USER MOD reduce.3.24.130724 H: found=0, std=0, add=958, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 964 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 103 ASN : amide:sc= 0 X(o=-0.61,f=-1.1) USER MOD Set 1.2: A 104 LYS NZ :NH3+ -154:sc= -0.614 (180deg=-1.1) USER MOD Set 2.1: A 53 HIS : no HD1:sc= -3.22 K(o=-6.4,f=-7.6!) USER MOD Set 2.2: B 53 HIS : no HD1:sc= -3.2 K(o=-6.4,f=-7.6!) USER MOD Single : A 50 THR OG1 : rot -60:sc= 1.22 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0.0078 USER MOD Single : A 66 GLN : amide:sc= -0.543 K(o=-0.54,f=-3.6!) USER MOD Single : A 79 MET CE :methyl 142:sc= -1.39 (180deg=-4.87!) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 MET CE :methyl -148:sc= -0.306 (180deg=-1.35!) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 109:sc= 1.02 USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 101 ASN : amide:sc= -0.568 K(o=-0.57,f=-1.4) USER MOD Single : B 50 THR OG1 : rot 18:sc= 0.727 USER MOD Single : B 55 THR OG1 : rot 180:sc= 0 USER MOD Single : B 59 SER OG : rot 180:sc= 0.00672 USER MOD Single : B 66 GLN : amide:sc= -0.524 K(o=-0.52,f=-3.6!) USER MOD Single : B 79 MET CE :methyl 141:sc= -1.44 (180deg=-4.88!) USER MOD Single : B 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 83 MET CE :methyl -148:sc= -0.288 (180deg=-1.31!) USER MOD Single : B 85 SER OG : rot 180:sc= 0 USER MOD Single : B 94 THR OG1 : rot 115:sc= 1.02 USER MOD Single : B 99 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 101 ASN : amide:sc= -0.646 K(o=-0.65,f=-1.4) USER MOD Single : B 103 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 104 LYS NZ :NH3+ 168:sc= -0.0171 (180deg=-0.169) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 50 -6.215 -39.701 -10.388 1.00 0.00 N ATOM 2 CA THR A 50 -6.355 -39.607 -8.911 1.00 0.00 C ATOM 3 C THR A 50 -4.994 -39.644 -8.224 1.00 0.00 C ATOM 4 O THR A 50 -4.870 -40.114 -7.092 1.00 0.00 O ATOM 5 CB THR A 50 -7.222 -40.771 -8.429 1.00 0.00 C ATOM 6 OG1 THR A 50 -7.262 -40.816 -7.013 1.00 0.00 O ATOM 7 CG2 THR A 50 -6.739 -42.121 -8.914 1.00 0.00 C ATOM 0 HA THR A 50 -6.825 -38.657 -8.656 1.00 0.00 H new ATOM 0 HB THR A 50 -8.211 -40.584 -8.848 1.00 0.00 H new ATOM 0 HG1 THR A 50 -6.354 -40.936 -6.664 1.00 0.00 H new ATOM 0 HG21 THR A 50 -7.399 -42.901 -8.535 1.00 0.00 H new ATOM 0 HG22 THR A 50 -6.744 -42.139 -10.004 1.00 0.00 H new ATOM 0 HG23 THR A 50 -5.726 -42.296 -8.553 1.00 0.00 H new ATOM 17 N ARG A 51 -3.974 -39.146 -8.916 1.00 0.00 N ATOM 18 CA ARG A 51 -2.619 -39.122 -8.374 1.00 0.00 C ATOM 19 C ARG A 51 -2.069 -37.699 -8.352 1.00 0.00 C ATOM 20 O ARG A 51 -2.765 -36.748 -8.704 1.00 0.00 O ATOM 21 CB ARG A 51 -1.702 -40.026 -9.197 1.00 0.00 C ATOM 22 CG ARG A 51 -0.648 -40.738 -8.365 1.00 0.00 C ATOM 23 CD ARG A 51 -0.552 -42.215 -8.720 1.00 0.00 C ATOM 24 NE ARG A 51 -0.756 -43.071 -7.554 1.00 0.00 N ATOM 25 CZ ARG A 51 -1.946 -43.305 -7.006 1.00 0.00 C ATOM 26 NH1 ARG A 51 -3.040 -42.749 -7.513 1.00 0.00 N ATOM 27 NH2 ARG A 51 -2.043 -44.097 -5.947 1.00 0.00 N ATOM 0 H ARG A 51 -4.060 -38.753 -9.854 1.00 0.00 H new ATOM 0 HA ARG A 51 -2.656 -39.493 -7.350 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -2.308 -40.769 -9.715 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -1.207 -39.428 -9.962 1.00 0.00 H new ATOM 0 HG2 ARG A 51 0.320 -40.263 -8.521 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -0.888 -40.633 -7.307 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -1.295 -42.454 -9.480 1.00 0.00 H new ATOM 0 HD3 ARG A 51 0.426 -42.421 -9.155 1.00 0.00 H new ATOM 0 HE ARG A 51 0.061 -43.515 -7.135 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -2.971 -42.138 -8.327 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -3.949 -42.932 -7.088 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -1.206 -44.526 -5.553 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -2.955 -44.277 -5.526 1.00 0.00 H new ATOM 41 N ALA A 52 -0.814 -37.563 -7.931 1.00 0.00 N ATOM 42 CA ALA A 52 -0.168 -36.256 -7.859 1.00 0.00 C ATOM 43 C ALA A 52 -0.835 -35.378 -6.806 1.00 0.00 C ATOM 44 O ALA A 52 -2.059 -35.250 -6.773 1.00 0.00 O ATOM 45 CB ALA A 52 -0.194 -35.572 -9.220 1.00 0.00 C ATOM 0 H ALA A 52 -0.225 -38.341 -7.635 1.00 0.00 H new ATOM 0 HA ALA A 52 0.871 -36.406 -7.567 1.00 0.00 H new ATOM 0 HB1 ALA A 52 0.292 -34.599 -9.148 1.00 0.00 H new ATOM 0 HB2 ALA A 52 0.335 -36.188 -9.947 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -1.227 -35.439 -9.541 1.00 0.00 H new ATOM 51 N HIS A 53 -0.021 -34.777 -5.944 1.00 0.00 N ATOM 52 CA HIS A 53 -0.531 -33.912 -4.885 1.00 0.00 C ATOM 53 C HIS A 53 -0.571 -32.456 -5.335 1.00 0.00 C ATOM 54 O HIS A 53 0.430 -31.913 -5.801 1.00 0.00 O ATOM 55 CB HIS A 53 0.335 -34.044 -3.632 1.00 0.00 C ATOM 56 CG HIS A 53 0.531 -35.460 -3.184 1.00 0.00 C ATOM 57 ND1 HIS A 53 -0.164 -36.522 -3.723 1.00 0.00 N ATOM 58 CD2 HIS A 53 1.350 -35.988 -2.244 1.00 0.00 C ATOM 59 CE1 HIS A 53 0.219 -37.641 -3.132 1.00 0.00 C ATOM 60 NE2 HIS A 53 1.137 -37.343 -2.231 1.00 0.00 N ATOM 0 H HIS A 53 0.994 -34.873 -5.958 1.00 0.00 H new ATOM 0 HA HIS A 53 -1.549 -34.228 -4.655 1.00 0.00 H new ATOM 0 HB2 HIS A 53 1.309 -33.595 -3.825 1.00 0.00 H new ATOM 0 HB3 HIS A 53 -0.123 -33.476 -2.822 1.00 0.00 H new ATOM 0 HD2 HIS A 53 2.043 -35.443 -1.620 1.00 0.00 H new ATOM 0 HE1 HIS A 53 -0.155 -38.630 -3.349 1.00 0.00 H new ATOM 0 HE2 HIS A 53 1.611 -38.012 -1.624 1.00 0.00 H new ATOM 69 N LEU A 54 -1.733 -31.827 -5.185 1.00 0.00 N ATOM 70 CA LEU A 54 -1.899 -30.429 -5.569 1.00 0.00 C ATOM 71 C LEU A 54 -3.280 -29.908 -5.161 1.00 0.00 C ATOM 72 O LEU A 54 -3.444 -29.398 -4.054 1.00 0.00 O ATOM 73 CB LEU A 54 -1.678 -30.261 -7.076 1.00 0.00 C ATOM 74 CG LEU A 54 -1.957 -28.858 -7.621 1.00 0.00 C ATOM 75 CD1 LEU A 54 -0.708 -27.994 -7.539 1.00 0.00 C ATOM 76 CD2 LEU A 54 -2.462 -28.933 -9.053 1.00 0.00 C ATOM 0 H LEU A 54 -2.572 -32.262 -4.801 1.00 0.00 H new ATOM 0 HA LEU A 54 -1.150 -29.838 -5.041 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -0.646 -30.525 -7.308 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -2.315 -30.972 -7.602 1.00 0.00 H new ATOM 0 HG LEU A 54 -2.732 -28.399 -7.007 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -0.926 -27.001 -7.931 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -0.390 -27.912 -6.500 1.00 0.00 H new ATOM 0 HD13 LEU A 54 0.089 -28.449 -8.127 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -2.655 -27.926 -9.424 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -1.710 -29.413 -9.679 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -3.384 -29.514 -9.084 1.00 0.00 H new ATOM 88 N THR A 55 -4.258 -30.044 -6.066 1.00 0.00 N ATOM 89 CA THR A 55 -5.642 -29.596 -5.844 1.00 0.00 C ATOM 90 C THR A 55 -5.850 -28.884 -4.493 1.00 0.00 C ATOM 91 O THR A 55 -5.540 -27.701 -4.361 1.00 0.00 O ATOM 92 CB THR A 55 -6.598 -30.783 -5.985 1.00 0.00 C ATOM 93 OG1 THR A 55 -6.532 -31.324 -7.292 1.00 0.00 O ATOM 94 CG2 THR A 55 -8.045 -30.432 -5.709 1.00 0.00 C ATOM 0 H THR A 55 -4.111 -30.471 -6.981 1.00 0.00 H new ATOM 0 HA THR A 55 -5.860 -28.850 -6.608 1.00 0.00 H new ATOM 0 HB THR A 55 -6.270 -31.504 -5.237 1.00 0.00 H new ATOM 0 HG1 THR A 55 -7.148 -32.083 -7.363 1.00 0.00 H new ATOM 0 HG21 THR A 55 -8.664 -31.321 -5.828 1.00 0.00 H new ATOM 0 HG22 THR A 55 -8.140 -30.057 -4.690 1.00 0.00 H new ATOM 0 HG23 THR A 55 -8.373 -29.665 -6.410 1.00 0.00 H new ATOM 102 N GLU A 56 -6.390 -29.604 -3.504 1.00 0.00 N ATOM 103 CA GLU A 56 -6.657 -29.035 -2.180 1.00 0.00 C ATOM 104 C GLU A 56 -5.591 -28.027 -1.751 1.00 0.00 C ATOM 105 O GLU A 56 -5.852 -26.827 -1.676 1.00 0.00 O ATOM 106 CB GLU A 56 -6.760 -30.154 -1.139 1.00 0.00 C ATOM 107 CG GLU A 56 -7.183 -29.667 0.238 1.00 0.00 C ATOM 108 CD GLU A 56 -8.687 -29.543 0.375 1.00 0.00 C ATOM 109 OE1 GLU A 56 -9.351 -30.578 0.602 1.00 0.00 O ATOM 110 OE2 GLU A 56 -9.204 -28.412 0.256 1.00 0.00 O ATOM 0 H GLU A 56 -6.651 -30.586 -3.597 1.00 0.00 H new ATOM 0 HA GLU A 56 -7.604 -28.500 -2.246 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -7.476 -30.898 -1.488 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -5.795 -30.653 -1.058 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -6.809 -30.357 0.994 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -6.723 -28.699 0.434 1.00 0.00 H new ATOM 117 N VAL A 57 -4.393 -28.523 -1.465 1.00 0.00 N ATOM 118 CA VAL A 57 -3.292 -27.661 -1.035 1.00 0.00 C ATOM 119 C VAL A 57 -3.165 -26.426 -1.926 1.00 0.00 C ATOM 120 O VAL A 57 -2.754 -25.351 -1.465 1.00 0.00 O ATOM 121 CB VAL A 57 -1.945 -28.410 -1.023 1.00 0.00 C ATOM 122 CG1 VAL A 57 -0.911 -27.612 -0.242 1.00 0.00 C ATOM 123 CG2 VAL A 57 -2.099 -29.808 -0.440 1.00 0.00 C ATOM 0 H VAL A 57 -4.157 -29.514 -1.522 1.00 0.00 H new ATOM 0 HA VAL A 57 -3.531 -27.349 -0.018 1.00 0.00 H new ATOM 0 HB VAL A 57 -1.602 -28.517 -2.052 1.00 0.00 H new ATOM 0 HG11 VAL A 57 0.037 -28.150 -0.239 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -0.774 -26.637 -0.710 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -1.254 -27.477 0.784 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -1.133 -30.312 -0.444 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -2.467 -29.737 0.584 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -2.808 -30.377 -1.041 1.00 0.00 H new ATOM 133 N GLU A 58 -3.548 -26.572 -3.196 1.00 0.00 N ATOM 134 CA GLU A 58 -3.492 -25.461 -4.128 1.00 0.00 C ATOM 135 C GLU A 58 -4.501 -24.416 -3.702 1.00 0.00 C ATOM 136 O GLU A 58 -4.182 -23.237 -3.574 1.00 0.00 O ATOM 137 CB GLU A 58 -3.749 -25.945 -5.566 1.00 0.00 C ATOM 138 CG GLU A 58 -5.142 -25.640 -6.094 1.00 0.00 C ATOM 139 CD GLU A 58 -5.381 -26.210 -7.479 1.00 0.00 C ATOM 140 OE1 GLU A 58 -4.581 -25.911 -8.390 1.00 0.00 O ATOM 141 OE2 GLU A 58 -6.367 -26.956 -7.652 1.00 0.00 O ATOM 0 H GLU A 58 -3.897 -27.444 -3.594 1.00 0.00 H new ATOM 0 HA GLU A 58 -2.497 -25.016 -4.116 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -3.015 -25.485 -6.227 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -3.586 -27.022 -5.608 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -5.884 -26.045 -5.406 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -5.288 -24.560 -6.120 1.00 0.00 H new ATOM 148 N SER A 59 -5.712 -24.866 -3.431 1.00 0.00 N ATOM 149 CA SER A 59 -6.754 -23.973 -2.964 1.00 0.00 C ATOM 150 C SER A 59 -6.376 -23.438 -1.586 1.00 0.00 C ATOM 151 O SER A 59 -6.963 -22.478 -1.104 1.00 0.00 O ATOM 152 CB SER A 59 -8.099 -24.701 -2.898 1.00 0.00 C ATOM 153 OG SER A 59 -8.272 -25.554 -4.016 1.00 0.00 O ATOM 0 H SER A 59 -5.997 -25.841 -3.526 1.00 0.00 H new ATOM 0 HA SER A 59 -6.853 -23.143 -3.663 1.00 0.00 H new ATOM 0 HB2 SER A 59 -8.156 -25.285 -1.979 1.00 0.00 H new ATOM 0 HB3 SER A 59 -8.909 -23.973 -2.863 1.00 0.00 H new ATOM 0 HG SER A 59 -9.138 -26.009 -3.950 1.00 0.00 H new ATOM 159 N ARG A 60 -5.391 -24.083 -0.962 1.00 0.00 N ATOM 160 CA ARG A 60 -4.922 -23.696 0.359 1.00 0.00 C ATOM 161 C ARG A 60 -4.034 -22.464 0.305 1.00 0.00 C ATOM 162 O ARG A 60 -4.463 -21.354 0.666 1.00 0.00 O ATOM 163 CB ARG A 60 -4.149 -24.857 0.990 1.00 0.00 C ATOM 164 CG ARG A 60 -4.330 -24.968 2.496 1.00 0.00 C ATOM 165 CD ARG A 60 -3.988 -23.664 3.198 1.00 0.00 C ATOM 166 NE ARG A 60 -3.584 -23.881 4.587 1.00 0.00 N ATOM 167 CZ ARG A 60 -4.421 -24.256 5.552 1.00 0.00 C ATOM 168 NH1 ARG A 60 -5.706 -24.456 5.286 1.00 0.00 N ATOM 169 NH2 ARG A 60 -3.971 -24.431 6.787 1.00 0.00 N ATOM 0 H ARG A 60 -4.901 -24.884 -1.359 1.00 0.00 H new ATOM 0 HA ARG A 60 -5.795 -23.453 0.964 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -4.469 -25.790 0.525 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -3.088 -24.738 0.769 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -5.361 -25.243 2.720 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -3.696 -25.767 2.881 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -3.183 -23.163 2.660 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -4.852 -23.000 3.171 1.00 0.00 H new ATOM 0 HE ARG A 60 -2.604 -23.737 4.830 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -6.057 -24.322 4.338 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -6.342 -24.743 6.030 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -2.985 -24.278 6.997 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -4.611 -24.718 7.527 1.00 0.00 H new ATOM 183 N LEU A 61 -2.787 -22.644 -0.136 1.00 0.00 N ATOM 184 CA LEU A 61 -1.878 -21.517 -0.201 1.00 0.00 C ATOM 185 C LEU A 61 -2.439 -20.456 -1.134 1.00 0.00 C ATOM 186 O LEU A 61 -2.176 -19.264 -0.977 1.00 0.00 O ATOM 187 CB LEU A 61 -0.483 -21.979 -0.601 1.00 0.00 C ATOM 188 CG LEU A 61 0.287 -22.644 0.540 1.00 0.00 C ATOM 189 CD1 LEU A 61 0.570 -21.642 1.652 1.00 0.00 C ATOM 190 CD2 LEU A 61 -0.499 -23.832 1.080 1.00 0.00 C ATOM 0 H LEU A 61 -2.399 -23.536 -0.444 1.00 0.00 H new ATOM 0 HA LEU A 61 -1.783 -21.063 0.785 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -0.565 -22.680 -1.431 1.00 0.00 H new ATOM 0 HB3 LEU A 61 0.086 -21.122 -0.962 1.00 0.00 H new ATOM 0 HG LEU A 61 1.241 -23.002 0.153 1.00 0.00 H new ATOM 0 HD11 LEU A 61 1.119 -22.135 2.455 1.00 0.00 H new ATOM 0 HD12 LEU A 61 1.166 -20.819 1.257 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -0.372 -21.254 2.041 1.00 0.00 H new ATOM 0 HD21 LEU A 61 0.059 -24.298 1.892 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -1.465 -23.490 1.452 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -0.654 -24.559 0.282 1.00 0.00 H new ATOM 202 N GLU A 62 -3.272 -20.896 -2.066 1.00 0.00 N ATOM 203 CA GLU A 62 -3.929 -19.975 -2.971 1.00 0.00 C ATOM 204 C GLU A 62 -5.009 -19.228 -2.198 1.00 0.00 C ATOM 205 O GLU A 62 -5.223 -18.031 -2.401 1.00 0.00 O ATOM 206 CB GLU A 62 -4.533 -20.717 -4.161 1.00 