 N ATOM 1308 CA ILE A 87 -6.838 -6.063 -4.027 1.00 0.00 C ATOM 1309 C ILE A 87 -6.961 -6.388 -2.527 1.00 0.00 C ATOM 1310 O ILE A 87 -8.060 -6.392 -1.964 1.00 0.00 O ATOM 1311 CB ILE A 87 -6.041 -4.758 -4.298 1.00 0.00 C ATOM 1312 CG1 ILE A 87 -6.625 -3.538 -3.549 1.00 0.00 C ATOM 1313 CG2 ILE A 87 -5.929 -4.534 -5.820 1.00 0.00 C ATOM 1314 CD1 ILE A 87 -6.074 -2.185 -4.017 1.00 0.00 C ATOM 0 H ILE A 87 -8.550 -5.095 -4.740 1.00 0.00 H new ATOM 0 HA ILE A 87 -6.264 -6.885 -4.455 1.00 0.00 H new ATOM 0 HB ILE A 87 -5.035 -4.874 -3.895 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -7.708 -3.537 -3.670 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -6.423 -3.650 -2.484 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -5.370 -3.618 -6.013 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -5.411 -5.378 -6.275 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -6.927 -4.447 -6.249 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -6.536 -1.384 -3.440 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -4.994 -2.161 -3.870 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -6.299 -2.047 -5.074 1.00 0.00 H new ATOM 1326 N ARG A 88 -5.836 -6.674 -1.862 1.00 0.00 N ATOM 1327 CA ARG A 88 -5.720 -6.833 -0.398 1.00 0.00 C ATOM 1328 C ARG A 88 -4.721 -5.823 0.158 1.00 0.00 C ATOM 1329 O ARG A 88 -3.634 -5.699 -0.404 1.00 0.00 O ATOM 1330 CB ARG A 88 -5.279 -8.262 -0.025 1.00 0.00 C ATOM 1331 CG ARG A 88 -6.192 -9.381 -0.547 1.00 0.00 C ATOM 1332 CD ARG A 88 -7.617 -9.333 0.025 1.00 0.00 C ATOM 1333 NE ARG A 88 -8.469 -10.343 -0.634 1.00 0.00 N ATOM 1334 CZ ARG A 88 -8.981 -10.245 -1.847 1.00 0.00 C ATOM 1335 NH1 ARG A 88 -8.929 -9.133 -2.522 1.00 0.00 N ATOM 1336 NH2 ARG A 88 -9.536 -11.272 -2.422 1.00 0.00 N ATOM 0 H ARG A 88 -4.945 -6.807 -2.341 1.00 0.00 H new ATOM 0 HA ARG A 88 -6.702 -6.654 0.040 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -4.272 -8.427 -0.408 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -5.223 -8.337 1.061 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -6.244 -9.318 -1.634 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -5.745 -10.345 -0.305 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -7.591 -9.515 1.099 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -8.041 -8.339 -0.120 1.00 0.00 H new ATOM 0 HE ARG A 88 -8.680 -11.190 -0.106 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -8.485 -8.310 -2.115 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -9.333 -9.085 -3.458 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -9.580 -12.167 -1.935 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -9.928 -11.182 -3.360 1.00 0.00 H new ATOM 1350 N VAL A 89 -5.064 -5.119 1.238 1.00 0.00 N ATOM 1351 CA VAL A 89 -4.224 -4.063 1.834 1.00 0.00 C ATOM 1352 C VAL A 89 -4.081 -4.251 3.347 1.00 0.00 C ATOM 1353 O VAL A 89 -5.065 -4.498 4.045 1.00 0.00 O ATOM 1354 CB VAL A 89 -4.749 -2.655 1.480 1.00 0.00 C ATOM 1355 CG1 VAL A 89 -3.759 -1.554 1.867 1.00 0.00 C ATOM 1356 CG2 VAL A 89 -4.971 -2.502 -0.028 1.00 0.00 C ATOM 0 H VAL A 89 -5.943 -5.263 1.734 1.00 0.00 H new ATOM 0 HA VAL A 89 -3.228 -4.153 1.401 1.00 0.00 H new ATOM 0 HB VAL A 89 -5.681 -2.552 2.036 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -4.173 -0.582 1.598 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -3.579 -1.587 2.942 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -2.819 -1.707 1.337 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -5.341 -1.499 -0.241 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -4.029 -2.661 -0.552 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -5.702 -3.237 -0.365 1.00 0.00 H new ATOM 1366 N ASN A 90 -2.850 -4.133 3.855 1.00 0.00 N ATOM 1367 CA ASN A 90 -2.486 -4.267 5.275 1.00 0.00 C ATOM 1368 C ASN A 90 -1.156 -3.550 5.581 1.00 0.00 C ATOM 1369 O ASN A 90 -0.455 -3.125 4.661 1.00 0.00 O ATOM 1370 CB ASN A 90 -2.434 -5.767 5.652 1.00 0.00 C ATOM 1371 CG ASN A 90 -1.580 -6.626 4.729 1.00 0.00 C ATOM 1372 OD1 ASN A 90 -2.077 -7.271 3.818 1.00 0.00 O ATOM 1373 ND2 ASN A 90 -0.281 -6.681 4.920 1.00 0.00 N ATOM 0 H ASN A 90 -2.043 -3.933 3.265 1.00 0.00 H new ATOM 0 HA ASN A 90 -3.247 -3.783 5.887 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -2.052 -5.859 6.669 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -3.450 -6.162 5.657 1.00 0.00 H new ATOM 0 HD21 ASN A 90 0.300 -7.257 4.311 1.00 0.00 H new ATOM 0 HD22 ASN A 90 0.146 -6.147 5.677 1.00 0.00 H new ATOM 1380 N LYS A 91 -0.771 -3.435 6.861 1.00 0.00 N ATOM 1381 CA LYS A 91 0.568 -2.953 7.269 1.00 0.00 C ATOM 1382 C LYS A 91 1.647 -3.867 6.665 1.00 0.00 C ATOM 1383 O LYS A 91 1.431 -5.078 6.584 1.00 0.00 O ATOM 1384 CB LYS A 91 0.707 -2.932 8.810 1.00 0.00 C ATOM 1385 CG LYS A 91 -0.412 -2.235 9.609 1.00 0.00 C ATOM 1386 CD LYS A 91 -0.512 -0.712 9.403 1.00 0.00 C ATOM 1387 CE LYS A 91 -0.086 0.129 10.608 1.00 0.00 C ATOM 1388 NZ LYS A 91 -1.086 0.075 11.706 1.00 0.00 N ATOM 0 H LYS A 91 -1.376 -3.672 7.647 1.00 0.00 H new ATOM 0 HA LYS A 91 0.695 -1.935 6.901 1.00 0.00 H new ATOM 0 HB2 LYS A 91 0.778 -3.963 9.157 1.00 0.00 H new ATOM 0 HB3 LYS A 91 1.651 -2.447 9.057 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -1.366 -2.686 9.337 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -0.257 -2.433 10.670 1.00 0.00 H new ATOM 0 HD2 LYS A 91 0.104 -0.434 8.548 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -1.542 -0.461 9.149 1.00 0.00 H new ATOM 0 HE2 LYS A 91 0.876 -0.227 10.976 1.00 0.00 H new ATOM 0 HE3 LYS A 91 0.055 1.164 10.