USER MOD reduce.3.24.130724 H: found=0, std=0, add=404, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 397 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 134 CYS SG : rot 80:sc= 0.411 USER MOD Set 1.2: A 137 CYS SG : rot -54:sc= 1.03 USER MOD Set 1.3: A 150 HIS : no HD1:sc= 0.545 K(o=-4,f=-17!) USER MOD Set 1.4: A 155 HIS : no HD1:sc= -5.98 X(o=-4,f=-3.5) USER MOD Set 2.1: A 106 CYS SG : rot 110:sc= -0.854 USER MOD Set 2.2: A 109 CYS SG : rot 160:sc= -0.789 USER MOD Set 2.3: A 122 HIS : no HD1:sc= -2.35! C(o=-6.2!,f=-20!) USER MOD Set 2.4: A 126 HIS : no HD1:sc= -2.19! C(o=-6.2!,f=-20!) USER MOD Single : A 110 THR OG1 : rot -1:sc= 0.548 USER MOD Single : A 116 GLN : amide:sc= -0.196 X(o=-0.2,f=0) USER MOD Single : A 118 HIS : no HD1:sc= -0.264 X(o=-0.26,f=-0.1) USER MOD Single : A 120 LYS NZ :NH3+ -147:sc= -0.317 (180deg=-1.21!) USER MOD Single : A 123 TYR OH : rot 180:sc= 0 USER MOD Single : A 125 SER OG : rot 180:sc=-0.00884 USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 138 ASN : amide:sc= -0.0905 K(o=-0.091,f=-1.4!) USER MOD Single : A 142 THR OG1 : rot 180:sc= 0 USER MOD Single : A 152 GLN : amide:sc= -0.17 K(o=-0.17,f=-1.1) USER MOD Single : A 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 36 N PHE A 104 -13.743 31.105 13.335 1.00 0.00 N ATOM 37 CA PHE A 104 -14.130 29.686 13.567 1.00 0.00 C ATOM 38 C PHE A 104 -14.458 29.490 15.049 1.00 0.00 C ATOM 39 O PHE A 104 -13.710 28.885 15.793 1.00 0.00 O ATOM 40 CB PHE A 104 -12.978 28.764 13.167 1.00 0.00 C ATOM 41 CG PHE A 104 -12.678 28.939 11.698 1.00 0.00 C ATOM 42 CD1 PHE A 104 -11.752 29.903 11.280 1.00 0.00 C ATOM 43 CD2 PHE A 104 -13.326 28.135 10.751 1.00 0.00 C ATOM 44 CE1 PHE A 104 -11.474 30.064 9.918 1.00 0.00 C ATOM 45 CE2 PHE A 104 -13.048 28.297 9.389 1.00 0.00 C ATOM 46 CZ PHE A 104 -12.122 29.260 8.972 1.00 0.00 C ATOM 0 HA PHE A 104 -15.005 29.443 12.964 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -12.092 28.993 13.759 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -13.240 27.726 13.374 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -11.252 30.523 12.010 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -14.040 27.391 11.072 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -10.760 30.808 9.597 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -13.549 27.678 8.659 1.00 0.00 H new ATOM 0 HZ PHE A 104 -11.907 29.383 7.921 1.00 0.00 H new ATOM 56 N VAL A 105 -15.579 30.004 15.474 1.00 0.00 N ATOM 57 CA VAL A 105 -15.986 29.861 16.906 1.00 0.00 C ATOM 58 C VAL A 105 -16.692 28.513 17.087 1.00 0.00 C ATOM 59 O VAL A 105 -17.613 28.178 16.366 1.00 0.00 O ATOM 60 CB VAL A 105 -16.915 31.033 17.311 1.00 0.00 C ATOM 61 CG1 VAL A 105 -17.996 31.246 16.247 1.00 0.00 C ATOM 62 CG2 VAL A 105 -17.591 30.756 18.664 1.00 0.00 C ATOM 0 H VAL A 105 -16.236 30.520 14.890 1.00 0.00 H new ATOM 0 HA VAL A 105 -15.107 29.892 17.550 1.00 0.00 H new ATOM 0 HB VAL A 105 -16.301 31.930 17.397 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -18.642 32.072 16.544 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -17.525 31.479 15.292 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -18.591 30.339 16.147 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -18.238 31.593 18.926 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -18.187 29.846 18.594 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -16.829 30.632 19.433 1.00 0.00 H new ATOM 72 N CYS A 106 -16.259 27.745 18.054 1.00 0.00 N ATOM 73 CA CYS A 106 -16.891 26.419 18.305 1.00 0.00 C ATOM 74 C CYS A 106 -18.332 26.628 18.771 1.00 0.00 C ATOM 75 O CYS A 106 -18.637 27.581 19.463 1.00 0.00 O ATOM 76 CB CYS A 106 -16.105 25.679 19.390 1.00 0.00 C ATOM 77 SG CYS A 106 -16.732 23.989 19.543 1.00 0.00 S ATOM 0 H CYS A 106 -15.491 27.982 18.682 1.00 0.00 H new ATOM 0 HA CYS A 106 -16.886 25.830 17.388 1.00 0.00 H new ATOM 0 HB2 CYS A 106 -15.044 25.663 19.139 1.00 0.00 H new ATOM 0 HB3 CYS A 106 -16.199 26.201 20.342 1.00 0.00 H new ATOM 0 HG CYS A 106 -15.844 23.154 19.090 1.00 0.00 H new ATOM 82 N GLU A 107 -19.220 25.742 18.395 1.00 0.00 N ATOM 83 CA GLU A 107 -20.648 25.881 18.813 1.00 0.00 C ATOM 84 C GLU A 107 -20.893 25.138 20.133 1.00 0.00 C ATOM 85 O GLU A 107 -22.019 24.811 20.460 1.00 0.00 O ATOM 86 CB GLU A 107 -21.551 25.292 17.726 1.00 0.00 C ATOM 87 CG GLU A 107 -21.268 25.986 16.391 1.00 0.00 C ATOM 88 CD GLU A 107 -22.286 27.106 16.166 1.00 0.00 C ATOM 89 OE1 GLU A 107 -23.472 26.822 16.227 1.00 0.00 O ATOM 90 OE2 GLU A 107 -21.864 28.227 15.937 1.00 0.00 O ATOM 0 H GLU A 107 -19.017 24.927 17.816 1.00 0.00 H new ATOM 0 HA GLU A 107 -20.874 26.938 18.955 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -21.375 24.220 17.635 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -22.598 25.421 18.000 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -20.257 26.394 16.389 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -21.321 25.264 15.576 1.00 0.00 H new ATOM 97 N VAL A 108 -19.858 24.865 20.893 1.00 0.00 N ATOM 98 CA VAL A 108 -20.047 24.141 22.185 1.00 0.00 C ATOM 99 C VAL A 108 -19.577 25.023 23.342 1.00 0.00 C ATOM 100 O VAL A 108 -20.275 25.190 24.325 1.00 0.00 O ATOM 101 CB VAL A 108 -19.238 22.842 22.167 1.00 0.00 C ATOM 102 CG1 VAL A 108 -19.561 22.020 23.417 1.00 0.00 C ATOM 103 CG2 VAL A 108 -19.600 22.032 20.921 1.00 0.00 C ATOM 0 H VAL A 108 -18.894 25.113 20.672 1.00 0.00 H new ATOM 0 HA VAL A 108 -21.103 23.907 22.317 1.00 0.00 H new ATOM 0 HB VAL A 108 -18.174 23.079 22.152 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -18.984 21.095 23.403 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -19.304 22.595 24.307 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -20.625 21.784 23.432 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -19.024 21.107 20.908 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -20.664 21.796 20.937 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -19.370 22.615 20.029 1.00 0.00 H new ATOM 113 N CYS A 109 -18.403 25.590 23.231 1.00 0.00 N ATOM 114 CA CYS A 109 -17.888 26.467 24.325 1.00 0.00 C ATOM 115 C CYS A 