0.00 C ATOM 207 CG GLU A 62 -5.098 -19.796 -5.230 1.00 0.00 C ATOM 208 CD GLU A 62 -5.010 -20.396 -6.620 1.00 0.00 C ATOM 209 OE1 GLU A 62 -5.795 -21.321 -6.918 1.00 0.00 O ATOM 210 OE2 GLU A 62 -4.158 -19.940 -7.410 1.00 0.00 O ATOM 0 H GLU A 62 -3.505 -21.878 -2.212 1.00 0.00 H new ATOM 0 HA GLU A 62 -3.200 -19.268 -3.366 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -3.769 -21.353 -4.608 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -5.326 -21.375 -3.804 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -6.140 -19.573 -4.999 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -4.558 -18.849 -5.212 1.00 0.00 H new ATOM 217 N ARG A 63 -5.673 -19.944 -1.280 1.00 0.00 N ATOM 218 CA ARG A 63 -6.707 -19.339 -0.451 1.00 0.00 C ATOM 219 C ARG A 63 -6.114 -18.187 0.337 1.00 0.00 C ATOM 220 O ARG A 63 -6.738 -17.135 0.483 1.00 0.00 O ATOM 221 CB ARG A 63 -7.316 -20.364 0.511 1.00 0.00 C ATOM 222 CG ARG A 63 -8.712 -20.818 0.113 1.00 0.00 C ATOM 223 CD ARG A 63 -9.739 -19.722 0.349 1.00 0.00 C ATOM 224 NE ARG A 63 -11.102 -20.247 0.381 1.00 0.00 N ATOM 225 CZ ARG A 63 -12.191 -19.493 0.231 1.00 0.00 C ATOM 226 NH1 ARG A 63 -12.080 -18.185 0.038 1.00 0.00 N ATOM 227 NH2 ARG A 63 -13.393 -20.051 0.274 1.00 0.00 N ATOM 0 H ARG A 63 -5.509 -20.934 -1.099 1.00 0.00 H new ATOM 0 HA ARG A 63 -7.500 -18.973 -1.103 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.661 -21.234 0.564 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -7.355 -19.933 1.511 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -8.717 -21.104 -0.939 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -8.985 -21.704 0.685 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -9.522 -19.219 1.291 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -9.657 -18.973 -0.439 1.00 0.00 H new ATOM 0 HE ARG A 63 -11.228 -21.249 0.527 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -11.158 -17.751 0.004 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -12.917 -17.613 -0.076 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -13.484 -21.056 0.422 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -14.227 -19.475 0.159 1.00 0.00 H new ATOM 241 N LEU A 64 -4.890 -18.378 0.831 1.00 0.00 N ATOM 242 CA LEU A 64 -4.227 -17.316 1.582 1.00 0.00 C ATOM 243 C LEU A 64 -3.661 -16.274 0.631 1.00 0.00 C ATOM 244 O LEU A 64 -3.473 -15.113 0.996 1.00 0.00 O ATOM 245 CB LEU A 64 -3.133 -17.858 2.512 1.00 0.00 C ATOM 246 CG LEU A 64 -2.228 -18.944 1.928 1.00 0.00 C ATOM 247 CD1 LEU A 64 -0.996 -18.325 1.283 1.00 0.00 C ATOM 248 CD2 LEU A 64 -1.823 -19.924 3.020 1.00 0.00 C ATOM 0 H LEU A 64 -4.350 -19.237 0.728 1.00 0.00 H new ATOM 0 HA LEU A 64 -4.978 -16.846 2.217 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -2.507 -17.023 2.828 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -3.610 -18.255 3.408 1.00 0.00 H new ATOM 0 HG LEU A 64 -2.780 -19.483 1.158 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -0.365 -19.114 0.873 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -1.304 -17.653 0.482 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -0.436 -17.764 2.032 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -1.179 -20.695 2.597 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -1.285 -19.392 3.805 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -2.715 -20.388 3.441 1.00 0.00 H new ATOM 260 N GLU A 65 -3.423 -16.696 -0.600 1.00 0.00 N ATOM 261 CA GLU A 65 -2.911 -15.806 -1.634 1.00 0.00 C ATOM 262 C GLU A 65 -3.955 -14.740 -1.950 1.00 0.00 C ATOM 263 O GLU A 65 -3.622 -13.591 -2.237 1.00 0.00 O ATOM 264 CB GLU A 65 -2.551 -16.612 -2.894 1.00 0.00 C ATOM 265 CG GLU A 65 -2.675 -15.840 -4.204 1.00 0.00 C ATOM 266 CD GLU A 65 -1.644 -14.737 -4.338 1.00 0.00 C ATOM 267 OE1 GLU A 65 -1.505 -13.933 -3.393 1.00 0.00 O ATOM 268 OE2 GLU A 65 -0.974 -14.676 -5.391 1.00 0.00 O ATOM 0 H GLU A 65 -3.577 -17.655 -0.911 1.00 0.00 H new ATOM 0 HA GLU A 65 -2.006 -15.314 -1.277 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -1.527 -16.973 -2.797 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -3.195 -17.490 -2.943 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -2.570 -16.532 -5.039 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -3.673 -15.408 -4.272 1.00 0.00 H new ATOM 275 N GLN A 66 -5.226 -15.130 -1.879 1.00 0.00 N ATOM 276 CA GLN A 66 -6.321 -14.206 -2.142 1.00 0.00 C ATOM 277 C GLN A 66 -6.469 -13.215 -0.992 1.00 0.00 C ATOM 278 O GLN A 66 -6.927 -12.089 -1.182 1.00 0.00 O ATOM 279 CB GLN A 66 -7.629 -14.973 -2.349 1.00 0.00 C ATOM 280 CG GLN A 66 -8.105 -14.983 -3.790 1.00 0.00 C ATOM 281 CD GLN A 66 -7.772 -16.279 -4.505 1.00 0.00 C ATOM 282 OE1 GLN A 66 -7.132 -17.166 -3.940 1.00 0.00 O ATOM 283 NE2 GLN A 66 -8.207 -16.395 -5.755 1.00 0.00 N ATOM 0 H GLN A 66 -5.520 -16.078 -1.642 1.00 0.00 H new ATOM 0 HA GLN A 66 -6.093 -13.652 -3.053 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -7.495 -16.001 -2.012 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -8.403 -14.530 -1.722 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -9.183 -14.826 -3.814 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -7.650 -14.150 -4.325 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -8.734 -15.635 -6.184 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -8.014 -17.245 -6.285 1.00 0.00 H new ATOM 292 N LEU A 67 -6.077 -13.647 0.203 1.00 0.00 N ATOM 293 CA LEU A 67 -6.160 -12.802 1.389 1.00 0.00 C ATOM 294 C LEU A 67 -4.852 -12.043 1.622 1.00 0.00 C ATOM 295 O LEU A 67 -4.739 -11.272 2.573 1.00 0.00 O ATOM 296 CB LEU A 67 -6.498 -13.653 2.617 1.00 0.00 C ATOM 297 CG LEU A 67 -7.753 -13.223 3.377 1.00 0.00 C ATOM 298 CD1 LEU A 67 -8.464 -14.432 3.964 1.00 0.00 C ATOM 299 CD2 LEU A 67 -7.396 -12.230 4.472 1.00 0.00 C ATOM 0 H LEU A 67 -5.698 -14.578 0.375 1.00 0.00 H new ATOM 0 HA LEU A 67 -6.952 -12.070 1.228 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -6.621 -14.689 2.300 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -5.650 -13.628 3.302 1.00 0.00 H new ATOM 0 HG LEU A 67 -8.430 -12.735 2.676 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -9.354 -14.105 4.501 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -8.753 -15.110 3.161 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -7.795 -14.949 4.652 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -8.300 -11.934 5.004 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -6.700 -12.694 5.171 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -6.932 -11.350 4.028 1.00 0.00 H new ATOM 311 N PHE A 68 -3.869 -12.265 0.745 1.00 0.00 N ATOM 312 CA PHE A 68 -2.566 -11.603 0.849 1.00 0.00 C ATOM 313 C PHE A 68 -2.014 -11.667 2.275 1.00 0.00 C ATOM 314 O PHE A 68 -1.286 -12.596 2.623 1.00 0.00 O ATOM 315 CB PHE A 68 -2.644 -10.143 0.369 1.00 0.00 C ATOM 316 CG PHE A 68 -4.031 -9.560 0.373 1.00 0.00 C ATOM 317 CD1 PHE A 68 -4.974 -9.980 -0.550 1.00 0.00 C ATOM 318 CD2 PHE A 68 -4.388 -8.596 1.301 1.00 0.00 C ATOM 319 CE1 PHE A 68 -6.251 -9.448 -0.547 1.00 0.00 C ATOM 320 CE2 PHE A 68 -5.663 -8.060 1.309 1.00 0.00 C ATOM 321 CZ PHE A 68 -6.595 -8.487 0.383 1.00 0.00 C ATOM 0 H PHE A 68 -3.952 -12.901 -0.048 1.00 0.00 H new ATOM 0 HA PHE A 68 -1.879 -12.143 0.198 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -2.004 -9.530 1.004 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -2.241 -10.084 -0.642 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -4.710 -10.731 -1.280 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -3.663 -8.259 2.027 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -6.978 -9.784 -1.271 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -5.929 -7.309 2.038 1.00 0.00 H new ATOM 0 HZ PHE A 68 -7.591 -8.070 0.386 1.00 0.00 H new ATOM 331 N LEU A 69 -2.360 -10.678 3.096 1.00 0.00 N ATOM 332 CA LEU A 69 -1.893 -10.632 4.478 1.00 0.00 C ATOM 333 C LEU A 69 -0.375 -10.474 4.535 1.00 0.00 C ATOM 334 O LEU A 69 0.260 -10.855 5.519 1.00 0.00 O ATOM 335 CB LEU A 69 -2.314 -11.896 5.227 1.00 0.00 C ATOM 336 CG LEU A 69 -2.160 -11.828 6.750 1.00 0.00 C ATOM 337 CD1 LEU A 69 -3.466 -11.396 7.400 1.00 0.00 C ATOM 338 CD2 LEU A 69 -1.708 -13.173 7.301 1.00 0.00 C ATOM 0 H LEU A 69 -2.961 -9.899 2.828 1.00 0.00 H new ATOM 0 HA LEU A 69 -2.350 -9.767 4.959 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -3.357 -12.109 4.992 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -1.725 -12.734 4.854 1.00 0.00 H new ATOM 0 HG LEU A 69 -1.397 -11.086 6.986 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -3.337 -11.353 8.482 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -3.749 -10.411 7.029 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -4.249 -12.114 7.156 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -1.604 -13.106 8.384 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -2.448 -13.935 7.054 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -0.748 -13.443 6.860 1.00 0.00 H new ATOM 350 N LEU A 70 0.200 -9.912 3.477 1.00 0.00 N ATOM 351 CA LEU A 70 1.641 -9.704 3.408 1.00 0.00 C ATOM 352 C LEU A 70 1.975 -8.463 2.587 1.00 0.00 C ATOM 353 O LEU A 70 2.763 -7.618 3.013 1.00 0.00 O ATOM 354 CB LEU A 70 2.326 -10.932 2.800 1.00 0.00 C ATOM 355 CG LEU A 70 2.363 -12.165 3.704 1.00 0.00 C ATOM 356 CD1 LEU A 70 2.532 -13.429 2.876 1.00 0.00 C ATOM 357 CD2 LEU A 70 3.483 -12.041 4.727 1.00 0.00 C ATOM 0 H LEU A 70 -0.311 -9.592 2.654 1.00 0.00 H new ATOM 0 HA LEU A 70 2.010 -9.555 4.423 1.00 0.00 H new ATOM 0 HB2 LEU A 70 1.814 -11.194 1.874 1.00 0.00 H new ATOM 0 HB3 LEU A 70 3.349 -10.664 2.534 1.00 0.00 H new ATOM 0 HG LEU A 70 1.415 -12.230 4.238 1.00 0.00 H new ATOM 0 HD11 LEU A 70 2.556 -14.296 3.536 1.00 0.00 H new ATOM 0 HD12 LEU A 70 1.696 -13.524 2.183 1.00 0.00 H new ATOM 0 HD13 LEU A 70 3.465 -13.374 2.315 1.00 0.00 H new ATOM 0 HD21 LEU A 70 3.495 -12.927 5.362 1.00 0.00 H new ATOM 0 HD22 LEU A 70 4.439 -11.951 4.211 1.00 0.00 H new ATOM 0 HD23 LEU A 70 3.318 -11.156 5.342 1.00 0.00 H new ATOM 369 N ILE A 71 1.371 -8.359 1.408 1.00 0.00 N ATOM 370 CA ILE A 71 1.604 -7.221 0.528 1.00 0.00 C ATOM 371 C ILE A 71 0.735 -6.032 0.923 1.00 0.00 C ATOM 372 O ILE A 71 1.148 -4.879 0.793 1.00 0.00 O ATOM 373 CB ILE A 71 1.323 -7.581 -0.943 1.00 0.00 C ATOM 374 CG1 ILE A 71 2.015 -8.894 -1.310 1.00 0.00 C ATOM 375 CG2 ILE A 71 1.781 -6.458 -1.862 1.00 0.00 C ATOM 376 CD1 ILE A 71 1.132 -10.110 -1.142 1.00 0.00 C ATOM 0 H ILE A 71 0.716 -9.049 1.040 1.00 0.00 H new ATOM 0 HA ILE A 71 2.655 -6.951 0.634 1.00 0.00 H new ATOM 0 HB ILE A 71 0.248 -7.711 -1.070 1.00 0.00 H new ATOM 0 HG12 ILE A 71 2.353 -8.840 -2.345 1.00 0.00 H new ATOM 0 HG13 ILE A 71 2.904 -9.012 -0.691 1.00 0.00 H new ATOM 0 HG21 ILE A 71 1.575 -6.729 -2.898 1.00 0.00 H new ATOM 0 HG22 ILE A 71 1.245 -5.542 -1.613 1.00 0.00 H new ATOM 0 HG23 ILE A 71 2.852 -6.298 -1.735 1.00 0.00 H new ATOM 0 HD11 ILE A 71 1.688 -11.005 -1.420 1.00 0.00 H new ATOM 0 HD12 ILE A 71 0.815 -10.189 -0.102 1.00 0.00 H new ATOM 0 HD13 ILE A 71 0.255 -10.014 -1.782 1.00 0.00 H new ATOM 388 N PHE A 72 -0.471 -6.319 1.403 1.00 0.00 N ATOM 389 CA PHE A 72 -1.398 -5.273 1.815 1.00 0.00 C ATOM 390 C PHE A 72 -1.453 -5.163 3.338 1.00 0.00 C ATOM 391 O PHE A 72 -2.232 -5.857 3.990 1.00 0.00 O ATOM 392 CB PHE A 72 -2.797 -5.554 1.260 1.00 0.00 C ATOM 393 CG PHE A 72 -3.475 -4.337 0.700 1.00 0.00 C ATOM 394 CD1 PHE A 72 -3.173 -3.884 -0.576 1.00 0.00 C ATOM 395 CD2 PHE A 72 -4.411 -3.642 1.449 1.00 0.00 C ATOM 396 CE1 PHE A 72 -3.795 -2.763 -1.092 1.00 0.00 C ATOM 397 CE2 PHE A 72 -5.035 -2.520 0.937 1.00 0.00 C ATOM 398 CZ PHE A 72 -4.726 -2.080 -0.336 1.00 0.00 C ATOM 0 H PHE A 72 -0.828 -7.268 1.516 1.00 0.00 H new ATOM 0 HA PHE A 72 -1.040 -4.325 1.413 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -2.724 -6.311 0.479 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -3.417 -5.973 2.053 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -2.444 -4.413 -1.172 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -4.656 -3.981 2.445 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -3.552 -2.421 -2.087 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -5.763 -1.988 1.531 1.00 0.00 H new ATOM 0 HZ PHE A 72 -5.212 -1.204 -0.738 1.00 0.00 H new ATOM 408 N PRO A 73 -0.623 -4.283 3.928 1.00 0.00 N ATOM 409 CA PRO A 73 -0.584 -4.090 5.381 1.00 0.00 C ATOM 410 C PRO A 73 -1.851 -3.428 5.912 1.00 0.00 C ATOM 411 O PRO A 73 -2.836 -3.279 5.187 1.00 0.00 O ATOM 412 CB PRO A 73 0.624 -3.173 5.588 1.00 0.00 C ATOM 413 CG PRO A 73 0.778 -2.449 4.296 1.00 0.00 C ATOM 414 CD PRO A 73 0.340 -3.413 3.228 1.00 0.00 C ATOM 0 HA PRO A 73 -0.512 -5.038 5.915 1.00 0.00 H new ATOM 0 HB2 PRO A 73 0.458 -2.480 6.412 1.00 0.00 H new ATOM 0 HB3 PRO A 73 1.519 -3.746 5.829 1.00 0.00 H new ATOM 0 HG2 PRO A 73 0.169 -1.545 4.280 1.00 0.00 H new ATOM 0 HG3 PRO A 73 1.812 -2.140 4.143 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -0.122 -2.897 2.386 1.00 0.00 H new ATOM 0 HD3 PRO A 73 1.181 -3.982 2.831 1.00 0.00 H new ATOM 422 N ARG A 74 -1.824 -3.035 7.181 1.00 0.00 N ATOM 423 CA ARG A 74 -2.973 -2.393 7.806 1.00 0.00 C ATOM 424 C ARG A 74 -2.535 -1.346 8.824 1.00 0.00 C ATOM 425 O ARG A 74 -2.446 -1.626 10.020 1.00 0.00 O ATOM 426 CB ARG A 74 -3.863 -3.436 8.482 1.00 0.00 C ATOM 427 CG ARG A 74 -4.854 -4.093 7.536 1.00 0.00 C ATOM 428 CD ARG A 74 -6.225 -3.441 7.622 1.00 0.00 C ATOM 429 NE ARG A 74 -6.893 -3.395 6.323 1.00 0.00 N ATOM 430 CZ ARG A 74 -7.928 -2.605 6.051 1.00 0.00 C ATOM 431 NH1 ARG A 74 -8.419 -1.796 6.983 1.00 0.00 N ATOM 432 NH2 ARG A 74 -8.477 -2.624 4.844 1.00 0.00 N ATOM 0 H ARG A 74 -1.019 -3.150 7.796 1.00 0.00 H new ATOM 0 HA ARG A 74 -3.541 -1.891 7.023 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -3.233 -4.206 8.927 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -4.410 -2.962 9.297 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -4.482 -4.026 6.514 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -4.939 -5.153 7.775 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -6.845 -3.993 8.329 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -6.121 -2.428 8.012 1.00 0.00 H new ATOM 0 HE ARG A 74 -6.545 -4.004 5.582 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -8.002 -1.778 7.914 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -9.213 -1.193 6.768 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -8.106 -3.244 4.125 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -9.271 -2.018 4.635 1.00 0.00 H new ATOM 446 N GLU A 75 -2.270 -0.138 8.339 1.00 0.00 N ATOM 447 CA GLU A 75 -1.849 0.960 9.201 1.00 0.00 C ATOM 448 C GLU A 75 -2.872 2.090 9.168 1.00 0.00 C ATOM 449 O GLU A 75 -3.728 2.139 8.284 1.00 0.00 O ATOM 450 CB GLU A 75 -0.476 1.480 8.768 1.00 0.00 C ATOM 451 CG GLU A 75 0.495 1.666 9.923 1.00 0.00 C ATOM 452 CD GLU A 75 1.782 0.887 9.736 1.00 0.00 C ATOM 453 OE1 GLU A 75 1.718 -0.252 9.225 1.00 0.00 O ATOM 454 OE2 GLU A 75 2.854 1.415 10.100 1.00 0.00 O ATOM 0 H GLU A 75 -2.340 0.106 7.351 1.00 0.00 H new ATOM 0 HA GLU A 75 -1.777 0.586 10.222 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -0.043 0.785 8.049 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -0.603 2.433 8.254 1.00 0.00 H new ATOM 0 HG2 GLU A 75 0.728 2.725 10.029 1.00 0.00 H new ATOM 0 HG3 GLU A 75 0.016 1.351 10.850 1.00 0.00 H new ATOM 461 N ASP A 76 -2.780 2.998 10.133 1.00 0.00 N ATOM 462 CA ASP A 76 -3.700 4.126 10.209 1.00 0.00 C ATOM 463 C ASP A 76 -3.158 5.326 9.438 1.00 0.00 C ATOM 464 O ASP A 76 -3.116 6.443 9.954 1.00 0.00 O ATOM 465 CB ASP A 76 -3.952 4.508 11.670 1.00 0.00 C ATOM 466 CG ASP A 76 -5.401 4.869 11.930 1.00 0.00 C ATOM 467 OD1 ASP A 76 -6.251 3.954 11.931 1.00 0.00 O ATOM 468 OD2 ASP A 76 -5.688 6.069 12.131 1.00 0.00 O ATOM 0 H ASP A 76 -2.078 2.975 10.873 1.00 0.00 H new ATOM 0 HA ASP A 76 -4.643 3.825 9.753 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -3.666 3.677 12.315 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -3.316 5.352 11.937 1.00 0.00 H new ATOM 473 N LEU A 77 -2.742 5.088 8.198 1.00 0.00 N ATOM 474 CA LEU A 77 -2.204 6.149 7.353 1.00 0.00 C ATOM 475 C LEU A 77 -1.809 5.609 5.982 1.00 0.00 C ATOM 476 O LEU A 77 -1.399 4.455 5.852 1.00 0.00 O ATOM 477 CB LEU A 77 -0.989 6.798 8.026 1.00 0.00 C ATOM 478 CG LEU A 77 -0.870 8.311 7.832 1.00 0.00 C ATOM 479 CD1 LEU A 77 -0.538 8.640 6.384 1.00 0.00 C ATOM 480 CD2 LEU A 77 -2.152 9.007 8.259 1.00 0.00 C ATOM 0 H LEU A 77 -2.767 4.169 7.756 1.00 0.00 H new ATOM 0 HA LEU A 77 -2.983 6.899 7.217 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -1.029 6.587 9.095 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -0.085 6.326 7.641 1.00 0.00 H new ATOM 0 HG LEU A 77 -0.057 8.675 8.461 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -0.457 9.721 6.266 1.00 0.00 H new ATOM 0 HD12 LEU A 77 0.409 8.174 6.113 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -1.328 8.262 5.735 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -2.048 10.082 8.114 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -2.984 8.638 7.658 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -2.345 8.800 9.312 1.00 0.00 H new ATOM 492 N ASP A 78 -1.931 6.455 4.965 1.00 0.00 N ATOM 493 CA ASP A 78 -1.583 6.069 3.601 1.00 0.00 C ATOM 494 C ASP A 78 -0.100 6.307 3.335 1.00 0.00 C ATOM 495 O ASP A 78 0.286 7.310 2.724 1.00 0.00 O ATOM 496 CB ASP A 78 -2.431 6.850 2.594 1.00 0.00 C ATOM 497 CG ASP A 78 -2.476 8.334 2.899 1.00 0.00 C ATOM 498 OD1 ASP A 78 -1.488 9.035 2.595 1.00 0.00 O ATOM 499 OD2 ASP A 78 -3.499 8.798 3.444 1.00 0.00 O ATOM 0 H ASP A 78 -2.268 7.413 5.059 1.00 0.00 H new ATOM 0 HA ASP A 78 -1.789 5.005 3.484 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -2.029 6.701 1.592 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -3.446 6.452 2.593 1.00 0.00 H new ATOM 504 N MET A 79 0.728 5.377 3.803 1.00 0.00 N ATOM 505 CA MET A 79 2.173 5.471 3.628 1.00 0.00 C ATOM 506 C MET A 79 2.537 5.737 2.172 1.00 0.00 C ATOM 507 O MET A 79 3.569 6.340 1.883 1.00 0.00 O ATOM 508 CB MET A 79 2.850 4.186 4.109 1.00 0.00 C ATOM 509 CG MET A 79 2.417 2.947 3.345 1.00 0.00 C ATOM 510 SD MET A 79 2.305 1.488 4.397 1.00 0.00 S ATOM 511 CE MET A 79 2.440 0.182 3.179 1.00 0.00 C ATOM 0 H MET A 79 0.420 4.546 4.309 1.00 0.00 H new ATOM 0 HA MET A 79 2.529 6.310 4.227 1.00 0.00 H new ATOM 0 HB2 MET A 79 3.930 4.299 4.019 1.00 0.00 H new ATOM 0 HB3 MET A 79 2.632 4.045 5.167 1.00 0.00 H new ATOM 0 HG2 MET A 79 1.448 3.131 2.881 1.00 0.00 H new ATOM 0 HG3 MET A 79 3.125 2.756 2.539 1.00 0.00 H new ATOM 0 HE1 MET A 79 3.033 -0.636 3.587 1.00 0.00 H new ATOM 0 HE2 MET A 79 1.445 -0.183 2.925 1.00 0.00 H new ATOM 0 HE3 MET A 79 2.924 0.569 2.282 1.00 0.00 H new ATOM 521 N ILE A 80 1.684 5.289 1.257 1.00 0.00 N ATOM 522 CA ILE A 80 1.922 5.489 -0.167 1.00 0.00 C ATOM 523 C ILE A 80 1.600 6.924 -0.572 1.00 0.00 C ATOM 524 O ILE A 80 2.463 7.653 -1.056 1.00 0.00 O ATOM 525 CB ILE A 80 1.076 4.524 -1.020 1.00 0.00 C ATOM 526 CG1 ILE A 80 1.222 3.092 -0.505 1.00 0.00 C ATOM 527 CG2 ILE A 80 1.487 4.613 -2.484 1.00 0.00 C ATOM 528 CD1 ILE A 80 0.126 2.164 -0.983 1.00 0.00 C ATOM 0 H ILE A 80 0.824 4.786 1.476 1.00 0.00 H new ATOM 0 HA ILE A 80 2.978 5.286 -0.348 1.00 0.00 H new ATOM 0 HB ILE A 80 0.028 4.813 -0.939 1.00 0.00 H new ATOM 0 HG12 ILE A 80 2.187 2.696 -0.823 1.00 0.00 H new ATOM 0 HG13 ILE A 80 1.227 3.105 0.585 1.00 0.00 H new ATOM 0 HG21 ILE A 80 0.881 3.926 -3.074 1.00 0.00 H new ATOM 0 HG22 ILE A 80 1.336 5.631 -2.843 1.00 0.00 H new ATOM 0 HG23 ILE A 80 2.539 4.346 -2.583 1.00 0.00 H new ATOM 0 HD11 ILE A 80 0.293 1.165 -0.579 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -0.840 2.536 -0.642 1.00 0.00 H new ATOM 0 HD13 ILE A 80 0.135 2.121 -2.072 1.00 0.00 H new ATOM 540 N LEU A 81 0.348 7.320 -0.371 1.00 0.00 N ATOM 541 CA LEU A 81 -0.101 8.664 -0.712 1.00 0.00 C ATOM 542 C LEU A 81 0.766 9.738 -0.048 1.00 0.00 C ATOM 543 O LEU A 81 0.759 10.893 -0.474 1.00 0.00 O ATOM 544 CB LEU A 81 -1.561 8.849 -0.281 1.00 0.00 C ATOM 545 CG LEU A 81 -2.619 8.571 -1.351 1.00 0.00 C ATOM 546 CD1 LEU A 81 -2.725 9.743 -2.314 1.00 0.00 C ATOM 547 CD2 LEU A 81 -2.313 7.280 -2.101 1.00 0.00 C ATOM 0 H LEU A 81 -0.378 6.725 0.029 1.00 0.00 H new ATOM 0 HA LEU A 81 -0.012 8.778 -1.792 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -1.753 8.195 0.570 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -1.688 9.873 0.069 1.00 0.00 H new ATOM 0 HG LEU A 81 -3.581 8.448 -0.853 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -3.482 9.527 -3.068 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -3.006 10.641 -1.764 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -1.763 9.902 -2.801 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -3.081 7.107 -2.855 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -1.340 7.363 -2.586 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -2.299 6.446 -1.399 1.00 0.00 H new ATOM 559 N LYS A 82 1.492 9.366 1.006 1.00 0.00 N ATOM 560 CA LYS A 82 2.329 10.328 1.720 1.00 0.00 C ATOM 561 C LYS A 82 3.817 10.180 1.387 1.00 0.00 C ATOM 562 O LYS A 82 4.581 11.136 1.527 1.00 0.00 O ATOM 563 CB LYS A 82 2.124 10.180 3.229 1.00 0.00 C ATOM 564 CG LYS A 82 0.736 10.589 3.696 1.00 0.00 C ATOM 565 CD LYS A 82 0.749 11.955 4.364 1.00 0.00 C ATOM 566 CE LYS A 82 -0.448 12.793 3.945 1.00 0.00 C ATOM 567 NZ LYS A 82 -0.893 13.710 5.031 1.00 0.00 N ATOM 0 H LYS A 82 1.518 8.418 1.380 1.00 0.00 H new ATOM 0 HA LYS A 82 2.020 11.321 1.393 1.00 0.00 H new ATOM 0 HB2 LYS A 82 2.303 9.143 3.512 1.00 0.00 H new ATOM 0 HB3 LYS A 82 2.867 10.785 3.750 1.00 0.00 H new ATOM 0 HG2 LYS A 82 0.056 10.606 2.845 1.00 0.00 H new ATOM 0 HG3 LYS A 82 0.353 9.845 4.395 1.00 0.00 H new ATOM 0 HD2 LYS A 82 0.746 11.831 5.447 1.00 0.00 H new ATOM 0 HD3 LYS A 82 1.669 12.479 4.105 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -0.191 13.376 3.061 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -1.271 12.135 3.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -1.711 14.263 4.705 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -1.163 13.153 5.867 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -0.116 14.355 5.281 1.00 0.00 H new ATOM 581 N MET A 83 4.234 8.990 0.968 1.00 0.00 N ATOM 582 CA MET A 83 5.642 8.749 0.650 1.00 0.00 C ATOM 583 C MET A 83 5.926 8.828 -0.850 1.00 0.00 C ATOM 584 O MET A 83 7.073 8.679 -1.274 1.00 0.00 O ATOM 585 CB MET A 83 6.078 7.383 1.184 1.00 0.00 C ATOM 586 CG MET A 83 6.007 7.269 2.698 1.00 0.00 C ATOM 587 SD MET A 83 7.622 7.424 3.485 1.00 0.00 S ATOM 588 CE MET A 83 8.500 6.058 2.729 1.00 0.00 C ATOM 0 H MET A 83 3.625 8.182 0.841 1.00 0.00 H new ATOM 0 HA MET A 83 6.216 9.539 1.135 1.00 0.00 H new ATOM 0 HB2 MET A 83 5.449 6.611 0.740 1.00 0.00 H new ATOM 0 HB3 MET A 83 7.100 7.186 0.861 1.00 0.00 H new ATOM 0 HG2 MET A 83 5.343 8.042 3.086 1.00 0.00 H new ATOM 0 HG3 MET A 83 5.568 6.308 2.966 1.00 0.00 H new ATOM 0 HE1 MET A 83 9.226 5.657 3.436 1.00 0.00 H new ATOM 0 HE2 MET A 83 7.791 5.277 2.454 1.00 0.00 H new ATOM 0 HE3 MET A 83 9.018 6.408 1.836 1.00 0.00 H new ATOM 598 N ASP A 84 4.892 9.055 -1.655 1.00 0.00 N ATOM 599 CA ASP A 84 5.065 9.137 -3.102 1.00 0.00 C ATOM 600 C ASP A 84 4.640 10.502 -3.637 1.00 0.00 C ATOM 601 O ASP A 84 3.493 10.693 -4.036 1.00 0.00 O ATOM 602 CB ASP A 84 4.263 8.033 -3.795 1.00 0.00 C ATOM 603 CG ASP A 84 5.144 6.900 -4.285 1.00 0.00 C ATOM 604 OD1 ASP A 84 6.121 7.180 -5.011 1.00 0.00 O ATOM 605 OD2 ASP A 84 4.858 5.735 -3.942 1.00 0.00 O ATOM 0 H ASP A 84 3.933 9.185 -1.333 1.00 0.00 H new ATOM 0 HA ASP A 84 6.125 9.003 -3.318 1.00 0.00 H new ATOM 0 HB2 ASP A 84 3.520 7.638 -3.102 1.00 0.00 H new ATOM 0 HB3 ASP A 84 3.719 8.458 -4.639 1.00 0.00 H new ATOM 610 N SER A 85 5.577 11.446 -3.648 1.00 0.00 N ATOM 611 CA SER A 85 5.301 12.793 -4.144 1.00 0.00 C ATOM 612 C SER A 85 4.046 13.377 -3.489 1.00 0.00 C ATOM 613 O SER A 85 3.657 12.959 -2.398 1.00 0.00 O ATOM 614 CB SER A 85 5.143 12.765 -5.666 1.00 0.00 C ATOM 615 OG SER A 85 5.991 11.792 -6.251 1.00 0.00 O ATOM 0 H SER A 85 6.532 11.305 -3.320 1.00 0.00 H new ATOM 0 HA SER A 85 6.143 13.434 -3.883 1.00 0.00 H new ATOM 0 HB2 SER A 85 4.106 12.549 -5.923 1.00 0.00 H new ATOM 0 HB3 SER A 85 5.375 13.748 -6.077 1.00 0.00 H new ATOM 0 HG SER A 85 5.869 11.794 -7.223 1.00 0.00 H new ATOM 621 N LEU A 86 3.422 14.345 -4.158 1.00 0.00 N ATOM 622 CA LEU A 86 2.217 14.985 -3.640 1.00 0.00 C ATOM 623 C LEU A 86 2.508 15.720 -2.336 1.00 0.00 C ATOM 624 O LEU A 86 1.632 15.859 -1.480 1.00 0.00 O ATOM 625 CB LEU A 86 1.110 13.951 -3.427 1.00 0.00 C ATOM 626 CG LEU A 86 0.347 13.553 -4.692 1.00 0.00 C ATOM 627 CD1 LEU A 86 -0.421 14.741 -5.248 1.00 0.00 C ATOM 628 CD2 LEU A 86 1.304 12.997 -5.736 1.00 0.00 C ATOM 0 H LEU A 86 3.733 14.703 -5.061 1.00 0.00 H new ATOM 0 HA LEU A 86 1.880 15.714 -4.377 1.00 0.00 H new ATOM 0 HB2 LEU A 86 1.549 13.055 -2.989 1.00 0.00 H new ATOM 0 HB3 LEU A 86 0.399 14.346 -2.701 1.00 0.00 H new ATOM 0 HG LEU A 86 -0.370 12.774 -4.433 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -0.957 14.439 -6.147 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -1.133 15.095 -4.503 1.00 0.00 H new ATOM 0 HD13 LEU A 86 0.276 15.542 -5.493 1.00 0.00 H new ATOM 0 HD21 LEU A 86 0.746 12.719 -6.630 1.00 0.00 H new ATOM 0 HD22 LEU A 86 2.044 13.755 -5.992 1.00 0.00 H new ATOM 0 HD23 LEU A 86 1.809 12.118 -5.335 1.00 0.00 H new ATOM 640 N ARG A 87 3.740 16.195 -2.194 1.00 0.00 N ATOM 641 CA ARG A 87 4.149 16.923 -0.999 1.00 0.00 C ATOM 642 C ARG A 87 4.792 18.254 -1.375 1.00 0.00 C ATOM 643 O ARG A 87 4.521 19.280 -0.755 1.00 0.00 O ATOM 644 CB ARG A 87 5.125 16.085 -0.171 1.00 0.00 C ATOM 645 CG ARG A 87 4.513 14.806 0.379 1.00 0.00 C ATOM 646 CD ARG A 87 4.421 14.837 1.897 1.00 0.00 C ATOM 647 NE ARG A 87 5.741 14.885 2.523 1.00 0.00 N ATOM 648 CZ ARG A 87 5.949 15.263 3.782 1.00 0.00 C ATOM 649 NH1 ARG A 87 4.931 15.625 4.552 1.00 0.00 N ATOM 650 NH2 ARG A 87 7.182 15.278 4.274 1.00 0.00 N ATOM 0 H ARG A 87 4.475 16.089 -2.894 1.00 0.00 H new ATOM 0 HA ARG A 87 3.260 17.122 -0.400 1.00 0.00 H new ATOM 0 HB2 ARG A 87 5.986 15.830 -0.788 1.00 0.00 H new ATOM 0 HB3 ARG A 87 5.495 16.687 0.659 1.00 0.00 H new ATOM 0 HG2 ARG A 87 3.518 14.667 -0.044 1.00 0.00 H new ATOM 0 HG3 ARG A 87 5.114 13.951 0.068 1.00 0.00 H new ATOM 0 HD2 ARG A 87 3.840 15.706 2.208 1.00 0.00 H new ATOM 0 HD3 ARG A 87 3.886 13.954 2.246 1.00 0.00 H new ATOM 0 HE ARG A 87 6.549 14.613 1.963 1.00 0.00 H new ATOM 0 HH11 ARG A 87 3.981 15.615 4.180 1.00 0.00 H new ATOM 0 HH12 ARG A 87 5.098 15.914 5.516 1.00 0.00 H new ATOM 0 HH21 ARG A 87 7.969 15.000 3.687 1.00 0.00 H new ATOM 0 HH22 ARG A 87 7.343 15.568 5.239 1.00 0.00 H new ATOM 664 N ASP A 88 5.635 18.232 -2.403 1.00 0.00 N ATOM 665 CA ASP A 88 6.306 19.441 -2.868 1.00 0.00 C ATOM 666 C ASP A 88 5.319 20.389 -3.551 1.00 0.00 C ATOM 667 O ASP A 88 5.646 21.541 -3.835 1.00 0.00 O ATOM 668 CB ASP A 88 7.435 19.081 -3.834 1.00 0.00 C ATOM 669 CG ASP A 88 8.347 20.258 -4.122 1.00 0.00 C ATOM 670 OD1 ASP A 88 9.236 20.536 -3.292 1.00 0.00 O ATOM 671 OD2 ASP A 88 8.172 20.901 -5.179 1.00 0.00 O ATOM 0 H ASP A 88 5.870 17.391 -2.930 1.00 0.00 H new ATOM 0 HA ASP A 88 6.725 19.949 -2.000 1.00 0.00 H new ATOM 0 HB2 ASP A 88 8.022 18.264 -3.414 1.00 0.00 H new ATOM 0 HB3 ASP A 88 7.008 18.719 -4.769 1.00 0.00 H new ATOM 676 N ILE A 89 4.104 19.906 -3.789 1.00 0.00 N ATOM 677 CA ILE A 89 3.068 20.709 -4.415 1.00 0.00 C ATOM 678 C ILE A 89 2.307 