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -0.792 0.711 12.475 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -2.014 0.374 11.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -1.152 -0.898 12.068 1.00 0.00 H new ATOM 1402 N ALA A 92 2.801 -3.331 6.260 1.00 0.00 N ATOM 1403 CA ALA A 92 3.867 -4.139 5.650 1.00 0.00 C ATOM 1404 C ALA A 92 4.502 -5.143 6.641 1.00 0.00 C ATOM 1405 O ALA A 92 4.916 -6.230 6.233 1.00 0.00 O ATOM 1406 CB ALA A 92 4.905 -3.200 5.025 1.00 0.00 C ATOM 0 H ALA A 92 3.024 -2.339 6.343 1.00 0.00 H new ATOM 0 HA ALA A 92 3.429 -4.759 4.868 1.00 0.00 H new ATOM 0 HB1 ALA A 92 5.701 -3.789 4.569 1.00 0.00 H new ATOM 0 HB2 ALA A 92 4.427 -2.585 4.263 1.00 0.00 H new ATOM 0 HB3 ALA A 92 5.326 -2.557 5.798 1.00 0.00 H new ATOM 1412 N SER A 93 4.527 -4.812 7.939 1.00 0.00 N ATOM 1413 CA SER A 93 4.896 -5.729 9.031 1.00 0.00 C ATOM 1414 C SER A 93 3.695 -6.563 9.495 1.00 0.00 C ATOM 1415 O SER A 93 3.720 -7.793 9.418 1.00 0.00 O ATOM 1416 CB SER A 93 5.512 -4.948 10.204 1.00 0.00 C ATOM 1417 OG SER A 93 5.488 -5.700 11.408 1.00 0.00 O ATOM 0 H SER A 93 4.286 -3.877 8.269 1.00 0.00 H new ATOM 0 HA SER A 93 5.644 -6.423 8.648 1.00 0.00 H new ATOM 0 HB2 SER A 93 6.541 -4.681 9.963 1.00 0.00 H new ATOM 0 HB3 SER A 93 4.966 -4.016 10.347 1.00 0.00 H new ATOM 0 HG SER A 93 5.889 -5.173 12.131 1.00 0.00 H new ATOM 1423 N ALA A 94 2.649 -5.885 9.989 1.00 0.00 N ATOM 1424 CA ALA A 94 1.490 -6.467 10.684 1.00 0.00 C ATOM 1425 C ALA A 94 1.841 -7.385 11.885 1.00 0.00 C ATOM 1426 O ALA A 94 1.008 -8.182 12.327 1.00 0.00 O ATOM 1427 CB ALA A 94 0.535 -7.098 9.659 1.00 0.00 C ATOM 0 H ALA A 94 2.584 -4.870 9.912 1.00 0.00 H new ATOM 0 HA ALA A 94 0.962 -5.650 11.176 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -0.322 -7.528 10.177 1.00 0.00 H new ATOM 0 HB2 ALA A 94 0.192 -6.333 8.963 1.00 0.00 H new ATOM 0 HB3 ALA A 94 1.057 -7.881 9.109 1.00 0.00 H new ATOM 1433 N HIS A 95 3.065 -7.281 12.425 1.00 0.00 N ATOM 1434 CA HIS A 95 3.598 -8.151 13.489 1.00 0.00 C ATOM 1435 C HIS A 95 4.421 -7.388 14.550 1.00 0.00 C ATOM 1436 O HIS A 95 5.211 -7.979 15.289 1.00 0.00 O ATOM 1437 CB HIS A 95 4.383 -9.305 12.833 1.00 0.00 C ATOM 1438 CG HIS A 95 4.222 -10.620 13.554 1.00 0.00 C ATOM 1439 ND1 HIS A 95 5.215 -11.311 14.256 1.00 0.00 N ATOM 1440 CD2 HIS A 95 3.067 -11.347 13.593 1.00 0.00 C