109 -17.824 27.927 23.857 1.00 0.00 C ATOM 116 O CYS A 109 -17.279 28.771 24.540 1.00 0.00 O ATOM 117 CB CYS A 109 -16.493 25.999 24.749 1.00 0.00 C ATOM 118 SG CYS A 109 -15.398 25.944 23.308 1.00 0.00 S ATOM 0 H CYS A 109 -17.779 25.484 22.431 1.00 0.00 H new ATOM 0 HA CYS A 109 -18.567 26.401 25.175 1.00 0.00 H new ATOM 0 HB2 CYS A 109 -16.086 26.675 25.501 1.00 0.00 H new ATOM 0 HB3 CYS A 109 -16.555 25.012 25.208 1.00 0.00 H new ATOM 0 HG CYS A 109 -14.160 25.968 23.703 1.00 0.00 H new ATOM 123 N THR A 110 -18.384 28.237 22.704 1.00 0.00 N ATOM 124 CA THR A 110 -18.368 29.652 22.195 1.00 0.00 C ATOM 125 C THR A 110 -16.946 30.235 22.263 1.00 0.00 C ATOM 126 O THR A 110 -16.728 31.308 22.798 1.00 0.00 O ATOM 127 CB THR A 110 -19.323 30.518 23.032 1.00 0.00 C ATOM 128 OG1 THR A 110 -18.766 30.732 24.321 1.00 0.00 O ATOM 129 CG2 THR A 110 -20.678 29.818 23.169 1.00 0.00 C ATOM 0 H THR A 110 -18.852 27.568 22.093 1.00 0.00 H new ATOM 0 HA THR A 110 -18.696 29.650 21.155 1.00 0.00 H new ATOM 0 HB THR A 110 -19.465 31.477 22.533 1.00 0.00 H new ATOM 0 HG1 THR A 110 -17.905 30.268 24.387 1.00 0.00 H new ATOM 0 HG21 THR A 110 -21.349 30.438 23.763 1.00 0.00 H new ATOM 0 HG22 THR A 110 -21.109 29.662 22.180 1.00 0.00 H new ATOM 0 HG23 THR A 110 -20.542 28.855 23.661 1.00 0.00 H new ATOM 137 N ARG A 111 -15.981 29.535 21.725 1.00 0.00 N ATOM 138 CA ARG A 111 -14.575 30.038 21.754 1.00 0.00 C ATOM 139 C ARG A 111 -14.317 30.891 20.508 1.00 0.00 C ATOM 140 O ARG A 111 -15.240 31.383 19.890 1.00 0.00 O ATOM 141 CB ARG A 111 -13.607 28.847 21.784 1.00 0.00 C ATOM 142 CG ARG A 111 -12.447 29.150 22.738 1.00 0.00 C ATOM 143 CD ARG A 111 -11.152 28.558 22.178 1.00 0.00 C ATOM 144 NE ARG A 111 -10.007 29.448 22.525 1.00 0.00 N ATOM 145 CZ ARG A 111 -9.680 29.636 23.774 1.00 0.00 C ATOM 146 NH1 ARG A 111 -9.572 28.615 24.580 1.00 0.00 N ATOM 147 NH2 ARG A 111 -9.459 30.844 24.217 1.00 0.00 N ATOM 0 H ARG A 111 -16.107 28.633 21.265 1.00 0.00 H new ATOM 0 HA ARG A 111 -14.419 30.647 22.645 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -14.131 27.948 22.107 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -13.225 28.651 20.782 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -12.340 30.227 22.866 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -12.654 28.731 23.723 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -10.989 27.561 22.587 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -11.227 28.450 21.096 1.00 0.00 H new ATOM 0 HE ARG A 111 -9.479 29.910 21.785 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -9.743 27.671 24.233 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -9.316 28.761 25.557 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -9.542 31.642 23.587 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -9.203 30.990 25.194 1.00 0.00 H new ATOM 161 N ALA A 112 -13.074 31.072 20.135 1.00 0.00 N ATOM 162 CA ALA A 112 -12.768 31.894 18.929 1.00 0.00 C ATOM 163 C ALA A 112 -11.480 31.394 18.273 1.00 0.00 C ATOM 164 O ALA A 112 -10.388 31.700 18.717 1.00 0.00 O ATOM 165 CB ALA A 112 -12.600 33.359 19.337 1.00 0.00 C ATOM 0 H ALA A 112 -12.261 30.686 20.614 1.00 0.00 H new ATOM 0 HA ALA A 112 -13.589 31.807 18.218 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -12.376 33.959 18.455 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -13.522 33.717 19.795 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -11.782 33.446 20.052 1.00 0.00 H new ATOM 171 N PHE A 113 -11.602 30.636 17.215 1.00 0.00 N ATOM 172 CA PHE A 113 -10.394 30.116 16.512 1.00 0.00 C ATOM 173 C PHE A 113 -10.210 30.888 15.204 1.00 0.00 C ATOM 174 O PHE A 113 -11.076 31.638 14.795 1.00 0.00 O ATOM 175 CB PHE A 113 -10.576 28.627 16.207 1.00 0.00 C ATOM 176 CG PHE A 113 -10.572 27.844 17.498 1.00 0.00 C ATOM 177 CD1 PHE A 113 -9.359 27.441 18.067 1.00 0.00 C ATOM 178 CD2 PHE A 113 -11.782 27.522 18.124 1.00 0.00 C ATOM 179 CE1 PHE A 113 -9.355 26.715 19.264 1.00 0.00 C ATOM 180 CE2 PHE A 113 -11.778 26.797 19.322 1.00 0.00 C ATOM 181 CZ PHE A 113 -10.565 26.393 19.891 1.00 0.00 C ATOM 0 H PHE A 113 -12.493 30.354 16.806 1.00 0.00 H new ATOM 0 HA PHE A 113 -9.516 30.246 17.145 1.00 0.00 H new ATOM 0 HB2 PHE A 113 -11.513 28.466 15.675 1.00 0.00 H new ATOM 0 HB3 PHE A 113 -9.775 28.278 15.555 1.00 0.00 H new ATOM 0 HD1 PHE A 113 -8.426 27.690 17.583 1.00 0.00 H new ATOM 0 HD2 PHE A 113 -12.718 27.832 17.683 1.00 0.00 H new ATOM 0 HE1 PHE A 113 -8.419 26.403 19.704 1.00 0.00 H new ATOM 0 HE2 PHE A 113 -12.711 26.550 19.807 1.00 0.00 H new ATOM 0 HZ PHE A 113 -10.562 25.833 20.814 1.00 0.00 H new ATOM 191 N ALA A 114 -9.089 30.715 14.551 1.00 0.00 N ATOM 192 CA ALA A 114 -8.847 31.444 13.271 1.00 0.00 C ATOM 193 C ALA A 114 -8.714 30.447 12.114 1.00 0.00 C ATOM 194 O ALA A 114 -8.983 30.776 10.974 1.00 0.00 O ATOM 195 CB ALA A 114 -7.563 32.265 13.389 1.00 0.00 C ATOM 0 H ALA A 114 -8.332 30.100 14.849 1.00 0.00 H new ATOM 0 HA ALA A 114 -9.689 32.107 13.073 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -7.385 32.798 12.455 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -7.664 32.983 14.203 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -6.724 31.600 13.593 1.00 0.00 H new ATOM 201 N ARG A 115 -8.300 29.236 12.395 1.00 0.00 N ATOM 202 CA ARG A 115 -8.148 28.223 11.309 1.00 0.00 C ATOM 203 C ARG A 115 -9.068 27.032 11.583 1.00 0.00 C ATOM 204 O ARG A 115 -9.274 26.644 12.718 1.00 0.00 O ATOM 205 CB ARG A 115 -6.696 27.745 11.258 1.00 0.00 C ATOM 206 CG ARG A 115 -5.801 28.881 10.760 1.00 0.00 C ATOM 207 CD ARG A 115 -6.111 29.169 9.290 1.00 0.00 C ATOM 208 NE ARG A 115 -5.074 30.083 8.733 1.00 0.00 N ATOM 209 CZ ARG A 115 -3.894 29.619 8.424 1.00 0.00 C ATOM 210 NH1 ARG A 115 -3.785 28.540 7.699 1.00 0.00 N ATOM 211 NH2 ARG A 115 -2.821 30.236 8.840 1.00 0.00 N ATOM 0 H ARG A 115 -8.061 28.907 13.330 1.00 0.00 H new ATOM 0 HA ARG A 115 -8.417 28.674 10.354 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -6.374 27.421 12.248 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -6.609 26.883 10.597 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -5.965 