21.456 -3.339 1.00 0.00 C ATOM 679 O ILE A 89 2.239 22.684 -3.345 1.00 0.00 O ATOM 680 CB ILE A 89 2.087 19.844 -5.234 1.00 0.00 C ATOM 681 CG1 ILE A 89 2.842 19.074 -6.321 1.00 0.00 C ATOM 682 CG2 ILE A 89 0.996 20.710 -5.852 1.00 0.00 C ATOM 683 CD1 ILE A 89 3.720 17.969 -5.781 1.00 0.00 C ATOM 0 H ILE A 89 3.815 18.956 -3.555 1.00 0.00 H new ATOM 0 HA ILE A 89 3.546 21.407 -5.102 1.00 0.00 H new ATOM 0 HB ILE A 89 1.614 19.126 -4.564 1.00 0.00 H new ATOM 0 HG12 ILE A 89 2.122 18.646 -7.018 1.00 0.00 H new ATOM 0 HG13 ILE A 89 3.458 19.772 -6.888 1.00 0.00 H new ATOM 0 HG21 ILE A 89 0.314 20.082 -6.426 1.00 0.00 H new ATOM 0 HG22 ILE A 89 0.443 21.218 -5.062 1.00 0.00 H new ATOM 0 HG23 ILE A 89 1.449 21.450 -6.511 1.00 0.00 H new ATOM 0 HD11 ILE A 89 4.223 17.467 -6.608 1.00 0.00 H new ATOM 0 HD12 ILE A 89 4.464 18.392 -5.106 1.00 0.00 H new ATOM 0 HD13 ILE A 89 3.107 17.249 -5.239 1.00 0.00 H new ATOM 695 N GLU A 90 1.774 20.698 -2.390 1.00 0.00 N ATOM 696 CA GLU A 90 1.056 21.277 -1.270 1.00 0.00 C ATOM 697 C GLU A 90 2.014 22.135 -0.447 1.00 0.00 C ATOM 698 O GLU A 90 1.593 23.004 0.310 1.00 0.00 O ATOM 699 CB GLU A 90 0.453 20.169 -0.400 1.00 0.00 C ATOM 700 CG GLU A 90 -0.177 20.677 0.889 1.00 0.00 C ATOM 701 CD GLU A 90 0.760 20.570 2.077 1.00 0.00 C ATOM 702 OE1 GLU A 90 1.551 21.511 2.297 1.00 0.00 O ATOM 703 OE2 GLU A 90 0.703 19.545 2.789 1.00 0.00 O ATOM 0 H GLU A 90 1.827 19.679 -2.376 1.00 0.00 H new ATOM 0 HA GLU A 90 0.244 21.901 -1.643 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -0.302 19.636 -0.978 1.00 0.00 H new ATOM 0 HB3 GLU A 90 1.233 19.448 -0.153 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -0.475 21.717 0.758 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -1.084 20.109 1.094 1.00 0.00 H new ATOM 710 N ALA A 91 3.312 21.878 -0.616 1.00 0.00 N ATOM 711 CA ALA A 91 4.344 22.618 0.097 1.00 0.00 C ATOM 712 C ALA A 91 4.703 23.895 -0.651 1.00 0.00 C ATOM 713 O ALA A 91 4.482 24.996 -0.153 1.00 0.00 O ATOM 714 CB ALA A 91 5.580 21.751 0.291 1.00 0.00 C ATOM 0 H ALA A 91 3.671 21.159 -1.244 1.00 0.00 H new ATOM 0 HA ALA A 91 3.954 22.893 1.077 1.00 0.00 H new ATOM 0 HB1 ALA A 91 6.342 22.318 0.825 1.00 0.00 H new ATOM 0 HB2 ALA A 91 5.316 20.865 0.868 1.00 0.00 H new ATOM 0 HB3 ALA A 91 5.968 21.448 -0.681 1.00 0.00 H new ATOM 720 N LEU A 92 5.245 23.742 -1.859 1.00 0.00 N ATOM 721 CA LEU A 92 5.614 24.898 -2.671 1.00 0.00 C ATOM 722 C LEU A 92 4.439 25.868 -2.783 1.00 0.00 C ATOM 723 O LEU A 92 4.625 27.065 -3.000 1.00 0.00 O ATOM 724 CB LEU A 92 6.072 24.459 -4.063 1.00 0.00 C ATOM 725 CG LEU A 92 7.189 25.307 -4.672 1.00 0.00 C ATOM 726 CD1 LEU A 92 7.891 24.545 -5.784 1.00 0.00 C ATOM 727 CD2 LEU A 92 6.635 26.628 -5.190 1.00 0.00 C ATOM 0 H LEU A 92 5.436 22.839 -2.292 1.00 0.00 H new ATOM 0 HA LEU A 92 6.443 25.408 -2.181 1.00 0.00 H new ATOM 0 HB2 LEU A 92 6.410 23.424 -4.008 1.00 0.00 H new ATOM 0 HB3 LEU A 92 5.214 24.479 -4.735 1.00 0.00 H new ATOM 0 HG LEU A 92 7.920 25.525 -3.894 1.00 0.00 H new ATOM 0 HD11 LEU A 92 8.683 25.164 -6.206 1.00 0.00 H new ATOM 0 HD12 LEU A 92 8.322 23.629 -5.381 1.00 0.00 H new ATOM 0 HD13 LEU A 92 7.172 24.295 -6.564 1.00 0.00 H new ATOM 0 HD21 LEU A 92 7.444 27.218 -5.620 1.00 0.00 H new ATOM 0 HD22 LEU A 92 5.883 26.432 -5.954 1.00 0.00 H new ATOM 0 HD23 LEU A 92 6.181 27.180 -4.367 1.00 0.00 H new ATOM 739 N LEU A 93 3.226 25.342 -2.615 1.00 0.00 N ATOM 740 CA LEU A 93 2.023 26.161 -2.678 1.00 0.00 C ATOM 741 C LEU A 93 1.671 26.699 -1.296 1.00 0.00 C ATOM 742 O LEU A 93 1.283 27.856 -1.152 1.00 0.00 O ATOM 743 CB LEU A 93 0.848 25.355 -3.238 1.00 0.00 C ATOM 744 CG LEU A 93 0.699 25.393 -4.761 1.00 0.00 C ATOM 745 CD1 LEU A 93 0.197 26.755 -5.213 1.00 0.00 C ATOM 746 CD2 LEU A 93 2.021 25.057 -5.437 1.00 0.00 C ATOM 0 H LEU A 93 3.054 24.353 -2.435 1.00 0.00 H new ATOM 0 HA LEU A 93 2.220 27.001 -3.345 1.00 0.00 H new ATOM 0 HB2 LEU A 93 0.959 24.317 -2.926 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -0.073 25.726 -2.789 1.00 0.00 H new ATOM 0 HG LEU A 93 -0.035 24.642 -5.054 1.00 0.00 H new ATOM 0 HD11 LEU A 93 0.097 26.764 -6.298 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -0.773 26.955 -4.757 1.00 0.00 H new ATOM 0 HD13 LEU A 93 0.907 27.524 -4.908 1.00 0.00 H new ATOM 0 HD21 LEU A 93 1.895 25.089 -6.519 1.00 0.00 H new ATOM 0 HD22 LEU A 93 2.777 25.783 -5.138 1.00 0.00 H new ATOM 0 HD23 LEU A 93 2.339 24.058 -5.138 1.00 0.00 H new ATOM 758 N THR A 94 1.811 25.854 -0.275 1.00 0.00 N ATOM 759 CA THR A 94 1.503 26.272 1.091 1.00 0.00 C ATOM 760 C THR A 94 2.472 27.356 1.569 1.00 0.00 C ATOM 761 O THR A 94 2.234 28.003 2.590 1.00 0.00 O ATOM 762 CB THR A 94 1.533 25.071 2.046 1.00 0.00 C ATOM 763 OG1 THR A 94 0.356 24.297 1.905 1.00 0.00 O ATOM 764 CG2 THR A 94 1.649 25.453 3.508 1.00 0.00 C ATOM 0 H THR A 94 2.131 24.890 -0.365 1.00 0.00 H new ATOM 0 HA THR A 94 0.497 26.692 1.091 1.00 0.00 H new ATOM 0 HB THR A 94 2.424 24.509 1.766 1.00 0.00 H new ATOM 0 HG1 THR A 94 0.572 23.451 1.459 1.00 0.00 H new ATOM 0 HG21 THR A 94 1.664 24.551 4.120 1.00 0.00 H new ATOM 0 HG22 THR A 94 2.570 26.014 3.666 1.00 0.00 H new ATOM 0 HG23 THR A 94 0.796 26.070 3.792 1.00 0.00 H new ATOM 772 N GLY A 95 3.569 27.547 0.838 1.00 0.00 N ATOM 773 CA GLY A 95 4.547 28.549 1.224 1.00 0.00 C ATOM 774 C GLY A 95 4.743 29.629 0.176 1.00 0.00 C ATOM 775 O GLY A 95 4.706 30.819 0.495 1.00 0.00 O ATOM 0 H GLY A 95 3.796 27.028 -0.010 1.00 0.00 H new ATOM 0 HA2 GLY A 95 4.233 29.012 2.159 1.00 0.00 H new ATOM 0 HA3 GLY A 95 5.502 28.060 1.415 1.00 0.00 H new ATOM 779 N LEU A 96 4.967 29.223 -1.071 1.00 0.00 N ATOM 780 CA LEU A 96 5.185 30.182 -2.151 1.00 0.00 C ATOM 781 C LEU A 96 3.921 30.439 -2.965 1.00 0.00 C ATOM 782 O LEU A 96 3.922 31.262 -3.880 1.00 0.00 O ATOM 783 CB LEU A 96 6.304 29.697 -3.070 1.00 0.00 C ATOM 784 CG LEU A 96 7.678 29.565 -2.408 1.00 0.00 C ATOM 785 CD1 LEU A 96 8.071 30.868 -1.729 1.00 0.00 C ATOM 786 CD2 LEU A 96 7.676 28.418 -1.408 1.00 0.00 C ATOM 0 H LEU A 96 5.002 28.245 -1.358 1.00 0.00 H new ATOM 0 HA LEU A 96 5.472 31.126 -1.687 1.00 0.00 H new ATOM 0 HB2 LEU A 96 6.021 28.728 -3.480 1.00 0.00 H new ATOM 0 HB3 LEU A 96 6.388 30.387 -3.910 1.00 0.00 H new ATOM 0 HG LEU A 96 8.415 29.347 -3.181 1.00 0.00 H new ATOM 0 HD11 LEU A 96 9.050 30.755 -1.264 1.00 0.00 H new ATOM 0 HD12 LEU A 96 8.111 31.667 -2.470 1.00 0.00 H new ATOM 0 HD13 LEU A 96 7.334 31.117 -0.966 1.00 0.00 H new ATOM 0 HD21 LEU A 96 8.660 28.337 -0.946 1.00 0.00 H new ATOM 0 HD22 LEU A 96 6.928 28.608 -0.638 1.00 0.00 H new ATOM 0 HD23 LEU A 96 7.439 27.487 -1.923 1.00 0.00 H new ATOM 798 N PHE A 97 2.850 29.739 -2.622 1.00 0.00 N ATOM 799 CA PHE A 97 1.567 29.888 -3.312 1.00 0.00 C ATOM 800 C PHE A 97 1.748 30.041 -4.822 1.00 0.00 C ATOM 801 O PHE A 97 0.977 30.740 -5.480 1.00 0.00 O ATOM 802 CB PHE A 97 0.810 31.095 -2.756 1.00 0.00 C ATOM 803 CG PHE A 97 1.619 32.360 -2.745 1.00 0.00 C ATOM 804 CD1 PHE A 97 2.413 32.681 -1.655 1.00 0.00 C ATOM 805 CD2 PHE A 97 1.588 33.227 -3.825 1.00 0.00 C ATOM 806 CE1 PHE A 97 3.160 33.844 -1.642 1.00 0.00 C ATOM 807 CE2 PHE A 97 2.332 34.392 -3.818 1.00 0.00 C ATOM 808 CZ PHE A 97 3.119 34.700 -2.725 1.00 0.00 C ATOM 0 H PHE A 97 2.840 29.056 -1.865 1.00 0.00 H new ATOM 0 HA PHE A 97 0.991 28.980 -3.135 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -0.090 31.254 -3.351 1.00 0.00 H new ATOM 0 HB3 PHE A 97 0.485 30.873 -1.740 1.00 0.00 H new ATOM 0 HD1 PHE A 97 2.448 32.015 -0.806 1.00 0.00 H new ATOM 0 HD2 PHE A 97 0.975 32.990 -4.682 1.00 0.00 H new ATOM 0 HE1 PHE A 97 3.775 34.083 -0.787 1.00 0.00 H new ATOM 0 HE2 PHE A 97 2.298 35.060 -4.666 1.00 0.00 H new ATOM 0 HZ PHE A 97 3.702 35.609 -2.718 1.00 0.00 H new ATOM 818 N VAL A 98 2.771 29.388 -5.365 1.00 0.00 N ATOM 819 CA VAL A 98 3.048 29.460 -6.795 1.00 0.00 C ATOM 820 C VAL A 98 2.081 28.590 -7.590 1.00 0.00 C ATOM 821 O VAL A 98 1.872 27.421 -7.269 1.00 0.00 O ATOM 822 CB VAL A 98 4.491 29.024 -7.114 1.00 0.00 C ATOM 823 CG1 VAL A 98 4.829 29.323 -8.566 1.00 0.00 C ATOM 824 CG2 VAL A 98 5.477 29.710 -6.177 1.00 0.00 C ATOM 0 H VAL A 98 3.420 28.804 -4.838 1.00 0.00 H new ATOM 0 HA VAL A 98 2.918 30.502 -7.086 1.00 0.00 H new ATOM 0 HB VAL A 98 4.569 27.948 -6.960 1.00 0.00 H new ATOM 0 HG11 VAL A 98 5.852 29.009 -8.774 1.00 0.00 H new ATOM 0 HG12 VAL A 98 4.144 28.782 -9.218 1.00 0.00 H new ATOM 0 HG13 VAL A 98 4.734 30.393 -8.749 1.00 0.00 H new ATOM 0 HG21 VAL A 98 6.491 29.390 -6.418 1.00 0.00 H new ATOM 0 HG22 VAL A 98 5.400 30.791 -6.296 1.00 0.00 H new ATOM 0 HG23 VAL A 98 5.247 29.441 -5.146 1.00 0.00 H new ATOM 834 N GLN A 99 1.494 29.169 -8.633 1.00 0.00 N ATOM 835 CA GLN A 99 0.549 28.449 -9.476 1.00 0.00 C ATOM 836 C GLN A 99 1.238 27.313 -10.226 1.00 0.00 C ATOM 837 O GLN A 99 0.911 26.143 -10.036 1.00 0.00 O ATOM 838 CB GLN A 99 -0.109 29.406 -10.474 1.00 0.00 C ATOM 839 CG GLN A 99 -0.770 30.608 -9.817 1.00 0.00 C ATOM 840 CD GLN A 99 -2.185 30.315 -9.357 1.00 0.00 C ATOM 841 OE1 GLN A 99 -2.399 29.818 -8.252 1.00 0.00 O ATOM 842 NE2 GLN A 99 -3.157 30.622 -10.206 1.00 0.00 N ATOM 0 H GLN A 99 1.657 30.136 -8.914 1.00 0.00 H new ATOM 0 HA GLN A 99 -0.218 28.021 -8.830 1.00 0.00 H new ATOM 0 HB2 GLN A 99 0.644 29.756 -11.180 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -0.856 28.860 -11.050 1.00 0.00 H new ATOM 0 HG2 GLN A 99 -0.172 30.925 -8.962 1.00 0.00 H new ATOM 0 HG3 GLN A 99 -0.786 31.440 -10.521 1.00 0.00 H new ATOM 0 HE21 GLN A 99 -2.932 31.033 -11.112 1.00 0.00 H new ATOM 0 HE22 GLN A 99 -4.129 30.447 -9.953 1.00 0.00 H new ATOM 851 N ASP A 100 2.194 27.668 -11.081 1.00 0.00 N ATOM 852 CA ASP A 100 2.926 26.675 -11.859 1.00 0.00 C ATOM 853 C ASP A 100 4.417 27.001 -11.904 1.00 0.00 C ATOM 854 O ASP A 100 5.259 26.121 -11.728 1.00 0.00 O ATOM 855 CB ASP A 100 2.368 26.601 -13.282 1.00 0.00 C ATOM 856 CG ASP A 100 1.328 25.507 -13.438 1.00 0.00 C ATOM 857 OD1 ASP A 100 1.695 24.319 -13.318 1.00 0.00 O ATOM 858 OD2 ASP A 100 0.149 25.840 -13.681 1.00 0.00 O ATOM 0 H ASP A 100 2.478 28.633 -11.252 1.00 0.00 H new ATOM 0 HA ASP A 100 2.800 25.708 -11.372 1.00 0.00 H new ATOM 0 HB2 ASP A 100 1.924 27.561 -13.546 1.00 0.00 H new ATOM 0 HB3 ASP A 100 3.185 26.424 -13.981 1.00 0.00 H new ATOM 863 N ASN A 101 4.735 28.270 -12.143 1.00 0.00 N ATOM 864 CA ASN A 101 6.126 28.713 -12.215 1.00 0.00 C ATOM 865 C ASN A 101 6.808 28.163 -13.462 1.00 0.00 C ATOM 866 O ASN A 101 7.114 26.974 -13.542 1.00 0.00 O ATOM 867 CB ASN A 101 6.895 28.275 -10.964 1.00 0.00 C ATOM 868 CG ASN A 101 7.821 29.358 -10.447 1.00 0.00 C ATOM 869 OD1 ASN A 101 7.376 30.435 -10.048 1.00 0.00 O ATOM 870 ND2 ASN A 101 9.119 29.078 -10.451 1.00 0.00 N ATOM 0 H ASN A 101 4.049 29.011 -12.290 1.00 0.00 H new ATOM 0 HA ASN A 101 6.129 29.802 -12.269 1.00 0.00 H new ATOM 0 HB2 ASN A 101 6.186 28.003 -10.182 1.00 0.00 H new ATOM 0 HB3 ASN A 101 7.477 27.382 -11.192 1.00 0.00 H new ATOM 0 HD21 ASN A 101 9.791 29.768 -10.115 1.00 0.00 H new ATOM 0 HD22 ASN A 101 9.444 28.173 -10.790 1.00 0.00 H new ATOM 877 N VAL A 102 7.044 29.037 -14.436 1.00 0.00 N ATOM 878 CA VAL A 102 7.690 28.639 -15.681 1.00 0.00 C ATOM 879 C VAL A 102 8.858 29.563 -16.012 1.00 0.00 C ATOM 880 O VAL A 102 8.667 30.743 -16.302 1.00 0.00 O ATOM 881 CB VAL A 102 6.693 28.640 -16.857 1.00 0.00 C ATOM 882 CG1 VAL A 102 6.129 30.034 -17.083 1.00 0.00 C ATOM 883 CG2 VAL A 102 7.355 28.112 -18.122 1.00 0.00 C ATOM 0 H VAL A 102 6.797 30.025 -14.386 1.00 0.00 H new ATOM 0 HA VAL A 102 8.064 27.625 -15.536 1.00 0.00 H new ATOM 0 HB VAL A 102 5.865 27.977 -16.604 1.00 0.00 H new ATOM 0 HG11 VAL A 102 5.428 30.012 -17.917 1.00 0.00 H new ATOM 0 HG12 VAL A 102 5.612 30.368 -16.183 1.00 0.00 H new ATOM 0 HG13 VAL A 102 6.942 30.723 -17.311 1.00 0.00 H new ATOM 0 HG21 VAL A 102 6.635 28.121 -18.940 1.00 0.00 H new ATOM 0 HG22 VAL A 102 8.204 28.745 -18.379 1.00 0.00 H new ATOM 0 HG23 VAL A 102 7.700 27.092 -17.953 1.00 0.00 H new ATOM 893 N ASN A 103 10.069 29.016 -15.967 1.00 0.00 N ATOM 894 CA ASN A 103 11.269 29.791 -16.264 1.00 0.00 C ATOM 895 C ASN A 103 12.293 28.945 -17.012 1.00 0.00 C ATOM 896 O ASN A 103 12.764 29.324 -18.083 1.00 0.00 O ATOM 897 CB ASN A 103 11.882 30.334 -14.969 1.00 0.00 C ATOM 898 CG ASN A 103 11.489 31.774 -14.704 1.00 0.00 C ATOM 899 OD1 ASN A 103 12.245 32.700 -14.997 1.00 0.00 O ATOM 900 ND2 ASN A 103 10.301 31.969 -14.144 1.00 0.00 N ATOM 0 H ASN A 103 10.245 28.040 -15.728 1.00 0.00 H new ATOM 0 HA ASN A 103 10.984 30.628 -16.902 1.00 0.00 H new ATOM 0 HB2 ASN A 103 11.564 29.713 -14.131 1.00 0.00 H new ATOM 0 HB3 ASN A 103 12.968 30.261 -15.026 1.00 0.00 H new ATOM 0 HD21 ASN A 103 9.983 32.916 -13.940 1.00 0.00 H new ATOM 0 HD22 ASN A 103 9.707 31.171 -13.918 1.00 0.00 H new ATOM 907 N LYS A 104 12.634 27.794 -16.438 1.00 0.00 N ATOM 908 CA LYS A 104 13.603 26.893 -17.051 1.00 0.00 C ATOM 909 C LYS A 104 13.697 25.584 -16.273 1.00 0.00 C ATOM 910 O LYS A 104 13.727 24.503 -16.860 1.00 0.00 O ATOM 911 CB LYS A 104 14.979 27.558 -17.120 1.00 0.00 C ATOM 912 CG LYS A 104 15.500 28.021 -15.771 1.00 0.00 C ATOM 913 CD LYS A 104 16.520 29.138 -15.921 1.00 0.00 C ATOM 914 CE LYS A 104 15.848 30.502 -15.979 1.00 0.00 C ATOM 915 NZ LYS A 104 15.342 30.927 -14.645 1.00 0.00 N ATOM 0 H LYS A 104 12.254 27.465 -15.551 1.00 0.00 H new ATOM 0 HA LYS A 104 13.264 26.671 -18.063 1.00 0.00 H new ATOM 0 HB2 LYS A 104 15.691 26.856 -17.553 1.00 0.00 H new ATOM 0 HB3 LYS A 104 14.926 28.414 -17.793 1.00 0.00 H new ATOM 0 HG2 LYS A 104 14.668 28.367 -15.158 1.00 0.00 H new ATOM 0 HG3 LYS A 104 15.954 27.180 -15.247 1.00 0.00 H new ATOM 0 HD2 LYS A 104 17.218 29.110 -15.084 1.00 0.00 H new ATOM 0 HD3 LYS A 104 17.104 28.980 -16.828 1.00 0.00 H new ATOM 0 HE2 LYS A 104 16.558 31.241 -16.351 1.00 0.00 H new ATOM 0 HE3 LYS A 104 15.021 30.470 -16.688 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 14.548 31.587 -14.