USER MOD reduce.3.24.130724 H: found=0, std=0, add=623, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 625 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 159 GLN : amide:sc= -3.87! C(o=-1.6!,f=-4.8!) USER MOD Set 1.2: A 167 TYR OH : rot -149:sc= 2.31 USER MOD Single : A 139 GLN : amide:sc= -1.14 K(o=-1.1,f=-7.3!) USER MOD Single : A 140 GLN : amide:sc= -0.0204 X(o=-0.02,f=0) USER MOD Single : A 141 GLN : amide:sc= -0.633 K(o=-0.63,f=-2.6) USER MOD Single : A 142 GLN : amide:sc= -2.08 K(o=-2.1,f=-5!) USER MOD Single : A 146 GLN : amide:sc= -5.93! C(o=-5.9!,f=-17!) USER MOD Single : A 150 MET CE :methyl -124:sc= -0.431 (180deg=-3.67!) USER MOD Single : A 151 MET CE :methyl -156:sc= 0 (180deg=-1.08) USER MOD Single : A 156 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 164 HIS : no HE2:sc= -2.92! C(o=-2.9!,f=-6.5!) USER MOD Single : A 168 GLN : amide:sc= 0.736 K(o=0.74,f=-2.5!) USER MOD Single : A 174 THR OG1 : rot 180:sc= 0 USER MOD Single : A 175 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 177 CYS SG : rot 30:sc= 0.259 USER MOD Single : A 179 GLN : amide:sc= 0 X(o=0,f=-0.064) USER MOD Single : A 180 MET CE :methyl 138:sc= -3.91 (180deg=-8.45!) USER MOD Single : A 183 TYR OH : rot 60:sc= 0.546 USER MOD Single : A 184 THR OG1 : rot -178:sc= 1.22 USER MOD Single : A 188 ASN : amide:sc= -0.855 X(o=-0.86,f=-0.44) USER MOD Single : A 192 GLN : amide:sc= 1.55 K(o=1.6,f=-12!) USER MOD Single : A 195 ASN : amide:sc= 1.14 K(o=1.1,f=-0.3) USER MOD Single : A 198 THR OG1 : rot 130:sc= -0.273 USER MOD Single : A 216 GLN : amide:sc= 0.761 K(o=0.76,f=-0.16) USER MOD Single : A 219 SER OG : rot -50:sc= 0.429 USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 138 -0.413 13.894 6.380 1.00 0.00 N ATOM 2 CA PRO A 138 -1.078 12.569 6.221 1.00 0.00 C ATOM 3 C PRO A 138 -0.069 11.463 5.889 1.00 0.00 C ATOM 4 O PRO A 138 -0.034 10.941 4.772 1.00 0.00 O ATOM 5 CB PRO A 138 -2.125 12.714 5.116 1.00 0.00 C ATOM 6 CG PRO A 138 -1.977 14.122 4.637 1.00 0.00 C ATOM 7 CD PRO A 138 -1.298 14.889 5.750 1.00 0.00 C ATOM 0 HA PRO A 138 -1.550 12.274 7.158 1.00 0.00 H new ATOM 0 HB2 PRO A 138 -1.952 12.001 4.310 1.00 0.00 H new ATOM 0 HB3 PRO A 138 -3.130 12.528 5.495 1.00 0.00 H new ATOM 0 HG2 PRO A 138 -1.384 14.160 3.723 1.00 0.00 H new ATOM 0 HG3 PRO A 138 -2.949 14.556 4.405 1.00 0.00 H new ATOM 0 HD2 PRO A 138 -0.733 15.737 5.363 1.00 0.00 H new ATOM 0 HD3 PRO A 138 -2.023 15.286 6.461 1.00 0.00 H new ATOM 17 N GLN A 139 0.761 11.126 6.873 1.00 0.00 N ATOM 18 CA GLN A 139 1.790 10.100 6.706 1.00 0.00 C ATOM 19 C GLN A 139 1.592 8.943 7.687 1.00 0.00 C ATOM 20 O GLN A 139 1.753 7.776 7.316 1.00 0.00 O ATOM 21 CB GLN A 139 3.186 10.715 6.872 1.00 0.00 C ATOM 22 CG GLN A 139 3.349 11.573 8.124 1.00 0.00 C ATOM 23 CD GLN A 139 2.818 12.986 7.951 1.00 0.00 C ATOM 24 OE1 GLN A 139 1.618 13.234 8.087 1.00 0.00 O ATOM 25 NE2 GLN A 139 3.704 13.920 7.649 1.00 0.00 N ATOM 0 H GLN A 139 0.741 11.551 7.800 1.00 0.00 H new ATOM 0 HA GLN A 139 1.700 9.696 5.698 1.00 0.00 H new ATOM 0 HB2 GLN A 139 3.923 9.913 6.897 1.00 0.00 H new ATOM 0 HB3 GLN A 139 3.408 11.325 5.996 1.00 0.00 H new ATOM 0 HG2 GLN A 139 2.830 11.095 8.955 1.00 0.00 H new ATOM 0 HG3 GLN A 139 4.405 11.618 8.391 1.00 0.00 H new ATOM 0 HE21 GLN A 139 4.689 13.674 7.545 1.00 0.00 H new ATOM 0 HE22 GLN A 139 3.403 14.886 7.520 1.00 0.00 H new ATOM 34 N GLN A 140 1.226 9.264 8.931 1.00 0.00 N ATOM 35 CA GLN A 140 0.993 8.243 9.952 1.00 0.00 C ATOM 36 C GLN A 140 -0.059 7.225 9.506 1.00 0.00 C ATOM 37 O GLN A 140 -0.133 6.125 10.044 1.00 0.00 O ATOM 38 CB GLN A 140 0.577 8.896 11.274 1.00 0.00 C ATOM 39 CG GLN A 140 -0.766 9.611 11.214 1.00 0.00 C ATOM 40 CD GLN A 140 -1.575 9.448 12.485 1.00 0.00 C ATOM 41 OE1 GLN A 140 -1.811 10.411 13.208 1.00 0.00 O ATOM 42 NE2 GLN A 140 -2.006 8.226 12.764 1.00 0.00 N ATOM 0 H GLN A 140 1.085 10.221 9.253 1.00 0.00 H new ATOM 0 HA GLN A 140 1.930 7.705 10.100 1.00 0.00 H new ATOM 0 HB2 GLN A 140 0.535 8.130 12.049 1.00 0.00 H new ATOM 0 HB3 GLN A 140 1.345 9.610 11.572 1.00 0.00 H new ATOM 0 HG2 GLN A 140 -0.600 10.672 11.028 1.00 0.00 H new ATOM 0 HG3 GLN A 140 -1.340 9.226 10.371 1.00 0.00 H new ATOM 0 HE21 GLN A 140 -1.788 7.452 12.136 1.00 0.00 H new ATOM 0 HE22 GLN A 140 -2.556 8.059 13.607 1.00 0.00 H new ATOM 51 N GLN A 141 -0.849 7.589 8.498 1.00 0.00 N ATOM 52 CA GLN A 141 -1.873 6.697 7.964 1.00 0.00 C ATOM 53 C GLN A 141 -1.267 5.694 6.975 1.00 0.00 C ATOM 54 O GLN A 141 -1.952 4.796 6.492 1.00 0.00 O ATOM 55 CB GLN A 141 -3.002 7.501 7.306 1.00 0.00 C ATOM 56 CG GLN A 141 -2.649 8.070 5.937 1.00 0.00 C ATOM 57 CD GLN A 141 -3.730 8.977 5.386 1.00 0.00 C ATOM 58 OE1 GLN A 141 -3.610 10.198 5.431 1.00 0.00 O ATOM 59 NE2 GLN A 141 -4.792 8.385 4.861 1.00 0.00 N ATOM 0 H GLN A 141 -0.799 8.496 8.035 1.00 0.00 H new ATOM 0 HA GLN A 141 -2.297 6.132 8.795 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -3.878 6.860 7.206 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -3.281 8.322 7.967 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -1.715 8.627 6.009 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -2.478 7.250 5.240 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -4.852 7.367 4.844 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -5.550 8.947 4.474 1.00 0.00 H new ATOM 68 N GLN A 142 0.031 5.839 6.699 1.00 0.00 N ATOM 69 CA GLN A 142 0.737 4.934 5.802 1.00 0.00 C ATOM 70 C GLN A 142 1.729 4.106 6.607 1.00 0.00 C ATOM 71 O GLN A 142 1.821 2.892 6.431 1.00 0.00 O ATOM 72 CB GLN A 142 1.455 5.707 4.690 1.00 0.00 C ATOM 73 CG GLN A 142 0.540 6.092 3.534 1.00 0.00 C ATOM 74 CD GLN A 142 0.383 7.591 3.361 1.00 0.00 C ATOM 75 OE1 GLN A 142 0.472 8.106 2.253 1.00 0.00 O ATOM 76 NE2 GLN A 142 0.141 8.302 4.455 1.00 0.00 N ATOM 0 H GLN A 142 0.613 6.580 7.089 1.00 0.00 H new ATOM 0 HA GLN A 142 0.014 4.272 5.325 1.00 0.00 H new ATOM 0 HB2 GLN A 142 1.896 6.610 5.112 1.00 0.00 H new ATOM 0 HB3 GLN A 142 2.276 5.101 4.308 1.00 0.00 H new ATOM 0 HG2 GLN A 142 0.935 5.667 2.611 1.00 0.00 H new ATOM 0 HG3 GLN A 142 -0.442 5.648 3.695 1.00 0.00 H new ATOM 0 HE21 GLN A 142 0.074 7.838 5.361 1.00 0.00 H new ATOM 0 HE22 GLN A 142 0.022 9.313 4.390 1.00 0.00 H new ATOM 85 N GLU A 143 2.446 4.765 7.522 1.00 0.00 N ATOM 86 CA GLU A 143 3.402 4.068 8.379 1.00 0.00 C ATOM 87 C GLU A 143 2.660 3.158 9.359 1.00 0.00 C ATOM 88 O GLU A 143 3.117 2.058 9.664 1.00 0.00 O ATOM 89 CB GLU A 143 4.285 5.064 9.137 1.00 0.00 C ATOM 90 CG GLU A 143 3.576 5.760 10.290 1.00 0.00 C ATOM 91 CD GLU A 143 4.318 6.984 10.777 1.00 0.00 C ATOM 92 OE1 GLU A 143 5.161 6.842 11.679 1.00 0.00 O ATOM 93 OE2 GLU A 143 4.056 8.086 10.253 1.00 0.00 O ATOM 0 H GLU A 143 2.382 5.770 7.686 1.00 0.00 H new ATOM 0 HA GLU A 143 4.048 3.457 7.749 1.00 0.00 H new ATOM 0 HB2 GLU A 143 5.159 4.540 9.524 1.00 0.00 H new ATOM 0 HB3 GLU A 143 4.649 5.818 8.438 1.00 0.00 H new ATOM 0 HG2 GLU A 143 2.574 6.050 9.973 1.00 0.00 H new ATOM 0 HG3 GLU A 143 3.459 5.058 11.116 1.00 0.00 H new ATOM 100 N GLU A 144 1.496 3.617 9.830 1.00 0.00 N ATOM 101 CA GLU A 144 0.680 2.831 10.756 1.00 0.00 C ATOM 102 C GLU A 144 -0.101 1.755 10.002 1.00 0.00 C ATOM 103 O GLU A 144 -0.393 0.694 10.547 1.00 0.00 O ATOM 104 CB GLU A 144 -0.279 3.745 11.530 1.00 0.00 C ATOM 105 CG GLU A 144 -1.220 3.004 12.474 1.00 0.00 C ATOM 106 CD GLU A 144 -0.492 2.285 13.590 1.00 0.00 C ATOM 107 OE1 GLU A 144 -0.029 1.149 13.358 1.00 0.00 O ATOM 108 OE2 GLU A 144 -0.394 2.853 14.696 1.00 0.00 O ATOM 0 H GLU A 144 1.101 4.525 9.586 1.00 0.00 H new ATOM 0 HA GLU A 144 1.343 2.340 11.468 1.00 0.00 H new ATOM 0 HB2 GLU A 144 0.306 4.462 12.106 1.00 0.00 H new ATOM 0 HB3 GLU A 144 -0.873 4.317 10.817 1.00 0.00 H new ATOM 0 HG2 GLU A 144 -1.926 3.714 12.906 1.00 0.00 H new ATOM 0 HG3 GLU A 144 -1.804 2.281 11.903 1.00 0.00 H new ATOM 115 N VAL A 145 -0.424 2.031 8.737 1.00 0.00 N ATOM 116 CA VAL A 145 -1.157 1.090 7.901 1.00 0.00 C ATOM 117 C VAL A 145 -0.266 -0.080 7.483 1.00 0.00 C ATOM 118 O VAL A 145 -0.714 -1.226 7.438 1.00 0.00 O ATOM 119 CB VAL A 145 -1.736 1.792 6.643 1.00 0.00 C ATOM 120 CG1 VAL A 145 -1.713 0.877 5.423 1.00 0.00 C ATOM 121 CG2 VAL A 145 -3.152 2.274 6.913 1.00 0.00 C ATOM 0 H VAL A 145 -0.186 2.906 8.270 1.00 0.00 H new ATOM 0 HA VAL A 145 -1.986 0.703 8.494 1.00 0.00 H new ATOM 0 HB VAL A 145 -1.101 2.650 6.423 1.00 0.00 H new ATOM 0 HG11 VAL A 145 -2.126 1.405 4.564 1.00 0.00 H new ATOM 0 HG12 VAL A 145 -0.686 0.583 5.208 1.00 0.00 H new ATOM 0 HG13 VAL A 145 -2.311 -0.012 5.624 1.00 0.00 H new ATOM 0 HG21 VAL A 145 -3.545 2.764 6.023 1.00 0.00 H new ATOM 0 HG22 VAL A 145 -3.784 1.423 7.168 1.00 0.00 H new ATOM 0 HG23 VAL A 145 -3.144 2.981 7.743 1.00 0.00 H new ATOM 131 N GLN A 146 0.997 0.214 7.178 1.00 0.00 N ATOM 132 CA GLN A 146 1.951 -0.815 6.757 1.00 0.00 C ATOM 133 C GLN A 146 2.177 -1.894 7.814 1.00 0.00 C ATOM 134 O GLN A 146 2.771 -2.933 7.510 1.00 0.00 O ATOM 135 CB GLN A 146 3.285 -0.177 6.406 1.00 0.00 C ATOM 136 