USER MOD reduce.3.24.130724 H: found=0, std=0, add=539, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 540 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: B 134 SER OG : rot 143:sc= 0.613 USER MOD Set 1.2: B 137 THR OG1 : rot 180:sc= 1.02 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot -67:sc= 1.05 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 THR OG1 : rot -80:sc= -1.58 USER MOD Single : B 85 THR OG1 : rot 180:sc= -0.21 USER MOD Single : B 101 TYR OH : rot 180:sc= 0 USER MOD Single : B 103 TYR OH : rot 180:sc= 0 USER MOD Single : B 107 THR OG1 : rot 180:sc= -0.145 USER MOD Single : B 112 SER OG : rot -16:sc= -0.632! USER MOD Single : B 114 HIS :FLIP no HD1:sc= -0.0124 F(o=-1,f=-0.012) USER MOD Single : B 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 120 GLN : amide:sc= -0.675 K(o=-0.68,f=-6.9!) USER MOD Single : B 123 ASN : amide:sc= 0 X(o=0,f=-0.042) USER MOD Single : B 124 SER OG : rot 180:sc= 0.0204 USER MOD Single : B 125 SER OG : rot 180:sc= 0 USER MOD Single : B 136 THR OG1 : rot 180:sc= 0 USER MOD Single : B 140 THR OG1 : rot 22:sc= 0.318 USER MOD Single : B 142 TYR OH : rot 180:sc= 0 USER MOD Single : B 145 SER OG : rot 180:sc= -1.38 USER MOD Single : B 146 ASN :FLIP amide:sc= -0.542 F(o=-1.3,f=-0.54) USER MOD Single : B 147 TYR OH : rot 0:sc= -0.268 USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 91 -21.859 3.299 -23.482 1.00 0.00 N ATOM 2 CA PRO A 91 -20.656 4.158 -23.549 1.00 0.00 C ATOM 3 C PRO A 91 -19.449 3.335 -24.013 1.00 0.00 C ATOM 4 O PRO A 91 -19.510 2.124 -24.065 1.00 0.00 O ATOM 5 CB PRO A 91 -20.433 4.669 -22.120 1.00 0.00 C ATOM 6 CG PRO A 91 -21.545 4.072 -21.231 1.00 0.00 C ATOM 7 CD PRO A 91 -22.443 3.209 -22.127 1.00 0.00 C ATOM 0 HA PRO A 91 -20.781 4.979 -24.255 1.00 0.00 H new ATOM 0 HB2 PRO A 91 -19.450 4.370 -21.756 1.00 0.00 H new ATOM 0 HB3 PRO A 91 -20.465 5.758 -22.094 1.00 0.00 H new ATOM 0 HG2 PRO A 91 -21.114 3.472 -20.430 1.00 0.00 H new ATOM 0 HG3 PRO A 91 -22.125 4.865 -20.759 1.00 0.00 H new ATOM 0 HD2 PRO A 91 -22.467 2.176 -21.779 1.00 0.00 H new ATOM 0 HD3 PRO A 91 -23.470 3.573 -22.118 1.00 0.00 H new ATOM 17 N PRO A 92 -18.382 4.025 -24.337 1.00 0.00 N ATOM 18 CA PRO A 92 -17.141 3.379 -24.800 1.00 0.00 C ATOM 19 C PRO A 92 -16.596 2.442 -23.717 1.00 0.00 C ATOM 20 O PRO A 92 -17.184 2.283 -22.666 1.00 0.00 O ATOM 21 CB PRO A 92 -16.166 4.539 -25.053 1.00 0.00 C ATOM 22 CG PRO A 92 -16.905 5.860 -24.715 1.00 0.00 C ATOM 23 CD PRO A 92 -18.330 5.497 -24.269 1.00 0.00 C ATOM 0 HA PRO A 92 -17.295 2.773 -25.692 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -15.275 4.431 -24.435 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -15.835 4.541 -26.092 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -16.383 6.399 -23.925 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -16.932 6.517 -25.585 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -18.531 5.854 -23.259 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -19.076 5.950 -24.922 1.00 0.00 H new ATOM 31 N ARG A 93 -15.476 1.818 -23.968 1.00 0.00 N ATOM 32 CA ARG A 93 -14.895 0.892 -22.956 1.00 0.00 C ATOM 33 C ARG A 93 -13.455 0.542 -23.353 1.00 0.00 C ATOM 34 O ARG A 93 -13.210 -0.499 -23.928 1.00 0.00 O ATOM 35 CB ARG A 93 -15.734 -0.385 -22.899 1.00 0.00 C ATOM 36 CG ARG A 93 -15.737 -1.056 -24.273 1.00 0.00 C ATOM 37 CD ARG A 93 -17.080 -1.753 -24.497 1.00 0.00 C ATOM 38 NE ARG A 93 -17.225 -2.106 -25.938 1.00 0.00 N ATOM 39 CZ ARG A 93 -18.071 -3.032 -26.301 1.00 0.00 C ATOM 40 NH1 ARG A 93 -18.915 -3.523 -25.435 1.00 0.00 N ATOM 41 NH2 ARG A 93 -18.074 -3.466 -27.532 1.00 0.00 N ATOM 0 H ARG A 93 -14.939 1.910 -24.830 1.00 0.00 H new ATOM 0 HA ARG A 93 -14.895 1.372 -21.977 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -15.328 -1.066 -22.151 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -16.754 -0.149 -22.596 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -15.566 -0.314 -25.053 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -14.924 -1.779 -24.338 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -17.141 -2.652 -23.884 