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 15.019 30.093 -14.114 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 16.105 31.399 -14.118 1.00 0.00 H new ATOM 929 N ASP A 105 13.741 25.690 -14.949 1.00 0.00 N ATOM 930 CA ASP A 105 13.830 24.514 -14.091 1.00 0.00 C ATOM 931 C ASP A 105 12.447 24.073 -13.627 1.00 0.00 C ATOM 932 O ASP A 105 11.521 24.881 -13.547 1.00 0.00 O ATOM 933 CB ASP A 105 14.717 24.807 -12.879 1.00 0.00 C ATOM 934 CG ASP A 105 16.162 25.057 -13.268 1.00 0.00 C ATOM 935 OD1 ASP A 105 16.658 24.367 -14.183 1.00 0.00 O ATOM 936 OD2 ASP A 105 16.796 25.942 -12.656 1.00 0.00 O ATOM 0 H ASP A 105 13.716 26.578 -14.447 1.00 0.00 H new ATOM 0 HA ASP A 105 14.274 23.705 -14.671 1.00 0.00 H new ATOM 0 HB2 ASP A 105 14.330 25.678 -12.351 1.00 0.00 H new ATOM 0 HB3 ASP A 105 14.670 23.967 -12.186 1.00 0.00 H new ATOM 941 N ALA A 106 12.313 22.786 -13.322 1.00 0.00 N ATOM 942 CA ALA A 106 11.042 22.238 -12.865 1.00 0.00 C ATOM 943 C ALA A 106 11.261 21.092 -11.883 1.00 0.00 C ATOM 944 O ALA A 106 11.831 20.060 -12.296 1.00 0.00 O ATOM 945 CB ALA A 106 10.214 21.767 -14.052 1.00 0.00 C ATOM 946 OXT ALA A 106 10.859 21.235 -10.709 1.00 0.00 O ATOM 0 H ALA A 106 13.069 22.104 -13.383 1.00 0.00 H new ATOM 0 HA ALA A 106 10.498 23.028 -12.347 1.00 0.00 H new ATOM 0 HB1 ALA A 106 9.267 21.360 -13.697 1.00 0.00 H new ATOM 0 HB2 ALA A 106 10.020 22.608 -14.717 1.00 0.00 H new ATOM 0 HB3 ALA A 106 10.761 20.995 -14.593 1.00 0.00 H new TER 952 ALA A 106 ATOM 953 N THR B 50 5.372 -38.165 6.553 1.00 0.00 N ATOM 954 CA THR B 50 4.865 -39.558 6.446 1.00 0.00 C ATOM 955 C THR B 50 3.689 -39.643 5.477 1.00 0.00 C ATOM 956 O THR B 50 3.689 -40.461 4.556 1.00 0.00 O ATOM 957 CB THR B 50 4.436 -40.030 7.836 1.00 0.00 C ATOM 958 OG1 THR B 50 5.172 -39.358 8.843 1.00 0.00 O ATOM 959 CG2 THR B 50 4.623 -41.517 8.046 1.00 0.00 C ATOM 0 HA THR B 50 5.658 -40.198 6.060 1.00 0.00 H new ATOM 0 HB THR B 50 3.373 -39.800 7.904 1.00 0.00 H new ATOM 0 HG1 THR B 50 5.585 -38.554 8.465 1.00 0.00 H new ATOM 0 HG21 THR B 50 4.300 -41.786 9.052 1.00 0.00 H new ATOM 0 HG22 THR B 50 4.029 -42.065 7.315 1.00 0.00 H new ATOM 0 HG23 THR B 50 5.675 -41.772 7.923 1.00 0.00 H new ATOM 969 N ARG B 51 2.689 -38.794 5.692 1.00 0.00 N ATOM 970 CA ARG B 51 1.507 -38.772 4.838 1.00 0.00 C ATOM 971 C ARG B 51 0.933 -37.360 4.740 1.00 0.00 C ATOM 972 O ARG B 51 1.596 -36.387 5.098 1.00 0.00 O ATOM 973 CB ARG B 51 0.448 -39.742 5.375 1.00 0.00 C ATOM 974 CG ARG B 51 0.211 -40.944 4.473 1.00 0.00 C ATOM 975 CD ARG B 51 -0.131 -40.524 3.051 1.00 0.00 C ATOM 976 NE ARG B 51 -1.549 -40.710 2.750 1.00 0.00 N ATOM 977 CZ ARG B 51 -2.088 -41.876 2.400 1.00 0.00 C ATOM 978 NH1 ARG B 51 -1.334 -42.965 2.312 1.00 0.00 N ATOM 979 NH2 ARG B 51 -3.386 -41.955 2.140 1.00 0.00 N ATOM 0 H ARG B 51 2.674 -38.112 6.450 1.00 0.00 H new ATOM 0 HA ARG B 51 1.801 -39.090 3.838 1.00 0.00 H new ATOM 0 HB2 ARG B 51 0.755 -40.092 6.361 1.00 0.00 H new ATOM 0 HB3 ARG B 51 -0.492 -39.205 5.506 1.00 0.00 H new ATOM 0 HG2 ARG B 51 1.102 -41.572 4.462 1.00 0.00 H new ATOM 0 HG3 ARG B 51 -0.600 -41.549 4.879 1.00 0.00 H new ATOM 0 HD2 ARG B 51 0.135 -39.477 2.909 1.00 0.00 H new ATOM 0 HD3 ARG B 51 0.468 -41.103 2.348 1.00 0.00 H new ATOM 0 HE ARG B 51 -2.163 -39.898 2.812 1.00 0.00 H new ATOM 0 HH11 ARG B 51 -0.335 -42.912 2.513 1.00 0.00 H new ATOM 0 HH12 ARG B 51 -1.753 -43.855 2.043 1.00 0.00 H new ATOM 0 HH21 ARG B 51 -3.971 -41.122 2.208 1.00 0.00 H new ATOM 0 HH22 ARG B 51 -3.799 -42.848 1.872 1.00 0.00 H new ATOM 993 N ALA B 52 -0.301 -37.254 4.253 1.00 0.00 N ATOM 994 CA ALA B 52 -0.962 -35.959 4.106 1.00 0.00 C ATOM 995 C ALA B 52 -0.303 -35.127 3.009 1.00 0.00 C ATOM 996 O ALA B 52 0.918 -34.986 2.972 1.00 0.00 O ATOM 997 CB ALA B 52 -0.953 -35.203 5.428 1.00 0.00 C ATOM 0 H ALA B 52 -0.864 -38.050 3.953 1.00 0.00 H new ATOM 0 HA ALA B 52 -1.997 -36.140 3.815 1.00 0.00 H new ATOM 0 HB1 ALA B 52 -1.449 -34.241 5.300 1.00 0.00 H new ATOM 0 HB2 ALA B 52 -1.480 -35.786 6.184 1.00 0.00 H new ATOM 0 HB3 ALA B 52 0.076 -35.041 5.747 1.00 0.00 H new ATOM 1003 N HIS B 53 -1.124 -34.581 2.116 1.00 0.00 N ATOM 1004 CA HIS B 53 -0.623 -33.767 1.014 1.00 0.00 C ATOM 1005 C HIS B 53 -0.606 -32.288 1.388 1.00 0.00 C ATOM 1006 O HIS B 53 -1.617 -31.735 1.822 1.00 0.00 O ATOM 1007 CB HIS B 53 -1.485 -33.974 -0.232 1.00 0.00 C ATOM 1008 CG HIS B 53 -1.660 -35.413 -0.607 1.00 0.00 C ATOM 1009 ND1 HIS B 53 -0.952 -36.437 -0.013 1.00 0.00 N ATOM 1010 CD2 HIS B 53 -2.470 -35.998 -1.521 1.00 0.00 C ATOM 1011 CE1 HIS B 53 -1.318 -37.590 -0.547 1.00 0.00 C ATOM 1012 NE2 HIS B 53 -2.239 -37.351 -1.464 1.00 0.00 N ATOM 0 H HIS B 53 -2.138 -34.688 2.134 1.00 0.00 H new ATOM 0 HA HIS B 53 0.399 -34.082 0.802 1.00 0.00 H new ATOM 0 HB2 HIS B 53 -2.466 -33.529 -0.063 1.00 0.00 H new ATOM 0 HB3 HIS B 53 -1.033 -33.441 -1.069 1.00 0.00 H new ATOM 0 HD2 HIS B 53 -3.168 -35.494 -2.174 1.00 0.00 H new ATOM 0 HE1 HIS B 53 -0.930 -38.562 -0.279 1.00 0.00 H new ATOM 0 HE2 HIS B 53 -2.703 -38.056 -2.036 1.00 0.00 H new ATOM 1021 N LEU B 54 0.547 -31.650 1.208 1.00 0.00 N ATOM 1022 CA LEU B 54 0.694 -30.234 1.520 1.00 0.00 C ATOM 1023 C LEU B 54 2.067 -29.716 1.087 1.00 0.00 C ATOM 1024 O LEU B 54 2.228 -29.262 -0.045 1.00 0.00 O ATOM 1025 CB LEU B 54 0.466 -29.992 3.018 1.00 0.00 C ATOM 1026 CG LEU B 54 0.725 -28.559 3.489 1.00 0.00 C ATOM 1027 CD1 LEU B 54 -0.535 -27.719 3.361 1.00 0.00 C ATOM 1028 CD2 LEU B 54 1.227 -28.556 4.925 1.00 0.00 C ATOM 0 H LEU B 54 1.393 -32.092 0.848 1.00 0.00 H new ATOM 0 HA LEU B 54 -0.061 -29.680 0.962 1.00 0.00 H new ATOM 0 HB2 LEU B 54 -0.563 -30.258 3.261 1.00 0.00 H new ATOM 0 HB3 LEU B 54 1.111 -30.666 3.582 1.00 0.00 H new ATOM 0 HG LEU B 54 1.494 -28.120 2.854 1.00 0.00 H new ATOM 0 HD11 LEU B 54 -0.331 -26.703 3.701 1.00 0.00 H new ATOM 0 HD12 LEU B 54 -0.853 -27.696 2.319 1.00 0.00 H new ATOM 0 HD13 LEU B 54 -1.326 -28.154 3.972 1.00 0.00 H new ATOM 0 HD21 LEU B 54 1.407 -27.530 5.245 1.00 0.00 H new ATOM 0 HD22 LEU B 54 0.479 -29.013 5.573 1.00 0.00 H new ATOM 0 HD23 LEU B 54 2.156 -29.123 4.987 1.00 0.00 H new ATOM 1040 N THR B 55 3.044 -29.789 1.999 1.00 0.00 N ATOM 1041 CA THR B 55 4.423 -29.333 1.756 1.00 0.00 C ATOM 1042 C THR B 55 4.623 -28.689 0.373 1.00 0.00 C ATOM 1043 O THR B 55 4.296 -27.519 0.179 1.00 0.00 O ATOM 1044 CB THR B 55 5.395 -30.497 1.960 1.00 0.00 C ATOM 1045 OG1 THR B 55 5.334 -30.973 3.292 1.00 0.00 O ATOM 1046 CG2 THR B 55 6.837 -30.140 1.667 1.00 0.00 C ATOM 0 H THR B 55 2.901 -30.169 2.935 1.00 0.00 H new ATOM 0 HA THR B 55 4.630 -28.546 2.481 1.00 0.00 H new ATOM 0 HB THR B 55 5.078 -31.261 1.250 1.00 0.00 H new ATOM 0 HG1 THR B 55 5.961 -31.718 3.402 1.00 0.00 H new ATOM 0 HG21 THR B 55 7.469 -31.013 1.833 1.00 0.00 H new ATOM 0 HG22 THR B 55 6.928 -29.818 0.630 1.00 0.00 H new ATOM 0 HG23 THR B 55 7.153 -29.332 2.327 1.00 0.00 H new ATOM 1054 N GLU B 56 5.176 -29.449 -0.577 1.00 0.00 N ATOM 1055 CA GLU B 56 5.437 -28.948 -1.930 1.00 0.00 C ATOM 1056 C GLU B 56 4.358 -27.977 -2.409 1.00 0.00 C ATOM 1057 O GLU B 56 4.603 -26.779 -2.546 1.00 0.00 O ATOM 1058 CB GLU B 56 5.557 -30.115 -2.910 1.00 0.00 C ATOM 1059 CG GLU B 56 5.976 -29.693 -4.309 1.00 0.00 C ATOM 1060 CD GLU B 56 7.480 -29.555 -4.451 1.00 0.00 C ATOM 1061 OE1 GLU B 56 8.158 -30.590 -4.622 1.00 0.00 O ATOM 1062 OE2 GLU B 56 7.980 -28.413 -4.388 1.00 0.00 O ATOM 0 H GLU B 56 5.453 -30.420 -0.432 1.00 0.00 H new ATOM 0 HA GLU B 56 6.378 -28.399 -1.893 1.00 0.00 H new ATOM 0 HB2 GLU B 56 6.282 -30.831 -2.523 1.00 0.00 H new ATOM 0 HB3 GLU B 56 4.599 -30.631 -2.967 1.00 0.00 H new ATOM 0 HG2 GLU B 56 5.612 -30.426 -5.030 1.00 0.00 H new ATOM 0 HG3 GLU B 56 5.503 -28.742 -4.555 1.00 0.00 H new ATOM 1069 N VAL B 57 3.168 -28.503 -2.671 1.00 0.00 N ATOM 1070 CA VAL B 57 2.056 -27.682 -3.148 1.00 0.00 C ATOM 1071 C VAL B 57 1.911 -26.404 -2.321 1.00 0.00 C ATOM 1072 O VAL B 57 1.488 -25.359 -2.837 1.00 0.00 O ATOM 1073 CB VAL B 57 0.719 -28.449 -3.124 1.00 0.00 C ATOM 1074 CG1 VAL B 57 -0.325 -27.706 -3.944 1.00 0.00 C ATOM 1075 CG2 VAL B 57 0.893 -29.874 -3.635 1.00 0.00 C ATOM 0 H VAL B 57 2.946 -29.493 -2.562 1.00 0.00 H new ATOM 0 HA VAL B 57 2.292 -27.421 -4.180 1.00 0.00 H new ATOM 0 HB VAL B 57 0.376 -28.508 -2.091 1.00 0.00 H new ATOM 0 HG11 VAL B 57 -1.266 -28.256 -3.920 1.00 0.00 H new ATOM 0 HG12 VAL B 57 -0.476 -26.711 -3.525 1.00 0.00 H new ATOM 0 HG13 VAL B 57 0.018 -27.617 -4.975 1.00 0.00 H new ATOM 0 HG21 VAL B 57 -0.066 -30.390 -3.606 1.00 0.00 H new ATOM 0 HG22 VAL B 57 1.262 -29.850 -4.660 1.00 0.00 H new ATOM 0 HG23 VAL B 57 1.608 -30.402 -3.004 1.00 0.00 H new ATOM 1085 N GLU B 58 2.292 -26.480 -1.042 1.00 0.00 N ATOM 1086 CA GLU B 58 2.219 -25.324 -0.169 1.00 0.00 C ATOM 1087 C GLU B 58 3.214 -24.287 -0.648 1.00 0.00 C ATOM 1088 O GLU B 58 2.878 -23.122 -0.840 1.00 0.00 O ATOM 1089 CB GLU B 58 2.480 -25.727 1.291 1.00 0.00 C ATOM 1090 CG GLU B 58 3.868 -25.377 1.805 1.00 0.00 C ATOM 1091 CD GLU B 58 4.110 -25.873 3.217 1.00 0.00 C ATOM 1092 OE1 GLU B 58 3.303 -25.539 4.111 1.00 0.00 O ATOM 1093 OE2 GLU B 58 5.107 -26.595 3.430 1.00 0.00 O ATOM 0 H GLU B 58 2.650 -27.326 -0.599 1.00 0.00 H new ATOM 0 HA GLU B 58 1.217 -24.896 -0.205 1.00 0.00 H new ATOM 0 HB2 GLU B 58 1.739 -25.242 1.926 1.00 0.00 H new ATOM 0 HB3 GLU B 58 2.330 -26.802 1.390 1.00 0.00 H new ATOM 0 HG2 GLU B 58 4.617 -25.807 1.140 1.00 0.00 H new ATOM 0 HG3 GLU B 58 4.000 -24.295 1.776 1.00 0.00 H new ATOM 1100 N SER B 59 4.433 -24.734 -0.893 1.00 0.00 N ATOM 1101 CA SER B 59 5.462 -23.851 -1.404 1.00 0.00 C ATOM 1102 C SER B 59 5.080 -23.391 -2.806 1.00 0.00 C ATOM 1103 O SER B 59 5.654 -22.449 -3.338 1.00 0.00 O ATOM 1104 CB SER B 59 6.818 -24.560 -1.432 1.00 0.00 C ATOM 1105 OG SER B 59 7.001 -25.354 -0.272 1.00 0.00 O ATOM 0 H SER B 59 4.732 -25.698 -0.747 1.00 0.00 H new ATOM 0 HA SER B 59 5.546 -22.986 -0.747 1.00 0.00 H new ATOM 0 HB2 SER B 59 6.886 -25.187 -2.321 1.00 0.00 H new ATOM 0 HB3 SER B 59 7.617 -23.822 -1.501 1.00 0.00 H new ATOM 0 HG SER B 59 7.874 -25.798 -0.314 1.00 0.00 H new ATOM 1111 N ARG B 60 4.104 -24.081 -3.399 1.00 0.00 N ATOM 1112 CA ARG B 60 3.633 -23.770 -4.739 1.00 0.00 C ATOM 1113 C ARG B 60 2.728 -22.548 -4.750 1.00 0.00 C ATOM 1114 O ARG B 60 3.141 -21.454 -5.165 1.00 0.00 O ATOM 1115 CB ARG B 60 2.877 -24.972 -5.311 1.00 0.00 C ATOM 1116 CG ARG B 60 3.063 -25.156 -6.808 1.00 0.00 C ATOM 1117 CD ARG B 60 2.703 -23.895 -7.578 1.00 0.00 C ATOM 1118 NE ARG B 60 2.306 -24.189 -8.953 1.00 0.00 N ATOM 1119 CZ ARG B 60 3.150 -24.601 -9.898 1.00 0.00 C ATOM 1120 NH1 ARG B 60 4.436 -24.768 -9.620 1.00 0.00 N ATOM 1121 NH2 ARG B 60 2.704 -24.845 -11.123 1.00 0.00 N ATOM 0 H ARG B 60 3.623 -24.867 -2.961 1.00 0.00 H new ATOM 0 HA ARG B 60 4.504 -23.547 -5.355 1.00 0.00 H new ATOM 0 HB2 ARG B 60 3.209 -25.875 -4.799 1.00 0.00 H new ATOM 0 HB3 ARG B 60 1.814 -24.856 -5.098 1.00 0.00 H new ATOM 0 HG2 ARG B 60 4.098 -25.426 -7.016 1.00 0.00 H new ATOM 0 HG3 ARG B 60 2.442 -25.983 -7.153 1.00 0.00 H new ATOM 0 HD2 ARG B 60 1.890 -23.378 -7.068 1.00 0.00 H new ATOM 0 HD3 ARG B 60 3.557 -23.217 -7.584 1.00 0.00 H new ATOM 0 HE ARG B 60 1.324 -24.072 -9.204 1.00 0.00 H new ATOM 0 HH11 ARG B 60 4.783 -24.581 -8.679 1.00 0.00 H new ATOM 0 HH12 ARG B 60 5.078 -25.084 -10.347 1.00 0.00 H new ATOM 0 HH21 ARG B 60 1.716 -24.717 -11.341 1.00 0.00 H new ATOM 0 HH22 ARG B 60 3.349 -25.160 -11.847 1.00 0.00 H new ATOM 1135 N LEU B 61 1.483 -22.723 -4.302 1.00 0.00 N ATOM 1136 CA LEU B 61 0.558 -21.608 -4.296 1.00 0.00 C ATOM 1137 C LEU B 61 1.101 -20.494 -3.418 1.00 0.00 C ATOM 1138 O LEU B 61 0.823 -19.313 -3.635 1.00 0.00 O ATOM 1139 CB LEU B 61 -0.832 -22.067 -3.873 1.00 0.00 C ATOM 1140 CG LEU B 61 -1.591 -22.802 -4.979 1.00 0.00 C ATOM 1141 CD1 LEU B 61 -1.886 -21.863 -6.142 1.00 0.00 C ATOM 1142 CD2 LEU B 61 -0.788 -24.005 -5.457 1.00 0.00 C ATOM 0 H LEU B 61 1.107 -23.603 -3.950 1.00 0.00 H new ATOM 0 HA LEU B 61 0.459 -21.208 -5.305 1.00 0.00 H new ATOM 0 HB2 LEU B 61 -0.742 -22.722 -3.007 1.00 0.00 H new ATOM 0 HB3 LEU B 61 -1.413 -21.200 -3.558 1.00 0.00 H new ATOM 0 HG LEU B 61 -2.540 -23.153 -4.574 1.00 0.00 H new ATOM 0 HD11 LEU B 61 -2.426 -22.404 -6.919 1.00 0.00 H new ATOM 0 HD12 LEU B 61 -2.494 -21.029 -5.791 1.00 0.00 H new ATOM 0 HD13 LEU B 61 -0.949 -21.483 -6.549 1.00 0.00 H new ATOM 0 HD21 LEU B 61 -1.338 -24.520 -6.244 1.00 0.00 H new ATOM 0 HD22 LEU B 61 0.173 -23.669 -5.846 1.00 0.00 H new ATOM 0 HD23 LEU B 61 -0.624 -24.687 -4.623 1.00 0.00 H new ATOM 1154 N GLU B 62 1.938 -20.873 -2.463 1.00 0.00 N ATOM 1155 CA GLU B 62 2.581 -19.898 -1.604 1.00 0.00 C ATOM 1156 C GLU B 62 3.651 -19.176 -2.414 1.00 0.00 C ATOM 1157 O GLU B 62 3.846 -17.967 -2.272 1.00 0.00 O ATOM 1158 CB GLU B 62 3.193 -20.570 -0.379 1.00 0.00 C ATOM 1159 CG GLU B 62 3.742 -19.588 0.643 1.00 0.00 C ATOM 1160 CD GLU B 62 3.660 -20.115 2.061 1.00 0.00 C ATOM 1161 OE1 GLU B 62 4.456 -21.013 2.409 1.00 0.00 O ATOM 1162 OE2 GLU B 62 2.799 -19.632 2.827 1.00 0.00 O ATOM 0 H GLU B 62 2.185 -21.843 -2.267 1.00 0.00 H new ATOM 0 HA GLU B 62 1.842 -19.182 -1.245 1.00 0.00 H new ATOM 0 HB2 GLU B 62 2.437 -21.194 0.098 1.00 0.00 H new ATOM 0 HB3 GLU B 62 3.996 -21.233 -0.702 1.00 0.00 H new ATOM 0 HG2 GLU B 62 4.781 -19.363 0.403 1.00 0.00 H new ATOM 0 HG3 GLU B 62 3.189 -18.651 0.575 1.00 0.00 H new ATOM 1169 N ARG B 63 4.328 -19.928 -3.294 1.00 0.00 N ATOM 1170 CA ARG B 63 5.354 -19.352 -4.150 1.00 0.00 C ATOM 1171 C ARG B 63 4.747 -18.250 -4.999 1.00 0.00 C ATOM 1172 O ARG B 63 5.357 -17.199 -5.197 1.00 0.00 O ATOM 1173 CB ARG