29.777 11.359 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -4.752 28.608 10.875 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -6.133 28.238 8.723 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -7.098 29.622 9.197 1.00 0.00 H new ATOM 0 HE ARG A 115 -5.286 31.071 8.593 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -4.623 28.058 7.373 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -2.862 28.178 7.458 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -2.905 31.080 9.406 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -1.899 29.874 8.599 1.00 0.00 H new ATOM 225 N GLN A 116 -9.622 26.451 10.549 1.00 0.00 N ATOM 226 CA GLN A 116 -10.531 25.281 10.734 1.00 0.00 C ATOM 227 C GLN A 116 -9.718 24.048 11.136 1.00 0.00 C ATOM 228 O GLN A 116 -10.237 23.128 11.740 1.00 0.00 O ATOM 229 CB GLN A 116 -11.268 24.998 9.423 1.00 0.00 C ATOM 230 CG GLN A 116 -12.334 23.927 9.658 1.00 0.00 C ATOM 231 CD GLN A 116 -13.111 23.686 8.362 1.00 0.00 C ATOM 232 OE1 GLN A 116 -13.273 22.559 7.939 1.00 0.00 O ATOM 233 NE2 GLN A 116 -13.601 24.704 7.710 1.00 0.00 N ATOM 0 H GLN A 116 -9.483 26.739 9.580 1.00 0.00 H new ATOM 0 HA GLN A 116 -11.252 25.507 11.520 1.00 0.00 H new ATOM 0 HB2 GLN A 116 -11.731 25.911 9.049 1.00 0.00 H new ATOM 0 HB3 GLN A 116 -10.563 24.664 8.662 1.00 0.00 H new ATOM 0 HG2 GLN A 116 -11.866 23.001 9.992 1.00 0.00 H new ATOM 0 HG3 GLN A 116 -13.014 24.243 10.449 1.00 0.00 H new ATOM 0 HE21 GLN A 116 -13.465 25.650 8.065 1.00 0.00 H new ATOM 0 HE22 GLN A 116 -14.120 24.554 6.845 1.00 0.00 H new ATOM 242 N GLU A 117 -8.448 24.018 10.809 1.00 0.00 N ATOM 243 CA GLU A 117 -7.602 22.843 11.173 1.00 0.00 C ATOM 244 C GLU A 117 -7.532 22.727 12.697 1.00 0.00 C ATOM 245 O GLU A 117 -7.616 21.647 13.252 1.00 0.00 O ATOM 246 CB GLU A 117 -6.189 23.035 10.616 1.00 0.00 C ATOM 247 CG GLU A 117 -6.257 23.306 9.110 1.00 0.00 C ATOM 248 CD GLU A 117 -5.994 22.010 8.341 1.00 0.00 C ATOM 249 OE1 GLU A 117 -4.932 21.439 8.525 1.00 0.00 O ATOM 250 OE2 GLU A 117 -6.860 21.610 7.579 1.00 0.00 O ATOM 0 H GLU A 117 -7.962 24.760 10.305 1.00 0.00 H new ATOM 0 HA GLU A 117 -8.038 21.937 10.752 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -5.698 23.866 11.123 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -5.589 22.146 10.808 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -7.237 23.704 8.846 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -5.521 24.061 8.833 1.00 0.00 H new ATOM 257 N HIS A 118 -7.378 23.836 13.373 1.00 0.00 N ATOM 258 CA HIS A 118 -7.300 23.810 14.863 1.00 0.00 C ATOM 259 C HIS A 118 -8.671 23.458 15.445 1.00 0.00 C ATOM 260 O HIS A 118 -8.776 22.694 16.385 1.00 0.00 O ATOM 261 CB HIS A 118 -6.870 25.186 15.374 1.00 0.00 C ATOM 262 CG HIS A 118 -5.368 25.265 15.405 1.00 0.00 C ATOM 263 ND1 HIS A 118 -4.683 26.428 15.091 1.00 0.00 N ATOM 264 CD2 HIS A 118 -4.407 24.335 15.711 1.00 0.00 C ATOM 265 CE1 HIS A 118 -3.368 26.169 15.214 1.00 0.00 C ATOM 266 NE2 HIS A 118 -3.144 24.907 15.590 1.00 0.00 N ATOM 0 H HIS A 118 -7.303 24.763 12.954 1.00 0.00 H new ATOM 0 HA HIS A 118 -6.572 23.060 15.173 1.00 0.00 H new ATOM 0 HB2 HIS A 118 -7.272 25.967 14.729 1.00 0.00 H new ATOM 0 HB3 HIS A 118 -7.274 25.357 16.372 1.00 0.00 H new ATOM 0 HD2 HIS A 118 -4.601 23.313 16.002 1.00 0.00 H new ATOM 0 HE1 HIS A 118 -2.588 26.894 15.031 1.00 0.00 H new ATOM 0 HE2 HIS A 118 -2.242 24.459 15.753 1.00 0.00 H new ATOM 274 N LEU A 119 -9.720 24.013 14.894 1.00 0.00 N ATOM 275 CA LEU A 119 -11.088 23.724 15.406 1.00 0.00 C ATOM 276 C LEU A 119 -11.402 22.233 15.242 1.00 0.00 C ATOM 277 O LEU A 119 -12.196 21.676 15.977 1.00 0.00 O ATOM 278 CB LEU A 119 -12.108 24.546 14.611 1.00 0.00 C ATOM 279 CG LEU A 119 -13.250 24.995 15.530 1.00 0.00 C ATOM 280 CD1 LEU A 119 -14.259 25.824 14.728 1.00 0.00 C ATOM 281 CD2 LEU A 119 -13.951 23.767 16.116 1.00 0.00 C ATOM 0 H LEU A 119 -9.684 24.659 14.105 1.00 0.00 H new ATOM 0 HA LEU A 119 -11.141 23.988 16.462 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -11.622 25.416 14.170 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -12.505 23.951 13.788 1.00 0.00 H new ATOM 0 HG LEU A 119 -12.844 25.601 16.340 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -15.070 26.142 15.383 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -13.762 26.701 14.313 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -14.664 25.219 13.917 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -14.762 24.088 16.769 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -14.355 23.158 15.307 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -13.235 23.179 16.690 1.00 0.00 H new ATOM 293 N LYS A 120 -10.794 21.585 14.281 1.00 0.00 N ATOM 294 CA LYS A 120 -11.062 20.131 14.058 1.00 0.00 C ATOM 295 C LYS A 120 -10.738 19.334 15.327 1.00 0.00 C ATOM 296 O LYS A 120 -11.528 18.526 15.779 1.00 0.00 O ATOM 297 CB LYS A 120 -10.192 19.624 12.906 1.00 0.00 C ATOM 298 CG LYS A 120 -10.906 19.880 11.576 1.00 0.00 C ATOM 299 CD LYS A 120 -10.566 18.760 10.591 1.00 0.00 C ATOM 300 CE LYS A 120 -11.703 18.610 9.578 1.00 0.00 C ATOM 301 NZ LYS A 120 -12.953 18.217 10.289 1.00 0.00 N ATOM 0 H LYS A 120 -10.121 22.002 13.638 1.00 0.00 H new ATOM 0 HA LYS A 120 -12.116 19.998 13.812 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -9.226 20.129 12.916 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -9.995 18.559 13.026 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -11.984 19.926 11.733 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -10.602 20.843 11.167 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -9.632 18.985 10.075 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -10.416 17.823 11.127 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -11.855 19.548 9.044 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -11.444 17.858 8.833 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -13.523 17.601 9.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -12.710 17.706 11.