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -17.896 -1.100 -24.188 1.00 0.00 H new ATOM 0 HE ARG A 93 -16.664 -1.624 -26.640 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -18.914 -3.183 -24.473 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -19.575 -4.246 -25.720 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -17.416 -3.082 -28.210 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -18.735 -4.189 -27.816 1.00 0.00 H new ATOM 55 N PRO A 94 -12.548 1.431 -23.034 1.00 0.00 N ATOM 56 CA PRO A 94 -11.120 1.246 -23.353 1.00 0.00 C ATOM 57 C PRO A 94 -10.583 -0.013 -22.668 1.00 0.00 C ATOM 58 O PRO A 94 -9.932 -0.835 -23.283 1.00 0.00 O ATOM 59 CB PRO A 94 -10.428 2.499 -22.798 1.00 0.00 C ATOM 60 CG PRO A 94 -11.519 3.395 -22.157 1.00 0.00 C ATOM 61 CD PRO A 94 -12.870 2.686 -22.333 1.00 0.00 C ATOM 0 HA PRO A 94 -10.946 1.122 -24.422 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -9.676 2.225 -22.059 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -9.912 3.035 -23.594 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -11.308 3.558 -21.100 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -11.537 4.375 -22.633 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -13.343 2.491 -21.370 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -13.564 3.295 -22.912 1.00 0.00 H new ATOM 69 N LEU A 95 -10.850 -0.174 -21.401 1.00 0.00 N ATOM 70 CA LEU A 95 -10.354 -1.382 -20.688 1.00 0.00 C ATOM 71 C LEU A 95 -8.821 -1.417 -20.757 1.00 0.00 C ATOM 72 O LEU A 95 -8.260 -1.745 -21.785 1.00 0.00 O ATOM 73 CB LEU A 95 -10.919 -2.633 -21.364 1.00 0.00 C ATOM 74 CG LEU A 95 -11.446 -3.593 -20.298 1.00 0.00 C ATOM 75 CD1 LEU A 95 -11.952 -4.873 -20.967 1.00 0.00 C ATOM 76 CD2 LEU A 95 -10.315 -3.935 -19.327 1.00 0.00 C ATOM 0 H LEU A 95 -11.389 0.478 -20.831 1.00 0.00 H new ATOM 0 HA LEU A 95 -10.673 -1.351 -19.646 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -11.720 -2.358 -22.050 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -10.145 -3.120 -21.957 1.00 0.00 H new ATOM 0 HG LEU A 95 -12.266 -3.123 -19.754 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -12.328 -5.557 -20.206 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -12.755 -4.627 -21.662 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -11.134 -5.347 -21.510 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -10.685 -4.620 -18.564 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -9.498 -4.407 -19.872 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -9.955 -3.022 -18.852 1.00 0.00 H new ATOM 88 N PRO A 96 -8.184 -1.077 -19.662 1.00 0.00 N ATOM 89 CA PRO A 96 -6.713 -1.065 -19.586 1.00 0.00 C ATOM 90 C PRO A 96 -6.165 -2.467 -19.865 1.00 0.00 C ATOM 91 O PRO A 96 -5.031 -2.630 -20.269 1.00 0.00 O ATOM 92 CB PRO A 96 -6.397 -0.633 -18.146 1.00 0.00 C ATOM 93 CG PRO A 96 -7.745 -0.405 -17.416 1.00 0.00 C ATOM 94 CD PRO A 96 -8.873 -0.686 -18.421 1.00 0.00 C ATOM 0 HA PRO A 96 -6.260 -0.396 -20.318 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -5.811 -1.398 -17.637 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -5.801 0.280 -18.143 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -7.829 -1.065 -16.552 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -7.810 0.617 -17.044 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -9.530 -1.480 -18.066 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -9.494 0.196 -18.575 1.00 0.00 H new ATOM 102 N VAL A 97 -6.964 -3.478 -19.654 1.00 0.00 N ATOM 103 CA VAL A 97 -6.493 -4.869 -19.910 1.00 0.00 C ATOM 104 C VAL A 97 -5.284 -5.170 -19.021 1.00 0.00 C ATOM 105 O VAL A 97 -4.299 -4.458 -19.033 1.00 0.00 O ATOM 106 CB VAL A 97 -6.098 -5.009 -21.381 1.00 0.00 C ATOM 107 CG1 VAL A 97 -5.548 -6.415 -21.632 1.00 0.00 C ATOM 108 CG2 VAL A 97 -7.330 -4.780 -22.261 1.00 0.00 C ATOM 0 H VAL A 97 -7.923 -3.400 -19.315 1.00 0.00 H new ATOM 0 HA VAL A 97 -7.293 -5.573 -19.682 1.00 0.00 H new ATOM 0 HB VAL A 97 -5.333 -4.272 -21.624 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -5.267 -6.514 -22.680 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -4.672 -6.581 -21.004 