B 63 5.979 -20.415 -5.058 1.00 0.00 C ATOM 1174 CG ARG B 63 7.380 -20.827 -4.635 1.00 0.00 C ATOM 1175 CD ARG B 63 8.393 -19.732 -4.924 1.00 0.00 C ATOM 1176 NE ARG B 63 9.764 -20.237 -4.932 1.00 0.00 N ATOM 1177 CZ ARG B 63 10.840 -19.464 -4.818 1.00 0.00 C ATOM 1178 NH1 ARG B 63 10.710 -18.149 -4.691 1.00 0.00 N ATOM 1179 NH2 ARG B 63 12.051 -20.005 -4.829 1.00 0.00 N ATOM 0 H ARG B 63 4.179 -20.929 -3.425 1.00 0.00 H new ATOM 0 HA ARG B 63 6.139 -18.942 -3.515 1.00 0.00 H new ATOM 0 HB2 ARG B 63 5.337 -21.296 -5.068 1.00 0.00 H new ATOM 0 HB3 ARG B 63 6.013 -20.035 -6.079 1.00 0.00 H new ATOM 0 HG2 ARG B 63 7.386 -21.058 -3.570 1.00 0.00 H new ATOM 0 HG3 ARG B 63 7.667 -21.738 -5.161 1.00 0.00 H new ATOM 0 HD2 ARG B 63 8.169 -19.278 -5.889 1.00 0.00 H new ATOM 0 HD3 ARG B 63 8.301 -18.947 -4.173 1.00 0.00 H new ATOM 0 HE ARG B 63 9.904 -21.242 -5.031 1.00 0.00 H new ATOM 0 HH11 ARG B 63 9.781 -17.727 -4.680 1.00 0.00 H new ATOM 0 HH12 ARG B 63 11.539 -17.561 -4.604 1.00 0.00 H new ATOM 0 HH21 ARG B 63 12.158 -21.015 -4.925 1.00 0.00 H new ATOM 0 HH22 ARG B 63 12.876 -19.411 -4.742 1.00 0.00 H new ATOM 1193 N LEU B 64 3.527 -18.483 -5.484 1.00 0.00 N ATOM 1194 CA LEU B 64 2.850 -17.469 -6.288 1.00 0.00 C ATOM 1195 C LEU B 64 2.268 -16.389 -5.392 1.00 0.00 C ATOM 1196 O LEU B 64 2.065 -15.251 -5.816 1.00 0.00 O ATOM 1197 CB LEU B 64 1.766 -18.074 -7.190 1.00 0.00 C ATOM 1198 CG LEU B 64 0.875 -19.142 -6.553 1.00 0.00 C ATOM 1199 CD1 LEU B 64 -0.366 -18.509 -5.942 1.00 0.00 C ATOM 1200 CD2 LEU B 64 0.487 -20.185 -7.593 1.00 0.00 C ATOM 0 H LEU B 64 2.999 -19.343 -5.339 1.00 0.00 H new ATOM 0 HA LEU B 64 3.595 -17.020 -6.945 1.00 0.00 H new ATOM 0 HB2 LEU B 64 1.129 -17.266 -7.549 1.00 0.00 H new ATOM 0 HB3 LEU B 64 2.251 -18.509 -8.064 1.00 0.00 H new ATOM 0 HG LEU B 64 1.433 -19.633 -5.756 1.00 0.00 H new ATOM 0 HD11 LEU B 64 -0.987 -19.285 -5.494 1.00 0.00 H new ATOM 0 HD12 LEU B 64 -0.069 -17.793 -5.175 1.00 0.00 H new ATOM 0 HD13 LEU B 64 -0.932 -17.995 -6.719 1.00 0.00 H new ATOM 0 HD21 LEU B 64 -0.147 -20.941 -7.131 1.00 0.00 H new ATOM 0 HD22 LEU B 64 -0.056 -19.703 -8.406 1.00 0.00 H new ATOM 0 HD23 LEU B 64 1.387 -20.658 -7.988 1.00 0.00 H new ATOM 1212 N GLU B 65 2.032 -16.750 -4.141 1.00 0.00 N ATOM 1213 CA GLU B 65 1.506 -15.817 -3.155 1.00 0.00 C ATOM 1214 C GLU B 65 2.534 -14.722 -2.892 1.00 0.00 C ATOM 1215 O GLU B 65 2.185 -13.564 -2.666 1.00 0.00 O ATOM 1216 CB GLU B 65 1.155 -16.562 -1.856 1.00 0.00 C ATOM 1217 CG GLU B 65 1.267 -15.723 -0.586 1.00 0.00 C ATOM 1218 CD GLU B 65 0.219 -14.630 -0.511 1.00 0.00 C ATOM 1219 OE1 GLU B 65 0.070 -13.878 -1.496 1.00 0.00 O ATOM 1220 OE2 GLU B 65 -0.453 -14.524 0.536 1.00 0.00 O ATOM 0 H GLU B 65 2.198 -17.690 -3.781 1.00 0.00 H new ATOM 0 HA GLU B 65 0.595 -15.358 -3.538 1.00 0.00 H new ATOM 0 HB2 GLU B 65 0.136 -16.941 -1.935 1.00 0.00 H new ATOM 0 HB3 GLU B 65 1.811 -17.428 -1.762 1.00 0.00 H new ATOM 0 HG2 GLU B 65 1.170 -16.373 0.283 1.00 0.00 H new ATOM 0 HG3 GLU B 65 2.259 -15.273 -0.539 1.00 0.00 H new ATOM 1227 N GLN B 66 3.810 -15.097 -2.941 1.00 0.00 N ATOM 1228 CA GLN B 66 4.892 -14.145 -2.723 1.00 0.00 C ATOM 1229 C GLN B 66 5.029 -13.211 -3.923 1.00 0.00 C ATOM 1230 O GLN B 66 5.467 -12.069 -3.787 1.00 0.00 O ATOM 1231 CB GLN B 66 6.211 -14.882 -2.476 1.00 0.00 C ATOM 1232 CG GLN B 66 6.683 -14.813 -1.034 1.00 0.00 C ATOM 1233 CD GLN B 66 6.368 -16.075 -0.255 1.00 0.00 C ATOM 1234 OE1 GLN B 66 5.742 -16.999 -0.775 1.00 0.00 O ATOM 1235 NE2 GLN B 66 6.803 -16.120 0.999 1.00 0.00 N ATOM 0 H GLN B 66 4.118 -16.051 -3.129 1.00 0.00 H new ATOM 0 HA GLN B 66 4.654 -13.550 -1.841 1.00 0.00 H new ATOM 0 HB2 GLN B 66 6.093 -15.927 -2.762 1.00 0.00 H new ATOM 0 HB3 GLN B 66 6.980 -14.460 -3.122 1.00 0.00 H new ATOM 0 HG2 GLN B 66 7.759 -14.639 -1.016 1.00 0.00 H new ATOM 0 HG3 GLN B 66 6.214 -13.961 -0.543 1.00 0.00 H new ATOM 0 HE21 GLN B 66 7.318 -15.331 1.389 1.00 0.00 H new ATOM 0 HE22 GLN B 66 6.622 -16.944 1.572 1.00 0.00 H new ATOM 1244 N LEU B 67 4.646 -13.709 -5.096 1.00 0.00 N ATOM 1245 CA LEU B 67 4.719 -12.925 -6.322 1.00 0.00 C ATOM 1246 C LEU B 67 3.401 -12.198 -6.595 1.00 0.00 C ATOM 1247 O LEU B 67 3.277 -11.479 -7.586 1.00 0.00 O ATOM 1248 CB LEU B 67 5.070 -13.831 -7.506 1.00 0.00 C ATOM 1249 CG LEU B 67 6.322 -13.423 -8.286 1.00 0.00 C ATOM 1250 CD1 LEU B 67 7.050 -14.653 -8.809 1.00 0.00 C ATOM 1251 CD2 LEU B 67 5.952 -12.494 -9.432 1.00 0.00 C ATOM 0 H LEU B 67 4.282 -14.653 -5.221 1.00 0.00 H new ATOM 0 HA LEU B 67 5.501 -12.176 -6.196 1.00 0.00 H new ATOM 0 HB2 LEU B 67 5.205 -14.848 -7.138 1.00 0.00 H new ATOM 0 HB3 LEU B 67 4.223 -13.850 -8.192 1.00 0.00 H new ATOM 0 HG LEU B 67 6.992 -12.890 -7.611 1.00 0.00 H new ATOM 0 HD11 LEU B 67 7.937 -14.343 -9.361 1.00 0.00 H new ATOM 0 HD12 LEU B 67 7.346 -15.284 -7.971 1.00 0.00 H new ATOM 0 HD13 LEU B 67 6.389 -15.213 -9.470 1.00 0.00 H new ATOM 0 HD21 LEU B 67 6.853 -12.212 -9.977 1.00 0.00 H new ATOM 0 HD22 LEU B 67 5.264 -13.004 -10.106 1.00 0.00 H new ATOM 0 HD23 LEU B 67 5.474 -11.599 -9.035 1.00 0.00 H new ATOM 1263 N PHE B 68 2.420 -12.387 -5.708 1.00 0.00 N ATOM 1264 CA PHE B 68 1.106 -11.750 -5.847 1.00 0.00 C ATOM 1265 C PHE B 68 0.560 -11.895 -7.269 1.00 0.00 C ATOM 1266 O PHE B 68 -0.155 -12.850 -7.571 1.00 0.00 O ATOM 1267 CB PHE B 68 1.161 -10.267 -5.442 1.00 0.00 C ATOM 1268 CG PHE B 68 2.541 -9.666 -5.476 1.00 0.00 C ATOM 1269 CD1 PHE B 68 3.489 -10.025 -4.533 1.00 0.00 C ATOM 1270 CD2 PHE B 68 2.886 -8.744 -6.452 1.00 0.00 C ATOM 1271 CE1 PHE B 68 4.758 -9.477 -4.561 1.00 0.00 C ATOM 1272 CE2 PHE B 68 4.154 -8.193 -6.486 1.00 0.00 C ATOM 1273 CZ PHE B 68 5.090 -8.559 -5.538 1.00 0.00 C ATOM 0 H PHE B 68 2.511 -12.979 -4.882 1.00 0.00 H new ATOM 0 HA PHE B 68 0.425 -12.266 -5.170 1.00 0.00 H new ATOM 0 HB2 PHE B 68 0.513 -9.697 -6.107 1.00 0.00 H new ATOM 0 HB3 PHE B 68 0.757 -10.162 -4.435 1.00 0.00 H new ATOM 0 HD1 PHE B 68 3.234 -10.742 -3.766 1.00 0.00 H new ATOM 0 HD2 PHE B 68 2.157 -8.453 -7.194 1.00 0.00 H new ATOM 0 HE1 PHE B 68 5.489 -9.766 -3.820 1.00 0.00 H new ATOM 0 HE2 PHE B 68 4.412 -7.477 -7.253 1.00 0.00 H new ATOM 0 HZ PHE B 68 6.080 -8.128 -5.561 1.00 0.00 H new ATOM 1283 N LEU B 69 0.894 -10.944 -8.139 1.00 0.00 N ATOM 1284 CA LEU B 69 0.429 -10.976 -9.522 1.00 0.00 C ATOM 1285 C LEU B 69 -1.091 -10.845 -9.590 1.00 0.00 C ATOM 1286 O LEU B 69 -1.717 -11.285 -10.554 1.00 0.00 O ATOM 1287 CB LEU B 69 0.877 -12.273 -10.203 1.00 0.00 C ATOM 1288 CG LEU B 69 1.624 -12.084 -11.525 1.00 0.00 C ATOM 1289 CD1 LEU B 69 3.121 -11.975 -11.280 1.00 0.00 C ATOM 1290 CD2 LEU B 69 1.320 -13.231 -12.477 1.00 0.00 C ATOM 0 H LEU B 69 1.484 -10.144 -7.910 1.00 0.00 H new ATOM 0 HA LEU B 69 0.870 -10.129 -10.048 1.00 0.00 H new ATOM 0 HB2 LEU B 69 1.519 -12.824 -9.516 1.00 0.00 H new ATOM 0 HB3 LEU B 69 -0.001 -12.893 -10.384 1.00 0.00 H new ATOM 0 HG LEU B 69 1.283 -11.156 -11.985 1.00 0.00 H new ATOM 0 HD11 LEU B 69 3.637 -11.841 -12.231 1.00 0.00 H new ATOM 0 HD12 LEU B 69 3.323 -11.120 -10.634 1.00 0.00 H new ATOM 0 HD13 LEU B 69 3.478 -12.886 -10.799 1.00 0.00 H new ATOM 0 HD21 LEU B 69 1.859 -13.080 -13.412 1.00 0.00 H new ATOM 0 HD22 LEU B 69 1.633 -14.172 -12.025 1.00 0.00 H new ATOM 0 HD23 LEU B 69 0.249 -13.264 -12.677 1.00 0.00 H new ATOM 1302 N LEU B 70 -1.676 -10.236 -8.563 1.00 0.00 N ATOM 1303 CA LEU B 70 -3.121 -10.047 -8.507 1.00 0.00 C ATOM 1304 C LEU B 70 -3.474 -8.770 -7.752 1.00 0.00 C ATOM 1305 O LEU B 70 -4.272 -7.960 -8.222 1.00 0.00 O ATOM 1306 CB LEU B 70 -3.790 -11.251 -7.840 1.00 0.00 C ATOM 1307 CG LEU B 70 -3.808 -12.529 -8.678 1.00 0.00 C ATOM 1308 CD1 LEU B 70 -3.960 -13.750 -7.787 1.00 0.00 C ATOM 1309 CD2 LEU B 70 -4.927 -12.473 -9.709 1.00 0.00 C ATOM 0 H LEU B 70 -1.171 -9.865 -7.758 1.00 0.00 H new ATOM 0 HA LEU B 70 -3.490 -9.957 -9.529 1.00 0.00 H new ATOM 0 HB2 LEU B 70 -3.277 -11.458 -6.901 1.00 0.00 H new ATOM 0 HB3 LEU B 70 -4.817 -10.984 -7.590 1.00 0.00 H new ATOM 0 HG LEU B 70 -2.858 -12.609 -9.206 1.00 0.00 H new ATOM 0 HD11 LEU B 70 -3.971 -14.650 -8.402 1.00 0.00 H new ATOM 0 HD12 LEU B 70 -3.124 -13.797 -7.089 1.00 0.00 H new ATOM 0 HD13 LEU B 70 -4.894 -13.680 -7.230 1.00 0.00 H new ATOM 0 HD21 LEU B 70 -4.926 -13.391 -10.297 1.00 0.00 H new ATOM 0 HD22 LEU B 70 -5.885 -12.369 -9.200 1.00 0.00 H new ATOM 0 HD23 LEU B 70 -4.772 -11.619 -10.368 1.00 0.00 H new ATOM 1321 N ILE B 71 -2.874 -8.598 -6.578 1.00 0.00 N ATOM 1322 CA ILE B 71 -3.125 -7.419 -5.758 1.00 0.00 C ATOM 1323 C ILE B 71 -2.271 -6.239 -6.210 1.00 0.00 C ATOM 1324 O ILE B 71 -2.699 -5.087 -6.140 1.00 0.00 O ATOM 1325 CB ILE B 71 -2.843 -7.699 -4.270 1.00 0.00 C ATOM 1326 CG1 ILE B 71 -3.516 -9.001 -3.836 1.00 0.00 C ATOM 1327 CG2 ILE B 71 -3.319 -6.537 -3.411 1.00 0.00 C ATOM 1328 CD1 ILE B 71 -2.614 -10.212 -3.941 1.00 0.00 C ATOM 0 H ILE B 71 -2.211 -9.260 -6.174 1.00 0.00 H new ATOM 0 HA ILE B 71 -4.179 -7.169 -5.882 1.00 0.00 H new ATOM 0 HB ILE B 71 -1.767 -7.807 -4.135 1.00 0.00 H new ATOM 0 HG12 ILE B 71 -3.855 -8.899 -2.805 1.00 0.00 H new ATOM 0 HG13 ILE B 71 -4.403 -9.164 -4.449 1.00 0.00 H new ATOM 0 HG21 ILE B 71 -3.112 -6.751 -2.362 1.00 0.00 H new ATOM 0 HG22 ILE B 71 -2.795 -5.628 -3.706 1.00 0.00 H new ATOM 0 HG23 ILE B 71 -4.391 -6.398 -3.548 1.00 0.00 H new ATOM 0 HD11 ILE B 71 -3.157 -11.100 -3.617 1.00 0.00 H new ATOM 0 HD12 ILE B 71 -2.295 -10.339 -4.975 1.00 0.00 H new ATOM 0 HD13 ILE B 71 -1.739 -10.070 -3.306 1.00 0.00 H new ATOM 1340 N PHE B 72 -1.062 -6.534 -6.675 1.00 0.00 N ATOM 1341 CA PHE B 72 -0.148 -5.496 -7.139 1.00 0.00 C ATOM 1342 C PHE B 72 -0.091 -5.462 -8.664 1.00 0.00 C ATOM 1343 O PHE B 72 0.701 -6.178 -9.279 1.00 0.00 O ATOM 1344 CB PHE B 72 1.253 -5.730 -6.567 1.00 0.00 C ATOM 1345 CG PHE B 72 1.912 -4.475 -6.070 1.00 0.00 C ATOM 1346 CD1 PHE B 72 1.602 -3.963 -4.820 1.00 0.00 C ATOM 1347 CD2 PHE B 72 2.840 -3.807 -6.852 1.00 0.00 C ATOM 1348 CE1 PHE B 72 2.206 -2.808 -4.360 1.00 0.00 C ATOM 1349 CE2 PHE B 72 3.447 -2.652 -6.398 1.00 0.00 C ATOM 1350 CZ PHE B 72 3.130 -2.151 -5.149 1.00 0.00 C ATOM 0 H PHE B 72 -0.692 -7.482 -6.741 1.00 0.00 H new ATOM 0 HA PHE B 72 -0.520 -4.534 -6.788 1.00 0.00 H new ATOM 0 HB2 PHE B 72 1.188 -6.446 -5.748 1.00 0.00 H new ATOM 0 HB3 PHE B 72 1.880 -6.181 -7.336 1.00 0.00 H new ATOM 0 HD1 PHE B 72 0.880 -4.472 -4.198 1.00 0.00 H new ATOM 0 HD2 PHE B 72 3.092 -4.194 -7.828 1.00 0.00 H new ATOM 0 HE1 PHE B 72 1.956 -2.419 -3.384 1.00 0.00 H new ATOM 0 HE2 PHE B 72 4.168 -2.141 -7.018 1.00 0.00 H new ATOM 0 HZ PHE B 72 3.603 -1.249 -4.791 1.00 0.00 H new ATOM 1360 N PRO B 73 -0.932 -4.626 -9.300 1.00 0.00 N ATOM 1361 CA PRO B 73 -0.968 -4.507 -10.761 1.00 0.00 C ATOM 1362 C PRO B 73 0.290 -3.855 -11.322 1.00 0.00 C ATOM 1363 O PRO B 73 1.269 -3.651 -10.604 1.00 0.00 O ATOM 1364 CB PRO B 73 -2.190 -3.621 -11.017 1.00 0.00 C ATOM 1365 CG PRO B 73 -2.357 -2.834 -9.764 1.00 0.00 C ATOM 1366 CD PRO B 73 -1.909 -3.735 -8.647 1.00 0.00 C ATOM 0 HA PRO B 73 -1.023 -5.481 -11.246 1.00 0.00 H new ATOM 0 HB2 PRO B 73 -2.033 -2.969 -11.876 1.00 0.00 H new ATOM 0 HB3 PRO B 73 -3.076 -4.220 -11.229 1.00 0.00 H new ATOM 0 HG2 PRO B 73 -1.760 -1.922 -9.793 1.00 0.00 H new ATOM 0 HG3 PRO B 73 -3.395 -2.531 -9.629 1.00 0.00 H new ATOM 0 HD2 PRO B 73 -1.456 -3.170 -7.832 1.00 0.00 H new ATOM 0 HD3 PRO B 73 -2.743 -4.295 -8.223 1.00 0.00 H new ATOM 1374 N ARG B 74 0.256 -3.529 -12.610 1.00 0.00 N ATOM 1375 CA ARG B 74 1.392 -2.900 -13.273 1.00 0.00 C ATOM 1376 C ARG B 74 0.914 -1.937 -14.356 1.00 0.00 C ATOM 1377 O ARG B 74 0.886 -2.282 -15.536 1.00 0.00 O ATOM 1378 CB ARG B 74 2.303 -3.964 -13.888 1.00 0.00 C ATOM 1379 CG ARG B 74 3.299 -4.558 -12.907 1.00 0.00 C ATOM 1380 CD ARG B 74 4.662 -3.894 -13.024 1.00 0.00 C ATOM 1381 NE ARG B 74 5.327 -3.773 -11.730 1.00 0.00 N ATOM 1382 CZ ARG B 74 6.352 -2.956 -11.496 1.00 0.00 C ATOM 1383 NH1 ARG B 74 6.832 -2.188 -12.468 1.00 0.00 N ATOM 1384 NH2 ARG B 74 6.899 -2.904 -10.289 1.00 0.00 N ATOM 0 H ARG B 74 -0.548 -3.691 -13.216 1.00 0.00 H new ATOM 0 HA ARG B 74 1.955 -2.338 -12.528 1.00 0.00 H new ATOM 0 HB2 ARG B 74 1.687 -4.765 -14.296 1.00 0.00 H new ATOM 0 HB3 ARG B 74 2.848 -3.524 -14.723 1.00 0.00 H new ATOM 0 HG2 ARG B 74 2.923 -4.442 -11.890 1.00 0.00 H new ATOM 0 HG3 ARG B 74 3.398 -5.628 -13.090 1.00 0.00 H new ATOM 0 HD2 ARG B 74 5.290 -4.473 -13.701 1.00 0.00 H new ATOM 0 HD3 ARG B 74 4.546 -2.904 -13.465 1.00 0.00 H new ATOM 0 HE ARG B 74 4.986 -4.348 -10.960 1.00 0.00 H new ATOM 0 HH11 ARG B 74 6.415 -2.223 -13.398 1.00 0.00 H new ATOM 0 HH12 ARG B 74 7.617 -1.564 -12.284 1.00 0.00 H new ATOM 0 HH21 ARG B 74 6.535 -3.490 -9.538 1.00 0.00 H new ATOM 0 HH22 ARG B 74 7.684 -2.278 -10.111 1.00 0.00 H new ATOM 1398 N GLU B 75 0.528 -0.731 -13.950 1.00 0.00 N ATOM 1399 CA GLU B 75 0.041 0.271 -14.894 1.00 0.00 C ATOM 1400 C GLU B 75 0.904 1.531 -14.873 1.00 0.00 C ATOM 1401 O GLU B 75 0.517 2.561 -15.425 1.00 0.00 O ATOM 1402 CB GLU B 75 -1.410 0.632 -14.579 1.00 0.00 C ATOM 1403 CG GLU B 75 -2.352 -0.561 -14.602 1.00 0.00 C ATOM 1404 CD GLU B 75 -3.635 -0.279 -15.357 1.00 0.00 C ATOM 1405 OE1 GLU B 75 -4.456 0.520 -14.858 1.00 0.00 O ATOM 1406 OE2 GLU B 75 -3.819 -0.854 -16.450 1.00 0.00 O ATOM 0 H GLU B 75 0.543 -0.424 -12.977 1.00 0.00 H new ATOM 0 HA GLU B 75 0.100 -0.161 -15.893 1.00 0.00 H new ATOM 0 HB2 GLU B 75 -1.454 1.100 -13.596 1.00 0.00 H new ATOM 0 HB3 GLU B 75 -1.756 1.372 -15.300 1.00 0.00 H new ATOM 0 HG2 GLU B 75 -1.845 -1.410 -15.060 1.00 0.00 H new ATOM 0 HG3 GLU B 75 -2.593 -0.848 -13.578 1.00 0.00 H new ATOM 1413 N ASP B 76 2.072 1.450 -14.241 1.00 0.00 N ATOM 1414 CA ASP B 76 2.979 2.590 -14.160 1.00 0.00 C ATOM 1415 C ASP B 76 2.369 3.713 -13.323 1.00 0.00 C ATOM 1416 O ASP B 76 2.786 3.951 -12.190 1.00 0.00 