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -13.499 19.069 10.528 1.00 0.00 H new ATOM 315 N ARG A 121 -9.582 19.555 15.900 1.00 0.00 N ATOM 316 CA ARG A 121 -9.198 18.812 17.138 1.00 0.00 C ATOM 317 C ARG A 121 -9.935 19.400 18.343 1.00 0.00 C ATOM 318 O ARG A 121 -10.213 18.711 19.308 1.00 0.00 O ATOM 319 CB ARG A 121 -7.688 18.933 17.355 1.00 0.00 C ATOM 320 CG ARG A 121 -7.196 17.762 18.210 1.00 0.00 C ATOM 321 CD ARG A 121 -7.150 18.182 19.680 1.00 0.00 C ATOM 322 NE ARG A 121 -5.961 17.566 20.335 1.00 0.00 N ATOM 323 CZ ARG A 121 -5.452 18.107 21.409 1.00 0.00 C ATOM 324 NH1 ARG A 121 -5.227 19.392 21.447 1.00 0.00 N ATOM 325 NH2 ARG A 121 -5.170 17.363 22.442 1.00 0.00 N ATOM 0 H ARG A 121 -8.886 20.220 15.563 1.00 0.00 H new ATOM 0 HA ARG A 121 -9.469 17.762 17.028 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -7.172 18.937 16.395 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -7.456 19.878 17.846 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -7.859 16.905 18.087 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -6.206 17.449 17.880 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -7.100 19.268 19.758 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -8.062 17.868 20.188 1.00 0.00 H new ATOM 0 HE ARG A 121 -5.545 16.721 19.944 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -5.449 19.973 20.638 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -4.829 19.816 22.285 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -5.347 16.359 22.411 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -4.772 17.785 23.281 1.00 0.00 H new ATOM 339 N HIS A 122 -10.251 20.668 18.296 1.00 0.00 N ATOM 340 CA HIS A 122 -10.967 21.315 19.435 1.00 0.00 C ATOM 341 C HIS A 122 -12.402 20.758 19.518 1.00 0.00 C ATOM 342 O HIS A 122 -13.036 20.825 20.554 1.00 0.00 O ATOM 343 CB HIS A 122 -10.989 22.838 19.205 1.00 0.00 C ATOM 344 CG HIS A 122 -11.866 23.527 20.222 1.00 0.00 C ATOM 345 ND1 HIS A 122 -11.441 23.777 21.518 1.00 0.00 N ATOM 346 CD2 HIS A 122 -13.143 24.027 20.145 1.00 0.00 C ATOM 347 CE1 HIS A 122 -12.444 24.402 22.161 1.00 0.00 C ATOM 348 NE2 HIS A 122 -13.505 24.579 21.370 1.00 0.00 N ATOM 0 H HIS A 122 -10.042 21.287 17.512 1.00 0.00 H new ATOM 0 HA HIS A 122 -10.457 21.103 20.375 1.00 0.00 H new ATOM 0 HB2 HIS A 122 -9.975 23.233 19.267 1.00 0.00 H new ATOM 0 HB3 HIS A 122 -11.354 23.052 18.200 1.00 0.00 H new ATOM 0 HD2 HIS A 122 -13.771 23.996 19.267 1.00 0.00 H new ATOM 0 HE1 HIS A 122 -12.397 24.722 23.192 1.00 0.00 H new ATOM 0 HE2 HIS A 122 -14.391 25.023 21.612 1.00 0.00 H new ATOM 356 N TYR A 123 -12.915 20.218 18.438 1.00 0.00 N ATOM 357 CA TYR A 123 -14.303 19.668 18.457 1.00 0.00 C ATOM 358 C TYR A 123 -14.280 18.226 18.968 1.00 0.00 C ATOM 359 O TYR A 123 -15.203 17.777 19.622 1.00 0.00 O ATOM 360 CB TYR A 123 -14.880 19.697 17.040 1.00 0.00 C ATOM 361 CG TYR A 123 -16.351 19.358 17.086 1.00 0.00 C ATOM 362 CD1 TYR A 123 -17.221 20.124 17.871 1.00 0.00 C ATOM 363 CD2 TYR A 123 -16.843 18.278 16.345 1.00 0.00 C ATOM 364 CE1 TYR A 123 -18.585 19.809 17.914 1.00 0.00 C ATOM 365 CE2 TYR A 123 -18.206 17.963 16.388 1.00 0.00 C ATOM 366 CZ TYR A 123 -19.078 18.729 17.172 1.00 0.00 C ATOM 367 OH TYR A 123 -20.422 18.419 17.213 1.00 0.00 O ATOM 0 H TYR A 123 -12.430 20.135 17.545 1.00 0.00 H new ATOM 0 HA TYR A 123 -14.923 20.274 19.117 1.00 0.00 H new ATOM 0 HB2 TYR A 123 -14.737 20.683 16.598 1.00 0.00 H new ATOM 0 HB3 TYR A 123 -14.352 18.984 16.407 1.00 0.00 H new ATOM 0 HD1 TYR A 123 -16.841 20.957 18.443 1.00 0.00 H new ATOM 0 HD2 TYR A 123 -16.171 17.687 15.740 1.00 0.00 H new ATOM 0 HE1 TYR A 123 -19.257 20.399 18.520 1.00 0.00 H new ATOM 0 HE2 TYR A 123 -18.586 17.129 15.816 1.00 0.00 H new ATOM 0 HH TYR A 123 -20.596 17.643 16.640 1.00 0.00 H new ATOM 377 N ARG A 124 -13.233 17.498 18.674 1.00 0.00 N ATOM 378 CA ARG A 124 -13.144 16.082 19.137 1.00 0.00 C ATOM 379 C ARG A 124 -13.119 16.044 20.667 1.00 0.00 C ATOM 380 O ARG A 124 -13.584 15.101 21.279 1.00 0.00 O ATOM 381 CB ARG A 124 -11.865 15.445 18.590 1.00 0.00 C ATOM 382 CG ARG A 124 -12.176 14.717 17.281 1.00 0.00 C ATOM 383 CD ARG A 124 -10.898 14.583 16.453 1.00 0.00 C ATOM 384 NE ARG A 124 -11.236 14.652 15.003 1.00 0.00 N ATOM 385 CZ ARG A 124 -10.894 15.698 14.302 1.00 0.00 C ATOM 386 NH1 ARG A 124 -9.633 15.953 14.085 1.00 0.00 N ATOM 387 NH2 ARG A 124 -11.813 16.489 13.819 1.00 0.00 N ATOM 0 H ARG A 124 -12.434 17.825 18.131 1.00 0.00 H new ATOM 0 HA ARG A 124 -14.010 15.528 18.775 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -11.108 16.211 18.421 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -11.454 14.746 19.318 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -12.590 13.731 17.491 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -12.930 15.266 16.718 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -10.199 15.378 16.713 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -10.404 13.638 16.678 1.00 0.00 H new ATOM 0 HE ARG A 124 -11.735 13.881 14.559 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -8.915 15.335 14.463 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -9.365 16.771 13.537 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -12.799 16.290 13.990 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -11.546 17.307 13.271 1.00 0.00 H new ATOM 401 N SER A 125 -12.579 17.064 21.285 1.00 0.00 N ATOM 402 CA SER A 125 -12.519 17.096 22.776 1.00 0.00 C ATOM 403 C SER A 125 -13.904 17.424 23.340 1.00 0.00 C ATOM 404 O SER A 125 -14.247 17.018 24.435 1.00 0.00 O ATOM 405 CB SER A 125 -11.521 18.164 23.222 1.00 0.00 C ATOM 406 OG SER A 125 -11.868 19.408 22.629 1.00 0.00 O ATOM 0 H SER A 125 -12.177 17.877 20.819 1.00 0.00 H new ATOM 0 HA SER A 125 -12.200 16.122 23.146 1.00 0.00 H new ATOM 0 HB2 SER A 125 -11.526 18.252 24.308 1.00 0.00 H new ATOM 0 HB3 SER A 125 -10.510 17.878 22.930 1.00 0.00 H new ATOM 0 HG SER A 125 -11.231 20.096 22.914 1.00 0.00 H new ATOM 412 N HIS A 126 -14.700 18.156 22.601 1.00 0.00 N ATOM 413 CA HIS A 126 -16.064 18.516 23.088 1.00 0.00 C ATOM 414 C HIS A 126 -16.941 17.264 23.126 1.00 0.00 C ATOM 415 O HIS A 126 -17.256 16.749 24.181 1.00 0.00 O ATOM 416 CB HIS A 126 -16.687 19.545 22.144 1.00 0.00 C ATOM 417 CG HIS A 126 -16.197 20.918 22.506 1.00 0.00 C ATOM 418 ND1 HIS A 126 -16.283 21.416 23.798 1.00 0.00 N ATOM 419 CD2 HIS A 126 -15.612 21.910 21.760 1.00 0.00 C ATOM 420 CE1 HIS A 126 -15.762 22.657 23.788 1.00 0.00 C ATOM 421 NE2 HIS A 126 -15.338 23.007 22.571 1.00 0.00 N ATOM 0 H HIS A 126 -14.462 18.520 21.679 1.00 0.00 H new ATOM 0 HA HIS A 126 -15.991 18.938 24.090 1.00 0.00 H new ATOM 0 HB2 HIS A 126 -16.424 19.314 21.112 1.00 0.00 H new ATOM 0 HB3 HIS A 126 -17.774 19.506 22.212 1.00 0.00 H new ATOM 0 HD2 HIS A 126 -15.397 21.849 20.703 1.00 0.00 H new ATOM 0 HE1 HIS A 126 -15.695 23.293 24.659 1.00 0.00 H new ATOM 0 HE2 HIS A 126 -14.906 23.889 22.295 1.00 0.00 H new ATOM 508 N TYR A 132 -12.309 6.746 12.347 1.00 0.00 N ATOM 509 CA TYR A 132 -11.275 5.762 11.909 1.00 0.00 C ATOM 510 C TYR A 132 -11.297 4.538 12.846 1.00 0.00 C ATOM 511 O TYR A 132 -10.444 4.410 13.703 1.00 0.00 O ATOM 512 CB TYR A 132 -9.890 6.417 11.948 1.00 0.00 C ATOM 513 CG TYR A 132 -9.911 7.697 11.146 1.00 0.00 C ATOM 514 CD1 TYR A 132 -9.996 7.645 9.749 1.00 0.00 C ATOM 515 CD2 TYR A 132 -9.845 8.934 11.798 1.00 0.00 C ATOM 516 CE1 TYR A 132 -10.014 8.831 9.005 1.00 0.00 C ATOM 517 CE2 TYR A 132 -9.864 10.120 11.054 1.00 0.00 C ATOM 518 CZ TYR A 132 -9.949 10.068 9.657 1.00 0.00 C ATOM 519 OH TYR A 132 -9.966 11.236 8.923 1.00 0.00 O ATOM 0 HA TYR A 132 -11.491 5.440 10.890 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -9.605 6.627 12.979 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -9.143 5.735 11.543 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -10.048 6.691 9.246 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -9.779 8.974 12.875 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -10.078 8.791 7.928 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -9.813 11.074 11.557 1.00 0.00 H new ATOM 0 HH TYR A 132 -9.915 12.004 9.529 1.00 0.00 H new ATOM 529 N PRO A 133 -12.271 3.662 12.661 1.00 0.00 N ATOM 530 CA PRO A 133 -12.394 2.448 13.490 1.00 0.00 C ATOM 531 C PRO A 133 -11.385 1.389 13.034 1.00 0.00 C ATOM 532 O PRO A 133 -10.745 1.532 12.009 1.00 0.00 O ATOM 533 CB PRO A 133 -13.830 1.978 13.235 1.00 0.00 C ATOM 534 CG PRO A 133 -14.256 2.587 11.879 1.00 0.00 C ATOM 535 CD PRO A 133 -13.331 3.792 11.628 1.00 0.00 C ATOM 0 HA PRO A 133 -12.193 2.628 14.546 1.00 0.00 H new ATOM 0 HB2 PRO A 133 -13.883 0.890 13.205 1.00 0.00 H new ATOM 0 HB3 PRO A 133 -14.494 2.308 14.034 1.00 0.00 H new ATOM 0 HG2 PRO A 133 -14.162 1.853 11.078 1.00 0.00 H new ATOM 0 HG3 PRO A 133 -15.300 2.899 11.905 1.00 0.00 H new ATOM 0 HD2 PRO A 133 -12.911 3.769 10.622 1.00 0.00 H new ATOM 0 HD3 PRO A 133 -13.870 4.734 11.727 1.00 0.00 H new ATOM 543 N CYS A 134 -11.242 0.330 13.788 1.00 0.00 N ATOM 544 CA CYS A 134 -10.277 -0.744 13.407 1.00 0.00 C ATOM 545 C CYS A 134 -11.022 -1.866 12.679 1.00 0.00 C ATOM 546 O CYS A 134 -12.055 -2.328 13.126 1.00 0.00 O ATOM 547 CB CYS A 134 -9.615 -1.306 14.669 1.00 0.00 C ATOM 548 SG CYS A 134 -8.304 -2.467 14.205 1.00 0.00 S ATOM 0 H CYS A 134 -11.754 0.162 14.654 1.00 0.00 H new ATOM 0 HA CYS A 134 -9.513 -0.329 12.749 1.00 0.00 H new ATOM 0 HB2 CYS A 134 -9.200 -0.494 15.266 1.00 0.00 H new ATOM 0 HB3 CYS A 134 -10.358 -1.810 15.288 1.00 0.00 H new ATOM 0 HG CYS A 134 -7.236 -1.805 13.872 1.00 0.00 H new ATOM 553 N GLY A 135 -10.502 -2.305 11.561 1.00 0.00 N ATOM 554 CA GLY A 135 -11.169 -3.400 10.797 1.00 0.00 C ATOM 555 C GLY A 135 -10.496 -4.733 11.122 1.00 0.00 C ATOM 556 O GLY A 135 -10.356 -5.591 10.270 1.00 0.00 O ATOM 0 H GLY A 135 -9.641 -1.950 11.144 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -12.228 -3.443 11.053 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -11.107 -3.201 9.727 1.00 0.00 H new ATOM 560 N LEU A 136 -10.075 -4.908 12.347 1.00 0.00 N ATOM 561 CA LEU A 136 -9.403 -6.184 12.742 1.00 0.00 C ATOM 562 C LEU A 136 -9.968 -6.652 14.084 1.00 0.00 C ATOM 563 O LEU A 136 -10.303 -7.809 14.259 1.00 0.00 O ATOM 564 CB LEU A 136 -7.890 -5.957 12.877 1.00 0.00 C ATOM 565 CG LEU A 136 -7.366 -5.148 11.684 1.00 0.00 C ATOM 566 CD1 LEU A 136 -5.899 -4.784 11.917 1.00 0.00 C ATOM 567 CD2 LEU A 136 -7.486 -5.980 10.407 1.00 0.00 C ATOM 0 H LEU A 136 -10.167 -4.220 13.095 1.00 0.00 H new ATOM 0 HA LEU A 136 -9.584 -6.941 11.979 1.00 0.00 H new ATOM 0 HB2 LEU A 136 -7.676 -5.429 13.806 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -7.375 -6.916 12.930 1.00 0.00 H new ATOM 0 HG LEU A 136 -7.955 -4.237 11.580 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -5.528 -4.209 11.069 1.00 0.00 H new ATOM 0 HD12 LEU A 136 -5.812 -4.188 12.825 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -5.310 -5.695 12.023 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -7.113 -5.403 9.561 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -6.899 -6.893 10.511 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -8.531 -6.238 10.238 1.00 0.00 H new ATOM 579 N CYS A 137 -10.076 -5.757 15.031 1.00 0.00 N ATOM 580 CA CYS A 137 -10.619 -6.127 16.372 1.00 0.00 C ATOM 581 C CYS A 137 -11.919 -5.357 16.660 1.00 0.00 C ATOM 582 O CYS A 137 -12.569 -5.586 17.660 1.00 0.00 O ATOM 583 CB CYS A 137 -9.579 -5.784 17.439 1.00 0.00 C ATOM 584 SG CYS A 137 -9.153 -4.024 17.346 1.00 0.00 S ATOM 0 H CYS A 137 -9.809 -4.778 14.932 1.00 0.00 H new ATOM 0 HA CYS A 137 -10.837 -7.195 16.386 1.00 0.00 H new ATOM 0 HB2 CYS A 137 -9.970 -6.020 18.429 1.00 0.00 H new ATOM 0 HB3 CYS A 137 -8.685 -6.391 17.296 1.00 0.00 H new ATOM 0 HG CYS A 137 -8.785 -3.730 16.134 1.00 0.00 H new ATOM 589 N ASN A 138 -12.291 -4.440 15.796 1.00 0.00 N ATOM 590 CA ASN A 138 -13.539 -3.635 16.008 1.00 0.00 C ATOM 591 C ASN A 138 -13.306 -2.629 17.137 1.00 0.00 C ATOM 592 O ASN A 138 -13.787 -2.795 18.242 1.00 0.00 O ATOM 593 CB ASN A 138 -14.725 -4.547 16.358 1.00 0.00 C ATOM 594 CG ASN A 138 -16.035 -3.802 16.102 1.00 0.00 C ATOM 595 OD1 ASN A 138 -16.150 -3.061 15.145 1.00 0.00 O ATOM 596 ND2 ASN A 138 -17.038 -3.969 16.922 1.00 0.00 N ATOM 0 H ASN A 138 -11.778 -4.213 14.944 1.00 0.00 H new ATOM 0 HA ASN A 138 -13.777 -3.106 15.085 1.00 0.00 H new ATOM 0 HB2 ASN A 138 -14.688 -5.456 15.757 1.00 0.00 H new ATOM 0 HB3 ASN A 138 -14.666 -4.853 17.403 1.00 0.00 H new ATOM 0 HD21 ASN A 138 -17.917 -3.478 16.759 1.00 0.00 H new ATOM 0 HD22 ASN A 138 -16.942 -4.591 17.725 1.00 0.00 H new ATOM 603 N ARG A 139 -12.567 -1.587 16.857 1.00 0.00 N ATOM 604 CA ARG A 139 -12.285 -0.553 17.895 1.00 0.00 C ATOM 605 C ARG A 139 -12.634 0.828 17.334 1.00 0.00 C ATOM 606 O ARG A 139 -13.195 0.942 16.260 1.00 0.00 O ATOM 607 CB ARG A 139 -10.800 -0.597 18.265 1.00 0.00 C ATOM 608 CG ARG A 139 -10.592 -1.572 19.427 1.00 0.00 C ATOM 609 CD ARG A 139 -9.216 -1.333 20.052 1.00 0.00 C ATOM 610 NE ARG A 139 -9.207 -0.013 20.742 1.00 0.00 N ATOM 611 CZ ARG A 139 -9.740 0.109 21.926 1.00 0.00 C ATOM 612 NH1 ARG A 139 -9.107 -0.338 22.976 1.00 0.00 N ATOM 613 NH2 ARG A 139 -10.907 0.676 22.060 1.00 0.00 N ATOM 0 H ARG A 139 -12.144 -1.407 15.946 1.00 0.00 H new ATOM 0 HA ARG A 139 -12.884 -0.748 18.784 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -10.209 -0.909 17.404 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -10.454 0.398 18.545 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -11.372 -1.434 20.176 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -10.669 -2.600 19.072 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -8.984 -2.128 20.761 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -8.445 -1.358 19.282 1.00 0.00 H new ATOM 0 HE ARG A 139 -8.784 0.796 20.288 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -8.195 -0.783 22.871 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -9.524 -0.242 23.902 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -11.402 1.024 21.239 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -11.324 0.772 22.986 1.00 0.00 H new ATOM 627 N ALA A 140 -12.308 1.875 18.051 1.00 0.00 N ATOM 628 CA ALA A 140 -12.624 3.249 17.557 1.00 0.00 C ATOM 629 C ALA A 140 -11.492 4.208 17.933 1.00 0.00 C ATOM 630 O ALA A 140 -10.967 4.162 19.030 1.00 0.00 O ATOM 631 CB ALA A 140 -13.931 3.727 18.195 1.00 0.00 C ATOM 0 H ALA A 140 -11.838 1.837 18.955 1.00 0.00 H new ATOM 0 HA ALA A 140 -12.730 3.228 16.472 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -14.165 4.730 17.837 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -14.738 3.047 17.924 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -13.821 3.745 19.279 1.00 0.00 H new ATOM 637 N PHE A 141 -11.119 5.080 17.030 1.00 0.00 N ATOM 638 CA PHE A 141 -10.026 6.053 17.323 1.00 0.00 C ATOM 639 C PHE A 141 -10.398 7.422 16.751 1.00 0.00 C ATOM 640 O PHE A 141 -11.229 7.530 15.869 1.00 0.00 O ATOM 641 CB PHE A 141 -8.722 5.571 16.684 1.00 0.00 C ATOM 642 CG PHE A 141 -8.356 4.218 17.244 1.00 0.00 C ATOM 643 CD1 PHE A 141 -7.603 4.128 18.421 1.00 0.00 C ATOM 644 CD2 PHE A 141 -8.770 3.053 16.586 1.00 0.00 C ATOM 645 CE1 PHE A 141 -7.263 2.872 18.940 1.00 0.00 C ATOM 646 CE2 PHE A 141 -8.430 1.799 17.105 1.00 0.00 C ATOM 647 CZ PHE A 141 -7.677 1.708 18.282 1.00 0.00 C ATOM 0 H PHE A 141 -11.527 5.159 16.099 1.00 0.00 H new ATOM 0 HA PHE A 141 -9.891 6.132 18.402 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -8.836 5.509 15.602 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -7.923 6.286 16.880 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -7.284 5.027 18.929 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -9.351 3.123 15.678 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -6.682 2.802 19.847 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -8.749 0.901 16.597 1.00 0.00 H new ATOM 0 HZ PHE A 141 -7.416 0.740 18.682 1.00 0.00 H new ATOM 657 N THR A 142 -9.791 8.469 17.251 1.00 0.00 N ATOM 658 CA THR A 142 -10.107 9.837 16.745 1.00 0.00 C ATOM 659 C THR A 142 -8.998 10.311 15.802 1.00 0.00 C ATOM 660 O THR A 142 -9.246 11.037 14.859 1.00 0.00 O ATOM 661 CB THR A 142 -10.217 10.803 17.927 1.00 0.00 C ATOM 662 OG1 THR A 142 -8.967 10.871 18.599 1.00 0.00 O ATOM 663 CG2 THR A 142 -11.293 10.309 18.895 1.00 0.00 C ATOM 0 H THR A 142 -9.089 8.434 17.990 1.00 0.00 H new ATOM 0 HA THR A 142 -11.052 9.811 16.203 1.00 0.00 H new ATOM 0 HB THR A 142 -10.488 11.794 17.562 1.00 0.00 H new ATOM 0 HG1 THR A 142 -9.035 11.491 19.355 1.00 0.00 H new ATOM 0 HG21 THR A 142 -11.370 10.998 19.736 1.00 0.00 H new ATOM 0 HG22 THR A 142 -12.252 10.258 18.379 1.00 0.00 H new ATOM 0 HG23 THR A 142 -11.026 9.318 19.261 1.00 0.00 H new ATOM 671 N ARG A 143 -7.778 9.908 16.054 1.00 0.00 N ATOM 672 CA ARG A 143 -6.648 10.336 15.177 1.00 0.00 C ATOM 673 C ARG A 143 -6.278 9.199 14.223 1.00 0.00 C ATOM 674 O ARG A 143 -6.298 8.038 14.590 1.00 0.00 O ATOM 675 CB ARG A 143 -5.436 10.692 16.041 1.00 0.00 C ATOM 676 CG ARG A 143 -5.612 12.102 16.617 1.00 0.00 C ATOM 677 CD ARG A 143 -4.259 12.821 16.661 1.00 0.00 C ATOM 678 NE ARG A 143 -4.358 14.106 15.912 1.00 0.00 N ATOM 679 CZ ARG A 143 -4.586 14.097 14.627 1.00 0.00 C ATOM 680 NH1 ARG A 143 -3.685 13.625 13.808 1.00 0.00 N ATOM 681 NH2 ARG A 143 -5.713 14.558 14.161 1.00 0.00 N ATOM 0 H ARG A 143 -7.516 9.300 16.830 1.00 0.00 H new ATOM 0 HA ARG A 143 -6.951 11.209 14.599 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -5.328 9.969 16.849 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -4.525 10.643 15.445 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -6.315 12.669 16.006 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -6.036 12.044 17.620 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -3.969 13.011 17.694 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -3.485 12.191 16.223 1.00 0.00 H new ATOM 0 HE ARG A 143 -4.248 14.993 16.404 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -2.804 13.264 14.173 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -3.863 13.618 12.804 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -6.417 14.926 14.801 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -5.891 14.551 13.157 1.00 0.00 H new ATOM 695 N ARG A 144 -5.937 9.527 13.002 1.00 0.00 N ATOM 696 CA ARG A 144 -5.560 8.473 12.015 1.00 0.00 C ATOM 697 C ARG A 144 -4.231 7.842 12.431 1.00 0.00 C ATOM 698 O ARG