CG GLN A 146 3.280 0.483 5.045 1.00 0.00 C ATOM 137 CD GLN A 146 4.061 -0.295 4.008 1.00 0.00 C ATOM 138 OE1 GLN A 146 5.001 0.218 3.422 1.00 0.00 O ATOM 139 NE2 GLN A 146 3.672 -1.538 3.773 1.00 0.00 N ATOM 0 H GLN A 146 1.385 1.157 7.214 1.00 0.00 H new ATOM 0 HA GLN A 146 1.514 -1.300 5.884 1.00 0.00 H new ATOM 0 HB2 GLN A 146 3.538 0.565 7.163 1.00 0.00 H new ATOM 0 HB3 GLN A 146 4.065 -0.938 6.433 1.00 0.00 H new ATOM 0 HG2 GLN A 146 2.250 0.597 4.706 1.00 0.00 H new ATOM 0 HG3 GLN A 146 3.700 1.485 5.132 1.00 0.00 H new ATOM 0 HE21 GLN A 146 2.881 -1.930 4.284 1.00 0.00 H new ATOM 0 HE22 GLN A 146 4.163 -2.104 3.081 1.00 0.00 H new ATOM 148 N ARG A 147 1.712 -1.663 9.044 1.00 0.00 N ATOM 149 CA ARG A 147 1.885 -2.631 10.123 1.00 0.00 C ATOM 150 C ARG A 147 1.339 -4.027 9.770 1.00 0.00 C ATOM 151 O ARG A 147 1.655 -5.000 10.452 1.00 0.00 O ATOM 152 CB ARG A 147 1.216 -2.094 11.396 1.00 0.00 C ATOM 153 CG ARG A 147 -0.228 -2.540 11.586 1.00 0.00 C ATOM 154 CD ARG A 147 -1.129 -2.117 10.434 1.00 0.00 C ATOM 155 NE ARG A 147 -2.533 -2.023 10.849 1.00 0.00 N ATOM 156 CZ ARG A 147 -3.025 -1.075 11.640 1.00 0.00 C ATOM 157 NH1 ARG A 147 -2.260 -0.086 12.067 1.00 0.00 N ATOM 158 NH2 ARG A 147 -4.297 -1.105 11.985 1.00 0.00 N ATOM 0 H ARG A 147 1.214 -0.815 9.315 1.00 0.00 H new ATOM 0 HA ARG A 147 2.955 -2.756 10.287 1.00 0.00 H new ATOM 0 HB2 ARG A 147 1.799 -2.414 12.260 1.00 0.00 H new ATOM 0 HB3 ARG A 147 1.247 -1.005 11.376 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -0.259 -3.625 11.687 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -0.614 -2.122 12.516 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -0.798 -1.153 10.049 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -1.038 -2.834 9.618 1.00 0.00 H new ATOM 0 HE ARG A 147 -3.177 -2.736 10.506 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -1.279 -0.044 11.790 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -2.650 0.635 12.674 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -4.900 -1.854 11.645 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -4.678 -0.379 12.592 1.00 0.00 H new ATOM 172 N LEU A 148 0.518 -4.123 8.719 1.00 0.00 N ATOM 173 CA LEU A 148 -0.060 -5.409 8.308 1.00 0.00 C ATOM 174 C LEU A 148 0.527 -5.903 6.980 1.00 0.00 C ATOM 175 O LEU A 148 0.676 -7.107 6.770 1.00 0.00 O ATOM 176 CB LEU A 148 -1.583 -5.286 8.191 1.00 0.00 C ATOM 177 CG LEU A 148 -2.375 -6.459 8.772 1.00 0.00 C ATOM 178 CD1 LEU A 148 -3.015 -6.070 10.095 1.00 0.00 C ATOM 179 CD2 LEU A 148 -3.436 -6.923 7.788 1.00 0.00 C ATOM 0 H LEU A 148 0.239 -3.331 8.140 1.00 0.00 H new ATOM 0 HA LEU A 148 0.192 -6.142 9.074 1.00 0.00 H new ATOM 0 HB2 LEU A 148 -1.898 -4.371 8.693 1.00 0.00 H new ATOM 0 HB3 LEU A 148 -1.843 -5.178 7.138 1.00 0.00 H new ATOM 0 HG LEU A 148 -1.684 -7.283 8.952 1.00 0.00 H new ATOM 0 HD11 LEU A 148 -3.574 -6.918 10.492 1.00 0.00 H new ATOM 0 HD12 LEU A 148 -2.239 -5.783 10.804 1.00 0.00 H new ATOM 0 HD13 LEU A 148 -3.692 -5.230 9.939 1.00 0.00 H new ATOM 0 HD21 LEU A 148 -3.990 -7.758 8.217 1.00 0.00 H new ATOM 0 HD22 LEU A 148 -4.122 -6.102 7.578 1.00 0.00 H new ATOM 0 HD23 LEU A 148 -2.958 -7.242 6.862 1.00 0.00 H new ATOM 191 N LEU A 149 0.853 -4.971 6.085 1.00 0.00 N ATOM 192 CA LEU A 149 1.419 -5.317 4.779 1.00 0.00 C ATOM 193 C LEU A 149 2.950 -5.419 4.834 1.00 0.00 C ATOM 194 O LEU A 149 3.553 -6.170 4.066 1.00 0.00 O ATOM 195 CB LEU A 149 0.989 -4.287 3.727 1.00 0.00 C ATOM 196 CG LEU A 149 -0.521 -4.042 3.639 1.00 0.00 C ATOM 197 CD1 LEU A 149 -0.896 -2.740 4.328 1.00 0.00 C ATOM 198 CD2 LEU A 149 -0.976 -4.022 2.191 1.00 0.00 C ATOM 0 H LEU A 149 0.735 -3.970 6.239 1.00 0.00 H new ATOM 0 HA LEU A 149 1.034 -6.297 4.498 1.00 0.00 H new ATOM 0 HB2 LEU A 149 1.483 -3.340 3.944 1.00 0.00 H new ATOM 0 HB3 LEU A 149 1.346 -4.616 2.751 1.00 0.00 H new ATOM 0 HG LEU A 149 -1.027 -4.861 4.150 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -1.972 -2.586 4.253 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -0.608 -2.788 5.378 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -0.377 -1.911 3.847 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -2.051 -3.847 2.150 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -0.458 -3.225 1.658 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -0.746 -4.980 1.724 1.00 0.00 H new ATOM 210 N MET A 150 3.574 -4.664 5.744 1.00 0.00 N ATOM 211 CA MET A 150 5.025 -4.676 5.898 1.00 0.00 C ATOM 212 C MET A 150 5.424 -5.249 7.264 1.00 0.00 C ATOM 213 O MET A 150 6.164 -4.626 8.023 1.00 0.00 O ATOM 214 CB MET A 150 5.574 -3.258 5.736 1.00 0.00 C ATOM 215 CG MET A 150 6.905 -3.200 5.002 1.00 0.00 C ATOM 216 SD MET A 150 8.302 -2.954 6.113 1.00 0.00 S ATOM 217 CE MET A 150 8.706 -4.650 6.518 1.00 0.00 C ATOM 0 H MET A 150 3.091 -4.036 6.386 1.00 0.00 H new ATOM 0 HA MET A 150 5.452 -5.315 5.125 1.00 0.00 H new ATOM 0 HB2 MET A 150 4.844 -2.654 5.196 1.00 0.00 H new ATOM 0 HB3 MET A 150 5.692 -2.808 6.722 1.00 0.00 H new ATOM 0 HG2 MET A 150 7.048 -4.126 4.444 1.00 0.00 H new ATOM 0 HG3 MET A 150 6.878 -2.390 4.273 1.00 0.00 H new ATOM 0 HE1 MET A 150 8.684 -4.781 7.600 1.00 0.00 H new ATOM 0 HE2 MET A 150 7.978 -5.318 6.057 1.00 0.00 H new ATOM 0 HE3 MET A 150 9.702 -4.886 6.144 1.00 0.00 H new ATOM 227 N MET A 151 4.917 -6.440 7.565 1.00 0.00 N ATOM 228 CA MET A 151 5.208 -7.111 8.830 1.00 0.00 C ATOM 229 C MET A 151 6.629 -7.698 8.831 1.00 0.00 C ATOM 230 O MET A 151 7.594 -6.994 8.521 1.00 0.00 O ATOM 231 CB MET A 151 4.147 -8.189 9.093 1.00 0.00 C ATOM 232 CG MET A 151 2.723 -7.658 9.065 1.00 0.00 C ATOM 233 SD MET A 151 1.554 -8.767 9.872 1.00 0.00 S ATOM 234 CE MET A 151 1.332 -7.940 11.444 1.00 0.00 C ATOM 0 H MET A 151 4.298 -6.964 6.946 1.00 0.00 H new ATOM 0 HA MET A 151 5.168 -6.382 9.639 1.00 0.00 H new ATOM 0 HB2 MET A 151 4.247 -8.976 8.346 1.00 0.00 H new ATOM 0 HB3 MET A 151 4.337 -8.645 10.064 1.00 0.00 H new ATOM 0 HG2 MET A 151 2.692 -6.685 9.555 1.00 0.00 H new ATOM 0 HG3 MET A 151 2.417 -7.504 8.030 1.00 0.00 H new ATOM 0 HE1 MET A 151 1.007 -8.663 12.193 1.00 0.00 H new ATOM 0 HE2 MET A 151 2.276 -7.493 11.756 1.00 0.00 H new ATOM 0 HE3 MET A 151 0.577 -7.160 11.341 1.00 0.00 H new ATOM 244 N GLY A 152 6.763 -8.979 9.189 1.00 0.00 N ATOM 245 CA GLY A 152 8.075 -9.624 9.231 1.00 0.00 C ATOM 246 C GLY A 152 8.744 -9.733 7.868 1.00 0.00 C ATOM 247 O GLY A 152 8.963 -10.837 7.369 1.00 0.00 O ATOM 0 H GLY A 152 5.985 -9.584 9.452 1.00 0.00 H new ATOM 0 HA2 GLY A 152 8.725 -9.063 9.902 1.00 0.00 H new ATOM 0 HA3 GLY A 152 7.966 -10.623 9.654 1.00 0.00 H new ATOM 251 N GLU A 153 9.075 -8.582 7.280 1.00 0.00 N ATOM 252 CA GLU A 153 9.737 -8.522 5.973 1.00 0.00 C ATOM 253 C GLU A 153 9.045 -9.406 4.922 1.00 0.00 C ATOM 254 O GLU A 153 9.684 -10.252 4.290 1.00 0.00 O ATOM 255 CB GLU A 153 11.209 -8.914 6.122 1.00 0.00 C ATOM 256 CG GLU A 153 12.020 -7.915 6.937 1.00 0.00 C ATOM 257 CD GLU A 153 13.515 -8.113 6.795 1.00 0.00 C ATOM 258 OE1 GLU A 153 14.060 -9.019 7.461 1.00 0.00 O ATOM 259 OE2 GLU A 153 14.141 -7.356 6.022 1.00 0.00 O ATOM 0 H GLU A 153 8.893 -7.668 7.694 1.00 0.00 H new ATOM 0 HA GLU A 153 9.666 -7.495 5.614 1.00 0.00 H new ATOM 0 HB2 GLU A 153 11.271 -9.894 6.596 1.00 0.00 H new ATOM 0 HB3 GLU A 153 11.654 -9.010 5.132 1.00 0.00 H new ATOM 0 HG2 GLU A 153 11.761 -6.903 6.624 1.00 0.00 H new ATOM 0 HG3 GLU A 153 11.745 -8.003 7.988 1.00 0.00 H new ATOM 266 N PRO A 154 7.724 -9.215 4.709 1.00 0.00 N ATOM 267 CA PRO A 154 6.968 -9.992 3.725 1.00 0.00 C ATOM 268 C PRO A 154 7.157 -9.487 2.296 1.00 0.00 C ATOM 269 O PRO A 154 7.309 -8.286 2.062 1.00 0.00 O ATOM 270 CB PRO A 154 5.518 -9.792 4.160 1.00 0.00 C ATOM 271 CG PRO A 154 5.499 -8.449 4.809 1.00 0.00 C ATOM 272 CD PRO A 154 6.871 -8.227 5.400 1.00 0.00 C ATOM 0 HA PRO A 154 7.292 -11.032 3.703 1.00 0.00 H new ATOM 0 HB2 PRO A 154 4.840 -9.829 3.307 1.00 0.00 H new ATOM 0 HB3 PRO A 154 5.201 -10.571 4.853 1.00 0.00 H new ATOM 0 HG2 PRO A 154 5.262 -7.672 4.082 1.00 0.00 H new ATOM 0 HG3 PRO A 154 4.733 -8.405 5.584 1.00 0.00 H new ATOM 0 HD2 PRO A 154 7.220 -7.209 5.227 1.00 0.00 H new ATOM 0 HD3 PRO A 154 6.871 -8.385 6.478 1.00 0.00 H new ATOM 280 N ALA A 155 7.103 -10.410 1.341 1.00 0.00 N ATOM 281 CA ALA A 155 7.231 -10.061 -0.075 1.00 0.00 C ATOM 282 C ALA A 155 5.855 -9.764 -0.692 1.00 0.00 C ATOM 283 O ALA A 155 5.683 -9.817 -1.911 1.00 0.00 O ATOM 284 CB ALA A 155 7.926 -11.189 -0.827 1.00 0.00 C ATOM 0 H ALA A 155 6.972 -11.406 1.519 1.00 0.00 H new ATOM 0 HA ALA A 155 7.836 -9.158 -0.158 1.00 0.00 H new ATOM 0 HB1 ALA A 155 8.018 -10.922 -1.880 1.00 0.00 H new ATOM 0 HB2 ALA A 155 8.918 -11.350 -0.406 1.00 0.00 H new ATOM 0 HB3 ALA A 155 7.340 -12.103 -0.734 1.00 0.00 H new ATOM 290 N LYS A 156 4.876 -9.477 0.167 1.00 0.00 N ATOM 291 CA LYS A 156 3.515 -9.196 -0.252 1.00 0.00 C ATOM 292 C LYS A 156 3.071 -7.781 0.142 1.00 0.00 C ATOM 293 O LYS A 156 3.874 -6.974 0.619 1.00 0.00 O ATOM 294 CB LYS A 156 2.601 -10.237 0.372 1.00 0.00 C ATOM 295 CG LYS A 156 2.797 -11.595 -0.255 1.00 0.00 C ATOM 296 CD LYS A 156 1.471 -12.249 -0.614 1.00 0.00 C ATOM 297 CE LYS A 156 1.604 -13.163 -1.820 1.00 0.00 C ATOM 298 NZ LYS A 156 1.195 -14.561 -1.500 1.00 0.00 N ATOM 0 H LYS A 156 5.012 -9.434 1.177 1.00 0.00 H new ATOM 0 HA LYS A 156 3.462 -9.245 -1.340 1.00 0.00 H new ATOM 0 HB2 LYS A 156 2.796 -10.298 1.443 1.00 0.00 H new ATOM 0 HB3 LYS A 156 1.562 -9.928 0.254 1.00 0.00 H new ATOM 0 HG2 LYS A 156 3.408 -11.496 -1.152 1.00 0.00 H new ATOM 0 HG3 LYS A 156 3.344 -12.238 0.434 1.00 0.00 H new ATOM 0 HD2 LYS A 156 1.105 -12.822 0.238 1.00 0.00 H new ATOM 0 HD3 LYS A 156 0.729 -11.478 -0.822 1.00 0.00 H new ATOM 0 HE2 LYS A 156 0.989 -12.782 -2.635 1.00 0.00 H new ATOM 0 HE3 LYS A 156 2.636 -13.157 -2.