O ATOM 1417 CB ASP B 76 3.317 3.104 -15.562 1.00 0.00 C ATOM 1418 CG ASP B 76 4.804 3.049 -15.855 1.00 0.00 C ATOM 1419 OD1 ASP B 76 5.377 1.941 -15.815 1.00 0.00 O ATOM 1420 OD2 ASP B 76 5.395 4.117 -16.125 1.00 0.00 O ATOM 0 H ASP B 76 2.412 0.607 -13.778 1.00 0.00 H new ATOM 0 HA ASP B 76 3.897 2.258 -13.674 1.00 0.00 H new ATOM 0 HB2 ASP B 76 2.781 2.510 -16.303 1.00 0.00 H new ATOM 0 HB3 ASP B 76 2.967 4.131 -15.664 1.00 0.00 H new ATOM 1425 N LEU B 77 1.379 4.399 -13.889 1.00 0.00 N ATOM 1426 CA LEU B 77 0.708 5.495 -13.194 1.00 0.00 C ATOM 1427 C LEU B 77 0.286 5.072 -11.790 1.00 0.00 C ATOM 1428 O LEU B 77 0.004 3.899 -11.546 1.00 0.00 O ATOM 1429 CB LEU B 77 -0.515 5.957 -13.990 1.00 0.00 C ATOM 1430 CG LEU B 77 -1.391 4.829 -14.545 1.00 0.00 C ATOM 1431 CD1 LEU B 77 -2.764 4.841 -13.891 1.00 0.00 C ATOM 1432 CD2 LEU B 77 -1.519 4.946 -16.057 1.00 0.00 C ATOM 0 H LEU B 77 1.023 4.215 -14.827 1.00 0.00 H new ATOM 0 HA LEU B 77 1.411 6.323 -13.108 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -1.128 6.591 -13.350 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -0.176 6.576 -14.821 1.00 0.00 H new ATOM 0 HG LEU B 77 -0.910 3.879 -14.312 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -3.369 4.032 -14.300 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -2.656 4.705 -12.815 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -3.253 5.795 -14.089 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -2.145 4.136 -16.433 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -1.974 5.904 -16.311 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -0.531 4.882 -16.512 1.00 0.00 H new ATOM 1444 N ASP B 78 0.260 6.028 -10.866 1.00 0.00 N ATOM 1445 CA ASP B 78 -0.115 5.739 -9.488 1.00 0.00 C ATOM 1446 C ASP B 78 -1.605 5.976 -9.253 1.00 0.00 C ATOM 1447 O ASP B 78 -2.008 7.005 -8.702 1.00 0.00 O ATOM 1448 CB ASP B 78 0.716 6.587 -8.526 1.00 0.00 C ATOM 1449 CG ASP B 78 0.737 8.053 -8.914 1.00 0.00 C ATOM 1450 OD1 ASP B 78 -0.261 8.754 -8.648 1.00 0.00 O ATOM 1451 OD2 ASP B 78 1.756 8.499 -9.485 1.00 0.00 O ATOM 0 H ASP B 78 0.493 7.005 -11.046 1.00 0.00 H new ATOM 0 HA ASP B 78 0.088 4.685 -9.300 1.00 0.00 H new ATOM 0 HB2 ASP B 78 0.313 6.487 -7.518 1.00 0.00 H new ATOM 0 HB3 ASP B 78 1.737 6.207 -8.501 1.00 0.00 H new ATOM 1456 N MET B 79 -2.418 5.007 -9.668 1.00 0.00 N ATOM 1457 CA MET B 79 -3.866 5.093 -9.507 1.00 0.00 C ATOM 1458 C MET B 79 -4.239 5.428 -8.064 1.00 0.00 C ATOM 1459 O MET B 79 -5.278 6.029 -7.809 1.00 0.00 O ATOM 1460 CB MET B 79 -4.523 3.775 -9.921 1.00 0.00 C ATOM 1461 CG MET B 79 -4.075 2.582 -9.092 1.00 0.00 C ATOM 1462 SD MET B 79 -3.942 1.071 -10.068 1.00 0.00 S ATOM 1463 CE MET B 79 -4.061 -0.173 -8.785 1.00 0.00 C ATOM 0 H MET B 79 -2.096 4.151 -10.120 1.00 0.00 H new ATOM 0 HA MET B 79 -4.230 5.894 -10.151 1.00 0.00 H new ATOM 0 HB2 MET B 79 -5.605 3.877 -9.839 1.00 0.00 H new ATOM 0 HB3 MET B 79 -4.300 3.582 -10.970 1.00 0.00 H new ATOM 0 HG2 MET B 79 -3.109 2.802 -8.637 1.00 0.00 H new ATOM 0 HG3 MET B 79 -4.782 2.423 -8.278 1.00 0.00 H new ATOM 0 HE1 MET B 79 -4.658 -1.011 -9.145 1.00 0.00 H new ATOM 0 HE2 MET B 79 -3.062 -0.524 -8.525 1.00 0.00 H new ATOM 0 HE3 MET B 79 -4.536 0.258 -7.903 1.00 0.00 H new ATOM 1473 N ILE B 80 -3.380 5.038 -7.126 1.00 0.00 N ATOM 1474 CA ILE B 80 -3.624 5.306 -5.714 1.00 0.00 C ATOM 1475 C ILE B 80 -3.324 6.763 -5.381 1.00 0.00 C ATOM 1476 O ILE B 80 -4.199 7.503 -4.938 1.00 0.00 O ATOM 1477 CB ILE B 80 -2.768 4.398 -4.812 1.00 0.00 C ATOM 1478 CG1 ILE B 80 -2.892 2.938 -5.253 1.00 0.00 C ATOM 1479 CG2 ILE B 80 -3.182 4.555 -3.356 1.00 0.00 C ATOM 1480 CD1 ILE B 80 -1.783 2.052 -4.726 1.00 0.00 C ATOM 0 H ILE B 80 -2.512 4.537 -7.318 1.00 0.00 H new ATOM 0 HA ILE B 80 -4.677 5.097 -5.526 1.00 0.00 H new ATOM 0 HB ILE B 80 -1.724 4.698 -4.907 1.00 0.00 H new ATOM 0 HG12 ILE B 80 -3.851 2.545 -4.916 1.00 0.00 H new ATOM 0 HG13 ILE B 80 -2.895 2.895 -6.342 1.00 0.00 H new ATOM 0 HG21 ILE B 80 -2.568 3.907 -2.731 1.00 0.00 H new ATOM 0 HG22 ILE B 80 -3.045 5.592 -3.048 1.00 0.00 H new ATOM 0 HG23 ILE B 80 -4.231 4.279 -3.244 1.00 0.00 H new ATOM 0 HD11 ILE B 80 -1.934 1.031 -5.078 1.00 0.00 H new ATOM 0 HD12 ILE B 80 -0.822 2.420 -5.084 1.00 0.00 H new ATOM 0 HD13 ILE B 80 -1.793 2.065 -3.636 1.00 0.00 H new ATOM 1492 N LEU B 81 -2.078 7.166 -5.601 1.00 0.00 N ATOM 1493 CA LEU B 81 -1.648 8.533 -5.328 1.00 0.00 C ATOM 1494 C LEU B 81 -2.528 9.557 -6.047 1.00 0.00 C ATOM 1495 O LEU B 81 -2.540 10.733 -5.681 1.00 0.00 O ATOM 1496 CB LEU B 81 -0.191 8.715 -5.766 1.00 0.00 C ATOM 1497 CG LEU B 81 0.869 8.509 -4.682 1.00 0.00 C ATOM 1498 CD1 LEU B 81 0.958 9.729 -3.781 1.00 0.00 C ATOM 1499 CD2 LEU B 81 0.582 7.254 -3.868 1.00 0.00 C ATOM 0 H LEU B 81 -1.344 6.562 -5.970 1.00 0.00 H new ATOM 0 HA LEU B 81 -1.740 8.702 -4.255 1.00 0.00 H new ATOM 0 HB2 LEU B 81 0.012 8.020 -6.580 1.00 0.00 H new ATOM 0 HB3 LEU B 81 -0.077 9.721 -6.170 1.00 0.00 H new ATOM 0 HG LEU B 81 1.833 8.376 -5.173 1.00 0.00 H new ATOM 0 HD11 LEU B 81 1.717 9.562 -3.017 1.00 0.00 H new ATOM 0 HD12 LEU B 81 1.227 10.602 -4.376 1.00 0.00 H new ATOM 0 HD13 LEU B 81 -0.007 9.899 -3.303 1.00 0.00 H new ATOM 0 HD21 LEU B 81 1.351 7.132 -3.105 1.00 0.00 H new ATOM 0 HD22 LEU B 81 -0.393 7.346 -3.390 1.00 0.00 H new ATOM 0 HD23 LEU B 81 0.583 6.385 -4.526 1.00 0.00 H new ATOM 1511 N LYS B 82 -3.247 9.122 -7.083 1.00 0.00 N ATOM 1512 CA LYS B 82 -4.097 10.034 -7.846 1.00 0.00 C ATOM 1513 C LYS B 82 -5.583 9.884 -7.507 1.00 0.00 C ATOM 1514 O LYS B 82 -6.361 10.818 -7.699 1.00 0.00 O ATOM 1515 CB LYS B 82 -3.886 9.813 -9.346 1.00 0.00 C ATOM 1516 CG LYS B 82 -2.503 10.217 -9.830 1.00 0.00 C ATOM 1517 CD LYS B 82 -2.535 11.547 -10.568 1.00 0.00 C ATOM 1518 CE LYS B 82 -1.350 12.422 -10.191 1.00 0.00 C ATOM 1519 NZ LYS B 82 -0.916 13.290 -11.321 1.00 0.00 N ATOM 0 H LYS B 82 -3.258 8.156 -7.409 1.00 0.00 H new ATOM 0 HA LYS B 82 -3.804 11.047 -7.569 1.00 0.00 H new ATOM 0 HB2 LYS B 82 -4.050 8.760 -9.577 1.00 0.00 H new ATOM 0 HB3 LYS B 82 -4.635 10.381 -9.898 1.00 0.00 H new ATOM 0 HG2 LYS B 82 -1.825 10.288 -8.979 1.00 0.00 H new ATOM 0 HG3 LYS B 82 -2.107 9.444 -10.489 1.00 0.00 H new ATOM 0 HD2 LYS B 82 -2.529 11.368 -11.643 1.00 0.00 H new ATOM 0 HD3 LYS B 82 -3.463 12.070 -10.337 1.00 0.00 H new ATOM 0 HE2 LYS B 82 -1.616 13.045 -9.337 1.00 0.00 H new ATOM 0 HE3 LYS B 82 -0.518 11.791 -9.878 1.00 0.00 H new ATOM 0 HZ1 LYS B 82 -0.106 13.870 -11.022 1.00 0.00 H new ATOM 0 HZ2 LYS B 82 -0.637 12.696 -12.128 1.00 0.00 H new ATOM 0 HZ3 LYS B 82 -1.701 13.911 -11.603 1.00 0.00 H new ATOM 1533 N MET B 83 -5.984 8.710 -7.029 1.00 0.00 N ATOM 1534 CA MET B 83 -7.389 8.466 -6.701 1.00 0.00 C ATOM 1535 C MET B 83 -7.678 8.618 -5.207 1.00 0.00 C ATOM 1536 O MET B 83 -8.822 8.473 -4.777 1.00 0.00 O ATOM 1537 CB MET B 83 -7.804 7.068 -7.163 1.00 0.00 C ATOM 1538 CG MET B 83 -7.728 6.876 -8.670 1.00 0.00 C ATOM 1539 SD MET B 83 -9.344 6.970 -9.467 1.00 0.00 S ATOM 1540 CE MET B 83 -10.204 5.632 -8.644 1.00 0.00 C ATOM 0 H MET B 83 -5.364 7.918 -6.860 1.00 0.00 H new ATOM 0 HA MET B 83 -7.972 9.222 -7.227 1.00 0.00 H new ATOM 0 HB2 MET B 83 -7.165 6.330 -6.679 1.00 0.00 H new ATOM 0 HB3 MET B 83 -8.824 6.873 -6.831 1.00 0.00 H new ATOM 0 HG2 MET B 83 -7.073 7.636 -9.096 1.00 0.00 H new ATOM 0 HG3 MET B 83 -7.277 5.908 -8.886 1.00 0.00 H new ATOM 0 HE1 MET B 83 -10.923 5.185 -9.330 1.00 0.00 H new ATOM 0 HE2 MET B 83 -9.485 4.876 -8.330 1.00 0.00 H new ATOM 0 HE3 MET B 83 -10.728 6.019 -7.770 1.00 0.00 H new ATOM 1550 N ASP B 84 -6.649 8.900 -4.413 1.00 0.00 N ATOM 1551 CA ASP B 84 -6.825 9.054 -2.972 1.00 0.00 C ATOM 1552 C ASP B 84 -6.422 10.449 -2.508 1.00 0.00 C ATOM 1553 O ASP B 84 -5.277 10.678 -2.118 1.00 0.00 O ATOM 1554 CB ASP B 84 -6.009 7.998 -2.223 1.00 0.00 C ATOM 1555 CG ASP B 84 -6.874 6.879 -1.677 1.00 0.00 C ATOM 1556 OD1 ASP B 84 -7.857 7.181 -0.968 1.00 0.00 O ATOM 1557 OD2 ASP B 84 -6.571 5.700 -1.960 1.00 0.00 O ATOM 0 H ASP B 84 -5.691 9.026 -4.740 1.00 0.00 H new ATOM 0 HA ASP B 84 -7.883 8.916 -2.749 1.00 0.00 H new ATOM 0 HB2 ASP B 84 -5.259 7.579 -2.894 1.00 0.00 H new ATOM 0 HB3 ASP B 84 -5.473 8.473 -1.401 1.00 0.00 H new ATOM 1562 N SER B 85 -7.371 11.380 -2.544 1.00 0.00 N ATOM 1563 CA SER B 85 -7.115 12.753 -2.117 1.00 0.00 C ATOM 1564 C SER B 85 -5.868 13.318 -2.801 1.00 0.00 C ATOM 1565 O SER B 85 -5.473 12.851 -3.869 1.00 0.00 O ATOM 1566 CB SER B 85 -6.959 12.807 -0.595 1.00 0.00 C ATOM 1567 OG SER B 85 -7.793 11.852 0.039 1.00 0.00 O ATOM 0 H SER B 85 -8.324 11.209 -2.864 1.00 0.00 H new ATOM 0 HA SER B 85 -7.966 13.368 -2.410 1.00 0.00 H new ATOM 0 HB2 SER B 85 -5.919 12.621 -0.326 1.00 0.00 H new ATOM 0 HB3 SER B 85 -7.207 13.806 -0.236 1.00 0.00 H new ATOM 0 HG SER B 85 -7.673 11.906 1.010 1.00 0.00 H new ATOM 1573 N LEU B 86 -5.255 14.325 -2.182 1.00 0.00 N ATOM 1574 CA LEU B 86 -4.057 14.951 -2.732 1.00 0.00 C ATOM 1575 C LEU B 86 -4.355 15.617 -4.072 1.00 0.00 C ATOM 1576 O LEU B 86 -3.483 15.722 -4.933 1.00 0.00 O ATOM 1577 CB LEU B 86 -2.940 13.915 -2.894 1.00 0.00 C ATOM 1578 CG LEU B 86 -2.306 13.430 -1.586 1.00 0.00 C ATOM 1579 CD1 LEU B 86 -3.373 12.898 -0.639 1.00 0.00 C ATOM 1580 CD2 LEU B 86 -1.257 12.363 -1.863 1.00 0.00 C ATOM 0 H LEU B 86 -5.570 14.725 -1.298 1.00 0.00 H new ATOM 0 HA LEU B 86 -3.727 15.720 -2.034 1.00 0.00 H new ATOM 0 HB2 LEU B 86 -3.341 13.053 -3.427 1.00 0.00 H new ATOM 0 HB3 LEU B 86 -2.158 14.342 -3.522 1.00 0.00 H new ATOM 0 HG LEU B 86 -1.815 14.278 -1.108 1.00 0.00 H new ATOM 0 HD11 LEU B 86 -2.903 12.558 0.284 1.00 0.00 H new ATOM 0 HD12 LEU B 86 -4.087 13.690 -0.413 1.00 0.00 H new ATOM 0 HD13 LEU B 86 -3.894 12.064 -1.109 1.00 0.00 H new ATOM 0 HD21 LEU B 86 -0.818 12.031 -0.922 1.00 0.00 H new ATOM 0 HD22 LEU B 86 -1.724 11.515 -2.365 1.00 0.00 H new ATOM 0 HD23 LEU B 86 -0.476 12.777 -2.501 1.00 0.00 H new ATOM 1592 N ARG B 87 -5.595 16.070 -4.237 1.00 0.00 N ATOM 1593 CA ARG B 87 -6.013 16.732 -5.467 1.00 0.00 C ATOM 1594 C ARG B 87 -6.675 18.072 -5.161 1.00 0.00 C ATOM 1595 O ARG B 87 -6.417 19.068 -5.832 1.00 0.00 O ATOM 1596 CB ARG B 87 -6.976 15.839 -6.253 1.00 0.00 C ATOM 1597 CG ARG B 87 -6.346 14.543 -6.738 1.00 0.00 C ATOM 1598 CD ARG B 87 -6.253 14.499 -8.255 1.00 0.00 C ATOM 1599 NE ARG B 87 -7.571 14.496 -8.885 1.00 0.00 N ATOM 1600 CZ ARG B 87 -7.782 14.806 -10.162 1.00 0.00 C ATOM 1601 NH1 ARG B 87 -6.767 15.144 -10.946 1.00 0.00 N ATOM 1602 NH2 ARG B 87 -9.013 14.778 -10.655 1.00 0.00 N ATOM 0 H ARG B 87 -6.328 15.990 -3.532 1.00 0.00 H new ATOM 0 HA ARG B 87 -5.126 16.914 -6.073 1.00 0.00 H new ATOM 0 HB2 ARG B 87 -7.834 15.603 -5.624 1.00 0.00 H new ATOM 0 HB3 ARG B 87 -7.353 16.394 -7.112 1.00 0.00 H new ATOM 0 HG2 ARG B 87 -5.349 14.439 -6.309 1.00 0.00 H new ATOM 0 HG3 ARG B 87 -6.935 13.697 -6.384 1.00 0.00 H new ATOM 0 HD2 ARG B 87 -5.684 15.359 -8.608 1.00 0.00 H new ATOM 0 HD3 ARG B 87 -5.704 13.608 -8.559 1.00 0.00 H new ATOM 0 HE ARG B 87 -8.376 14.242 -8.313 1.00 0.00 H new ATOM 0 HH11 ARG B 87 -5.819 15.167 -10.571 1.00 0.00 H new ATOM 0 HH12 ARG B 87 -6.935 15.381 -11.924 1.00 0.00 H new ATOM 0 HH21 ARG B 87 -9.797 14.519 -10.056 1.00 0.00 H new ATOM 0 HH22 ARG B 87 -9.176 15.015 -11.634 1.00 0.00 H new ATOM 1616 N ASP B 88 -7.522 18.089 -4.135 1.00 0.00 N ATOM 1617 CA ASP B 88 -8.211 19.313 -3.735 1.00 0.00 C ATOM 1618 C ASP B 88 -7.239 20.308 -3.100 1.00 0.00 C ATOM 1619 O ASP B 88 -7.582 21.468 -2.874 1.00 0.00 O ATOM 1620 CB ASP B 88 -9.337 18.987 -2.751 1.00 0.00 C ATOM 1621 CG ASP B 88 -10.266 20.164 -2.525 1.00 0.00 C ATOM 1622 OD1 ASP B 88 -11.158 20.387 -3.371 1.00 0.00 O ATOM 1623 OD2 ASP B 88 -10.103 20.861 -1.503 1.00 0.00 O ATOM 0 H ASP B 88 -7.747 17.272 -3.567 1.00 0.00 H new ATOM 0 HA ASP B 88 -8.635 19.770 -4.629 1.00 0.00 H new ATOM 0 HB2 ASP B 88 -9.912 18.141 -3.128 1.00 0.00 H new ATOM 0 HB3 ASP B 88 -8.906 18.680 -1.798 1.00 0.00 H new ATOM 1628 N ILE B 89 -6.017 19.855 -2.835 1.00 0.00 N ATOM 1629 CA ILE B 89 -4.995 20.705 -2.250 1.00 0.00 C ATOM 1630 C ILE B 89 -4.242 21.406 -3.361 1.00 0.00 C ATOM 1631 O ILE B 89 -4.192 22.634 -3.418 1.00 0.00 O ATOM 1632 CB ILE B 89 -4.004 19.896 -1.385 1.00 0.00 C ATOM 1633 CG1 ILE B 89 -4.748 19.172 -0.263 1.00 0.00 C ATOM 1634 CG2 ILE B 89 -2.925 20.806 -0.811 1.00 0.00 C ATOM 1635 CD1 ILE B 89 -5.610 18.027 -0.746 1.00 0.00 C ATOM 0 H ILE B 89 -5.713 18.899 -3.019 1.00 0.00 H new ATOM 0 HA ILE B 89 -5.485 21.432 -1.602 1.00 0.00 H new ATOM 0 HB ILE B 89 -3.521 19.152 -2.018 1.00 0.00 H new ATOM 0 HG12 ILE B 89 -4.022 18.791 0.455 1.00 0.00 H new ATOM 0 HG13 ILE B 89 -5.375 19.889 0.267 1.00 0.00 H new ATOM 0 HG21 ILE B 89 -2.237 20.217 -0.205 1.00 0.00 H new ATOM 0 HG22 ILE B 89 -2.377 21.279 -1.626 1.00 0.00 H new ATOM 0 HG23 ILE B 89 -3.388 21.574 -0.191 1.00 0.00 H new ATOM 0 HD11 ILE B 89 -6.107 17.561 0.105 1.00 0.00 H new ATOM 0 HD12 ILE B 89 -6.360 18.404 -1.442 1.00 0.00 H new ATOM 0 HD13 ILE B 89 -4.986 17.289 -1.250 1.00 0.00 H new ATOM 1647 N GLU B 90 -3.697 20.608 -4.269 1.00 0.00 N ATOM 1648 CA GLU B 90 -2.986 21.140 -5.418 1.00 0.00 C ATOM 1649 C GLU B 90 -3.952 21.940 -6.283 1.00 0.00 C ATOM 1650 O GLU B 90 -3.542 22.775 -7.084 1.00 0.00 O ATOM 1651 CB GLU B 90 -2.364 19.997 -6.230 1.00 0.00 C ATOM 1652 CG GLU B 90 -1.739 20.447 -7.541 1.00 0.00 C ATOM 1653 CD GLU B 90 -2.671 20.266 -8.724 1.00 0.00 C ATOM 1654 OE1 GLU B 90 -3.475 21.184 -8.993 1.00 0.00 O ATOM 1655 OE2 GLU B 90 -2.598 19.207 -9.381 1.00 0.00 O ATOM 0 H GLU B 90 -3.735 19.589 -4.230 1.00 0.00 H new ATOM 0 HA GLU B 90 -2.184 21.795 -5.077 1.00 0.00 H new ATOM 0 HB2 GLU B 90 -1.602 19.506 -5.624 1.00 0.00 H new ATOM 0 HB3 GLU B 90 -3.132 19.253 -6.441 1.00 0.00 H new ATOM 0 HG2 GLU B 90 -1.457 21.497 -7.463 1.00 0.00 H