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -6.313 -7.153 -21.390 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -7.051 -4.879 -23.310 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -8.094 -5.518 -22.017 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -7.723 -3.779 -22.083 1.00 0.00 H new ATOM 118 N ALA A 98 -5.350 -6.218 -18.246 1.00 0.00 N ATOM 119 CA ALA A 98 -4.203 -6.555 -17.359 1.00 0.00 C ATOM 120 C ALA A 98 -2.914 -6.592 -18.188 1.00 0.00 C ATOM 121 O ALA A 98 -2.920 -7.057 -19.311 1.00 0.00 O ATOM 122 CB ALA A 98 -4.435 -7.927 -16.720 1.00 0.00 C ATOM 0 H ALA A 98 -6.146 -6.853 -18.189 1.00 0.00 H new ATOM 0 HA ALA A 98 -4.115 -5.801 -16.577 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -3.595 -8.173 -16.071 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -5.353 -7.904 -16.133 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -4.523 -8.682 -17.501 1.00 0.00 H new ATOM 128 N PRO A 99 -1.847 -6.097 -17.613 1.00 0.00 N ATOM 129 CA PRO A 99 -0.539 -6.062 -18.291 1.00 0.00 C ATOM 130 C PRO A 99 -0.073 -7.483 -18.617 1.00 0.00 C ATOM 131 O PRO A 99 -0.212 -8.390 -17.821 1.00 0.00 O ATOM 132 CB PRO A 99 0.410 -5.400 -17.282 1.00 0.00 C ATOM 133 CG PRO A 99 -0.413 -5.064 -16.012 1.00 0.00 C ATOM 134 CD PRO A 99 -1.855 -5.534 -16.250 1.00 0.00 C ATOM 0 HA PRO A 99 -0.576 -5.518 -19.235 1.00 0.00 H new ATOM 0 HB2 PRO A 99 1.235 -6.069 -17.037 1.00 0.00 H new ATOM 0 HB3 PRO A 99 0.847 -4.496 -17.705 1.00 0.00 H new ATOM 0 HG2 PRO A 99 0.011 -5.560 -15.139 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -0.388 -3.993 -15.813 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -2.154 -6.281 -15.515 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -2.560 -4.706 -16.168 1.00 0.00 H new ATOM 142 N GLY A 100 0.477 -7.685 -19.784 1.00 0.00 N ATOM 143 CA GLY A 100 0.949 -9.048 -20.158 1.00 0.00 C ATOM 144 C GLY A 100 2.443 -9.172 -19.858 1.00 0.00 C ATOM 145 O GLY A 100 2.839 -9.592 -18.789 1.00 0.00 O ATOM 0 H GLY A 100 0.619 -6.966 -20.493 1.00 0.00 H new ATOM 0 HA2 GLY A 100 0.392 -9.802 -19.602 1.00 0.00 H new ATOM 0 HA3 GLY A 100 0.764 -9.231 -21.216 1.00 0.00 H new ATOM 149 N SER A 101 3.276 -8.809 -20.794 1.00 0.00 N ATOM 150 CA SER A 101 4.744 -8.905 -20.561 1.00 0.00 C ATOM 151 C SER A 101 5.490 -8.481 -21.827 1.00 0.00 C ATOM 152 O SER A 101 4.890 -8.157 -22.834 1.00 0.00 O ATOM 153 CB SER A 101 5.111 -10.349 -20.212 1.00 0.00 C ATOM 154 OG SER A 101 6.072 -10.350 -19.165 1.00 0.00 O ATOM 0 H SER A 101 3.004 -8.450 -21.709 1.00 0.00 H new ATOM 0 HA SER A 101 5.025 -8.249 -19.737 1.00 0.00 H new ATOM 0 HB2 SER A 101 4.221 -10.898 -19.905 1.00 0.00 H new ATOM 0 HB3 SER A 101 5.512 -10.857 -21.089 1.00 0.00 H new ATOM 0 HG SER A 101 6.308 -11.274 -18.938 1.00 0.00 H new ATOM 160 N SER A 102 6.794 -8.475 -21.786 1.00 0.00 N ATOM 161 CA SER A 102 7.577 -8.068 -22.987 1.00 0.00 C ATOM 162 C SER A 102 7.267 -6.609 -23.323 1.00 0.00 C ATOM 163 O SER A 102 6.367 -6.314 -24.085 1.00 0.00 O ATOM 164 CB SER A 102 7.197 -8.960 -24.171 1.00 0.00 C ATOM 165 OG SER A 102 7.116 -8.170 -25.351 1.00 0.00 O ATOM 0 H SER A 102 7.352 -8.735 -20.972 1.00 0.00 H new ATOM 0 HA SER A 102 8.642 -8.175 -22.782 1.00 0.00 H new ATOM 0 HB2 SER A 102 7.938 -9.749 -24.299 1.00 0.00 H new ATOM 0 HB3 SER A 102 6.241 -9.448 -23.981 1.00 0.00 H new ATOM 0 HG SER A 102 6.361 -7.549 -25.278 1.00 0.00 H new ATOM 171 N LYS A 103 8.005 -5.692 -22.759 1.00 0.00 N ATOM 172 CA LYS A 103 7.752 -4.253 -23.046 1.00 0.00 C ATOM 173 C LYS A 103 6.248 -3.976 -22.984 1.00 0.00 C ATOM 174 O LYS A 103 5.609 -3.737 -23.990 1.00 0.00 O ATOM 175 CB LYS A 103 8.277 -3.913 -24.441 1.00 0.00 C ATOM 176 CG LYS A 103 8.155 -2.408 -24.681 1.00 0.00 C ATOM 177 CD LYS A 103 7.481 -2.160 -26.031 1.00 0.00 C ATOM 178 CE LYS A 103 7.707 -0.708 -26.456 1.00 0.00 C ATOM 179 NZ LYS A 103 7.356 -0.552 -27.896 1.00 0.00 N ATOM 0 H LYS A 103 8.772 -5.878 -22.112 1.00 0.00 H new ATOM 0 HA LYS A 103 8.264 -3.639 -22.305 1.00 0.00 H new ATOM 0 HB2 LYS A 103 9.318 -4.223 -24.535 1.00 0.00 H new ATOM 0 HB3 LYS A 103 7.712 -4.459 -25.196 1.00 0.00 H new ATOM 0 HG2 LYS A 103 7.574 -1.948 -23.882 1.00 0.00 H new ATOM 0 HG3 LYS A 103 9.142 -1.945 -24.665 1.00 0.00 H new ATOM 0 HD2 LYS A 103 7.888 -2.837 -26.782 1.00 0.00 H new ATOM 0 HD3 LYS A 103 6.413 -2.367 -25.960 1.00 0.00 H new ATOM 0 HE2 LYS A 103 7.097 -0.040 -25.847 1.00 0.00 H new ATOM 0 HE3 LYS A 103 8.747 -0.427 -26.