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 1.299 -15.156 -2.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 1.798 -14.934 -0.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 0.202 -14.570 -1.191 1.00 0.00 H new ATOM 312 N GLY A 157 1.784 -7.484 -0.069 1.00 0.00 N ATOM 313 CA GLY A 157 1.246 -6.170 0.269 1.00 0.00 C ATOM 314 C GLY A 157 1.865 -5.058 -0.553 1.00 0.00 C ATOM 315 O GLY A 157 1.608 -4.955 -1.757 1.00 0.00 O ATOM 0 H GLY A 157 1.105 -8.131 -0.468 1.00 0.00 H new ATOM 0 HA2 GLY A 157 0.167 -6.173 0.115 1.00 0.00 H new ATOM 0 HA3 GLY A 157 1.417 -5.973 1.327 1.00 0.00 H new ATOM 319 N TRP A 158 2.700 -4.238 0.091 1.00 0.00 N ATOM 320 CA TRP A 158 3.378 -3.140 -0.597 1.00 0.00 C ATOM 321 C TRP A 158 4.128 -3.670 -1.818 1.00 0.00 C ATOM 322 O TRP A 158 4.062 -3.087 -2.899 1.00 0.00 O ATOM 323 CB TRP A 158 4.340 -2.412 0.355 1.00 0.00 C ATOM 324 CG TRP A 158 5.505 -3.251 0.783 1.00 0.00 C ATOM 325 CD1 TRP A 158 5.547 -4.120 1.834 1.00 0.00 C ATOM 326 CD2 TRP A 158 6.794 -3.310 0.160 1.00 0.00 C ATOM 327 NE1 TRP A 158 6.782 -4.714 1.902 1.00 0.00 N ATOM 328 CE2 TRP A 158 7.565 -4.236 0.886 1.00 0.00 C ATOM 329 CE3 TRP A 158 7.372 -2.673 -0.942 1.00 0.00 C ATOM 330 CZ2 TRP A 158 8.880 -4.539 0.547 1.00 0.00 C ATOM 331 CZ3 TRP A 158 8.677 -2.976 -1.278 1.00 0.00 C ATOM 332 CH2 TRP A 158 9.419 -3.902 -0.536 1.00 0.00 C ATOM 0 H TRP A 158 2.921 -4.314 1.084 1.00 0.00 H new ATOM 0 HA TRP A 158 2.628 -2.423 -0.931 1.00 0.00 H new ATOM 0 HB2 TRP A 158 4.711 -1.512 -0.135 1.00 0.00 H new ATOM 0 HB3 TRP A 158 3.790 -2.090 1.239 1.00 0.00 H new ATOM 0 HD1 TRP A 158 4.729 -4.312 2.512 1.00 0.00 H new ATOM 0 HE1 TRP A 158 7.070 -5.402 2.598 1.00 0.00 H new ATOM 0 HE3 TRP A 158 6.808 -1.956 -1.521 1.00 0.00 H new ATOM 0 HZ2 TRP A 158 9.455 -5.252 1.119 1.00 0.00 H new ATOM 0 HZ3 TRP A 158 9.133 -2.490 -2.128 1.00 0.00 H new ATOM 0 HH2 TRP A 158 10.437 -4.118 -0.825 1.00 0.00 H new ATOM 343 N GLN A 159 4.817 -4.801 -1.640 1.00 0.00 N ATOM 344 CA GLN A 159 5.558 -5.435 -2.727 1.00 0.00 C ATOM 345 C GLN A 159 4.621 -5.805 -3.878 1.00 0.00 C ATOM 346 O GLN A 159 4.985 -5.675 -5.052 1.00 0.00 O ATOM 347 CB GLN A 159 6.278 -6.686 -2.217 1.00 0.00 C ATOM 348 CG GLN A 159 7.768 -6.481 -2.000 1.00 0.00 C ATOM 349 CD GLN A 159 8.597 -7.644 -2.502 1.00 0.00 C ATOM 350 OE1 GLN A 159 9.180 -8.387 -1.720 1.00 0.00 O ATOM 351 NE2 GLN A 159 8.659 -7.806 -3.816 1.00 0.00 N ATOM 0 H GLN A 159 4.875 -5.295 -0.750 1.00 0.00 H new ATOM 0 HA GLN A 159 6.297 -4.724 -3.097 1.00 0.00 H new ATOM 0 HB2 GLN A 159 5.822 -7.001 -1.278 1.00 0.00 H new ATOM 0 HB3 GLN A 159 6.131 -7.497 -2.931 1.00 0.00 H new ATOM 0 HG2 GLN A 159 8.083 -5.570 -2.508 1.00 0.00 H new ATOM 0 HG3 GLN A 159 7.960 -6.336 -0.937 1.00 0.00 H new ATOM 0 HE21 GLN A 159 8.159 -7.166 -4.433 1.00 0.00 H new ATOM 0 HE22 GLN A 159 9.207 -8.571 -4.210 1.00 0.00 H new ATOM 360 N GLU A 160 3.414 -6.258 -3.530 1.00 0.00 N ATOM 361 CA GLU A 160 2.411 -6.643 -4.514 1.00 0.00 C ATOM 362 C GLU A 160 1.802 -5.407 -5.178 1.00 0.00 C ATOM 363 O GLU A 160 1.797 -5.304 -6.405 1.00 0.00 O ATOM 364 CB GLU A 160 1.323 -7.489 -3.851 1.00 0.00 C ATOM 365 CG GLU A 160 1.750 -8.929 -3.597 1.00 0.00 C ATOM 366 CD GLU A 160 0.786 -9.686 -2.708 1.00 0.00 C ATOM 367 OE1 GLU A 160 0.590 -9.267 -1.549 1.00 0.00 O ATOM 368 OE2 GLU A 160 0.234 -10.704 -3.166 1.00 0.00 O ATOM 0 H GLU A 160 3.110 -6.366 -2.562 1.00 0.00 H new ATOM 0 HA GLU A 160 2.894 -7.239 -5.288 1.00 0.00 H new ATOM 0 HB2 GLU A 160 1.041 -7.029 -2.904 1.00 0.00 H new ATOM 0 HB3 GLU A 160 0.435 -7.487 -4.483 1.00 0.00 H new ATOM 0 HG2 GLU A 160 1.840 -9.449 -4.551 1.00 0.00 H new ATOM 0 HG3 GLU A 160 2.738 -8.933 -3.137 1.00 0.00 H new ATOM 375 N LEU A 161 1.308 -4.460 -4.370 1.00 0.00 N ATOM 376 CA LEU A 161 0.728 -3.230 -4.920 1.00 0.00 C ATOM 377 C LEU A 161 1.775 -2.476 -5.734 1.00 0.00 C ATOM 378 O LEU A 161 1.492 -2.004 -6.837 1.00 0.00 O ATOM 379 CB LEU A 161 0.136 -2.339 -3.819 1.00 0.00 C ATOM 380 CG LEU A 161 1.094 -1.933 -2.703 1.00 0.00 C ATOM 381 CD1 LEU A 161 1.804 -0.637 -3.052 1.00 0.00 C ATOM 382 CD2 LEU A 161 0.344 -1.789 -1.389 1.00 0.00 C ATOM 0 H LEU A 161 1.298 -4.520 -3.352 1.00 0.00 H new ATOM 0 HA LEU A 161 -0.094 -3.509 -5.580 1.00 0.00 H new ATOM 0 HB2 LEU A 161 -0.256 -1.434 -4.283 1.00 0.00 H new ATOM 0 HB3 LEU A 161 -0.711 -2.860 -3.373 1.00 0.00 H new ATOM 0 HG LEU A 161 1.844 -2.716 -2.592 1.00 0.00 H new ATOM 0 HD11 LEU A 161 2.482 -0.365 -2.244 1.00 0.00 H new ATOM 0 HD12 LEU A 161 2.372 -0.770 -3.973 1.00 0.00 H new ATOM 0 HD13 LEU A 161 1.068 0.155 -3.190 1.00 0.00 H new ATOM 0 HD21 LEU A 161 1.041 -1.499 -0.602 1.00 0.00 H new ATOM 0 HD22 LEU A 161 -0.426 -1.025 -1.492 1.00 0.00 H new ATOM 0 HD23 LEU A 161 -0.121 -2.740 -1.129 1.00 0.00 H new ATOM 394 N ALA A 162 3.001 -2.403 -5.212 1.00 0.00 N ATOM 395 CA ALA A 162 4.089 -1.747 -5.929 1.00 0.00 C ATOM 396 C ALA A 162 4.431 -2.540 -7.193 1.00 0.00 C ATOM 397 O ALA A 162 4.872 -1.968 -8.190 1.00 0.00 O ATOM 398 CB ALA A 162 5.314 -1.587 -5.042 1.00 0.00 C ATOM 0 H ALA A 162 3.261 -2.787 -4.304 1.00 0.00 H new ATOM 0 HA ALA A 162 3.761 -0.748 -6.217 1.00 0.00 H new ATOM 0 HB1 ALA A 162 6.108 -1.095 -5.604 1.00 0.00 H new ATOM 0 HB2 ALA A 162 5.057 -0.983 -4.172 1.00 0.00 H new ATOM 0 HB3 ALA A 162 5.656 -2.568 -4.714 1.00 0.00 H new ATOM 404 N GLY A 163 4.188 -3.859 -7.159 1.00 0.00 N ATOM 405 CA GLY A 163 4.439 -4.699 -8.326 1.00 0.00 C ATOM 406 C GLY A 163 3.699 -4.188 -9.553 1.00 0.00 C ATOM 407 O GLY A 163 4.118 -4.426 -10.683 1.00 0.00 O ATOM 0 H GLY A 163 3.823 -4.356 -6.346 1.00 0.00 H new ATOM 0 HA2 GLY A 163 5.509 -4.727 -8.531 1.00 0.00 H new ATOM 0 HA3 GLY A 163 4.128 -5.722 -8.113 1.00 0.00 H new ATOM 411 N HIS A 164 2.614 -3.446 -9.313 1.00 0.00 N ATOM 412 CA HIS A 164 1.814 -2.845 -10.375 1.00 0.00 C ATOM 413 C HIS A 164 2.493 -1.572 -10.898 1.00 0.00 C ATOM 414 O HIS A 164 2.121 -1.041 -11.949 1.00 0.00 O ATOM 415 CB HIS A 164 0.417 -2.516 -9.842 1.00 0.00 C ATOM 416 CG HIS A 164 -0.611 -2.310 -10.906 1.00 0.00 C ATOM 417 ND1 HIS A 164 -0.351 -1.664 -12.095 1.00 0.00 N ATOM 418 CD2 HIS A 164 -1.911 -2.662 -10.948 1.00 0.00 C ATOM 419 CE1 HIS A 164 -1.455 -1.626 -12.823 1.00 0.00 C ATOM 420 NE2 HIS A 164 -2.419 -2.226 -12.148 1.00 0.00 N ATOM 0 H HIS A 164 2.268 -3.247 -8.374 1.00 0.00 H new ATOM 0 HA HIS A 164 1.726 -3.554 -11.199 1.00 0.00 H new ATOM 0 HB2 HIS A 164 0.090 -3.325 -9.188 1.00 0.00 H new ATOM 0 HB3 HIS A 164 0.476 -1.616 -9.230 1.00 0.00 H new ATOM 0 HD1 HIS A 164 0.551 -1.276 -12.371 1.00 0.00 H new ATOM 0 HD2 HIS A 164 -2.455 -3.190 -10.179 1.00 0.00 H new ATOM 0 HE1 HIS A 164 -1.552 -1.180 -13.802 1.00 0.00 H new ATOM 429 N LEU A 165 3.507 -1.108 -10.161 1.00 0.00 N ATOM 430 CA LEU A 165 4.278 0.069 -10.526 1.00 0.00 C ATOM 431 C LEU A 165 5.414 -0.351 -11.452 1.00 0.00 C ATOM 432 O LEU A 165 5.815 0.390 -12.351 1.00 0.00 O ATOM 433 CB LEU A 165 4.828 0.715 -9.244 1.00 0.00 C ATOM 434 CG LEU A 165 5.730 1.937 -9.420 1.00 0.00 C ATOM 435 CD1 LEU A 165 7.091 1.532 -9.955 1.00 0.00 C ATOM 436 CD2 LEU A 165 5.081 2.966 -10.332 1.00 0.00 C ATOM 0 H LEU A 165 3.812 -1.545 -9.291 1.00 0.00 H new ATOM 0 HA LEU A 165 3.653 0.795 -11.047 1.00 0.00 H new ATOM 0 HB2 LEU A 165 3.983 1.004 -8.620 1.00 0.00 H new ATOM 0 HB3 LEU A 165 5.386 -0.043 -8.694 1.00 0.00 H new ATOM 0 HG LEU A 165 5.870 2.393 -8.440 1.00 0.00 H new ATOM 0 HD11 LEU A 165 7.715 2.418 -10.072 1.00 0.00 H new ATOM 0 HD12 LEU A 165 7.566 0.843 -9.256 1.00 0.00 H new ATOM 0 HD13 LEU A 165 6.971 1.043 -10.922 1.00 0.00 H new ATOM 0 HD21 LEU A 165 5.743 3.825 -10.441 1.00 0.00 H new ATOM 0 HD22 LEU A 165 4.900 2.522 -11.311 1.00 0.00 H new ATOM 0 HD23 LEU A 165 4.134 3.290 -9.899 1.00 0.00 H new ATOM 448 N GLY A 166 5.911 -1.568 -11.222 1.00 0.00 N ATOM 449 CA GLY A 166 6.991 -2.107 -12.033 1.00 0.00 C ATOM 450 C GLY A 166 8.370 -1.802 -11.478 1.00 0.00 C ATOM 451 O GLY A 166 9.310 -1.590 -12.243 1.00 0.00 O ATOM 0 H GLY A 166 5.582 -2.191 -10.485 1.00 0.00 H new ATOM 0 HA2 GLY A 166 6.871 -3.187 -12.114 1.00 0.00 H new ATOM 0 HA3 GLY A 166 6.915 -1.701 -13.042 1.00 0.00 H new ATOM 455 N TYR A 167 8.498 -1.778 -10.151 1.00 0.00 N ATOM 456 CA TYR A 167 9.788 -1.497 -9.519 1.00 