new ATOM 0 HG3 GLU B 90 -0.823 19.883 -7.715 1.00 0.00 H new ATOM 1662 N ALA B 91 -5.247 21.673 -6.103 1.00 0.00 N ATOM 1663 CA ALA B 91 -6.288 22.362 -6.855 1.00 0.00 C ATOM 1664 C ALA B 91 -6.666 23.668 -6.173 1.00 0.00 C ATOM 1665 O ALA B 91 -6.461 24.748 -6.727 1.00 0.00 O ATOM 1666 CB ALA B 91 -7.511 21.469 -7.006 1.00 0.00 C ATOM 0 H ALA B 91 -5.597 20.982 -5.440 1.00 0.00 H new ATOM 0 HA ALA B 91 -5.900 22.593 -7.847 1.00 0.00 H new ATOM 0 HB1 ALA B 91 -8.280 21.997 -7.570 1.00 0.00 H new ATOM 0 HB2 ALA B 91 -7.233 20.558 -7.537 1.00 0.00 H new ATOM 0 HB3 ALA B 91 -7.897 21.211 -6.020 1.00 0.00 H new ATOM 1672 N LEU B 92 -7.208 23.570 -4.961 1.00 0.00 N ATOM 1673 CA LEU B 92 -7.595 24.761 -4.209 1.00 0.00 C ATOM 1674 C LEU B 92 -6.434 25.752 -4.145 1.00 0.00 C ATOM 1675 O LEU B 92 -6.638 26.956 -3.991 1.00 0.00 O ATOM 1676 CB LEU B 92 -8.049 24.388 -2.796 1.00 0.00 C ATOM 1677 CG LEU B 92 -9.180 25.251 -2.234 1.00 0.00 C ATOM 1678 CD1 LEU B 92 -9.874 24.534 -1.085 1.00 0.00 C ATOM 1679 CD2 LEU B 92 -8.647 26.603 -1.783 1.00 0.00 C ATOM 0 H LEU B 92 -7.388 22.687 -4.483 1.00 0.00 H new ATOM 0 HA LEU B 92 -8.431 25.232 -4.726 1.00 0.00 H new ATOM 0 HB2 LEU B 92 -8.372 23.347 -2.797 1.00 0.00 H new ATOM 0 HB3 LEU B 92 -7.192 24.455 -2.125 1.00 0.00 H new ATOM 0 HG LEU B 92 -9.912 25.421 -3.024 1.00 0.00 H new ATOM 0 HD11 LEU B 92 -10.676 25.161 -0.696 1.00 0.00 H new ATOM 0 HD12 LEU B 92 -10.291 23.592 -1.442 1.00 0.00 H new ATOM 0 HD13 LEU B 92 -9.153 24.334 -0.292 1.00 0.00 H new ATOM 0 HD21 LEU B 92 -9.466 27.203 -1.386 1.00 0.00 H new ATOM 0 HD22 LEU B 92 -7.895 26.457 -1.008 1.00 0.00 H new ATOM 0 HD23 LEU B 92 -8.198 27.119 -2.632 1.00 0.00 H new ATOM 1691 N LEU B 93 -5.214 25.235 -4.285 1.00 0.00 N ATOM 1692 CA LEU B 93 -4.023 26.073 -4.261 1.00 0.00 C ATOM 1693 C LEU B 93 -3.676 26.544 -5.669 1.00 0.00 C ATOM 1694 O LEU B 93 -3.305 27.700 -5.871 1.00 0.00 O ATOM 1695 CB LEU B 93 -2.838 25.316 -3.660 1.00 0.00 C ATOM 1696 CG LEU B 93 -2.692 25.431 -2.141 1.00 0.00 C ATOM 1697 CD1 LEU B 93 -2.212 26.823 -1.758 1.00 0.00 C ATOM 1698 CD2 LEU B 93 -4.011 25.113 -1.451 1.00 0.00 C ATOM 0 H LEU B 93 -5.028 24.241 -4.416 1.00 0.00 H new ATOM 0 HA LEU B 93 -4.234 26.942 -3.637 1.00 0.00 H new ATOM 0 HB2 LEU B 93 -2.931 24.262 -3.921 1.00 0.00 H new ATOM 0 HB3 LEU B 93 -1.922 25.680 -4.125 1.00 0.00 H new ATOM 0 HG LEU B 93 -1.949 24.706 -1.810 1.00 0.00 H new ATOM 0 HD11 LEU B 93 -2.113 26.888 -0.674 1.00 0.00 H new ATOM 0 HD12 LEU B 93 -1.245 27.015 -2.223 1.00 0.00 H new ATOM 0 HD13 LEU B 93 -2.933 27.564 -2.102 1.00 0.00 H new ATOM 0 HD21 LEU B 93 -3.887 25.200 -0.372 1.00 0.00 H new ATOM 0 HD22 LEU B 93 -4.775 25.814 -1.786 1.00 0.00 H new ATOM 0 HD23 LEU B 93 -4.316 24.097 -1.700 1.00 0.00 H new ATOM 1710 N THR B 94 -3.802 25.648 -6.645 1.00 0.00 N ATOM 1711 CA THR B 94 -3.497 26.001 -8.030 1.00 0.00 C ATOM 1712 C THR B 94 -4.480 27.045 -8.565 1.00 0.00 C ATOM 1713 O THR B 94 -4.248 27.640 -9.616 1.00 0.00 O ATOM 1714 CB THR B 94 -3.508 24.751 -8.922 1.00 0.00 C ATOM 1715 OG1 THR B 94 -2.319 24.002 -8.741 1.00 0.00 O ATOM 1716 CG2 THR B 94 -3.626 25.057 -10.403 1.00 0.00 C ATOM 0 H THR B 94 -4.109 24.685 -6.507 1.00 0.00 H new ATOM 0 HA THR B 94 -2.498 26.436 -8.050 1.00 0.00 H new ATOM 0 HB THR B 94 -4.391 24.191 -8.614 1.00 0.00 H new ATOM 0 HG1 THR B 94 -2.536 23.135 -8.339 1.00 0.00 H new ATOM 0 HG21 THR B 94 -3.627 24.125 -10.968 1.00 0.00 H new ATOM 0 HG22 THR B 94 -4.555 25.596 -10.590 1.00 0.00 H new ATOM 0 HG23 THR B 94 -2.781 25.670 -10.716 1.00 0.00 H new ATOM 1724 N GLY B 95 -5.581 27.258 -7.845 1.00 0.00 N ATOM 1725 CA GLY B 95 -6.572 28.224 -8.284 1.00 0.00 C ATOM 1726 C GLY B 95 -6.785 29.354 -7.293 1.00 0.00 C ATOM 1727 O GLY B 95 -6.766 30.524 -7.671 1.00 0.00 O ATOM 0 H GLY B 95 -5.802 26.781 -6.971 1.00 0.00 H new ATOM 0 HA2 GLY B 95 -6.263 28.643 -9.242 1.00 0.00 H new ATOM 0 HA3 GLY B 95 -7.520 27.712 -8.451 1.00 0.00 H new ATOM 1731 N LEU B 96 -7.005 29.010 -6.027 1.00 0.00 N ATOM 1732 CA LEU B 96 -7.241 30.018 -4.997 1.00 0.00 C ATOM 1733 C LEU B 96 -5.983 30.334 -4.196 1.00 0.00 C ATOM 1734 O LEU B 96 -5.997 31.203 -3.324 1.00 0.00 O ATOM 1735 CB LEU B 96 -8.356 29.565 -4.056 1.00 0.00 C ATOM 1736 CG LEU B 96 -9.723 29.378 -4.712 1.00 0.00 C ATOM 1737 CD1 LEU B 96 -10.133 30.639 -5.457 1.00 0.00 C ATOM 1738 CD2 LEU B 96 -9.705 28.182 -5.653 1.00 0.00 C ATOM 0 H LEU B 96 -7.025 28.047 -5.691 1.00 0.00 H new ATOM 0 HA LEU B 96 -7.542 30.932 -5.508 1.00 0.00 H new ATOM 0 HB2 LEU B 96 -8.060 28.623 -3.594 1.00 0.00 H new ATOM 0 HB3 LEU B 96 -8.453 30.297 -3.254 1.00 0.00 H new ATOM 0 HG LEU B 96 -10.457 29.187 -3.930 1.00 0.00 H new ATOM 0 HD11 LEU B 96 -11.109 30.488 -5.918 1.00 0.00 H new ATOM 0 HD12 LEU B 96 -10.187 31.473 -4.758 1.00 0.00 H new ATOM 0 HD13 LEU B 96 -9.397 30.861 -6.230 1.00 0.00 H new ATOM 0 HD21 LEU B 96 -10.687 28.065 -6.111 1.00 0.00 H new ATOM 0 HD22 LEU B 96 -8.959 28.342 -6.431 1.00 0.00 H new ATOM 0 HD23 LEU B 96 -9.456 27.281 -5.092 1.00 0.00 H new ATOM 1750 N PHE B 97 -4.902 29.633 -4.500 1.00 0.00 N ATOM 1751 CA PHE B 97 -3.622 29.835 -3.818 1.00 0.00 C ATOM 1752 C PHE B 97 -3.808 30.063 -2.319 1.00 0.00 C ATOM 1753 O PHE B 97 -3.049 30.806 -1.697 1.00 0.00 O ATOM 1754 CB PHE B 97 -2.879 31.021 -4.434 1.00 0.00 C ATOM 1755 CG PHE B 97 -3.707 32.273 -4.510 1.00 0.00 C ATOM 1756 CD1 PHE B 97 -4.503 32.527 -5.616 1.00 0.00 C ATOM 1757 CD2 PHE B 97 -3.690 33.195 -3.475 1.00 0.00 C ATOM 1758 CE1 PHE B 97 -5.266 33.677 -5.689 1.00 0.00 C ATOM 1759 CE2 PHE B 97 -4.451 34.348 -3.543 1.00 0.00 C ATOM 1760 CZ PHE B 97 -5.240 34.588 -4.652 1.00 0.00 C ATOM 0 H PHE B 97 -4.881 28.911 -5.221 1.00 0.00 H new ATOM 0 HA PHE B 97 -3.033 28.927 -3.948 1.00 0.00 H new ATOM 0 HB2 PHE B 97 -1.983 31.223 -3.847 1.00 0.00 H new ATOM 0 HB3 PHE B 97 -2.549 30.752 -5.437 1.00 0.00 H new ATOM 0 HD1 PHE B 97 -4.527 31.818 -6.430 1.00 0.00 H new ATOM 0 HD2 PHE B 97 -3.076 33.011 -2.606 1.00 0.00 H new ATOM 0 HE1 PHE B 97 -5.882 33.863 -6.556 1.00 0.00 H new ATOM 0 HE2 PHE B 97 -4.429 35.060 -2.731 1.00 0.00 H new ATOM 0 HZ PHE B 97 -5.836 35.487 -4.707 1.00 0.00 H new ATOM 1770 N VAL B 98 -4.822 29.422 -1.744 1.00 0.00 N ATOM 1771 CA VAL B 98 -5.104 29.564 -0.320 1.00 0.00 C ATOM 1772 C VAL B 98 -4.126 28.751 0.520 1.00 0.00 C ATOM 1773 O VAL B 98 -3.899 27.569 0.257 1.00 0.00 O ATOM 1774 CB VAL B 98 -6.541 29.126 0.019 1.00 0.00 C ATOM 1775 CG1 VAL B 98 -6.886 29.493 1.454 1.00 0.00 C ATOM 1776 CG2 VAL B 98 -7.533 29.747 -0.953 1.00 0.00 C ATOM 0 H VAL B 98 -5.460 28.801 -2.241 1.00 0.00 H new ATOM 0 HA VAL B 98 -4.991 30.622 -0.083 1.00 0.00 H new ATOM 0 HB VAL B 98 -6.604 28.042 -0.079 1.00 0.00 H new ATOM 0 HG11 VAL B 98 -7.905 29.176 1.676 1.00 0.00 H new ATOM 0 HG12 VAL B 98 -6.195 28.994 2.133 1.00 0.00 H new ATOM 0 HG13 VAL B 98 -6.806 30.572 1.583 1.00 0.00 H new ATOM 0 HG21 VAL B 98 -8.543 29.426 -0.697 1.00 0.00 H new ATOM 0 HG22 VAL B 98 -7.471 30.834 -0.891 1.00 0.00 H new ATOM 0 HG23 VAL B 98 -7.297 29.427 -1.968 1.00 0.00 H new ATOM 1786 N GLN B 99 -3.550 29.390 1.533 1.00 0.00 N ATOM 1787 CA GLN B 99 -2.595 28.728 2.414 1.00 0.00 C ATOM 1788 C GLN B 99 -3.271 27.622 3.219 1.00 0.00 C ATOM 1789 O GLN B 99 -2.926 26.447 3.089 1.00 0.00 O ATOM 1790 CB GLN B 99 -1.953 29.743 3.361 1.00 0.00 C ATOM 1791 CG GLN B 99 -1.308 30.919 2.645 1.00 0.00 C ATOM 1792 CD GLN B 99 0.110 30.623 2.202 1.00 0.00 C ATOM 1793 OE1 GLN B 99 0.335 30.074 1.123 1.00 0.00 O ATOM 1794 NE2 GLN B 99 1.078 30.987 3.037 1.00 0.00 N ATOM 0 H GLN B 99 -3.728 30.367 1.764 1.00 0.00 H new ATOM 0 HA GLN B 99 -1.820 28.279 1.794 1.00 0.00 H new ATOM 0 HB2 GLN B 99 -2.712 30.118 4.047 1.00 0.00 H new ATOM 0 HB3 GLN B 99 -1.199 29.238 3.965 1.00 0.00 H new ATOM 0 HG2 GLN B 99 -1.909 31.184 1.775 1.00 0.00 H new ATOM 0 HG3 GLN B 99 -1.305 31.785 3.306 1.00 0.00 H new ATOM 0 HE21 GLN B 99 0.846 31.439 3.921 1.00 0.00 H new ATOM 0 HE22 GLN B 99 2.053 30.814 2.794 1.00 0.00 H new ATOM 1803 N ASP B 100 -4.233 28.005 4.053 1.00 0.00 N ATOM 1804 CA ASP B 100 -4.953 27.042 4.880 1.00 0.00 C ATOM 1805 C ASP B 100 -6.447 27.350 4.907 1.00 0.00 C ATOM 1806 O ASP B 100 -7.277 26.451 4.774 1.00 0.00 O ATOM 1807 CB ASP B 100 -4.394 27.049 6.306 1.00 0.00 C ATOM 1808 CG ASP B 100 -3.342 25.981 6.518 1.00 0.00 C ATOM 1809 OD1 ASP B 100 -3.691 24.782 6.459 1.00 0.00 O ATOM 1810 OD2 ASP B 100 -2.167 26.341 6.744 1.00 0.00 O ATOM 0 H ASP B 100 -4.532 28.973 4.174 1.00 0.00 H new ATOM 0 HA ASP B 100 -4.815 26.053 4.444 1.00 0.00 H new ATOM 0 HB2 ASP B 100 -3.963 28.027 6.520 1.00 0.00 H new ATOM 0 HB3 ASP B 100 -5.209 26.898 7.014 1.00 0.00 H new ATOM 1815 N ASN B 101 -6.785 28.625 5.081 1.00 0.00 N ATOM 1816 CA ASN B 101 -8.180 29.052 5.127 1.00 0.00 C ATOM 1817 C ASN B 101 -8.858 28.555 6.401 1.00 0.00 C ATOM 1818 O ASN B 101 -9.148 27.367 6.539 1.00 0.00 O ATOM 1819 CB ASN B 101 -8.939 28.540 3.899 1.00 0.00 C ATOM 1820 CG ASN B 101 -9.881 29.581 3.327 1.00 0.00 C ATOM 1821 OD1 ASN B 101 -9.450 30.641 2.872 1.00 0.00 O ATOM 1822 ND2 ASN B 101 -11.175 29.282 3.344 1.00 0.00 N ATOM 0 H ASN B 101 -6.110 29.382 5.193 1.00 0.00 H new ATOM 0 HA ASN B 101 -8.198 30.142 5.125 1.00 0.00 H new ATOM 0 HB2 ASN B 101 -8.224 28.240 3.132 1.00 0.00 H new ATOM 0 HB3 ASN B 101 -9.507 27.650 4.171 1.00 0.00 H new ATOM 0 HD21 ASN B 101 -11.856 29.943 2.970 1.00 0.00 H new ATOM 0 HD22 ASN B 101 -11.488 28.392 3.731 1.00 0.00 H new ATOM 1829 N VAL B 102 -9.107 29.474 7.328 1.00 0.00 N ATOM 1830 CA VAL B 102 -9.750 29.131 8.591 1.00 0.00 C ATOM 1831 C VAL B 102 -10.934 30.054 8.874 1.00 0.00 C ATOM 1832 O VAL B 102 -10.759 31.251 9.102 1.00 0.00 O ATOM 1833 CB VAL B 102 -8.757 29.207 9.767 1.00 0.00 C ATOM 1834 CG1 VAL B 102 -8.214 30.620 9.921 1.00 0.00 C ATOM 1835 CG2 VAL B 102 -9.413 28.735 11.057 1.00 0.00 C ATOM 0 H VAL B 102 -8.873 30.462 7.228 1.00 0.00 H new ATOM 0 HA VAL B 102 -10.108 28.106 8.496 1.00 0.00 H new ATOM 0 HB VAL B 102 -7.920 28.544 9.551 1.00 0.00 H new ATOM 0 HG11 VAL B 102 -7.515 30.652 10.757 1.00 0.00 H new ATOM 0 HG12 VAL B 102 -7.700 30.914 9.006 1.00 0.00 H new ATOM 0 HG13 VAL B 102 -9.038 31.308 10.111 1.00 0.00 H new ATOM 0 HG21 VAL B 102 -8.695 28.797 11.874 1.00 0.00 H new ATOM 0 HG22 VAL B 102 -10.272 29.367 11.281 1.00 0.00 H new ATOM 0 HG23 VAL B 102 -9.743 27.703 10.941 1.00 0.00 H new ATOM 1845 N ASN B 103 -12.137 29.488 8.854 1.00 0.00 N ATOM 1846 CA ASN B 103 -13.347 30.262 9.108 1.00 0.00 C ATOM 1847 C ASN B 103 -14.361 29.439 9.897 1.00 0.00 C ATOM 1848 O ASN B 103 -14.841 29.866 10.947 1.00 0.00 O ATOM 1849 CB ASN B 103 -13.964 30.728 7.788 1.00 0.00 C ATOM 1850 CG ASN B 103 -13.593 32.159 7.450 1.00 0.00 C ATOM 1851 OD1 ASN B 103 -14.361 33.087 7.694 1.00 0.00 O ATOM 1852 ND2 ASN B 103 -12.406 32.342 6.882 1.00 0.00 N ATOM 0 H ASN B 103 -12.300 28.499 8.665 1.00 0.00 H new ATOM 0 HA ASN B 103 -13.075 31.135 9.701 1.00 0.00 H new ATOM 0 HB2 ASN B 103 -13.634 30.070 6.984 1.00 0.00 H new ATOM 0 HB3 ASN B 103 -15.049 30.641 7.846 1.00 0.00 H new ATOM 0 HD21 ASN B 103 -12.100 33.282 6.630 1.00 0.00 H new ATOM 0 HD22 ASN B 103 -11.800 31.542 6.698 1.00 0.00 H new ATOM 1859 N LYS B 104 -14.683 28.256 9.383 1.00 0.00 N ATOM 1860 CA LYS B 104 -15.640 27.373 10.040 1.00 0.00 C ATOM 1861 C LYS B 104 -15.713 26.025 9.330 1.00 0.00 C ATOM 1862 O LYS B 104 -15.728 24.974 9.970 1.00 0.00 O ATOM 1863 CB LYS B 104 -17.026 28.022 10.070 1.00 0.00 C ATOM 1864 CG LYS B 104 -17.885 27.567 11.239 1.00 0.00 C ATOM 1865 CD LYS B 104 -19.033 28.530 11.494 1.00 0.00 C ATOM 1866 CE LYS B 104 -19.956 28.625 10.288 1.00 0.00 C ATOM 1867 NZ LYS B 104 -20.607 27.320 9.984 1.00 0.00 N ATOM 0 H LYS B 104 -14.296 27.887 8.514 1.00 0.00 H new ATOM 0 HA LYS B 104 -15.301 27.207 11.063 1.00 0.00 H new ATOM 0 HB2 LYS B 104 -16.910 29.105 10.115 1.00 0.00 H new ATOM 0 HB3 LYS B 104 -17.545 27.795 9.139 1.00 0.00 H new ATOM 0 HG2 LYS B 104 -18.281 26.572 11.035 1.00 0.00 H new ATOM 0 HG3 LYS B 104 -17.269 27.487 12.135 1.00 0.00 H new ATOM 0 HD2 LYS B 104 -19.601 28.199 12.364 1.00 0.00 H new ATOM 0 HD3 LYS B 104 -18.636 29.518 11.729 1.00 0.00 H new ATOM 0 HE2 LYS B 104 -20.722 29.378 10.475 1.00 0.00 H new ATOM 0 HE3 LYS B 104 -19.387 28.958 9.420 1.00 0.00 H new ATOM 0 HZ1 LYS B 104 -21.373 27.466 9.295 1.00 0.00 H new ATOM 0 HZ2 LYS B 104 -19.904 26.666 9.586 1.00 0.00 H new ATOM 0 HZ3 LYS B 104 -21.000 26.916 10.858 1.00 0.00 H new ATOM 1881 N ASP B 105 -15.758 26.063 8.002 1.00 0.00 N ATOM 1882 CA ASP B 105 -15.829 24.844 7.204 1.00 0.00 C ATOM 1883 C ASP B 105 -14.438 24.400 6.766 1.00 0.00 C ATOM 1884 O ASP B 105 -13.523 25.215 6.647 1.00 0.00 O ATOM 1885 CB ASP B 105 -16.717 25.062 5.979 1.00 0.00 C ATOM 1886 CG ASP B 105 -18.166 25.310 6.353 1.00 0.00 C ATOM 1887 OD1 ASP B 105 -18.655 24.661 7.301 1.00 0.00 O ATOM 1888 OD2 ASP B 105 -18.812 26.154 5.696 1.00 0.00 O ATOM 0 H ASP B 105 -15.747 26.924 7.456 1.00 0.00 H new ATOM 0 HA ASP B 105 -16.263 24.059 7.823 1.00 0.00 H new ATOM 0 HB2 ASP B 105 -16.341 25.911 5.408 1.00 0.00 H new ATOM 0 HB3 ASP B 105 -16.656 24.189 5.329 1.00 0.00 H new ATOM 1893 N ALA B 106 -14.286 23.102 6.527 1.00 0.00 N ATOM 1894 CA ALA B 106 -13.007 22.547 6.100 1.00 0.00 C ATOM 1895 C ALA B 106 -13.206 21.351 5.178 1.00 0.00 C ATOM 1896 O ALA B 106 -13.763 20.334 5.643 1.00 0.00 O ATOM 1897 CB ALA B 106 -12.174 22.152 7.311 1.00 0.00 C ATOM 1898 OXT ALA B 106 -12.807 21.440 3.998 1.00 0.00 O ATOM 0 H ALA B 106 -15.033 22.414 6.622 1.00 0.00 H new ATOM 0 HA ALA B 106 -12.474 23.316 5.541 1.00 0.00 H new ATOM 0 HB1 ALA B 106 -11.222 21.739 6.978 1.00 0.00 H new ATOM 0 HB2 ALA B 106 -11.992 23.031 7.930 1.00 0.00 H new ATOM 0 HB3 ALA B 106 -12.711 21.403 7.893 1.00 0.00 H new TER 1904 ALA B 106