A 144 -4.032 6.649 12.297 1.00 0.00 O ATOM 699 CB ARG A 144 -5.415 9.101 10.627 1.00 0.00 C ATOM 700 CG ARG A 144 -5.621 8.027 9.558 1.00 0.00 C ATOM 701 CD ARG A 144 -5.910 8.695 8.212 1.00 0.00 C ATOM 702 NE ARG A 144 -5.635 7.730 7.110 1.00 0.00 N ATOM 703 CZ ARG A 144 -6.415 7.695 6.064 1.00 0.00 C ATOM 704 NH1 ARG A 144 -6.580 8.767 5.338 1.00 0.00 N ATOM 705 NH2 ARG A 144 -7.027 6.589 5.743 1.00 0.00 N ATOM 0 H ARG A 144 -5.904 10.483 12.647 1.00 0.00 H new ATOM 0 HA ARG A 144 -6.335 7.707 11.986 1.00 0.00 H new ATOM 0 HB2 ARG A 144 -6.145 9.901 10.500 1.00 0.00 H new ATOM 0 HB3 ARG A 144 -4.428 9.551 10.521 1.00 0.00 H new ATOM 0 HG2 ARG A 144 -4.733 7.400 9.481 1.00 0.00 H new ATOM 0 HG3 ARG A 144 -6.448 7.375 9.837 1.00 0.00 H new ATOM 0 HD2 ARG A 144 -6.949 9.023 8.172 1.00 0.00 H new ATOM 0 HD3 ARG A 144 -5.290 9.584 8.095 1.00 0.00 H new ATOM 0 HE ARG A 144 -4.838 7.097 7.173 1.00 0.00 H new ATOM 0 HH11 ARG A 144 -6.100 9.631 5.588 1.00 0.00 H new ATOM 0 HH12 ARG A 144 -7.189 8.740 4.520 1.00 0.00 H new ATOM 0 HH21 ARG A 144 -6.896 5.751 6.309 1.00 0.00 H new ATOM 0 HH22 ARG A 144 -7.636 6.562 4.926 1.00 0.00 H new ATOM 719 N ASP A 145 -3.322 8.636 12.939 1.00 0.00 N ATOM 720 CA ASP A 145 -2.000 8.092 13.371 1.00 0.00 C ATOM 721 C ASP A 145 -2.205 7.076 14.499 1.00 0.00 C ATOM 722 O ASP A 145 -1.408 6.178 14.685 1.00 0.00 O ATOM 723 CB ASP A 145 -1.118 9.239 13.872 1.00 0.00 C ATOM 724 CG ASP A 145 -1.863 10.024 14.952 1.00 0.00 C ATOM 725 OD1 ASP A 145 -2.095 9.465 16.010 1.00 0.00 O ATOM 726 OD2 ASP A 145 -2.190 11.173 14.702 1.00 0.00 O ATOM 0 H ASP A 145 -3.440 9.640 13.073 1.00 0.00 H new ATOM 0 HA ASP A 145 -1.517 7.601 12.526 1.00 0.00 H new ATOM 0 HB2 ASP A 145 -0.184 8.845 14.273 1.00 0.00 H new ATOM 0 HB3 ASP A 145 -0.856 9.898 13.044 1.00 0.00 H new ATOM 731 N LEU A 146 -3.270 7.214 15.250 1.00 0.00 N ATOM 732 CA LEU A 146 -3.536 6.260 16.366 1.00 0.00 C ATOM 733 C LEU A 146 -3.886 4.883 15.798 1.00 0.00 C ATOM 734 O LEU A 146 -3.328 3.878 16.193 1.00 0.00 O ATOM 735 CB LEU A 146 -4.712 6.773 17.199 1.00 0.00 C ATOM 736 CG LEU A 146 -4.195 7.664 18.328 1.00 0.00 C ATOM 737 CD1 LEU A 146 -5.380 8.287 19.068 1.00 0.00 C ATOM 738 CD2 LEU A 146 -3.371 6.823 19.306 1.00 0.00 C ATOM 0 H LEU A 146 -3.968 7.949 15.136 1.00 0.00 H new ATOM 0 HA LEU A 146 -2.646 6.179 16.990 1.00 0.00 H new ATOM 0 HB2 LEU A 146 -5.401 7.334 16.567 1.00 0.00 H new ATOM 0 HB3 LEU A 146 -5.271 5.933 17.612 1.00 0.00 H new ATOM 0 HG LEU A 146 -3.570 8.453 17.910 1.00 0.00 H new ATOM 0 HD11 LEU A 146 -5.012 8.923 19.874 1.00 0.00 H new ATOM 0 HD12 LEU A 146 -5.969 8.886 18.373 1.00 0.00 H new ATOM 0 HD13 LEU A 146 -6.004 7.497 19.485 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -3.002 7.458 20.111 1.00 0.00 H new ATOM 0 HD22 LEU A 146 -3.996 6.034 19.724 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -2.527 6.377 18.780 1.00 0.00 H new ATOM 750 N LEU A 147 -4.817 4.835 14.878 1.00 0.00 N ATOM 751 CA LEU A 147 -5.230 3.528 14.274 1.00 0.00 C ATOM 752 C LEU A 147 -4.009 2.790 13.707 1.00 0.00 C ATOM 753 O LEU A 147 -3.903 1.583 13.818 1.00 0.00 O ATOM 754 CB LEU A 147 -6.234 3.785 13.150 1.00 0.00 C ATOM 755 CG LEU A 147 -6.998 2.495 12.841 1.00 0.00 C ATOM 756 CD1 LEU A 147 -8.319 2.831 12.143 1.00 0.00 C ATOM 757 CD2 LEU A 147 -6.148 1.607 11.927 1.00 0.00 C ATOM 0 H LEU A 147 -5.313 5.650 14.516 1.00 0.00 H new ATOM 0 HA LEU A 147 -5.687 2.911 15.047 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -6.930 4.571 13.443 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -5.715 4.135 12.258 1.00 0.00 H new ATOM 0 HG LEU A 147 -7.207 1.967 13.771 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -8.860 1.910 11.925 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -8.924 3.462 12.794 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -8.114 3.361 11.213 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -6.690 0.688 11.706 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -5.938 2.137 10.998 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -5.210 1.364 12.426 1.00 0.00 H new ATOM 769 N ILE A 148 -3.091 3.505 13.104 1.00 0.00 N ATOM 770 CA ILE A 148 -1.882 2.841 12.534 1.00 0.00 C ATOM 771 C ILE A 148 -1.038 2.264 13.673 1.00 0.00 C ATOM 772 O ILE A 148 -0.631 1.122 13.635 1.00 0.00 O ATOM 773 CB ILE A 148 -1.052 3.858 11.744 1.00 0.00 C ATOM 774 CG1 ILE A 148 -1.929 4.510 10.672 1.00 0.00 C ATOM 775 CG2 ILE A 148 0.124 3.146 11.070 1.00 0.00 C ATOM 776 CD1 ILE A 148 -1.159 5.652 10.006 1.00 0.00 C ATOM 0 H ILE A 148 -3.128 4.517 12.983 1.00 0.00 H new ATOM 0 HA ILE A 148 -2.192 2.039 11.865 1.00 0.00 H new ATOM 0 HB ILE A 148 -0.675 4.622 12.424 1.00 0.00 H new ATOM 0 HG12 ILE A 148 -2.220 3.770 9.926 1.00 0.00 H new ATOM 0 HG13 ILE A 148 -2.847 4.889 11.120 1.00 0.00 H new ATOM 0 HG21 ILE A 148 0.714 3.870 10.508 1.00 0.00 H new ATOM 0 HG22 ILE A 148 0.750 2.679 11.830 1.00 0.00 H new ATOM 0 HG23 ILE A 148 -0.254 2.381 10.391 1.00 0.00 H new ATOM 0 HD11 ILE A 148 -1.784 6.116 9.243 1.00 0.00 H new ATOM 0 HD12 ILE A 148 -0.890 6.396 10.756 1.00 0.00 H new ATOM 0 HD13 ILE A 148 -0.253 5.259 9.544 1.00 0.00 H new ATOM 788 N ARG A 149 -0.783 3.046 14.690 1.00 0.00 N ATOM 789 CA ARG A 149 0.027 2.549 15.843 1.00 0.00 C ATOM 790 C ARG A 149 -0.677 1.355 16.504 1.00 0.00 C ATOM 791 O ARG A 149 -0.065 0.590 17.225 1.00 0.00 O ATOM 792 CB ARG A 149 0.187 3.677 16.868 1.00 0.00 C ATOM 793 CG ARG A 149 1.125 3.225 17.993 1.00 0.00 C ATOM 794 CD ARG A 149 0.302 2.739 19.188 1.00 0.00 C ATOM 795 NE ARG A 149 0.212 3.826 20.204 1.00 0.00 N ATOM 796 CZ ARG A 149 0.090 3.529 21.469 1.00 0.00 C ATOM 797 NH1 ARG A 149 1.025 2.846 22.072 1.00 0.00 N ATOM 798 NH2 ARG A 149 -0.965 3.915 22.132 1.00 0.00 N ATOM 0 H ARG A 149 -1.102 4.011 14.772 1.00 0.00 H new ATOM 0 HA ARG A 149 1.006 2.231 15.485 1.00 0.00 H new ATOM 0 HB2 ARG A 149 0.588 4.567 16.383 1.00 0.00 H new ATOM 0 HB3 ARG A 149 -0.785 3.948 17.279 1.00 0.00 H new ATOM 0 HG2 ARG A 149 1.775 2.425 17.638 1.00 0.00 H new ATOM 0 HG3 ARG A 149 1.770 4.050 18.295 1.00 0.00 H new ATOM 0 HD2 ARG A 149 -0.696 