0.00 C ATOM 457 C TYR A 167 10.791 -2.630 -9.767 1.00 0.00 C ATOM 458 O TYR A 167 10.525 -3.562 -10.532 1.00 0.00 O ATOM 459 CB TYR A 167 9.616 -1.267 -8.013 1.00 0.00 C ATOM 460 CG TYR A 167 9.062 -2.463 -7.272 1.00 0.00 C ATOM 461 CD1 TYR A 167 9.874 -3.534 -6.925 1.00 0.00 C ATOM 462 CD2 TYR A 167 7.725 -2.518 -6.925 1.00 0.00 C ATOM 463 CE1 TYR A 167 9.364 -4.626 -6.252 1.00 0.00 C ATOM 464 CE2 TYR A 167 7.208 -3.603 -6.252 1.00 0.00 C ATOM 465 CZ TYR A 167 8.030 -4.657 -5.915 1.00 0.00 C ATOM 466 OH TYR A 167 7.519 -5.746 -5.241 1.00 0.00 O ATOM 0 H TYR A 167 7.733 -1.948 -9.498 1.00 0.00 H new ATOM 0 HA TYR A 167 10.183 -0.588 -9.972 1.00 0.00 H new ATOM 0 HB2 TYR A 167 10.582 -1.000 -7.583 1.00 0.00 H new ATOM 0 HB3 TYR A 167 8.952 -0.416 -7.858 1.00 0.00 H new ATOM 0 HD1 TYR A 167 10.922 -3.513 -7.186 1.00 0.00 H new ATOM 0 HD2 TYR A 167 7.075 -1.696 -7.186 1.00 0.00 H new ATOM 0 HE1 TYR A 167 10.009 -5.452 -5.991 1.00 0.00 H new ATOM 0 HE2 TYR A 167 6.161 -3.628 -5.989 1.00 0.00 H new ATOM 0 HH TYR A 167 6.581 -5.877 -5.494 1.00 0.00 H new ATOM 476 N GLN A 168 11.944 -2.542 -9.111 1.00 0.00 N ATOM 477 CA GLN A 168 12.993 -3.553 -9.248 1.00 0.00 C ATOM 478 C GLN A 168 13.444 -4.073 -7.882 1.00 0.00 C ATOM 479 O GLN A 168 13.358 -3.364 -6.876 1.00 0.00 O ATOM 480 CB GLN A 168 14.191 -2.978 -10.017 1.00 0.00 C ATOM 481 CG GLN A 168 14.811 -1.745 -9.366 1.00 0.00 C ATOM 482 CD GLN A 168 15.213 -0.682 -10.374 1.00 0.00 C ATOM 483 OE1 GLN A 168 14.739 -0.667 -11.508 1.00 0.00 O ATOM 484 NE2 GLN A 168 16.091 0.218 -9.964 1.00 0.00 N ATOM 0 H GLN A 168 12.178 -1.779 -8.476 1.00 0.00 H new ATOM 0 HA GLN A 168 12.579 -4.391 -9.809 1.00 0.00 H new ATOM 0 HB2 GLN A 168 14.955 -3.750 -10.110 1.00 0.00 H new ATOM 0 HB3 GLN A 168 13.872 -2.722 -11.027 1.00 0.00 H new ATOM 0 HG2 GLN A 168 14.100 -1.317 -8.659 1.00 0.00 H new ATOM 0 HG3 GLN A 168 15.688 -2.045 -8.793 1.00 0.00 H new ATOM 0 HE21 GLN A 168 16.462 0.173 -9.015 1.00 0.00 H new ATOM 0 HE22 GLN A 168 16.397 0.957 -10.597 1.00 0.00 H new ATOM 493 N ALA A 169 13.923 -5.319 -7.853 1.00 0.00 N ATOM 494 CA ALA A 169 14.388 -5.943 -6.612 1.00 0.00 C ATOM 495 C ALA A 169 15.393 -5.057 -5.875 1.00 0.00 C ATOM 496 O ALA A 169 15.315 -4.903 -4.658 1.00 0.00 O ATOM 497 CB ALA A 169 14.994 -7.309 -6.902 1.00 0.00 C ATOM 0 H ALA A 169 13.999 -5.916 -8.676 1.00 0.00 H new ATOM 0 HA ALA A 169 13.523 -6.070 -5.961 1.00 0.00 H new ATOM 0 HB1 ALA A 169 15.335 -7.761 -5.971 1.00 0.00 H new ATOM 0 HB2 ALA A 169 14.242 -7.950 -7.362 1.00 0.00 H new ATOM 0 HB3 ALA A 169 15.839 -7.195 -7.581 1.00 0.00 H new ATOM 503 N GLU A 170 16.308 -4.448 -6.626 1.00 0.00 N ATOM 504 CA GLU A 170 17.308 -3.554 -6.045 1.00 0.00 C ATOM 505 C GLU A 170 16.619 -2.514 -5.163 1.00 0.00 C ATOM 506 O GLU A 170 17.135 -2.128 -4.112 1.00 0.00 O ATOM 507 CB GLU A 170 18.125 -2.876 -7.156 1.00 0.00 C ATOM 508 CG GLU A 170 18.788 -1.567 -6.737 1.00 0.00 C ATOM 509 CD GLU A 170 18.143 -0.345 -7.365 1.00 0.00 C ATOM 510 OE1 GLU A 170 16.897 -0.313 -7.477 1.00 0.00 O ATOM 511 OE2 GLU A 170 18.884 0.581 -7.751 1.00 0.00 O ATOM 0 H GLU A 170 16.378 -4.557 -7.638 1.00 0.00 H new ATOM 0 HA GLU A 170 17.994 -4.134 -5.428 1.00 0.00 H new ATOM 0 HB2 GLU A 170 18.896 -3.567 -7.498 1.00 0.00 H new ATOM 0 HB3 GLU A 170 17.471 -2.683 -8.006 1.00 0.00 H new ATOM 0 HG2 GLU A 170 18.745 -1.476 -5.652 1.00 0.00 H new ATOM 0 HG3 GLU A 170 19.842 -1.596 -7.013 1.00 0.00 H new ATOM 518 N ALA A 171 15.430 -2.096 -5.588 1.00 0.00 N ATOM 519 CA ALA A 171 14.646 -1.133 -4.834 1.00 0.00 C ATOM 520 C ALA A 171 13.745 -1.848 -3.837 1.00 0.00 C ATOM 521 O ALA A 171 13.513 -1.349 -2.733 1.00 0.00 O ATOM 522 CB ALA A 171 13.838 -0.248 -5.773 1.00 0.00 C ATOM 0 H ALA A 171 14.991 -2.412 -6.453 1.00 0.00 H new ATOM 0 HA ALA A 171 15.325 -0.491 -4.274 1.00 0.00 H new ATOM 0 HB1 ALA A 171 13.257 0.467 -5.190 1.00 0.00 H new ATOM 0 HB2 ALA A 171 14.514 0.290 -6.437 1.00 0.00 H new ATOM 0 HB3 ALA A 171 13.163 -0.866 -6.365 1.00 0.00 H new ATOM 528 N VAL A 172 13.269 -3.039 -4.207 1.00 0.00 N ATOM 529 CA VAL A 172 12.429 -3.825 -3.307 1.00 0.00 C ATOM 530 C VAL A 172 13.227 -4.232 -2.072 1.00 0.00 C ATOM 531 O VAL A 172 12.664 -4.446 -0.997 1.00 0.00 O ATOM 532 CB VAL A 172 11.843 -5.082 -3.995 1.00 0.00 C ATOM 533 CG1 VAL A 172 12.712 -6.314 -3.762 1.00 0.00 C ATOM 534 CG2 VAL A 172 10.434 -5.335 -3.497 1.00 0.00 C ATOM 0 H VAL A 172 13.449 -3.474 -5.112 1.00 0.00 H new ATOM 0 HA VAL A 172 11.590 -3.194 -3.014 1.00 0.00 H new ATOM 0 HB VAL A 172 11.822 -4.893 -5.068 1.00 0.00 H new ATOM 0 HG11 VAL A 172 12.266 -7.174 -4.261 1.00 0.00 H new ATOM 0 HG12 VAL A 172 13.709 -6.138 -4.165 1.00 0.00 H new ATOM 0 HG13 VAL A 172 12.783 -6.512 -2.693 1.00 0.00 H new ATOM 0 HG21 VAL A 172 10.029 -6.221 -3.986 1.00 0.00 H new ATOM 0 HG22 VAL A 172 10.452 -5.492 -2.418 1.00 0.00 H new ATOM 0 HG23 VAL A 172 9.806 -4.474 -3.728 1.00 0.00 H new ATOM 544 N GLU A 173 14.550 -4.309 -2.237 1.00 0.00 N ATOM 545 CA GLU A 173 15.444 -4.665 -1.146 1.00 0.00 C ATOM 546 C GLU A 173 15.474 -3.545 -0.112 1.00 0.00 C ATOM 547 O GLU A 173 15.438 -3.793 1.094 1.00 0.00 O ATOM 548 CB GLU A 173 16.854 -4.939 -1.680 1.00 0.00 C ATOM 549 CG GLU A 173 17.159 -6.421 -1.867 1.00 0.00 C ATOM 550 CD GLU A 173 16.992 -6.885 -3.301 1.00 0.00 C ATOM 551 OE1 GLU A 173 17.793 -6.459 -4.158 1.00 0.00 O ATOM 552 OE2 GLU A 173 16.062 -7.677 -3.563 1.00 0.00 O ATOM 0 H GLU A 173 15.022 -4.127 -3.123 1.00 0.00 H new ATOM 0 HA GLU A 173 15.075 -5.573 -0.669 1.00 0.00 H new ATOM 0 HB2 GLU A 173 16.977 -4.428 -2.635 1.00 0.00 H new ATOM 0 HB3 GLU A 173 17.583 -4.511 -0.993 1.00 0.00 H new ATOM 0 HG2 GLU A 173 18.181 -6.619 -1.544 1.00 0.00 H new ATOM 0 HG3 GLU A 173 16.502 -7.005 -1.223 1.00 0.00 H new ATOM 559 N THR A 174 15.518 -2.309 -0.599 1.00 0.00 N ATOM 560 CA THR A 174 15.529 -1.138 0.271 1.00 0.00 C ATOM 561 C THR A 174 14.114 -0.808 0.731 1.00 0.00 C ATOM 562 O THR A 174 13.882 -0.569 1.913 1.00 0.00 O ATOM 563 CB THR A 174 16.142 0.068 -0.450 1.00 0.00 C ATOM 564 OG1 THR A 174 17.381 -0.272 -1.045 1.00 0.00 O ATOM 565 CG2 THR A 174 16.388 1.251 0.459 1.00 0.00 C ATOM 0 H THR A 174 15.547 -2.092 -1.595 1.00 0.00 H new ATOM 0 HA THR A 174 16.141 -1.367 1.144 1.00 0.00 H new ATOM 0 HB THR A 174 15.405 0.350 -1.202 1.00 0.00 H new ATOM 0 HG1 THR A 174 17.752 0.513 -1.500 1.00 0.00 H new ATOM 0 HG21 THR A 174 16.823 2.068 -0.117 1.00 0.00 H new ATOM 0 HG22 THR A 174 15.444 1.577 0.896 1.00 0.00 H new ATOM 0 HG23 THR A 174 17.075 0.962 1.254 1.00 0.00 H new ATOM 573 N MET A 175 13.167 -0.817 -0.209 1.00 0.00 N ATOM 574 CA MET A 175 11.766 -0.531 0.094 1.00 0.00 C ATOM 575 C MET A 175 11.292 -1.314 1.319 1.00 0.00 C ATOM 576 O MET A 175 10.581 -0.783 2.167 1.00 0.00 O ATOM 577 CB MET A 175 10.892 -0.867 -1.113 1.00 0.00 C ATOM 578 CG MET A 175 10.807 0.253 -2.139 1.00 0.00 C ATOM 579 SD MET A 175 9.143 0.464 -2.800 1.00 0.00 S ATOM 580 CE MET A 175 9.267 -0.449 -4.336 1.00 0.00 C ATOM 0 H MET A 175 13.348 -1.021 -1.192 1.00 0.00 H new ATOM 0 HA MET A 175 11.678 0.532 0.319 1.00 0.00 H new ATOM 0 HB2 MET A 175 11.285 -1.761 -1.597 1.00 0.00 H new ATOM 0 HB3 MET A 175 9.887 -1.107 -0.767 1.00 0.00 H new ATOM 0 HG2 MET A 175 11.133 1.187 -1.680 1.00 0.00 H new ATOM 0 HG3 MET A 175 11.495 0.043 -2.958 1.00 0.00 H new ATOM 0 HE1 MET A 175 8.312 -0.410 -4.860 1.00 0.00 H new ATOM 0 HE2 MET A 175 10.043 -0.006 -4.961 1.00 0.00 H new ATOM 0 HE3 MET A 175 9.522 -1.487 -4.123 1.00 0.00 H new ATOM 590 N ALA A 176 11.699 -2.579 1.406 1.00 0.00 N ATOM 591 CA ALA A 176 11.321 -3.435 2.527 1.00 0.00 C ATOM 592 C ALA A 176 11.850 -2.911 3.871 1.00 0.00 C ATOM 593 O ALA A 176 11.362 -3.323 4.924 1.00 0.00 O ATOM 594 CB ALA A 176 11.812 -4.857 2.284 1.00 0.00 C ATOM 0 H ALA A 176 12.292 -3.034 0.712 1.00 0.00 H new ATOM 0 HA ALA A 176 10.233 -3.428 2.589 1.00 0.00 H new ATOM 0 HB1 ALA A 176 11.526 -5.489 3.125 1.00 0.00 H new ATOM 0 HB2 ALA A 176 11.364 -5.245 1.369 1.00 0.00 H new ATOM 0 HB3 ALA A 176 12.897 -4.855 2.184 1.00 0.00 H new ATOM 600 N CYS A 177 12.847 -2.014 3.842 1.00 0.00 N ATOM 601 CA CYS A 177 13.414 -1.476 5.084 1.00 0.00 C ATOM 602 C CYS A 177 13.955 -0.045 4.917 1.00 0.00 C ATOM 603 O CYS A 177 14.980 0.310 5.508 1.00 0.00 O ATOM 604 CB CYS A 177 14.524 -2.405 5.589 1.00 0.00 C ATOM 605 SG CYS A 177 13.943 -3.721 6.684 1.00 0.00 S ATOM 0 H CYS A 177 13.270 -1.652 2.987 1.00 0.00 H new ATOM 0 HA CYS A 177 12.608 -1.426 5.816 1.00 0.00 H new ATOM 0 HB2 CYS A 177 15.025 -2.855 4.732 1.00 0.00 H new ATOM 0 HB3 CYS A 177 15.269 -1.810 6.117 1.00 0.00 H new ATOM 0 HG CYS A 177 12.725 -4.044 6.366 1.00 0.00 H new ATOM 611 N ASP A 178 13.263 0.780 4.127 1.00 0.00 N ATOM 612 CA ASP A 178 13.685 2.164 3.908 1.00 0.00 C ATOM 613 C ASP A 178 12.750 3.152 4.623 1.00 0.00 C ATOM 614 O ASP A 178 12.294 4.136 4.039 1.00 0.00 O ATOM 615 CB ASP A 178 13.768 2.464 2.402 1.00 0.00 C ATOM 616 CG ASP A 178 12.414 2.678 1.747 1.00 0.00 C ATOM 617 OD1 ASP A 178 11.476 1.913 