ATOM 1441 CE1 HIS A 95 4.629 -12.434 14.711 1.00 0.00 C ATOM 1442 NE2 HIS A 95 3.341 -12.480 14.327 1.00 0.00 N ATOM 0 H HIS A 95 3.732 -6.569 12.126 1.00 0.00 H new ATOM 0 HA HIS A 95 2.762 -8.564 14.054 1.00 0.00 H new ATOM 0 HB2 HIS A 95 4.051 -9.421 11.801 1.00 0.00 H new ATOM 0 HB3 HIS A 95 5.441 -9.043 12.800 1.00 0.00 H new ATOM 0 HD2 HIS A 95 2.123 -11.085 13.138 1.00 0.00 H new ATOM 0 HE1 HIS A 95 5.123 -13.191 15.301 1.00 0.00 H new ATOM 0 HE2 HIS A 95 2.680 -13.226 14.542 1.00 0.00 H new ATOM 1450 N ASN A 96 4.251 -6.062 14.627 1.00 0.00 N ATOM 1451 CA ASN A 96 4.988 -5.173 15.530 1.00 0.00 C ATOM 1452 C ASN A 96 4.657 -5.451 17.015 1.00 0.00 C ATOM 1453 O ASN A 96 3.487 -5.584 17.388 1.00 0.00 O ATOM 1454 CB ASN A 96 4.686 -3.717 15.109 1.00 0.00 C ATOM 1455 CG ASN A 96 5.520 -2.664 15.823 1.00 0.00 C ATOM 1456 OD1 ASN A 96 6.357 -2.941 16.670 1.00 0.00 O ATOM 1457 ND2 ASN A 96 5.316 -1.407 15.503 1.00 0.00 N ATOM 0 H ASN A 96 3.577 -5.565 14.045 1.00 0.00 H new ATOM 0 HA ASN A 96 6.059 -5.356 15.446 1.00 0.00 H new ATOM 0 HB2 ASN A 96 4.848 -3.622 14.035 1.00 0.00 H new ATOM 0 HB3 ASN A 96 3.631 -3.511 15.292 1.00 0.00 H new ATOM 0 HD21 ASN A 96 5.854 -0.671 15.960 1.00 0.00 H new ATOM 0 HD22 ASN A 96 4.620 -1.167 14.797 1.00 0.00 H new ATOM 1464 N LYS A 97 5.691 -5.512 17.868 1.00 0.00 N ATOM 1465 CA LYS A 97 5.600 -5.780 19.319 1.00 0.00 C ATOM 1466 C LYS A 97 5.539 -4.513 20.191 1.00 0.00 C ATOM 1467 O LYS A 97 5.340 -4.617 21.403 1.00 0.00 O ATOM 1468 CB LYS A 97 6.766 -6.696 19.743 1.00 0.00 C ATOM 1469 CG LYS A 97 6.724 -8.068 19.044 1.00 0.00 C ATOM 1470 CD LYS A 97 7.795 -9.040 19.562 1.00 0.00 C ATOM 1471 CE LYS A 97 9.220 -8.559 19.249 1.00 0.00 C ATOM 1472 NZ LYS A 97 10.240 -9.539 19.706 1.00 0.00 N ATOM 0 H LYS A 97 6.652 -5.371 17.558 1.00 0.00 H new ATOM 0 HA LYS A 97 4.648 -6.282 19.490 1.00 0.00 H new ATOM 0 HB2 LYS A 97 7.711 -6.204 19.514 1.00 0.00 H new ATOM 0 HB3 LYS A 97 6.735 -6.841 20.823 1.00 0.00 H new ATOM 0 HG2 LYS A 97 5.739 -8.512 19.187 1.00 0.00 H new ATOM 0 HG3 LYS A 97 6.858 -7.927 17.971 1.00 0.00 H new ATOM 0 HD2 LYS A 97 7.683 -9.160 20.640 1.00 0.00 H new ATOM 0 HD3 LYS A 97 7.639 -10.021 19.114 1.00 0.00 H new ATOM 0 HE2 LYS A 97 9.323 -8.399 18.176 1.00 0.00 H new ATOM 0 HE3 LYS A 97 9.395 -7.598 19.