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 7.509 0.435 -28.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 7.956 -1.178 -28.469 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 6.357 -0.803 -28.039 1.00 0.00 H new ATOM 193 N THR A 104 5.677 -4.007 -21.812 1.00 0.00 N ATOM 194 CA THR A 104 4.217 -3.744 -21.688 1.00 0.00 C ATOM 195 C THR A 104 3.993 -2.503 -20.823 1.00 0.00 C ATOM 196 O THR A 104 3.453 -1.537 -21.336 1.00 0.00 O ATOM 197 CB THR A 104 3.533 -4.948 -21.038 1.00 0.00 C ATOM 198 OG1 THR A 104 4.389 -6.079 -21.123 1.00 0.00 O ATOM 199 CG2 THR A 104 2.218 -5.242 -21.762 1.00 0.00 C ATOM 200 OXT THR A 104 4.366 -2.539 -19.661 1.00 0.00 O ATOM 0 H THR A 104 6.159 -4.203 -20.935 1.00 0.00 H new ATOM 0 HA THR A 104 3.794 -3.578 -22.679 1.00 0.00 H new ATOM 0 HB THR A 104 3.325 -4.728 -19.991 1.00 0.00 H new ATOM 0 HG1 THR A 104 4.323 -6.473 -22.018 1.00 0.00 H new ATOM 0 HG21 THR A 104 1.731 -6.100 -21.298 1.00 0.00 H new ATOM 0 HG22 THR A 104 1.563 -4.373 -21.694 1.00 0.00 H new ATOM 0 HG23 THR A 104 2.421 -5.463 -22.810 1.00 0.00 H new TER 208 THR A 104 ATOM 209 N VAL B 84 -23.634 -7.860 -0.939 1.00 0.00 N ATOM 210 CA VAL B 84 -23.640 -9.216 -1.555 1.00 0.00 C ATOM 211 C VAL B 84 -22.856 -9.182 -2.869 1.00 0.00 C ATOM 212 O VAL B 84 -22.897 -10.108 -3.653 1.00 0.00 O ATOM 213 CB VAL B 84 -25.082 -9.645 -1.829 1.00 0.00 C ATOM 214 CG1 VAL B 84 -25.883 -9.601 -0.525 1.00 0.00 C ATOM 215 CG2 VAL B 84 -25.713 -8.691 -2.846 1.00 0.00 C ATOM 0 HA VAL B 84 -23.174 -9.928 -0.874 1.00 0.00 H new ATOM 0 HB VAL B 84 -25.090 -10.659 -2.228 1.00 0.00 H new ATOM 0 HG11 VAL B 84 -26.911 -9.907 -0.719 1.00 0.00 H new ATOM 0 HG12 VAL B 84 -25.434 -10.279 0.201 1.00 0.00 H new ATOM 0 HG13 VAL B 84 -25.875 -8.586 -0.127 1.00 0.00 H new ATOM 0 HG21 VAL B 84 -26.741 -8.996 -3.042 1.00 0.00 H new ATOM 0 HG22 VAL B 84 -25.705 -7.677 -2.447 1.00 0.00 H new ATOM 0 HG23 VAL B 84 -25.143 -8.720 -3.774 1.00 0.00 H new ATOM 224 N THR B 85 -22.139 -8.118 -3.113 1.00 0.00 N ATOM 225 CA THR B 85 -21.347 -8.019 -4.372 1.00 0.00 C ATOM 226 C THR B 85 -20.059 -7.242 -4.092 1.00 0.00 C ATOM 227 O THR B 85 -19.805 -6.211 -4.680 1.00 0.00 O ATOM 228 CB THR B 85 -22.167 -7.283 -5.433 1.00 0.00 C ATOM 229 OG1 THR B 85 -23.551 -7.463 -5.169 1.00 0.00 O ATOM 230 CG2 THR B 85 -21.833 -7.844 -6.817 1.00 0.00 C ATOM 0 H THR B 85 -22.068 -7.311 -2.493 1.00 0.00 H new ATOM 0 HA THR B 85 -21.103 -9.018 -4.734 1.00 0.00 H new ATOM 0 HB THR B 85 -21.927 -6.220 -5.406 1.00 0.00 H new ATOM 0 HG1 THR B 85 -24.078 -6.991 -5.847 1.00 0.00 H new ATOM 0 HG21 THR B 85 -22.417 -7.319 -7.573 1.00 0.00 H new ATOM 0 HG22 THR B 85 -20.771 -7.706 -7.019 1.00 0.00 H new ATOM 0 HG23 THR B 85 -22.073 -8.907 -6.846 1.00 0.00 H new ATOM 238 N LEU B 86 -19.248 -7.729 -3.194 1.00 0.00 N ATOM 239 CA LEU B 86 -17.980 -7.018 -2.867 1.00 0.00 C ATOM 240 C LEU B 86 -16.848 -7.532 -3.762 1.00 0.00 C ATOM 241 O LEU B 86 -16.624 -8.720 -3.878 1.00 0.00 O ATOM 242 CB LEU B 86 -17.620 -7.269 -1.400 1.00 0.00 C ATOM 243 CG LEU B 86 -17.769 -5.973 -0.600 1.00 0.00 C ATOM 244 CD1 LEU B 86 -16.612 -5.030 -0.934 1.00 0.00 C ATOM 245 CD2 LEU B 86 -19.095 -5.298 -0.958 1.00 0.00 C ATOM 0 H LEU B 86 -19.409 -8.590 -2.672 1.00 0.00 H new ATOM 0 HA LEU B 86 -18.115 -5.950 -3.036 1.00 0.00 H new ATOM 0 HB2 LEU B 86 -18.268 -8.040 -0.984 1.00 0.00 H new ATOM 0 HB3 LEU B 86 -16.597 -7.638 -1.325 1.00 0.00 H new ATOM 0 HG LEU B 86 -17.755 -6.203 0.465 1.00 0.00 H new ATOM 0 HD11 LEU B 86 -16.719 -4.107 -0.364 1.00 0.00 H new ATOM 0 HD12 LEU B 86 -15.667 -5.508 -0.677 1.00 0.00 H new ATOM 0 HD13 LEU B 86 -16.625 -4.802 -2.000 1.00 0.00 H new ATOM 0 HD21 LEU B 86 -19.199 -4.375 -0.387 1.00 0.00 H new ATOM 0 HD22 LEU B 86 -19.111 -5.069 -2.024 1.00 0.00 H new ATOM 0 HD23 LEU B 86 -19.921 -5.968 -0.718 1.00 0.00 H new ATOM 257 N PHE B 