2.049 1.00 0.00 O ATOM 618 OD2 ASP A 178 12.300 3.611 0.926 1.00 0.00 O ATOM 0 H ASP A 178 12.412 0.515 3.631 1.00 0.00 H new ATOM 0 HA ASP A 178 14.679 2.291 4.338 1.00 0.00 H new ATOM 0 HB2 ASP A 178 14.380 3.353 2.251 1.00 0.00 H new ATOM 0 HB3 ASP A 178 14.277 1.639 1.904 1.00 0.00 H new ATOM 623 N GLN A 179 12.475 2.875 5.898 1.00 0.00 N ATOM 624 CA GLN A 179 11.596 3.724 6.708 1.00 0.00 C ATOM 625 C GLN A 179 10.134 3.586 6.258 1.00 0.00 C ATOM 626 O GLN A 179 9.419 4.579 6.112 1.00 0.00 O ATOM 627 CB GLN A 179 12.049 5.190 6.641 1.00 0.00 C ATOM 628 CG GLN A 179 12.358 5.796 8.005 1.00 0.00 C ATOM 629 CD GLN A 179 13.806 6.228 8.149 1.00 0.00 C ATOM 630 OE1 GLN A 179 14.726 5.475 7.834 1.00 0.00 O ATOM 631 NE2 GLN A 179 14.019 7.444 8.629 1.00 0.00 N ATOM 0 H GLN A 179 12.849 2.067 6.395 1.00 0.00 H new ATOM 0 HA GLN A 179 11.663 3.391 7.744 1.00 0.00 H new ATOM 0 HB2 GLN A 179 12.937 5.259 6.013 1.00 0.00 H new ATOM 0 HB3 GLN A 179 11.270 5.781 6.158 1.00 0.00 H new ATOM 0 HG2 GLN A 179 11.710 6.657 8.169 1.00 0.00 H new ATOM 0 HG3 GLN A 179 12.123 5.068 8.781 1.00 0.00 H new ATOM 0 HE21 GLN A 179 13.229 8.039 8.879 1.00 0.00 H new ATOM 0 HE22 GLN A 179 14.973 7.785 8.749 1.00 0.00 H new ATOM 640 N MET A 180 9.709 2.334 6.047 1.00 0.00 N ATOM 641 CA MET A 180 8.340 2.010 5.618 1.00 0.00 C ATOM 642 C MET A 180 8.128 2.299 4.126 1.00 0.00 C ATOM 643 O MET A 180 8.162 3.455 3.695 1.00 0.00 O ATOM 644 CB MET A 180 7.302 2.763 6.461 1.00 0.00 C ATOM 645 CG MET A 180 7.184 2.246 7.887 1.00 0.00 C ATOM 646 SD MET A 180 5.885 1.009 8.073 1.00 0.00 S ATOM 647 CE MET A 180 6.663 -0.419 7.321 1.00 0.00 C ATOM 0 H MET A 180 10.305 1.515 6.169 1.00 0.00 H new ATOM 0 HA MET A 180 8.202 0.940 5.774 1.00 0.00 H new ATOM 0 HB2 MET A 180 7.566 3.820 6.487 1.00 0.00 H new ATOM 0 HB3 MET A 180 6.329 2.689 5.975 1.00 0.00 H new ATOM 0 HG2 MET A 180 8.137 1.815 8.193 1.00 0.00 H new ATOM 0 HG3 MET A 180 6.983 3.082 8.557 1.00 0.00 H new ATOM 0 HE1 MET A 180 6.456 -1.305 7.921 1.00 0.00 H new ATOM 0 HE2 MET A 180 6.267 -0.561 6.315 1.00 0.00 H new ATOM 0 HE3 MET A 180 7.740 -0.261 7.268 1.00 0.00 H new ATOM 657 N PRO A 181 7.880 1.241 3.324 1.00 0.00 N ATOM 658 CA PRO A 181 7.643 1.373 1.881 1.00 0.00 C ATOM 659 C PRO A 181 6.577 2.422 1.577 1.00 0.00 C ATOM 660 O PRO A 181 6.714 3.209 0.648 1.00 0.00 O ATOM 661 CB PRO A 181 7.160 -0.023 1.461 1.00 0.00 C ATOM 662 CG PRO A 181 7.685 -0.950 2.499 1.00 0.00 C ATOM 663 CD PRO A 181 7.788 -0.158 3.773 1.00 0.00 C ATOM 0 HA PRO A 181 8.535 1.699 1.347 1.00 0.00 H new ATOM 0 HB2 PRO A 181 6.072 -0.064 1.411 1.00 0.00 H new ATOM 0 HB3 PRO A 181 7.534 -0.287 0.472 1.00 0.00 H new ATOM 0 HG2 PRO A 181 7.020 -1.804 2.627 1.00 0.00 H new ATOM 0 HG3 PRO A 181 8.659 -1.345 2.209 1.00 0.00 H new ATOM 0 HD2 PRO A 181 6.918 -0.315 4.411 1.00 0.00 H new ATOM 0 HD3 PRO A 181 8.664 -0.448 4.352 1.00 0.00 H new ATOM 671 N ALA A 182 5.521 2.424 2.385 1.00 0.00 N ATOM 672 CA ALA A 182 4.413 3.374 2.231 1.00 0.00 C ATOM 673 C ALA A 182 4.893 4.821 2.326 1.00 0.00 C ATOM 674 O ALA A 182 4.425 5.686 1.583 1.00 0.00 O ATOM 675 CB ALA A 182 3.336 3.104 3.270 1.00 0.00 C ATOM 0 H ALA A 182 5.405 1.773 3.162 1.00 0.00 H new ATOM 0 HA ALA A 182 3.991 3.231 1.236 1.00 0.00 H new ATOM 0 HB1 ALA A 182 2.521 3.817 3.143 1.00 0.00 H new ATOM 0 HB2 ALA A 182 2.955 2.091 3.144 1.00 0.00 H new ATOM 0 HB3 ALA A 182 3.759 3.211 4.269 1.00 0.00 H new ATOM 681 N TYR A 183 5.840 5.077 3.229 1.00 0.00 N ATOM 682 CA TYR A 183 6.390 6.413 3.403 1.00 0.00 C ATOM 683 C TYR A 183 7.105 6.842 2.131 1.00 0.00 C ATOM 684 O TYR A 183 6.885 7.942 1.620 1.00 0.00 O ATOM 685 CB TYR A 183 7.341 6.439 4.602 1.00 0.00 C ATOM 686 CG TYR A 183 6.841 7.288 5.750 1.00 0.00 C ATOM 687 CD1 TYR A 183 5.591 7.061 6.307 1.00 0.00 C ATOM 688 CD2 TYR A 183 7.616 8.316 6.274 1.00 0.00 C ATOM 689 CE1 TYR A 183 5.125 7.833 7.352 1.00 0.00 C ATOM 690 CE2 TYR A 183 7.155 9.092 7.322 1.00 0.00 C ATOM 691 CZ TYR A 183 5.909 8.846 7.857 1.00 0.00 C ATOM 692 OH TYR A 183 5.445 9.615 8.900 1.00 0.00 O ATOM 0 H TYR A 183 6.240 4.373 3.850 1.00 0.00 H new ATOM 0 HA TYR A 183 5.580 7.116 3.599 1.00 0.00 H new ATOM 0 HB2 TYR A 183 7.496 5.419 4.955 1.00 0.00 H new ATOM 0 HB3 TYR A 183 8.311 6.815 4.278 1.00 0.00 H new ATOM 0 HD1 TYR A 183 4.972 6.267 5.916 1.00 0.00 H new ATOM 0 HD2 TYR A 183 8.593 8.512 5.857 1.00 0.00 H new ATOM 0 HE1 TYR A 183 4.148 7.643 7.772 1.00 0.00 H new ATOM 0 HE2 TYR A 183 7.769 9.887 7.719 1.00 0.00 H new ATOM 0 HH TYR A 183 5.266 9.042 9.674 1.00 0.00 H new ATOM 702 N THR A 184 7.926 5.942 1.603 1.00 0.00 N ATOM 703 CA THR A 184 8.645 6.199 0.358 1.00 0.00 C ATOM 704 C THR A 184 7.669 6.146 -0.816 1.00 0.00 C ATOM 705 O THR A 184 7.747 6.955 -1.741 1.00 0.00 O ATOM 706 CB THR A 184 9.776 5.179 0.167 1.00 0.00 C ATOM 707 OG1 THR A 184 11.012 5.733 0.564 1.00 0.00 O ATOM 708 CG2 THR A 184 9.945 4.696 -1.258 1.00 0.00 C ATOM 0 H THR A 184 8.111 5.028 2.016 1.00 0.00 H new ATOM 0 HA THR A 184 9.092 7.192 0.404 1.00 0.00 H new ATOM 0 HB THR A 184 9.487 4.328 0.784 1.00 0.00 H new ATOM 0 HG1 THR A 184 11.727 5.079 0.414 1.00 0.00 H new ATOM 0 HG21 THR A 184 10.764 3.979 -1.304 1.00 0.00 H new ATOM 0 HG22 THR A 184 9.024 4.217 -1.591 1.00 0.00 H new ATOM 0 HG23 THR A 184 10.168 5.544 -1.906 1.00 0.00 H new ATOM 716 N LEU A 185 6.742 5.188 -0.760 1.00 0.00 N ATOM 717 CA LEU A 185 5.732 5.009 -1.803 1.00 0.00 C ATOM 718 C LEU A 185 4.976 6.306 -2.083 1.00 0.00 C ATOM 719 O LEU A 185 4.710 6.631 -3.240 1.00 0.00 O ATOM 720 CB LEU A 185 4.748 3.907 -1.406 1.00 0.00 C ATOM 721 CG LEU A 185 3.910 3.346 -2.553 1.00 0.00 C ATOM 722 CD1 LEU A 185 3.690 1.856 -2.369 1.00 0.00 C ATOM 723 CD2 LEU A 185 2.578 4.071 -2.643 1.00 0.00 C ATOM 0 H LEU A 185 6.671 4.518 0.006 1.00 0.00 H new ATOM 0 HA LEU A 185 6.250 4.718 -2.717 1.00 0.00 H new ATOM 0 HB2 LEU A 185 5.306 3.089 -0.950 1.00 0.00 H new ATOM 0 HB3 LEU A 185 4.076 4.299 -0.643 1.00 0.00 H new ATOM 0 HG LEU A 185 4.452 3.504 -3.485 1.00 0.00 H new ATOM 0 HD11 LEU A 185 3.091 1.472 -3.195 1.00 0.00 H new ATOM 0 HD12 LEU A 185 4.653 1.346 -2.351 1.00 0.00 H new ATOM 0 HD13 LEU A 185 3.168 1.679 -1.429 1.00 0.00 H new ATOM 0 HD21 LEU A 185 1.994 3.658 -3.466 1.00 0.00 H new ATOM 0 HD22 LEU A 185 2.030 3.943 -1.709 1.00 0.00 H new ATOM 0 HD23 LEU A 185 2.753 5.132 -2.819 1.00 0.00 H new ATOM 735 N LEU A 186 4.640 7.051 -1.033 1.00 0.00 N ATOM 736 CA LEU A 186 3.923 8.316 -1.192 1.00 0.00 C ATOM 737 C LEU A 186 4.652 9.227 -2.175 1.00 0.00 C ATOM 738 O LEU A 186 4.027 9.922 -2.976 1.00 0.00 O ATOM 739 CB LEU A 186 3.771 9.018 0.161 1.00 0.00 C ATOM 740 CG LEU A 186 2.373 9.565 0.459 1.00 0.00 C ATOM 741 CD1 LEU A 186 2.366 10.315 1.779 1.00 0.00 C ATOM 742 CD2 LEU A 186 1.902 10.472 -0.666 1.00 0.00 C ATOM 0 H LEU A 186 4.851 6.803 -0.066 1.00 0.00 H new ATOM 0 HA LEU A 186 2.931 8.098 -1.589 1.00 0.00 H new ATOM 0 HB2 LEU A 186 4.044 8.316 0.949 1.00 0.00 H new ATOM 0 HB3 LEU A 186 4.483 9.842 0.207 1.00 0.00 H new ATOM 0 HG LEU A 186 1.685 8.723 0.534 1.00 0.00 H new ATOM 0 HD11 LEU A 186 1.364 10.697 1.975 1.00 0.00 H new ATOM 0 HD12 LEU A 186 2.661 9.640 2.583 1.00 0.00 H new ATOM 0 HD13 LEU A 186 3.068 11.147 1.728 1.00 0.00 H new ATOM 0 HD21 LEU A 186 0.906 10.851 -0.435 1.00 0.00 H new ATOM 0 HD22 LEU A 186 2.593 11.308 -0.772 1.00 0.00 H new ATOM 0 HD23 LEU A 186 1.869 9.908 -1.598 1.00 0.00 H new ATOM 754 N ARG A 187 5.977 9.207 -2.114 1.00 0.00 N ATOM 755 CA ARG A 187 6.798 10.018 -3.004 1.00 0.00 C ATOM 756 C ARG A 187 7.263 9.217 -4.225 1.00 0.00 C ATOM 757 O ARG A 187 7.529 9.783 -5.282 1.00 0.00 O ATOM 758 CB ARG A 187 8.006 10.571 -2.244 1.00 0.00 C ATOM 759 CG ARG A 187 8.489 11.920 -2.754 1.00 0.00 C ATOM 760 CD ARG A 187 8.841 12.857 -1.607 1.00 0.00 C ATOM 761 NE ARG A 187 8.210 14.169 -1.762 1.00 0.00 N ATOM 762 CZ ARG A 187 6.903 14.390 -1.664 1.00 0.00 C ATOM 763 NH1 ARG A 187 6.077 13.402 -1.399 1.00 0.00 N ATOM 764 NH2 ARG A 187 6.424 15.607 -1.834 1.00 0.00 N ATOM 0 H ARG A 187 6.508 8.636 -1.456 1.00 0.00 H new ATOM 0 HA ARG A 187 6.187 10.847 -3.362 1.00 0.00 H new ATOM 0 HB2 ARG A 187 7.748 10.663 -1.189 1.00 0.00 H new ATOM 0 HB3 ARG A 187 8.824 9.854 -2.311 1.00 0.00 H new ATOM 0 HG2 ARG A 187 9.363 11.778 -3.390 1.00 0.00 H new ATOM 0 HG3 ARG A 187 7.715 12.375 -3.372 1.00 0.00 H new ATOM 0 HD2 ARG A 187 8.525 12.411 -0.664 1.00 0.00 H new ATOM 0 HD3 ARG A 187 9.923 12.978 -1.556 1.00 0.00 H new ATOM 0 HE ARG A 187 8.814 14.967 -1.958 1.00 0.00 H new ATOM 0 HH11 ARG A 187 6.438 12.457 -1.267 1.00 0.00 H new ATOM 0 HH12 ARG A 187 5.075 13.580 -1.326 1.00 0.00 H new ATOM 0 HH21 ARG A 187 7.057 16.380 -2.041 1.00 0.00 H new ATOM 0 HH22 ARG A 187 5.421 15.775 -1.759 1.00 0.00 H new ATOM 778 N ASN A 188 7.363 7.899 -4.073 1.00 0.00 N ATOM 779 CA ASN A 188 7.803 7.030 -5.160 1.00 0.00 C ATOM 780 C ASN A 188 6.658 6.713 -6.124 1.00 0.00 C ATOM 781 O ASN A 188 6.818 6.801 -7.343 1.00 0.00 O ATOM 782 CB ASN A 188 8.382 5.732 -4.584 1.00 0.00 