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 11.190 -9.182 19.479 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 10.157 -9.673 20.734 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 10.087 -10.449 19.225 1.00 0.00 H new ATOM 1486 N ASN A 98 5.709 -3.324 19.604 1.00 0.00 N ATOM 1487 CA ASN A 98 5.675 -2.036 20.307 1.00 0.00 C ATOM 1488 C ASN A 98 4.302 -1.751 20.965 1.00 0.00 C ATOM 1489 O ASN A 98 3.259 -2.170 20.454 1.00 0.00 O ATOM 1490 CB ASN A 98 6.085 -0.933 19.312 1.00 0.00 C ATOM 1491 CG ASN A 98 6.174 0.441 19.952 1.00 0.00 C ATOM 1492 OD1 ASN A 98 5.307 1.286 19.793 1.00 0.00 O ATOM 1493 ND2 ASN A 98 7.208 0.700 20.721 1.00 0.00 N ATOM 0 H ASN A 98 5.878 -3.227 18.603 1.00 0.00 H new ATOM 0 HA ASN A 98 6.382 -2.062 21.136 1.00 0.00 H new ATOM 0 HB2 ASN A 98 7.050 -1.187 18.874 1.00 0.00 H new ATOM 0 HB3 ASN A 98 5.363 -0.901 18.496 1.00 0.00 H new ATOM 0 HD21 ASN A 98 7.285 1.606 21.184 1.00 0.00 H new ATOM 0 HD22 ASN A 98 7.933 -0.005 20.855 1.00 0.00 H new ATOM 1500 N LEU A 99 4.312 -1.017 22.087 1.00 0.00 N ATOM 1501 CA LEU A 99 3.133 -0.639 22.884 1.00 0.00 C ATOM 1502 C LEU A 99 2.262 -1.851 23.296 1.00 0.00 C ATOM 1503 O LEU A 99 1.039 -1.859 23.142 1.00 0.00 O ATOM 1504 CB LEU A 99 2.385 0.519 22.184 1.00 0.00 C ATOM 1505 CG LEU A 99 1.383 1.299 23.062 1.00 0.00 C ATOM 1506 CD1 LEU A 99 2.062 2.032 24.223 1.00 0.00 C ATOM 1507 CD2 LEU A 99 0.668 2.349 22.208 1.00 0.00 C ATOM 0 H LEU A 99 5.179 -0.654 22.482 1.00 0.00 H new ATOM 0 HA LEU A 99 3.459 -0.253 23.850 1.00 0.00 H new ATOM 0 HB2 LEU A 99 3.123 1.221 21.796 1.00 0.00 H new ATOM 0 HB3 LEU A 99 1.849 0.114 21.326 1.00 0.00 H new ATOM 0 HG LEU A 99 0.688 0.566 23.472 1.00 0.00 H new ATOM 0 HD11 LEU A 99 1.311 2.563 24.807 1.00 0.00 H new ATOM 0 HD12 LEU A 99 2.573 1.310 24.860 1.00 0.00 H new ATOM 0 HD13 LEU A 99 2.786 2.745 23.829 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -0.040 2.901 22.827 1.00 0.00 H new ATOM 0 HD22 LEU A 99 1.401 3.040 21.792 1.00 0.00 H new ATOM 0 HD23 LEU A 99 0.133 1.855 21.397 1.00 0.00 H new ATOM 1519 N SER A 100 2.911 -2.900 23.814 1.00 0.00 N ATOM 1520 CA SER A 100 2.250 -4.087 24.379 1.00 0.00 C ATOM 1521 C SER A 100 1.555 -3.797 25.721 1.00 0.00 C ATOM 1522 O SER A 100 0.467 -4.320 25.982 1.00 0.00 O ATOM 1523 CB SER A 100 3.273 -5.219 24.540 1.00 0.00 C ATOM 1524 OG SER A 100 4.380 -4.794 25.324 1.00 0.00 O ATOM 0 H SER A 100 3.929 -2.951 23.854 1.00 0.00 H new ATOM 0 HA SER A 100 1.469 -4.390 23.682 1.00 0.00 H new ATOM 0 HB2 SER A 100 2.798 -6.080 25.011 1.00 0.00 H new ATOM 0 HB3 SER A 100 3.620 -5.543 23.559 1.00 0.00 H new ATOM 0 HG SER A 100 5.019 -5.532 25.415 1.00 0.00 H new ATOM 1530 N GLY A 101 2.151 -2.934 26.553 1.00 0.00 N ATOM 1531 CA GLY A 101 1.544 -2.371 27.769 1.00 0.00 C ATOM 1532 C GLY A 101 0.773 -1.060 27.515 1.00 0.00 C ATOM 1533 O GLY A 101 0.824 -0.521 26.403 1.00 0.00 O ATOM 0 H GLY A 101 3.100 -2.596 26.394 1.00 0.00 H new ATOM 