87 -16.129 -6.639 -4.386 1.00 0.00 N ATOM 258 CA PHE B 87 -15.002 -7.061 -5.265 1.00 0.00 C ATOM 259 C PHE B 87 -13.819 -6.115 -5.041 1.00 0.00 C ATOM 260 O PHE B 87 -13.971 -4.910 -5.036 1.00 0.00 O ATOM 261 CB PHE B 87 -15.440 -6.996 -6.730 1.00 0.00 C ATOM 262 CG PHE B 87 -16.509 -8.031 -6.986 1.00 0.00 C ATOM 263 CD1 PHE B 87 -17.775 -7.887 -6.407 1.00 0.00 C ATOM 264 CD2 PHE B 87 -16.235 -9.134 -7.805 1.00 0.00 C ATOM 265 CE1 PHE B 87 -18.767 -8.846 -6.645 1.00 0.00 C ATOM 266 CE2 PHE B 87 -17.228 -10.092 -8.044 1.00 0.00 C ATOM 267 CZ PHE B 87 -18.494 -9.948 -7.464 1.00 0.00 C ATOM 0 H PHE B 87 -16.275 -5.631 -4.324 1.00 0.00 H new ATOM 0 HA PHE B 87 -14.710 -8.083 -5.025 1.00 0.00 H new ATOM 0 HB2 PHE B 87 -15.820 -6.001 -6.963 1.00 0.00 H new ATOM 0 HB3 PHE B 87 -14.586 -7.172 -7.384 1.00 0.00 H new ATOM 0 HD1 PHE B 87 -17.987 -7.036 -5.777 1.00 0.00 H new ATOM 0 HD2 PHE B 87 -15.258 -9.245 -8.252 1.00 0.00 H new ATOM 0 HE1 PHE B 87 -19.743 -8.735 -6.197 1.00 0.00 H new ATOM 0 HE2 PHE B 87 -17.017 -10.942 -8.676 1.00 0.00 H new ATOM 0 HZ PHE B 87 -19.260 -10.687 -7.648 1.00 0.00 H new ATOM 277 N VAL B 88 -12.643 -6.648 -4.846 1.00 0.00 N ATOM 278 CA VAL B 88 -11.459 -5.772 -4.612 1.00 0.00 C ATOM 279 C VAL B 88 -10.749 -5.486 -5.936 1.00 0.00 C ATOM 280 O VAL B 88 -10.843 -6.245 -6.881 1.00 0.00 O ATOM 281 CB VAL B 88 -10.487 -6.474 -3.662 1.00 0.00 C ATOM 282 CG1 VAL B 88 -9.607 -5.432 -2.966 1.00 0.00 C ATOM 283 CG2 VAL B 88 -11.276 -7.258 -2.611 1.00 0.00 C ATOM 0 H VAL B 88 -12.451 -7.650 -4.839 1.00 0.00 H new ATOM 0 HA VAL B 88 -11.793 -4.832 -4.173 1.00 0.00 H new ATOM 0 HB VAL B 88 -9.858 -7.159 -4.230 1.00 0.00 H new ATOM 0 HG11 VAL B 88 -8.915 -5.934 -2.289 1.00 0.00 H new ATOM 0 HG12 VAL B 88 -9.043 -4.874 -3.714 1.00 0.00 H new ATOM 0 HG13 VAL B 88 -10.235 -4.745 -2.399 1.00 0.00 H new ATOM 0 HG21 VAL B 88 -10.583 -7.758 -1.934 1.00 0.00 H new ATOM 0 HG22 VAL B 88 -11.907 -6.573 -2.044 1.00 0.00 H new ATOM 0 HG23 VAL B 88 -11.901 -8.002 -3.105 1.00 0.00 H new ATOM 293 N ALA B 89 -10.028 -4.398 -6.005 1.00 0.00 N ATOM 294 CA ALA B 89 -9.297 -4.060 -7.260 1.00 0.00 C ATOM 295 C ALA B 89 -7.944 -4.774 -7.254 1.00 0.00 C ATOM 296 O ALA B 89 -7.099 -4.519 -6.420 1.00 0.00 O ATOM 297 CB ALA B 89 -9.084 -2.546 -7.333 1.00 0.00 C ATOM 0 H ALA B 89 -9.914 -3.728 -5.244 1.00 0.00 H new ATOM 0 HA ALA B 89 -9.876 -4.381 -8.126 1.00 0.00 H new ATOM 0 HB1 ALA B 89 -8.550 -2.298 -8.250 1.00 0.00 H new ATOM 0 HB2 ALA B 89 -10.050 -2.042 -7.328 1.00 0.00 H new ATOM 0 HB3 ALA B 89 -8.500 -2.219 -6.473 1.00 0.00 H new ATOM 303 N LEU B 100 -7.739 -5.682 -8.170 1.00 0.00 N ATOM 304 CA LEU B 100 -6.449 -6.430 -8.211 1.00 0.00 C ATOM 305 C LEU B 100 -5.358 -5.578 -8.863 1.00 0.00 C ATOM 306 O LEU B 100 -4.210 -5.974 -8.929 1.00 0.00 O ATOM 307 CB LEU B 100 -6.638 -7.711 -9.024 1.00 0.00 C ATOM 308 CG LEU B 100 -7.968 -8.367 -8.648 1.00 0.00 C ATOM 309 CD1 LEU B 100 -8.815 -8.563 -9.907 1.00 0.00 C ATOM 310 CD2 LEU B 100 -7.699 -9.726 -8.000 1.00 0.00 C ATOM 0 H LEU B 100 -8.411 -5.939 -8.893 1.00 0.00 H new ATOM 0 HA LEU B 100 -6.147 -6.671 -7.192 1.00 0.00 H new ATOM 0 HB2 LEU B 100 -6.622 -7.483 -10.090 1.00 0.00 H new ATOM 0 HB3 LEU B 100 -5.815 -8.399 -8.833 1.00 0.00 H new ATOM 0 HG LEU B 100 -8.503 -7.727 -7.946 1.00 0.00 H new ATOM 0 HD11 LEU B 100 -9.763 -9.030 -9.639 1.00 0.00 H new ATOM 0 HD12 LEU B 100 -9.006 -7.595 -10.371 1.00 0.00 H new ATOM 0 HD13 LEU B 100 -8.281 -9.203 -10.609 1.00 0.00 H new ATOM 0 HD21 LEU B 100 -8.646 -10.195 -7.731 1.00 0.00 H new ATOM 0 HD22 LEU B 100 -7.164 -10.365 -8.703 1.00 0.00 H new ATOM 0 HD23 LEU B 100 -7.095 -9.588 -7.103 1.00 0.00 H new ATOM 322 N TYR B 101 -5.696 -4.418 -9.350 1.00 0.00 N ATOM 323 CA TYR B 101 -4.663 -3.560 -9.999 1.00 0.00 C ATOM 324 C TYR B 101 -4.994 -2.084 -9.772 1.00 0.00 C ATOM 325 O TYR B 101 -6.140 -1.710 -9.626 1.00 0.00 O ATOM 326 CB TYR B 101 -4.629 -3.848 -11.503 1.00 0.00 C ATOM 327 CG TYR B 101 -3.856 -5.121 -11.756 1.00 0.00 C ATOM 328 CD1 TYR B 101 -2.466 -5.140 -11.587 1.00 0.00 C ATOM 329 CD2 TYR B 101 -4.528 -6.281 -12.160 1.00 0.00 C ATOM 330 CE1 TYR B 101 -1.749 -6.320 -11.822 1.00 0.00 C ATOM 331 CE2 TYR B 101 -3.811 -7.460 -12.395 1.00 0.00 C ATOM 332 CZ TYR B 101 -2.421 -7.479 -12.226 1.00 0.00 C ATOM 333 OH TYR B 101 -1.714 -8.642 -12.458 1.00 0.00 O ATOM 0 H TYR B 101 -6.638 -4.027 -9.328 1.00 0.00 H new ATOM 0 HA TYR B 101 -3.689 -3.781 -9.562 1.00 0.00 H new ATOM 0 HB2 TYR B 101 -5.644 -3.944 -11.889 1.00 0.00 H new ATOM 0 HB3 TYR B 101 -4.164 -3.017 -12.033 1.00 0.00 H new ATOM 0 HD1 TYR B 101 -1.947 -4.245 -11.276 1.00 0.00 H new ATOM 0 HD2 TYR B 101 -5.600 -6.266 -12.290 1.00 0.00 H new ATOM 0 HE1 TYR B 101 -0.677 -6.335 -11.691 1.00 0.00 H new ATOM 0 HE2 TYR B 101 -4.330 -8.355 -12.707 1.00 0.00 H new ATOM 0 HH TYR B 101 -2.332 -9.352 -12.730 1.00 0.00 H new ATOM 343 N ASP B 102 -3.996 -1.243 -9.746 1.00 0.00 N ATOM 344 CA ASP B 102 -4.248 0.210 -9.534 1.00 0.00 C ATOM 345 C ASP B 102 -4.780 0.825 -10.829 1.00 0.00 C ATOM 346 O ASP B 102 -4.666 0.247 -11.892 1.00 0.00 O ATOM 347 CB ASP B 102 -2.941 0.903 -9.141 1.00 0.00 C ATOM 348 CG ASP B 102 -1.861 0.580 -10.175 1.00 0.00 C ATOM 349 OD1 ASP B 102 -1.885 1.184 -11.236 1.00 0.00 O ATOM 350 OD2 ASP B 102 -1.028 -0.263 -9.890 1.00 0.00 O ATOM 0 H ASP B 102 -3.016 -1.500 -9.863 1.00 0.00 H new ATOM 0 HA ASP B 102 -4.981 0.341 -8.738 1.00 0.00 H new ATOM 0 HB2 ASP B 102 -3.092 1.981 -9.082 1.00 0.00 H new ATOM 0 HB3 ASP B 102 -2.624 0.571 -8.152 1.00 0.00 H new ATOM 355 N TYR B 103 -5.359 1.991 -10.752 1.00 0.00 N ATOM 356 CA TYR B 103 -5.894 2.639 -11.983 1.00 0.00 C ATOM 357 C TYR B 103 -6.085 4.134 -11.729 1.00 0.00 C ATOM 358 O TYR B 103 -6.449 4.549 -10.646 1.00 0.00 O ATOM 359 CB TYR B 103 -7.239 2.010 -12.350 1.00 0.00 C ATOM 360 CG TYR B 103 -7.879 2.804 -13.464 1.00 0.00 C ATOM 361 CD1 TYR B 103 -7.415 2.667 -14.777 1.00 0.00 C ATOM 362 CD2 TYR B 103 -8.938 3.677 -13.183 1.00 0.00 C ATOM 363 CE1 TYR B 103 -8.009 3.403 -15.810 1.00 0.00 C ATOM 364 CE2 TYR B 103 -9.531 4.412 -14.216 1.00 0.00 C ATOM 365 CZ TYR B 103 -9.068 4.275 -15.530 1.00 0.00 C ATOM 366 OH TYR B 103 -9.654 4.998 -16.548 1.00 0.00 O ATOM 0 H TYR B 103 -5.485 2.523 -9.891 1.00 0.00 H new ATOM 0 HA TYR B 103 -5.190 2.495 -12.803 1.00 0.00 H new ATOM 0 HB2 TYR B 103 -7.096 0.976 -12.662 1.00 0.00 H new ATOM 0 HB3 TYR B 103 -7.894 1.992 -11.479 1.00 0.00 H new ATOM 0 HD1 TYR B 103 -6.599 1.994 -14.994 1.00 0.00 H new ATOM 0 HD2 TYR B 103 -9.297 3.783 -12.170 1.00 0.00 H new ATOM 0 HE1 TYR B 103 -7.650 3.298 -16.823 1.00 0.00 H new ATOM 0 HE2 TYR B 103 -10.347 5.086 -13.999 1.00 0.00 H new ATOM 0 HH TYR B 103 -10.374 5.553 -16.182 1.00 0.00 H new ATOM 376 N GLU B 104 -5.841 4.949 -12.718 1.00 0.00 N ATOM 377 CA GLU B 104 -6.007 6.417 -12.532 1.00 0.00 C ATOM 378 C GLU B 104 -7.206 6.903 -13.349 1.00 0.00 C ATOM 379 O GLU B 104 -7.245 6.767 -14.555 1.00 0.00 O ATOM 380 CB GLU B 104 -4.744 7.137 -13.006 1.00 0.00 C ATOM 381 CG GLU B 104 -3.515 6.287 -12.676 1.00 0.00 C ATOM 382 CD GLU B 104 -2.252 7.134 -12.850 1.00 0.00 C ATOM 383 OE1 GLU B 104 -2.137 8.136 -12.163 1.00 0.00 O ATOM 384 OE2 GLU B 104 -1.424 6.767 -13.667 1.00 0.00 O ATOM 0 H GLU B 104 -5.534 4.661 -13.647 1.00 0.00 H new ATOM 0 HA GLU B 104 -6.175 6.632 -11.477 1.00 0.00 H new ATOM 0 HB2 GLU B 104 -4.797 7.317 -14.080 1.00 0.00 H new ATOM 0 HB3 GLU B 104 -4.665 8.111 -12.523 1.00 0.00 H new ATOM 0 HG2 GLU B 104 -3.580 5.916 -11.653 1.00 0.00 H new ATOM 0 HG3 GLU B 104 -3.475 5.416 -13.330 1.00 0.00 H new ATOM 391 N ALA B 105 -8.187 7.467 -12.699 1.00 0.00 N ATOM 392 CA ALA B 105 -9.383 7.960 -13.436 1.00 0.00 C ATOM 393 C ALA B 105 -8.964 9.038 -14.437 1.00 0.00 C ATOM 394 O ALA B 105 -8.462 10.081 -14.068 1.00 0.00 O ATOM 395 CB ALA B 105 -10.387 8.552 -12.443 1.00 0.00 C ATOM 0 H ALA B 105 -8.211 7.607 -11.689 1.00 0.00 H new ATOM 0 HA ALA B 105 -9.844 7.129 -13.970 1.00 0.00 H new ATOM 0 HB1 ALA B 105 -11.263 8.913 -12.983 1.00 0.00 H new ATOM 0 HB2 ALA B 105 -10.690 7.784 -11.731 1.00 0.00 H new ATOM 0 HB3 ALA B 105 -9.924 9.381 -11.908 1.00 0.00 H new ATOM 401 N ARG B 106 -9.170 8.797 -15.704 1.00 0.00 N ATOM 402 CA ARG B 106 -8.790 9.810 -16.729 1.00 0.00 C ATOM 403 C ARG B 106 -9.999 10.694 -17.037 