C ATOM 783 CG ASN A 188 9.898 5.715 -4.572 1.00 0.00 C ATOM 784 OD1 ASN A 188 10.519 4.771 -5.046 1.00 0.00 O ATOM 785 ND2 ASN A 188 10.502 6.759 -4.020 1.00 0.00 N ATOM 0 H ASN A 188 7.145 7.409 -3.206 1.00 0.00 H new ATOM 0 HA ASN A 188 8.574 7.556 -5.723 1.00 0.00 H new ATOM 0 HB2 ASN A 188 8.014 5.596 -3.567 1.00 0.00 H new ATOM 0 HB3 ASN A 188 8.019 4.887 -5.169 1.00 0.00 H new ATOM 0 HD21 ASN A 188 11.521 6.796 -3.979 1.00 0.00 H new ATOM 0 HD22 ASN A 188 9.948 7.525 -3.637 1.00 0.00 H new ATOM 792 N TRP A 189 5.508 6.342 -5.575 1.00 0.00 N ATOM 793 CA TRP A 189 4.346 6.006 -6.383 1.00 0.00 C ATOM 794 C TRP A 189 3.656 7.256 -6.929 1.00 0.00 C ATOM 795 O TRP A 189 3.259 7.290 -8.095 1.00 0.00 O ATOM 796 CB TRP A 189 3.365 5.170 -5.556 1.00 0.00 C ATOM 797 CG TRP A 189 2.658 4.099 -6.334 1.00 0.00 C ATOM 798 CD1 TRP A 189 3.132 3.409 -7.415 1.00 0.00 C ATOM 799 CD2 TRP A 189 1.344 3.593 -6.081 1.00 0.00 C ATOM 800 NE1 TRP A 189 2.186 2.510 -7.851 1.00 0.00 N ATOM 801 CE2 TRP A 189 1.082 2.604 -7.046 1.00 0.00 C ATOM 802 CE3 TRP A 189 0.363 3.882 -5.129 1.00 0.00 C ATOM 803 CZ2 TRP A 189 -0.120 1.905 -7.087 1.00 0.00 C ATOM 804 CZ3 TRP A 189 -0.828 3.188 -5.169 1.00 0.00 C ATOM 805 CH2 TRP A 189 -1.062 2.208 -6.143 1.00 0.00 C ATOM 0 H TRP A 189 5.357 6.267 -4.569 1.00 0.00 H new ATOM 0 HA TRP A 189 4.686 5.423 -7.239 1.00 0.00 H new ATOM 0 HB2 TRP A 189 3.906 4.706 -4.731 1.00 0.00 H new ATOM 0 HB3 TRP A 189 2.621 5.834 -5.116 1.00 0.00 H new ATOM 0 HD1 TRP A 189 4.106 3.549 -7.861 1.00 0.00 H new ATOM 0 HE1 TRP A 189 2.290 1.877 -8.644 1.00 0.00 H new ATOM 0 HE3 TRP A 189 0.534 4.636 -4.375 1.00 0.00 H new ATOM 0 HZ2 TRP A 189 -0.303 1.150 -7.837 1.00 0.00 H new ATOM 0 HZ3 TRP A 189 -1.593 3.403 -4.438 1.00 0.00 H new ATOM 0 HH2 TRP A 189 -2.005 1.682 -6.148 1.00 0.00 H new ATOM 816 N ALA A 190 3.514 8.280 -6.088 1.00 0.00 N ATOM 817 CA ALA A 190 2.858 9.519 -6.509 1.00 0.00 C ATOM 818 C ALA A 190 3.839 10.526 -7.116 1.00 0.00 C ATOM 819 O ALA A 190 3.472 11.272 -8.024 1.00 0.00 O ATOM 820 CB ALA A 190 2.117 10.140 -5.336 1.00 0.00 C ATOM 0 H ALA A 190 3.840 8.278 -5.122 1.00 0.00 H new ATOM 0 HA ALA A 190 2.147 9.259 -7.293 1.00 0.00 H new ATOM 0 HB1 ALA A 190 1.632 11.061 -5.659 1.00 0.00 H new ATOM 0 HB2 ALA A 190 1.364 9.442 -4.971 1.00 0.00 H new ATOM 0 HB3 ALA A 190 2.823 10.363 -4.536 1.00 0.00 H new ATOM 826 N ALA A 191 5.071 10.557 -6.586 1.00 0.00 N ATOM 827 CA ALA A 191 6.125 11.486 -7.034 1.00 0.00 C ATOM 828 C ALA A 191 6.168 12.720 -6.135 1.00 0.00 C ATOM 829 O ALA A 191 7.214 13.343 -5.955 1.00 0.00 O ATOM 830 CB ALA A 191 5.948 11.886 -8.496 1.00 0.00 C ATOM 0 H ALA A 191 5.367 9.937 -5.832 1.00 0.00 H new ATOM 0 HA ALA A 191 7.078 10.963 -6.956 1.00 0.00 H new ATOM 0 HB1 ALA A 191 6.745 12.571 -8.785 1.00 0.00 H new ATOM 0 HB2 ALA A 191 5.988 10.996 -9.124 1.00 0.00 H new ATOM 0 HB3 ALA A 191 4.984 12.377 -8.625 1.00 0.00 H new ATOM 836 N GLN A 192 5.015 13.048 -5.567 1.00 0.00 N ATOM 837 CA GLN A 192 4.874 14.190 -4.668 1.00 0.00 C ATOM 838 C GLN A 192 3.835 13.906 -3.571 1.00 0.00 C ATOM 839 O GLN A 192 4.017 14.313 -2.420 1.00 0.00 O ATOM 840 CB GLN A 192 4.497 15.459 -5.450 1.00 0.00 C ATOM 841 CG GLN A 192 3.871 15.198 -6.816 1.00 0.00 C ATOM 842 CD GLN A 192 2.443 14.701 -6.723 1.00 0.00 C ATOM 843 OE1 GLN A 192 2.202 13.514 -6.506 1.00 0.00 O ATOM 844 NE2 GLN A 192 1.487 15.601 -6.878 1.00 0.00 N ATOM 0 H GLN A 192 4.149 12.530 -5.716 1.00 0.00 H new ATOM 0 HA GLN A 192 5.838 14.355 -4.188 1.00 0.00 H new ATOM 0 HB2 GLN A 192 3.800 16.046 -4.851 1.00 0.00 H new ATOM 0 HB3 GLN A 192 5.392 16.067 -5.585 1.00 0.00 H new ATOM 0 HG2 GLN A 192 3.894 16.117 -7.402 1.00 0.00 H new ATOM 0 HG3 GLN A 192 4.472 14.463 -7.352 1.00 0.00 H new ATOM 0 HE21 GLN A 192 1.728 16.576 -7.057 1.00 0.00 H new ATOM 0 HE22 GLN A 192 0.508 15.321 -6.819 1.00 0.00 H new ATOM 853 N GLU A 193 2.755 13.200 -3.935 1.00 0.00 N ATOM 854 CA GLU A 193 1.682 12.851 -2.992 1.00 0.00 C ATOM 855 C GLU A 193 0.463 12.290 -3.726 1.00 0.00 C ATOM 856 O GLU A 193 -0.122 11.288 -3.308 1.00 0.00 O ATOM 857 CB GLU A 193 1.259 14.076 -2.175 1.00 0.00 C ATOM 858 CG GLU A 193 0.947 15.299 -3.030 1.00 0.00 C ATOM 859 CD GLU A 193 1.739 16.523 -2.615 1.00 0.00 C ATOM 860 OE1 GLU A 193 1.606 16.953 -1.450 1.00 0.00 O ATOM 861 OE2 GLU A 193 2.494 17.050 -3.456 1.00 0.00 O ATOM 0 H GLU A 193 2.601 12.857 -4.883 1.00 0.00 H new ATOM 0 HA GLU A 193 2.074 12.086 -2.321 1.00 0.00 H new ATOM 0 HB2 GLU A 193 0.379 13.822 -1.583 1.00 0.00 H new ATOM 0 HB3 GLU A 193 2.054 14.327 -1.473 1.00 0.00 H new ATOM 0 HG2 GLU A 193 1.160 15.071 -4.074 1.00 0.00 H new ATOM 0 HG3 GLU A 193 -0.118 15.521 -2.963 1.00 0.00 H new ATOM 868 N GLY A 194 0.095 12.951 -4.824 1.00 0.00 N ATOM 869 CA GLY A 194 -1.044 12.540 -5.627 1.00 0.00 C ATOM 870 C GLY A 194 -1.010 13.172 -7.004 1.00 0.00 C ATOM 871 O GLY A 194 -0.941 14.398 -7.126 1.00 0.00 O ATOM 0 H GLY A 194 0.577 13.779 -5.175 1.00 0.00 H new ATOM 0 HA2 GLY A 194 -1.049 11.454 -5.724 1.00 0.00 H new ATOM 0 HA3 GLY A 194 -1.968 12.819 -5.120 1.00 0.00 H new ATOM 875 N ASN A 195 -1.049 12.337 -8.040 1.00 0.00 N ATOM 876 CA ASN A 195 -1.011 12.819 -9.424 1.00 0.00 C ATOM 877 C ASN A 195 -0.962 11.660 -10.421 1.00 0.00 C ATOM 878 O ASN A 195 -1.703 11.651 -11.402 1.00 0.00 O ATOM 879 CB ASN A 195 0.203 13.733 -9.642 1.00 0.00 C ATOM 880 CG ASN A 195 -0.190 15.107 -10.140 1.00 0.00 C ATOM 881 OD1 ASN A 195 0.046 15.450 -11.295 1.00 0.00 O ATOM 882 ND2 ASN A 195 -0.793 15.904 -9.271 1.00 0.00 N ATOM 0 H ASN A 195 -1.107 11.323 -7.950 1.00 0.00 H new ATOM 0 HA ASN A 195 -1.927 13.384 -9.597 1.00 0.00 H new ATOM 0 HB2 ASN A 195 0.752 13.832 -8.706 1.00 0.00 H new ATOM 0 HB3 ASN A 195 0.879 13.269 -10.360 1.00 0.00 H new ATOM 0 HD21 ASN A 195 -1.080 16.841 -9.553 1.00 0.00 H new ATOM 0 HD22 ASN A 195 -0.971 15.580 -8.320 1.00 0.00 H new ATOM 889 N ARG A 196 -0.077 10.695 -10.170 1.00 0.00 N ATOM 890 CA ARG A 196 0.064 9.542 -11.072 1.00 0.00 C ATOM 891 C ARG A 196 -0.564 8.267 -10.492 1.00 0.00 C ATOM 892 O ARG A 196 -1.516 7.731 -11.059 1.00 0.00 O ATOM 893 CB ARG A 196 1.540 9.308 -11.447 1.00 0.00 C ATOM 894 CG ARG A 196 2.500 9.230 -10.266 1.00 0.00 C ATOM 895 CD ARG A 196 3.929 9.531 -10.692 1.00 0.00 C ATOM 896 NE ARG A 196 4.913 8.765 -9.916 1.00 0.00 N ATOM 897 CZ ARG A 196 6.216 8.740 -10.182 1.00 0.00 C ATOM 898 NH1 ARG A 196 6.697 9.405 -11.216 1.00 0.00 N ATOM 899 NH2 ARG A 196 7.041 8.049 -9.418 1.00 0.00 N ATOM 0 H ARG A 196 0.547 10.684 -9.363 1.00 0.00 H new ATOM 0 HA ARG A 196 -0.487 9.783 -11.981 1.00 0.00 H new ATOM 0 HB2 ARG A 196 1.612 8.381 -12.016 1.00 0.00 H new ATOM 0 HB3 ARG A 196 1.864 10.113 -12.106 1.00 0.00 H new ATOM 0 HG2 ARG A 196 2.191 9.938 -9.497 1.00 0.00 H new ATOM 0 HG3 ARG A 196 2.453 8.236 -9.822 1.00 0.00 H new ATOM 0 HD2 ARG A 196 4.046 9.302 -11.751 1.00 0.00 H new ATOM 0 HD3 ARG A 196 4.125 10.597 -10.573 1.00 0.00 H new ATOM 0 HE ARG A 196 4.576 8.218 -9.124 1.00 0.00 H new ATOM 0 HH11 ARG A 196 6.069 9.941 -11.815 1.00 0.00 H new ATOM 0 HH12 ARG A 196 7.697 9.383 -11.416 1.00 0.00 H new ATOM 0 HH21 ARG A 196 6.681 7.530 -8.618 1.00 0.00 H new ATOM 0 HH22 ARG A 196 8.039 8.034 -9.628 1.00 0.00 H new ATOM 913 N ALA A 197 -0.040 7.788 -9.365 1.00 0.00 N ATOM 914 CA ALA A 197 -0.563 6.581 -8.724 1.00 0.00 C ATOM 915 C ALA A 197 -1.559 6.938 -7.614 1.00 0.00 C ATOM 916 O ALA A 197 -1.416 6.507 -6.469 1.00 0.00 O ATOM 917 CB ALA A 197 0.591 5.751 -8.176 1.00 0.00 C ATOM 0 H ALA A 197 0.746 8.217 -8.876 1.00 0.00 H new ATOM 0 HA ALA A 197 -1.099 5.991 -9.467 1.00 0.00 H new ATOM 0 HB1 ALA A 197 0.199 4.853 -7.699 1.00 0.00 H new ATOM 0 HB2 ALA A 197 1.255 5.468 -8.992 1.00 0.00 H new ATOM 0 HB3 ALA A 197 1.146 6.338 -7.444 1.00 0.00 H new ATOM 923 N THR A 198 -2.559 7.748 -7.961 1.00 0.00 N ATOM 924 CA THR A 198 -3.562 8.191 -6.987 1.00 0.00 C ATOM 925 C THR A 198 -4.928 8.417 -7.634 1.00 0.00 C ATOM 926 O THR A 198 -5.111 8.135 -8.821 1.00 0.00 O ATOM 927 CB THR A 198 -3.076 9.480 -6.329 1.00 0.00 C ATOM 928 OG1 THR A 198 -2.738 10.439 -7.319 1.00 0.00 O ATOM 929 CG2 THR A 198 -1.859 9.272 -5.462 1.00 0.00 C ATOM 0 H THR A 198 -2.698 8.111 -8.904 1.00 0.00 H new ATOM 0 HA THR A 198 -3.685 7.406 -6.241 1.00 0.00 H new ATOM 0 HB THR A 198 -3.898 9.827 -5.702 1.00 0.00 H new ATOM 0 HG1 THR A 198 -3.176 11.291 -7.112 1.00 0.00 H new ATOM 0 HG21 THR A 198 -1.560 10.223 -5.021 1.00 0.00 H new ATOM 0 HG22 THR A 198 -2.094 8.562 -4.669 1.00 0.00 H new ATOM 0 HG23 THR A 198 -1.043 8.880 -6.069 1.00 0.00 H new ATOM 937 N LEU A 199 -5.885 8.925 -6.842 1.00 0.00 N ATOM 938 CA LEU A 199 -7.250 9.192 -7.317 1.00 0.00 C ATOM 939 C LEU A 199 -7.959 7.888 -7.680 1.00 0.00 C ATOM 940 O LEU A 199 -8.975 7.531 -7.084 1.00 0.00 O ATOM 941 CB LEU A 199 -7.231 10.145 -8.522 1.00 0.00 C ATOM 942 CG LEU A 199 -7.833 11.529 -8.267 1.00 0.00 C ATOM 943 CD1 LEU A 199 -9.315 11.419 -7.946 1.00 0.00 C ATOM 944 CD2 LEU A 199 -7.096 12.234 -7.139 1.00 0.00 C ATOM 0 H LEU