2.448 18.861 1.00 0.00 H new ATOM 0 HD3 ARG A 149 0.764 1.854 19.626 1.00 0.00 H new ATOM 0 HE ARG A 149 0.246 4.802 19.910 1.00 0.00 H new ATOM 0 HH11 ARG A 149 1.851 2.545 21.554 1.00 0.00 H new ATOM 0 HH12 ARG A 149 0.930 2.614 23.061 1.00 0.00 H new ATOM 0 HH21 ARG A 149 -1.696 4.449 21.662 1.00 0.00 H new ATOM 0 HH22 ARG A 149 -1.059 3.682 23.121 1.00 0.00 H new ATOM 812 N HIS A 150 -1.958 1.196 16.272 1.00 0.00 N ATOM 813 CA HIS A 150 -2.708 0.064 16.889 1.00 0.00 C ATOM 814 C HIS A 150 -2.377 -1.244 16.148 1.00 0.00 C ATOM 815 O HIS A 150 -2.061 -2.245 16.762 1.00 0.00 O ATOM 816 CB HIS A 150 -4.216 0.374 16.801 1.00 0.00 C ATOM 817 CG HIS A 150 -5.042 -0.824 17.200 1.00 0.00 C ATOM 818 ND1 HIS A 150 -4.738 -1.600 18.307 1.00 0.00 N ATOM 819 CD2 HIS A 150 -6.152 -1.397 16.633 1.00 0.00 C ATOM 820 CE1 HIS A 150 -5.647 -2.590 18.370 1.00 0.00 C ATOM 821 NE2 HIS A 150 -6.533 -2.513 17.372 1.00 0.00 N ATOM 0 H HIS A 150 -2.517 1.808 15.677 1.00 0.00 H new ATOM 0 HA HIS A 150 -2.423 -0.057 17.934 1.00 0.00 H new ATOM 0 HB2 HIS A 150 -4.455 1.217 17.450 1.00 0.00 H new ATOM 0 HB3 HIS A 150 -4.470 0.672 15.784 1.00 0.00 H new ATOM 0 HD2 HIS A 150 -6.654 -1.037 15.747 1.00 0.00 H new ATOM 0 HE1 HIS A 150 -5.659 -3.354 19.134 1.00 0.00 H new ATOM 0 HE2 HIS A 150 -7.319 -3.138 17.191 1.00 0.00 H new ATOM 829 N ALA A 151 -2.468 -1.248 14.843 1.00 0.00 N ATOM 830 CA ALA A 151 -2.182 -2.497 14.071 1.00 0.00 C ATOM 831 C ALA A 151 -0.682 -2.809 14.087 1.00 0.00 C ATOM 832 O ALA A 151 -0.270 -3.887 14.471 1.00 0.00 O ATOM 833 CB ALA A 151 -2.650 -2.319 12.625 1.00 0.00 C ATOM 0 H ALA A 151 -2.728 -0.440 14.277 1.00 0.00 H new ATOM 0 HA ALA A 151 -2.716 -3.326 14.535 1.00 0.00 H new ATOM 0 HB1 ALA A 151 -2.442 -3.228 12.061 1.00 0.00 H new ATOM 0 HB2 ALA A 151 -3.722 -2.120 12.611 1.00 0.00 H new ATOM 0 HB3 ALA A 151 -2.120 -1.482 12.171 1.00 0.00 H new ATOM 839 N GLN A 152 0.137 -1.882 13.657 1.00 0.00 N ATOM 840 CA GLN A 152 1.619 -2.115 13.619 1.00 0.00 C ATOM 841 C GLN A 152 2.132 -2.666 14.960 1.00 0.00 C ATOM 842 O GLN A 152 3.157 -3.320 15.013 1.00 0.00 O ATOM 843 CB GLN A 152 2.334 -0.793 13.319 1.00 0.00 C ATOM 844 CG GLN A 152 1.729 -0.136 12.069 1.00 0.00 C ATOM 845 CD GLN A 152 2.846 0.277 11.106 1.00 0.00 C ATOM 846 OE1 GLN A 152 3.949 0.567 11.526 1.00 0.00 O ATOM 847 NE2 GLN A 152 2.604 0.318 9.825 1.00 0.00 N ATOM 0 H GLN A 152 -0.158 -0.963 13.327 1.00 0.00 H new ATOM 0 HA GLN A 152 1.827 -2.848 12.839 1.00 0.00 H new ATOM 0 HB2 GLN A 152 2.244 -0.121 14.172 1.00 0.00 H new ATOM 0 HB3 GLN A 152 3.398 -0.973 13.166 1.00 0.00 H new ATOM 0 HG2 GLN A 152 1.049 -0.830 11.575 1.00 0.00 H new ATOM 0 HG3 GLN A 152 1.141 0.737 12.354 1.00 0.00 H new ATOM 0 HE21 GLN A 152 1.678 0.075 9.473 1.00 0.00 H new ATOM 0 HE22 GLN A 152 3.341 0.593 9.175 1.00 0.00 H new ATOM 856 N LYS A 153 1.441 -2.397 16.039 1.00 0.00 N ATOM 857 CA LYS A 153 1.904 -2.891 17.371 1.00 0.00 C ATOM 858 C LYS A 153 1.227 -4.222 17.718 1.00 0.00 C ATOM 859 O LYS A 153 1.791 -5.041 18.419 1.00 0.00 O ATOM 860 CB LYS A 153 1.552 -1.856 18.438 1.00 0.00 C ATOM 861 CG LYS A 153 2.711 -0.868 18.599 1.00 0.00 C ATOM 862 CD LYS A 153 2.916 -0.082 17.296 1.00 0.00 C ATOM 863 CE LYS A 153 4.124 -0.638 16.538 1.00 0.00 C ATOM 864 NZ LYS A 153 5.319 0.209 16.818 1.00 0.00 N ATOM 0 H LYS A 153 0.576 -1.857 16.055 1.00 0.00 H new ATOM 0 HA LYS A 153 2.982 -3.045 17.334 1.00 0.00 H new ATOM 0 HB2 LYS A 153 0.644 -1.323 18.156 1.00 0.00 H new ATOM 0 HB3 LYS A 153 1.349 -2.352 19.387 1.00 0.00 H new ATOM 0 HG2 LYS A 153 2.503 -0.181 19.419 1.00 0.00 H new ATOM 0 HG3 LYS A 153 3.624 -1.405 18.857 1.00 0.00 H new ATOM 0 HD2 LYS A 153 2.023 -0.151 16.675 1.00 0.00 H new ATOM 0 HD3 LYS A 153 3.069 0.974 17.518 1.00 0.00 H new ATOM 0 HE2 LYS A 153 4.315 -1.667 16.842 1.00 0.00 H new ATOM 0 HE3 LYS A 153 3.919 -0.654 15.468 1.00 0.00 H new ATOM 0 HZ1 LYS A 153 6.140 -0.168 16.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 153 5.134 1.184 16.507 1.00 0.00 H new ATOM 0 HZ3 LYS A 153 5.518 0.203 17.839 1.00 0.00 H new ATOM 878 N ILE A 154 0.022 -4.436 17.252 1.00 0.00 N ATOM 879 CA ILE A 154 -0.688 -5.711 17.579 1.00 0.00 C ATOM 880 C ILE A 154 -1.030 -6.479 16.295 1.00 0.00 C ATOM 881 O ILE A 154 -0.691 -7.640 16.157 1.00 0.00 O ATOM 882 CB ILE A 154 -1.972 -5.386 18.352 1.00 0.00 C ATOM 883 CG1 ILE A 154 -1.612 -4.601 19.618 1.00 0.00 C ATOM 884 CG2 ILE A 154 -2.686 -6.682 18.749 1.00 0.00 C ATOM 885 CD1 ILE A 154 -1.693 -3.102 19.333 1.00 0.00 C ATOM 0 H ILE A 154 -0.499 -3.787 16.662 1.00 0.00 H new ATOM 0 HA ILE A 154 -0.038 -6.337 18.191 1.00 0.00 H new ATOM 0 HB ILE A 154 -2.632 -4.792 17.719 1.00 0.00 H new ATOM 0 HG12 ILE A 154 -2.293 -4.865 20.427 1.00 0.00 H new ATOM 0 HG13 ILE A 154 -0.607 -4.865 19.948 1.00 0.00 H new ATOM 0 HG21 ILE A 154 -3.597 -6.442 19.298 1.00 0.00 H new ATOM 0 HG22 ILE A 154 -2.941 -7.247 17.852 1.00 0.00 H new ATOM 0 HG23 ILE A 154 -2.029 -7.281 19.380 1.00 0.00 H new ATOM 0 HD11 ILE A 154 -1.437 -2.546 20.235 1.00 0.00 H new ATOM 0 HD12 ILE A 154 -0.994 -2.845 18.537 1.00 0.00 H new ATOM 0 HD13 ILE A 154 -2.706 -2.845 19.024 1.00 0.00 H new ATOM 897 N HIS A 155 -1.707 -5.853 15.364 1.00 0.00 N ATOM 898 CA HIS A 155 -2.078 -6.563 14.103 1.00 0.00 C ATOM 899 C HIS A 155 -0.866 -6.626 13.168 1.00 0.00 C ATOM 900 O HIS A 155 -0.209 -7.645 13.065 1.00 0.00 O ATOM 901 CB HIS A 155 -3.234 -5.824 13.422 1.00 0.00 C ATOM 902 CG HIS A 155 -4.429 -5.814 14.335 1.00 0.00 C ATOM 903 ND1 HIS A 155 -5.213 -6.938 14.542 1.00 0.00 N ATOM 904 CD2 HIS A 155 -4.988 -4.821 15.101 1.00 0.00 C ATOM 905 CE1 HIS A 155 -6.191 -6.598 15.402 1.00 0.00 C ATOM 906 NE2 HIS A 155 -6.101 -5.318 15.774 1.00 0.00 N ATOM 0 H HIS A 155 -2.018 -4.883 15.423 1.00 0.00 H new ATOM 0 HA HIS A 155 -2.394 -7.580 14.337 1.00 0.00 H new ATOM 0 HB2 HIS A 155 -2.937 -4.803 13.183 1.00 0.00 H new ATOM 0 HB3 HIS A 155 -3.487 -6.311 12.480 1.00 0.00 H new ATOM 0 HD2 HIS A 155 -4.620 -3.808 15.171 1.00 0.00 H new ATOM 0 HE1 HIS A 155 -6.956 -7.277 15.749 1.00 0.00 H new ATOM 0 HE2 HIS A 155 -6.715 -4.814 16.413 1.00 0.00 H new