1.00 0.00 C ATOM 404 O ARG B 106 -9.872 11.764 -17.597 1.00 0.00 O ATOM 405 CB ARG B 106 -8.339 9.099 -18.007 1.00 0.00 C ATOM 406 CG ARG B 106 -7.293 8.037 -17.662 1.00 0.00 C ATOM 407 CD ARG B 106 -7.432 6.854 -18.621 1.00 0.00 C ATOM 408 NE ARG B 106 -6.633 5.705 -18.109 1.00 0.00 N ATOM 409 CZ ARG B 106 -5.611 5.264 -18.791 1.00 0.00 C ATOM 410 NH1 ARG B 106 -4.810 6.106 -19.385 1.00 0.00 N ATOM 411 NH2 ARG B 106 -5.391 3.981 -18.879 1.00 0.00 N ATOM 0 H ARG B 106 -9.585 7.942 -16.073 1.00 0.00 H new ATOM 0 HA ARG B 106 -7.974 10.425 -16.350 1.00 0.00 H new ATOM 0 HB2 ARG B 106 -9.194 8.635 -18.498 1.00 0.00 H new ATOM 0 HB3 ARG B 106 -7.921 9.821 -18.709 1.00 0.00 H new ATOM 0 HG2 ARG B 106 -6.291 8.461 -17.733 1.00 0.00 H new ATOM 0 HG3 ARG B 106 -7.425 7.702 -16.633 1.00 0.00 H new ATOM 0 HD2 ARG B 106 -8.480 6.569 -18.715 1.00 0.00 H new ATOM 0 HD3 ARG B 106 -7.088 7.136 -19.616 1.00 0.00 H new ATOM 0 HE ARG B 106 -6.885 5.263 -17.225 1.00 0.00 H new ATOM 0 HH11 ARG B 106 -4.982 7.109 -19.316 1.00 0.00 H new ATOM 0 HH12 ARG B 106 -4.012 5.761 -19.918 1.00 0.00 H new ATOM 0 HH21 ARG B 106 -6.017 3.323 -18.415 1.00 0.00 H new ATOM 0 HH22 ARG B 106 -4.593 3.636 -19.412 1.00 0.00 H new ATOM 425 N THR B 107 -11.171 10.253 -16.673 1.00 0.00 N ATOM 426 CA THR B 107 -12.389 11.066 -16.941 1.00 0.00 C ATOM 427 C THR B 107 -13.205 11.196 -15.653 1.00 0.00 C ATOM 428 O THR B 107 -12.941 10.531 -14.671 1.00 0.00 O ATOM 429 CB THR B 107 -13.234 10.380 -18.017 1.00 0.00 C ATOM 430 OG1 THR B 107 -14.365 11.185 -18.313 1.00 0.00 O ATOM 431 CG2 THR B 107 -13.697 9.012 -17.510 1.00 0.00 C ATOM 0 H THR B 107 -11.338 9.364 -16.201 1.00 0.00 H new ATOM 0 HA THR B 107 -12.098 12.057 -17.288 1.00 0.00 H new ATOM 0 HB THR B 107 -12.636 10.247 -18.919 1.00 0.00 H new ATOM 0 HG1 THR B 107 -14.906 10.748 -19.003 1.00 0.00 H new ATOM 0 HG21 THR B 107 -14.299 8.524 -18.277 1.00 0.00 H new ATOM 0 HG22 THR B 107 -12.828 8.395 -17.284 1.00 0.00 H new ATOM 0 HG23 THR B 107 -14.295 9.142 -16.608 1.00 0.00 H new ATOM 439 N GLU B 108 -14.193 12.046 -15.648 1.00 0.00 N ATOM 440 CA GLU B 108 -15.022 12.216 -14.421 1.00 0.00 C ATOM 441 C GLU B 108 -16.035 11.073 -14.322 1.00 0.00 C ATOM 442 O GLU B 108 -16.743 10.942 -13.345 1.00 0.00 O ATOM 443 CB GLU B 108 -15.766 13.550 -14.490 1.00 0.00 C ATOM 444 CG GLU B 108 -16.801 13.499 -15.616 1.00 0.00 C ATOM 445 CD GLU B 108 -17.386 14.896 -15.836 1.00 0.00 C ATOM 446 OE1 GLU B 108 -16.762 15.675 -16.536 1.00 0.00 O ATOM 447 OE2 GLU B 108 -18.448 15.162 -15.297 1.00 0.00 O ATOM 0 H GLU B 108 -14.463 12.630 -16.439 1.00 0.00 H new ATOM 0 HA GLU B 108 -14.375 12.203 -13.544 1.00 0.00 H new ATOM 0 HB2 GLU B 108 -16.257 13.754 -13.539 1.00 0.00 H new ATOM 0 HB3 GLU B 108 -15.061 14.363 -14.666 1.00 0.00 H new ATOM 0 HG2 GLU B 108 -16.337 13.139 -16.534 1.00 0.00 H new ATOM 0 HG3 GLU B 108 -17.595 12.796 -15.363 1.00 0.00 H new ATOM 454 N ASP B 109 -16.110 10.243 -15.328 1.00 0.00 N ATOM 455 CA ASP B 109 -17.078 9.112 -15.289 1.00 0.00 C ATOM 456 C ASP B 109 -16.349 7.829 -14.886 1.00 0.00 C ATOM 457 O ASP B 109 -16.822 6.735 -15.119 1.00 0.00 O ATOM 458 CB ASP B 109 -17.703 8.932 -16.673 1.00 0.00 C ATOM 459 CG ASP B 109 -18.633 10.109 -16.970 1.00 0.00 C ATOM 460 OD1 ASP B 109 -18.241 11.231 -16.694 1.00 0.00 O ATOM 461 OD2 ASP B 109 -19.720 9.869 -17.470 1.00 0.00 O ATOM 0 H ASP B 109 -15.543 10.300 -16.174 1.00 0.00 H new ATOM 0 HA ASP B 109 -17.860 9.327 -14.561 1.00 0.00 H new ATOM 0 HB2 ASP B 109 -16.922 8.871 -17.431 1.00 0.00 H new ATOM 0 HB3 ASP B 109 -18.260 7.996 -16.713 1.00 0.00 H new ATOM 466 N ASP B 110 -15.201 7.955 -14.279 1.00 0.00 N ATOM 467 CA ASP B 110 -14.441 6.743 -13.861 1.00 0.00 C ATOM 468 C ASP B 110 -13.999 6.896 -12.405 1.00 0.00 C ATOM 469 O ASP B 110 -14.270 7.892 -11.765 1.00 0.00 O ATOM 470 CB ASP B 110 -13.210 6.583 -14.754 1.00 0.00 C ATOM 471 CG ASP B 110 -13.020 5.105 -15.098 1.00 0.00 C ATOM 472 OD1 ASP B 110 -13.570 4.677 -16.098 1.00 0.00 O ATOM 473 OD2 ASP B 110 -12.328 4.428 -14.356 1.00 0.00 O ATOM 0 H ASP B 110 -14.756 8.845 -14.054 1.00 0.00 H new ATOM 0 HA ASP B 110 -15.077 5.863 -13.956 