A 199 -5.735 9.161 -5.861 1.00 0.00 H new ATOM 0 HA LEU A 199 -7.802 9.672 -6.509 1.00 0.00 H new ATOM 0 HB2 LEU A 199 -6.199 10.270 -8.850 1.00 0.00 H new ATOM 0 HB3 LEU A 199 -7.772 9.677 -9.344 1.00 0.00 H new ATOM 0 HG LEU A 199 -7.721 12.121 -9.175 1.00 0.00 H new ATOM 0 HD11 LEU A 199 -9.724 12.414 -7.768 1.00 0.00 H new ATOM 0 HD12 LEU A 199 -9.836 10.958 -8.785 1.00 0.00 H new ATOM 0 HD13 LEU A 199 -9.450 10.807 -7.054 1.00 0.00 H new ATOM 0 HD21 LEU A 199 -7.539 13.216 -6.973 1.00 0.00 H new ATOM 0 HD22 LEU A 199 -7.174 11.642 -6.227 1.00 0.00 H new ATOM 0 HD23 LEU A 199 -6.046 12.350 -7.407 1.00 0.00 H new ATOM 956 N ARG A 200 -7.397 7.182 -8.652 1.00 0.00 N ATOM 957 CA ARG A 200 -7.934 5.906 -9.102 1.00 0.00 C ATOM 958 C ARG A 200 -6.865 4.813 -9.030 1.00 0.00 C ATOM 959 O ARG A 200 -7.170 3.665 -8.711 1.00 0.00 O ATOM 960 CB ARG A 200 -8.467 6.023 -10.536 1.00 0.00 C ATOM 961 CG ARG A 200 -9.883 6.582 -10.632 1.00 0.00 C ATOM 962 CD ARG A 200 -10.820 5.965 -9.599 1.00 0.00 C ATOM 963 NE ARG A 200 -10.730 4.501 -9.570 1.00 0.00 N ATOM 964 CZ ARG A 200 -11.191 3.742 -8.585 1.00 0.00 C ATOM 965 NH1 ARG A 200 -11.802 4.284 -7.548 1.00 0.00 N ATOM 966 NH2 ARG A 200 -11.031 2.439 -8.645 1.00 0.00 N ATOM 0 H ARG A 200 -6.557 7.478 -9.150 1.00 0.00 H new ATOM 0 HA ARG A 200 -8.757 5.633 -8.441 1.00 0.00 H new ATOM 0 HB2 ARG A 200 -7.796 6.662 -11.110 1.00 0.00 H new ATOM 0 HB3 ARG A 200 -8.445 5.038 -11.002 1.00 0.00 H new ATOM 0 HG2 ARG A 200 -9.855 7.663 -10.494 1.00 0.00 H new ATOM 0 HG3 ARG A 200 -10.277 6.399 -11.632 1.00 0.00 H new ATOM 0 HD2 ARG A 200 -10.581 6.361 -8.612 1.00 0.00 H new ATOM 0 HD3 ARG A 200 -11.846 6.259 -9.820 1.00 0.00 H new ATOM 0 HE ARG A 200 -10.283 4.036 -10.360 1.00 0.00 H new ATOM 0 HH11 ARG A 200 -11.923 5.296 -7.499 1.00 0.00 H new ATOM 0 HH12 ARG A 200 -12.153 3.691 -6.796 1.00 0.00 H new ATOM 0 HH21 ARG A 200 -10.556 2.020 -9.444 1.00 0.00 H new ATOM 0 HH22 ARG A 200 -11.382 1.847 -7.892 1.00 0.00 H new ATOM 980 N VAL A 201 -5.608 5.174 -9.323 1.00 0.00 N ATOM 981 CA VAL A 201 -4.507 4.208 -9.291 1.00 0.00 C ATOM 982 C VAL A 201 -4.355 3.564 -7.918 1.00 0.00 C ATOM 983 O VAL A 201 -4.294 2.341 -7.807 1.00 0.00 O ATOM 984 CB VAL A 201 -3.168 4.856 -9.693 1.00 0.00 C ATOM 985 CG1 VAL A 201 -2.049 3.825 -9.650 1.00 0.00 C ATOM 986 CG2 VAL A 201 -3.266 5.475 -11.078 1.00 0.00 C ATOM 0 H VAL A 201 -5.332 6.121 -9.583 1.00 0.00 H new ATOM 0 HA VAL A 201 -4.762 3.436 -10.017 1.00 0.00 H new ATOM 0 HB VAL A 201 -2.941 5.648 -8.980 1.00 0.00 H new ATOM 0 HG11 VAL A 201 -1.109 4.296 -9.936 1.00 0.00 H new ATOM 0 HG12 VAL A 201 -1.962 3.425 -8.640 1.00 0.00 H new ATOM 0 HG13 VAL A 201 -2.274 3.014 -10.343 1.00 0.00 H new ATOM 0 HG21 VAL A 201 -2.310 5.927 -11.343 1.00 0.00 H new ATOM 0 HG22 VAL A 201 -3.516 4.702 -11.805 1.00 0.00 H new ATOM 0 HG23 VAL A 201 -4.042 6.240 -11.080 1.00 0.00 H new ATOM 996 N LEU A 202 -4.293 4.392 -6.879 1.00 0.00 N ATOM 997 CA LEU A 202 -4.147 3.897 -5.507 1.00 0.00 C ATOM 998 C LEU A 202 -5.143 2.774 -5.205 1.00 0.00 C ATOM 999 O LEU A 202 -4.829 1.848 -4.462 1.00 0.00 O ATOM 1000 CB LEU A 202 -4.307 5.045 -4.497 1.00 0.00 C ATOM 1001 CG LEU A 202 -5.717 5.632 -4.375 1.00 0.00 C ATOM 1002 CD1 LEU A 202 -6.478 4.962 -3.241 1.00 0.00 C ATOM 1003 CD2 LEU A 202 -5.653 7.132 -4.147 1.00 0.00 C ATOM 0 H LEU A 202 -4.341 5.408 -6.957 1.00 0.00 H new ATOM 0 HA LEU A 202 -3.143 3.484 -5.411 1.00 0.00 H new ATOM 0 HB2 LEU A 202 -3.997 4.687 -3.516 1.00 0.00 H new ATOM 0 HB3 LEU A 202 -3.623 5.847 -4.775 1.00 0.00 H new ATOM 0 HG LEU A 202 -6.246 5.444 -5.309 1.00 0.00 H new ATOM 0 HD11 LEU A 202 -7.477 5.392 -3.169 1.00 0.00 H new ATOM 0 HD12 LEU A 202 -6.556 3.893 -3.437 1.00 0.00 H new ATOM 0 HD13 LEU A 202 -5.947 5.121 -2.303 1.00 0.00 H new ATOM 0 HD21 LEU A 202 -6.664 7.531 -4.063 1.00 0.00 H new ATOM 0 HD22 LEU A 202 -5.104 7.337 -3.228 1.00 0.00 H new ATOM 0 HD23 LEU A 202 -5.145 7.606 -4.986 1.00 0.00 H new ATOM 1015 N GLU A 203 -6.337 2.862 -5.793 1.00 0.00 N ATOM 1016 CA GLU A 203 -7.382 1.857 -5.593 1.00 0.00 C ATOM 1017 C GLU A 203 -7.361 0.787 -6.695 1.00 0.00 C ATOM 1018 O GLU A 203 -7.438 -0.411 -6.408 1.00 0.00 O ATOM 1019 CB GLU A 203 -8.746 2.550 -5.553 1.00 0.00 C ATOM 1020 CG GLU A 203 -9.851 1.714 -4.923 1.00 0.00 C ATOM 1021 CD GLU A 203 -11.178 1.894 -5.622 1.00 0.00 C ATOM 1022 OE1 GLU A 203 -11.889 2.874 -5.315 1.00 0.00 O ATOM 1023 OE2 GLU A 203 -11.499 1.076 -6.509 1.00 0.00 O ATOM 0 H GLU A 203 -6.605 3.624 -6.415 1.00 0.00 H new ATOM 0 HA GLU A 203 -7.195 1.350 -4.646 1.00 0.00 H new ATOM 0 HB2 GLU A 203 -8.651 3.484 -4.999 1.00 0.00 H new ATOM 0 HB3 GLU A 203 -9.038 2.812 -6.570 1.00 0.00 H new ATOM 0 HG2 GLU A 203 -9.568 0.662 -4.952 1.00 0.00 H new ATOM 0 HG3 GLU A 203 -9.956 1.987 -3.873 1.00 0.00 H new ATOM 1030 N ASP A 204 -7.258 1.224 -7.951 1.00 0.00 N ATOM 1031 CA ASP A 204 -7.236 0.313 -9.098 1.00 0.00 C ATOM 1032 C ASP A 204 -5.978 -0.553 -9.101 1.00 0.00 C ATOM 1033 O ASP A 204 -6.053 -1.776 -9.263 1.00 0.00 O ATOM 1034 CB ASP A 204 -7.332 1.107 -10.409 1.00 0.00 C ATOM 1035 CG ASP A 204 -8.702 1.018 -11.048 1.00 0.00 C ATOM 1036 OD1 ASP A 204 -9.633 1.693 -10.555 1.00 0.00 O ATOM 1037 OD2 ASP A 204 -8.845 0.280 -12.041 1.00 0.00 O ATOM 0 H ASP A 204 -7.188 2.210 -8.201 1.00 0.00 H new ATOM 0 HA ASP A 204 -8.099 -0.348 -9.014 1.00 0.00 H new ATOM 0 HB2 ASP A 204 -7.094 2.153 -10.214 1.00 0.00 H new ATOM 0 HB3 ASP A 204 -6.584 0.735 -11.110 1.00 0.00 H new ATOM 1042 N ALA A 205 -4.823 0.081 -8.918 1.00 0.00 N ATOM 1043 CA ALA A 205 -3.555 -0.639 -8.900 1.00 0.00 C ATOM 1044 C ALA A 205 -3.507 -1.648 -7.756 1.00 0.00 C ATOM 1045 O ALA A 205 -2.939 -2.730 -7.904 1.00 0.00 O ATOM 1046 CB ALA A 205 -2.389 0.334 -8.812 1.00 0.00 C ATOM 0 H ALA A 205 -4.740 1.088 -8.781 1.00 0.00 H new ATOM 0 HA ALA A 205 -3.471 -1.194 -9.834 1.00 0.00 H new ATOM 0 HB1 ALA A 205 -1.451 -0.222 -8.800 1.00 0.00 H new ATOM 0 HB2 ALA A 205 -2.405 1.000 -9.675 1.00 0.00 H new ATOM 0 HB3 ALA A 205 -2.474 0.922 -7.898 1.00 0.00 H new ATOM 1052 N LEU A 206 -4.115 -1.300 -6.619 1.00 0.00 N ATOM 1053 CA LEU A 206 -4.138 -2.197 -5.457 1.00 0.00 C ATOM 1054 C LEU A 206 -5.092 -3.376 -5.681 1.00 0.00 C ATOM 1055 O LEU A 206 -4.795 -4.512 -5.292 1.00 0.00 O ATOM 1056 CB LEU A 206 -4.515 -1.427 -4.176 1.00 0.00 C ATOM 1057 CG LEU A 206 -5.995 -1.474 -3.764 1.00 0.00 C ATOM 1058 CD1 LEU A 206 -6.320 -2.783 -3.065 1.00 0.00 C ATOM 1059 CD2 LEU A 206 -6.332 -0.304 -2.855 1.00 0.00 C ATOM 0 H LEU A 206 -4.595 -0.411 -6.477 1.00 0.00 H new ATOM 0 HA LEU A 206 -3.133 -2.600 -5.331 1.00 0.00 H new ATOM 0 HB2 LEU A 206 -3.918 -1.819 -3.353 1.00 0.00 H new ATOM 0 HB3 LEU A 206 -4.229 -0.383 -4.308 1.00 0.00 H new ATOM 0 HG LEU A 206 -6.599 -1.404 -4.669 1.00 0.00 H new ATOM 0 HD11 LEU A 206 -7.373 -2.793 -2.783 1.00 0.00 H new ATOM 0 HD12 LEU A 206 -6.117 -3.615 -3.739 1.00 0.00 H new ATOM 0 HD13 LEU A 206 -5.704 -2.881 -2.171 1.00 0.00 H new ATOM 0 HD21 LEU A 206 -7.384 -0.353 -2.573 1.00 0.00 H new ATOM 0 HD22 LEU A 206 -5.714 -0.350 -1.959 1.00 0.00 H new ATOM 0 HD23 LEU A 206 -6.141 0.632 -3.380 1.00 0.00 H new ATOM 1071 N ALA A 207 -6.240 -3.102 -6.305 1.00 0.00 N ATOM 1072 CA ALA A 207 -7.232 -4.140 -6.570 1.00 0.00 C ATOM 1073 C ALA A 207 -6.790 -5.083 -7.688 1.00 0.00 C ATOM 1074 O ALA A 207 -7.087 -6.275 -7.644 1.00 0.00 O ATOM 1075 CB ALA A 207 -8.580 -3.508 -6.897 1.00 0.00 C ATOM 0 H ALA A 207 -6.503 -2.173 -6.634 1.00 0.00 H new ATOM 0 HA ALA A 207 -7.332 -4.741 -5.666 1.00 0.00 H new ATOM 0 HB1 ALA A 207 -9.312 -4.292 -7.093 1.00 0.00 H new ATOM 0 HB2 ALA A 207 -8.913 -2.904 -6.053 1.00 0.00 H new ATOM 0 HB3 ALA A 207 -8.481 -2.876 -7.779 1.00 0.00 H new ATOM 1081 N ALA A 208 -6.072 -4.554 -8.682 1.00 0.00 N ATOM 1082 CA ALA A 208 -5.590 -5.370 -9.798 1.00 0.00 C ATOM 1083 C ALA A 208 -4.820 -6.602 -9.303 1.00 0.00 C ATOM 1084 O ALA A 208 -4.770 -7.623 -9.991 1.00 0.00 O ATOM 1085 CB ALA A 208 -4.719 -4.535 -10.726 1.00 0.00 C ATOM 0 H ALA A 208 -5.813 -3.569 -8.737 1.00 0.00 H new ATOM 0 HA ALA A 208 -6.459 -5.724 -10.353 1.00 0.00 H new ATOM 0 HB1 ALA A 208 -4.368 -5.155 -11.551 1.00 0.00 H new ATOM 0 HB2 ALA A 208 -5.301 -3.702 -11.120 1.00 0.00 H new ATOM 0 HB3 ALA A 208 -3.863 -4.149 -10.172 1.00 0.00 H new ATOM 1091 N ILE A 209 -4.231 -6.499 -8.110 1.00 0.00 N ATOM 1092 CA ILE A 209 -3.474 -7.608 -7.526 1.00 0.00 C ATOM 1093 C ILE A 209 -4.234 -8.264 -6.369 1.00 0.00 C ATOM 1094 O ILE A 209 -3.941 -9.398 -5.987 1.00 0.00 O ATOM 1095 CB ILE A 209 -2.091 -7.135 -7.013 1.00 0.00 C ATOM 1096 CG1 ILE A 209 -2.211 -6.544 -5.594 1.00 0.00 C ATOM 1097 CG2 ILE A 209 -1.476 -6.129 -7.980 1.00 0.00 C ATOM 1098 CD1 ILE A 209 -1.405 -5.286 -5.374 1.00 0.00 C ATOM 0 H ILE A 209 -4.263 -5.660 -7.530 1.00 0.00 H new ATOM 0 HA ILE A 209 -3.335 -8.341 -8.321 1.00 0.00 H new ATOM 0 HB ILE A 209 -1.427 -7.998 -6.960 1.00 0.00 H new ATOM 0 HG12 ILE A 209 -3.260 -6.330 -5.390 1.00 0.00 H new ATOM 0 HG13 ILE A 209 -1.893 -7.296 -4.872 