0 HA2 GLY A 101 0.865 -3.106 28.201 1.00 0.00 H new ATOM 0 HA3 GLY A 101 2.326 -2.188 28.506 1.00 0.00 H new ATOM 1537 N PRO A 102 0.070 -0.515 28.530 1.00 0.00 N ATOM 1538 CA PRO A 102 -0.686 0.736 28.412 1.00 0.00 C ATOM 1539 C PRO A 102 0.188 1.959 28.091 1.00 0.00 C ATOM 1540 O PRO A 102 1.323 2.073 28.565 1.00 0.00 O ATOM 1541 CB PRO A 102 -1.405 0.921 29.757 1.00 0.00 C ATOM 1542 CG PRO A 102 -1.475 -0.494 30.326 1.00 0.00 C ATOM 1543 CD PRO A 102 -0.169 -1.115 29.835 1.00 0.00 C ATOM 0 HA PRO A 102 -1.378 0.665 27.573 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -0.854 1.591 30.417 1.00 0.00 H new ATOM 0 HB3 PRO A 102 -2.399 1.349 29.625 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -1.538 -0.491 31.414 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -2.346 -1.037 29.958 1.00 0.00 H new ATOM 0 HD2 PRO A 102 0.651 -0.904 30.522 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -0.252 -2.199 29.761 1.00 0.00 H new ATOM 1551 N SER A 103 -0.369 2.928 27.361 1.00 0.00 N ATOM 1552 CA SER A 103 0.278 4.223 27.069 1.00 0.00 C ATOM 1553 C SER A 103 0.445 5.123 28.307 1.00 0.00 C ATOM 1554 O SER A 103 1.287 6.024 28.312 1.00 0.00 O ATOM 1555 CB SER A 103 -0.516 4.961 25.984 1.00 0.00 C ATOM 1556 OG SER A 103 -1.872 5.125 26.377 1.00 0.00 O ATOM 0 H SER A 103 -1.297 2.840 26.947 1.00 0.00 H new ATOM 0 HA SER A 103 1.286 3.998 26.719 1.00 0.00 H new ATOM 0 HB2 SER A 103 -0.066 5.936 25.797 1.00 0.00 H new ATOM 0 HB3 SER A 103 -0.468 4.403 25.049 1.00 0.00 H new ATOM 0 HG SER A 103 -2.362 5.599 25.673 1.00 0.00 H new ATOM 1562 N SER A 104 -0.315 4.855 29.374 1.00 0.00 N ATOM 1563 CA SER A 104 -0.220 5.498 30.694 1.00 0.00 C ATOM 1564 C SER A 104 0.817 4.857 31.639 1.00 0.00 C ATOM 1565 O SER A 104 1.034 5.368 32.743 1.00 0.00 O ATOM 1566 CB SER A 104 -1.611 5.500 31.342 1.00 0.00 C ATOM 1567 OG SER A 104 -2.125 4.177 31.423 1.00 0.00 O ATOM 0 H SER A 104 -1.050 4.149 29.341 1.00 0.00 H new ATOM 0 HA SER A 104 0.137 6.515 30.529 1.00 0.00 H new ATOM 0 HB2 SER A 104 -1.553 5.936 32.340 1.00 0.00 H new ATOM 0 HB3 SER A 104 -2.289 6.125 30.760 1.00 0.00 H new ATOM 0 HG SER A 104 -3.012 4.195 31.840 1.00 0.00 H new ATOM 1573 N GLY A 105 1.461 3.752 31.227 1.00 0.00 N ATOM 1574 CA GLY A 105 2.471 3.008 32.002 1.00 0.00 C ATOM 1575 C GLY A 105 3.767 3.786 32.249 1.00 0.00 C ATOM 1576 O GLY A 105 4.210 3.842 33.418 1.00 0.00 O ATOM 1577 OXT GLY A 105 4.351 4.310 31.273 1.00 0.00 O ATOM 0 H GLY A 105 1.287 3.336 30.312 1.00 0.00 H new ATOM 0 HA2 GLY A 105 2.041 2.726 32.963 1.00 0.00 H new ATOM 0 HA3 GLY A 105 2.709 2.084 31.475 1.00 0.00 H new TER 1581 GLY A 105