1.00 0.00 H new ATOM 0 HG21 ILE A 209 -0.505 -5.808 -7.603 1.00 0.00 H new ATOM 0 HG22 ILE A 209 -1.350 -6.594 -8.958 1.00 0.00 H new ATOM 0 HG23 ILE A 209 -2.133 -5.264 -8.072 1.00 0.00 H new ATOM 0 HD11 ILE A 209 -1.546 -4.938 -4.351 1.00 0.00 H new ATOM 0 HD12 ILE A 209 -0.349 -5.496 -5.543 1.00 0.00 H new ATOM 0 HD13 ILE A 209 -1.737 -4.515 -6.069 1.00 0.00 H new ATOM 1110 N GLY A 210 -5.192 -7.529 -5.800 1.00 0.00 N ATOM 1111 CA GLY A 210 -5.958 -8.032 -4.674 1.00 0.00 C ATOM 1112 C GLY A 210 -5.297 -7.666 -3.364 1.00 0.00 C ATOM 1113 O GLY A 210 -5.074 -8.527 -2.510 1.00 0.00 O ATOM 0 H GLY A 210 -5.450 -6.590 -6.103 1.00 0.00 H new ATOM 0 HA2 GLY A 210 -6.967 -7.622 -4.704 1.00 0.00 H new ATOM 0 HA3 GLY A 210 -6.052 -9.115 -4.748 1.00 0.00 H new ATOM 1117 N ARG A 211 -4.952 -6.386 -3.218 1.00 0.00 N ATOM 1118 CA ARG A 211 -4.280 -5.903 -2.014 1.00 0.00 C ATOM 1119 C ARG A 211 -5.173 -4.977 -1.193 1.00 0.00 C ATOM 1120 O ARG A 211 -4.705 -3.983 -0.625 1.00 0.00 O ATOM 1121 CB ARG A 211 -2.970 -5.202 -2.385 1.00 0.00 C ATOM 1122 CG ARG A 211 -1.772 -5.711 -1.597 1.00 0.00 C ATOM 1123 CD ARG A 211 -1.370 -7.115 -2.029 1.00 0.00 C ATOM 1124 NE ARG A 211 -2.442 -8.093 -1.804 1.00 0.00 N ATOM 1125 CZ ARG A 211 -2.643 -8.751 -0.668 1.00 0.00 C ATOM 1126 NH1 ARG A 211 -1.838 -8.584 0.360 1.00 0.00 N ATOM 1127 NH2 ARG A 211 -3.668 -9.573 -0.565 1.00 0.00 N ATOM 0 H ARG A 211 -5.127 -5.666 -3.919 1.00 0.00 H new ATOM 0 HA ARG A 211 -4.056 -6.769 -1.391 1.00 0.00 H new ATOM 0 HB2 ARG A 211 -2.781 -5.340 -3.450 1.00 0.00 H new ATOM 0 HB3 ARG A 211 -3.079 -4.131 -2.216 1.00 0.00 H new ATOM 0 HG2 ARG A 211 -0.930 -5.032 -1.735 1.00 0.00 H new ATOM 0 HG3 ARG A 211 -2.009 -5.711 -0.533 1.00 0.00 H new ATOM 0 HD2 ARG A 211 -1.105 -7.106 -3.086 1.00 0.00 H new ATOM 0 HD3 ARG A 211 -0.480 -7.421 -1.480 1.00 0.00 H new ATOM 0 HE ARG A 211 -3.080 -8.281 -2.578 1.00 0.00 H new ATOM 0 HH11 ARG A 211 -1.048 -7.943 0.290 1.00 0.00 H new ATOM 0 HH12 ARG A 211 -2.004 -9.096 1.226 1.00 0.00 H new ATOM 0 HH21 ARG A 211 -4.301 -9.701 -1.355 1.00 0.00 H new ATOM 0 HH22 ARG A 211 -3.828 -10.082 0.304 1.00 0.00 H new ATOM 1141 N GLU A 212 -6.454 -5.327 -1.100 1.00 0.00 N ATOM 1142 CA GLU A 212 -7.406 -4.547 -0.310 1.00 0.00 C ATOM 1143 C GLU A 212 -6.936 -4.433 1.137 1.00 0.00 C ATOM 1144 O GLU A 212 -7.356 -3.533 1.862 1.00 0.00 O ATOM 1145 CB GLU A 212 -8.799 -5.178 -0.372 1.00 0.00 C ATOM 1146 CG GLU A 212 -8.810 -6.656 -0.009 1.00 0.00 C ATOM 1147 CD GLU A 212 -10.103 -7.343 -0.389 1.00 0.00 C ATOM 1148 OE1 GLU A 212 -11.070 -7.256 0.396 1.00 0.00 O ATOM 1149 OE2 GLU A 212 -10.145 -7.971 -1.466 1.00 0.00 O ATOM 0 H GLU A 212 -6.857 -6.143 -1.560 1.00 0.00 H new ATOM 0 HA GLU A 212 -7.462 -3.544 -0.733 1.00 0.00 H new ATOM 0 HB2 GLU A 212 -9.464 -4.640 0.304 1.00 0.00 H new ATOM 0 HB3 GLU A 212 -9.201 -5.056 -1.378 1.00 0.00 H new ATOM 0 HG2 GLU A 212 -7.979 -7.154 -0.508 1.00 0.00 H new ATOM 0 HG3 GLU A 212 -8.648 -6.763 1.064 1.00 0.00 H new ATOM 1156 N ASP A 213 -6.035 -5.334 1.534 1.00 0.00 N ATOM 1157 CA ASP A 213 -5.464 -5.333 2.874 1.00 0.00 C ATOM 1158 C ASP A 213 -4.993 -3.930 3.270 1.00 0.00 C ATOM 1159 O ASP A 213 -5.040 -3.559 4.445 1.00 0.00 O ATOM 1160 CB ASP A 213 -4.290 -6.316 2.921 1.00 0.00 C ATOM 1161 CG ASP A 213 -4.179 -7.056 4.239 1.00 0.00 C ATOM 1162 OD1 ASP A 213 -5.188 -7.136 4.972 1.00 0.00 O ATOM 1163 OD2 ASP A 213 -3.076 -7.559 4.532 1.00 0.00 O ATOM 0 H ASP A 213 -5.684 -6.081 0.934 1.00 0.00 H new ATOM 0 HA ASP A 213 -6.232 -5.641 3.584 1.00 0.00 H new ATOM 0 HB2 ASP A 213 -4.399 -7.040 2.114 1.00 0.00 H new ATOM 0 HB3 ASP A 213 -3.363 -5.773 2.738 1.00 0.00 H new ATOM 1168 N VAL A 214 -4.567 -3.139 2.281 1.00 0.00 N ATOM 1169 CA VAL A 214 -4.122 -1.775 2.550 1.00 0.00 C ATOM 1170 C VAL A 214 -5.318 -0.910 2.933 1.00 0.00 C ATOM 1171 O VAL A 214 -5.274 -0.168 3.915 1.00 0.00 O ATOM 1172 CB VAL A 214 -3.358 -1.161 1.349 1.00 0.00 C ATOM 1173 CG1 VAL A 214 -4.311 -0.627 0.288 1.00 0.00 C ATOM 1174 CG2 VAL A 214 -2.415 -0.064 1.821 1.00 0.00 C ATOM 0 H VAL A 214 -4.522 -3.417 1.301 1.00 0.00 H new ATOM 0 HA VAL A 214 -3.420 -1.809 3.383 1.00 0.00 H new ATOM 0 HB VAL A 214 -2.770 -1.957 0.892 1.00 0.00 H new ATOM 0 HG11 VAL A 214 -3.737 -0.205 -0.537 1.00 0.00 H new ATOM 0 HG12 VAL A 214 -4.935 -1.440 -0.083 1.00 0.00 H new ATOM 0 HG13 VAL A 214 -4.943 0.147 0.723 1.00 0.00 H new ATOM 0 HG21 VAL A 214 -1.887 0.355 0.965 1.00 0.00 H new ATOM 0 HG22 VAL A 214 -2.988 0.721 2.314 1.00 0.00 H new ATOM 0 HG23 VAL A 214 -1.693 -0.482 2.523 1.00 0.00 H new ATOM 1184 N VAL A 215 -6.408 -1.062 2.183 1.00 0.00 N ATOM 1185 CA VAL A 215 -7.643 -0.349 2.469 1.00 0.00 C ATOM 1186 C VAL A 215 -8.293 -0.953 3.715 1.00 0.00 C ATOM 1187 O VAL A 215 -8.853 -0.239 4.549 1.00 0.00 O ATOM 1188 CB VAL A 215 -8.622 -0.422 1.275 1.00 0.00 C ATOM 1189 CG1 VAL A 215 -10.027 -0.010 1.692 1.00 0.00 C ATOM 1190 CG2 VAL A 215 -8.132 0.446 0.124 1.00 0.00 C ATOM 0 H VAL A 215 -6.457 -1.676 1.370 1.00 0.00 H new ATOM 0 HA VAL A 215 -7.407 0.701 2.643 1.00 0.00 H new ATOM 0 HB VAL A 215 -8.660 -1.457 0.936 1.00 0.00 H new ATOM 0 HG11 VAL A 215 -10.694 -0.071 0.832 1.00 0.00 H new ATOM 0 HG12 VAL A 215 -10.384 -0.677 2.476 1.00 0.00 H new ATOM 0 HG13 VAL A 215 -10.010 1.014 2.066 1.00 0.00 H new ATOM 0 HG21 VAL A 215 -8.835 0.380 -0.706 1.00 0.00 H new ATOM 0 HG22 VAL A 215 -8.057 1.482 0.455 1.00 0.00 H new ATOM 0 HG23 VAL A 215 -7.152 0.098 -0.202 1.00 0.00 H new ATOM 1200 N GLN A 216 -8.181 -2.281 3.839 1.00 0.00 N ATOM 1201 CA GLN A 216 -8.727 -3.011 4.982 1.00 0.00 C ATOM 1202 C GLN A 216 -8.070 -2.553 6.282 1.00 0.00 C ATOM 1203 O GLN A 216 -8.756 -2.260 7.261 1.00 0.00 O ATOM 1204 CB GLN A 216 -8.522 -4.519 4.795 1.00 0.00 C ATOM 1205 CG GLN A 216 -9.810 -5.327 4.864 1.00 0.00 C ATOM 1206 CD GLN A 216 -10.478 -5.482 3.512 1.00 0.00 C ATOM 1207 OE1 GLN A 216 -11.114 -4.557 3.015 1.00 0.00 O ATOM 1208 NE2 GLN A 216 -10.337 -6.653 2.909 1.00 0.00 N ATOM 0 H GLN A 216 -7.712 -2.873 3.154 1.00 0.00 H new ATOM 0 HA GLN A 216 -9.795 -2.801 5.042 1.00 0.00 H new ATOM 0 HB2 GLN A 216 -8.045 -4.695 3.831 1.00 0.00 H new ATOM 0 HB3 GLN A 216 -7.836 -4.881 5.561 1.00 0.00 H new ATOM 0 HG2 GLN A 216 -9.593 -6.314 5.273 1.00 0.00 H new ATOM 0 HG3 GLN A 216 -10.502 -4.842 5.553 1.00 0.00 H new ATOM 0 HE21 GLN A 216 -9.800 -7.396 3.357 1.00 0.00 H new ATOM 0 HE22 GLN A 216 -10.765 -6.812 1.997 1.00 0.00 H new ATOM 1217 N VAL A 217 -6.733 -2.488 6.285 1.00 0.00 N ATOM 1218 CA VAL A 217 -5.986 -2.057 7.470 1.00 0.00 C ATOM 1219 C VAL A 217 -6.464 -0.686 7.957 1.00 0.00 C ATOM 1220 O VAL A 217 -6.604 -0.459 9.160 1.00 0.00 O ATOM 1221 CB VAL A 217 -4.469 -2.002 7.186 1.00 0.00 C ATOM 1222 CG1 VAL A 217 -3.745 -1.146 8.215 1.00 0.00 C ATOM 1223 CG2 VAL A 217 -3.884 -3.404 7.161 1.00 0.00 C ATOM 0 H VAL A 217 -6.150 -2.727 5.483 1.00 0.00 H new ATOM 0 HA VAL A 217 -6.172 -2.794 8.251 1.00 0.00 H new ATOM 0 HB VAL A 217 -4.328 -1.543 6.208 1.00 0.00 H new ATOM 0 HG11 VAL A 217 -2.679 -1.127 7.988 1.00 0.00 H new ATOM 0 HG12 VAL A 217 -4.140 -0.131 8.186 1.00 0.00 H new ATOM 0 HG13 VAL A 217 -3.896 -1.566 9.209 1.00 0.00 H new ATOM 0 HG21 VAL A 217 -2.814 -3.348 6.960 1.00 0.00 H new ATOM 0 HG22 VAL A 217 -4.047 -3.884 8.126 1.00 0.00 H new ATOM 0 HG23 VAL A 217 -4.370 -3.987 6.379 1.00 0.00 H new ATOM 1233 N LEU A 218 -6.717 0.220 7.012 1.00 0.00 N ATOM 1234 CA LEU A 218 -7.186 1.563 7.337 1.00 0.00 C ATOM 1235 C LEU A 218 -8.692 1.558 7.611 1.00 0.00 C ATOM 1236 O LEU A 218 -9.149 2.094 8.620 1.00 0.00 O ATOM 1237 CB LEU A 218 -6.847 2.524 6.193 1.00 0.00 C ATOM 1238 CG LEU A 218 -6.597 3.975 6.607 1.00 0.00 C ATOM 1239 CD1 LEU A 218 -5.787 4.043 7.893 1.00 0.00 C ATOM 1240 CD2 LEU A 218 -5.887 4.727 5.495 1.00 0.00 C ATOM 0 H LEU A 218 -6.604 0.045 6.013 1.00 0.00 H new ATOM 0 HA LEU A 218 -6.681 1.902 8.242 1.00 0.00 H new ATOM 0 HB2 LEU A 218 -5.960 2.152 5.680 1.00 0.00 H new ATOM 0 HB3 LEU A 218 -7.664 2.505 5.472 1.00 0.00 H new ATOM 0 HG LEU A 218 -7.563 4.447 6.789 1.00 0.00 H new ATOM 0 HD11 LEU A 218 -5.623 5.086 8.165 1.00 0.00 H new ATOM 0 HD12 LEU A 218 -6.331 3.540 8.693 1.00 0.00 H new ATOM 0 HD13 LEU A 218 -4.825 3.552 7.744 1.00 0.00 H new ATOM 0 HD21 LEU A 218 -5.716 5.758 5.805 1.00 0.00 H new ATOM 0 HD22 LEU A 218 -4.931 4.248 5.285 1.00 0.00 H new ATOM 0 HD23 LEU A 218 -6.504 4.715 4.596 1.00 0.00 H new ATOM 1252 N SER A 219 -9.454 0.930 6.713 1.00 0.00 N ATOM 1253 CA SER A 219 -10.909 0.823 6.854 1.00 0.00 C ATOM 1254 C SER A 219 -11.606 2.193 6.827 1.00 0.00 C ATOM 1255 O SER A 219 -12.541 2.436 7.594 1.00 0.00 O ATOM 1256 CB SER A 219 -11.250 0.075 8.146 1.00 0.00 C ATOM 1257 OG SER A 219 -12.627 -0.248 8.198 1.00 0.00 O ATOM 0 H SER A 219 -9.084 0.484 5.873 1.00 0.00 H new ATOM 0 HA SER A 219 -11.281 0.264 5.996 1.00 0.00 H new ATOM 0 HB2 SER A 219 -10.656 -0.837 8.210 1.00 0.00 H new ATOM 0 HB3 SER A 219 -10.984 0.689 9.007 1.00 0.00 H new ATOM 0 HG SER A 219 -13.158 0.554 8.011 1.00 0.00 H new