1.00 0.00 H new ATOM 0 HB2 ASP B 110 -13.331 7.167 -15.666 1.00 0.00 H new ATOM 0 HB3 ASP B 110 -12.326 6.966 -14.245 1.00 0.00 H new ATOM 478 N LEU B 111 -13.319 5.916 -11.874 1.00 0.00 N ATOM 479 CA LEU B 111 -12.863 6.011 -10.458 1.00 0.00 C ATOM 480 C LEU B 111 -11.359 5.734 -10.384 1.00 0.00 C ATOM 481 O LEU B 111 -10.760 5.241 -11.320 1.00 0.00 O ATOM 482 CB LEU B 111 -13.607 4.979 -9.606 1.00 0.00 C ATOM 483 CG LEU B 111 -15.116 5.164 -9.769 1.00 0.00 C ATOM 484 CD1 LEU B 111 -15.819 3.821 -9.560 1.00 0.00 C ATOM 485 CD2 LEU B 111 -15.620 6.168 -8.730 1.00 0.00 C ATOM 0 H LEU B 111 -13.060 5.056 -12.358 1.00 0.00 H new ATOM 0 HA LEU B 111 -13.071 7.013 -10.082 1.00 0.00 H new ATOM 0 HB2 LEU B 111 -13.320 3.971 -9.906 1.00 0.00 H new ATOM 0 HB3 LEU B 111 -13.329 5.090 -8.558 1.00 0.00 H new ATOM 0 HG LEU B 111 -15.331 5.536 -10.771 1.00 0.00 H new ATOM 0 HD11 LEU B 111 -16.895 3.952 -9.676 1.00 0.00 H new ATOM 0 HD12 LEU B 111 -15.459 3.103 -10.297 1.00 0.00 H new ATOM 0 HD13 LEU B 111 -15.604 3.450 -8.558 1.00 0.00 H new ATOM 0 HD21 LEU B 111 -16.696 6.301 -8.845 1.00 0.00 H new ATOM 0 HD22 LEU B 111 -15.405 5.794 -7.729 1.00 0.00 H new ATOM 0 HD23 LEU B 111 -15.118 7.125 -8.875 1.00 0.00 H new ATOM 497 N SER B 112 -10.747 6.042 -9.274 1.00 0.00 N ATOM 498 CA SER B 112 -9.285 5.792 -9.129 1.00 0.00 C ATOM 499 C SER B 112 -9.043 4.977 -7.858 1.00 0.00 C ATOM 500 O SER B 112 -9.790 5.066 -6.904 1.00 0.00 O ATOM 501 CB SER B 112 -8.545 7.125 -9.032 1.00 0.00 C ATOM 502 OG SER B 112 -7.318 7.034 -9.743 1.00 0.00 O ATOM 0 H SER B 112 -11.198 6.457 -8.459 1.00 0.00 H new ATOM 0 HA SER B 112 -8.918 5.241 -9.995 1.00 0.00 H new ATOM 0 HB2 SER B 112 -9.159 7.926 -9.444 1.00 0.00 H new ATOM 0 HB3 SER B 112 -8.356 7.374 -7.988 1.00 0.00 H new ATOM 0 HG SER B 112 -7.104 6.092 -9.906 1.00 0.00 H new ATOM 508 N PHE B 113 -8.012 4.177 -7.834 1.00 0.00 N ATOM 509 CA PHE B 113 -7.743 3.359 -6.618 1.00 0.00 C ATOM 510 C PHE B 113 -6.445 2.569 -6.795 1.00 0.00 C ATOM 511 O PHE B 113 -5.769 2.677 -7.799 1.00 0.00 O ATOM 512 CB PHE B 113 -8.899 2.382 -6.403 1.00 0.00 C ATOM 513 CG PHE B 113 -9.194 1.665 -7.700 1.00 0.00 C ATOM 514 CD1 PHE B 113 -8.449 0.536 -8.060 1.00 0.00 C ATOM 515 CD2 PHE B 113 -10.211 2.130 -8.542 1.00 0.00 C ATOM 516 CE1 PHE B 113 -8.721 -0.128 -9.263 1.00 0.00 C ATOM 517 CE2 PHE B 113 -10.483 1.466 -9.743 1.00 0.00 C ATOM 518 CZ PHE B 113 -9.738 0.337 -10.104 1.00 0.00 C ATOM 0 H PHE B 113 -7.348 4.055 -8.599 1.00 0.00 H new ATOM 0 HA PHE B 113 -7.647 4.020 -5.756 1.00 0.00 H new ATOM 0 HB2 PHE B 113 -8.642 1.662 -5.626 1.00 0.00 H new ATOM 0 HB3 PHE B 113 -9.784 2.918 -6.061 1.00 0.00 H new ATOM 0 HD1 PHE B 113 -7.665 0.177 -7.410 1.00 0.00 H new ATOM 0 HD2 PHE B 113 -10.786 3.001 -8.265 1.00 0.00 H new ATOM 0 HE1 PHE B 113 -8.146 -0.999 -9.541 1.00 0.00 H new ATOM 0 HE2 PHE B 113 -11.268 1.825 -10.392 1.00 0.00 H new ATOM 0 HZ PHE B 113 -9.948 -0.175 -11.031 1.00 0.00 H new ATOM 528 N HIS B 114 -6.101 1.770 -5.823 1.00 0.00 N ATOM 529 CA HIS B 114 -4.854 0.960 -5.920 1.00 0.00 C ATOM 530 C HIS B 114 -5.162 -0.482 -5.510 1.00 0.00 C ATOM 531 O HIS B 114 -6.138 -0.749 -4.839 1.00 0.00 O ATOM 532 CB HIS B 114 -3.794 1.540 -4.981 1.00 0.00 C ATOM 533 CG HIS B 114 -3.325 2.867 -5.509 1.00 0.00 C ATOM 534 ND1 HIS B 114 -2.658 3.215 -6.658 1.00 0.00 N flip ATOM 535 CD2 HIS B 114 -3.530 4.052 -4.818 1.00 0.00 C flip ATOM 536 CE1 HIS B 114 -2.451 4.591 -6.682 1.00 0.00 C flip ATOM 537 NE2 HIS B 114 -2.995 5.046 -5.551 1.00 0.00 N flip ATOM 0 H HIS B 114 -6.632 1.643 -4.962 1.00 0.00 H new ATOM 0 HA HIS B 114 -4.480 0.981 -6.944 1.00 0.00 H new ATOM 0 HB2 HIS B 114 -4.208 1.661 -3.980 1.00 0.00 H new ATOM 0 HB3 HIS B 114 -2.952 0.852 -4.897 1.00 0.00 H new ATOM 0 HD2 HIS B 114 -4.028 4.158 -3.866 1.00 0.00 H new ATOM 0 HE1 HIS B 114 -1.957 5.167 -7.450 1.00 0.00 H new ATOM 0 HE2 HIS B 114 -3.004 6.028 -5.276 1.00 0.00 H new ATOM 545 N LYS B 115 -4.339 -1.413 -5.904 1.00 0.00 N ATOM 546 CA LYS B 115 -4.592 -2.834 -5.532 1.00 0.00 C ATOM 547 C LYS B 115 -4.899 -2.922 -4.033 1.00 0.00 C ATOM 548 O LYS B 115 -4.089 -2.561 -3.203 1.00 0.00 O ATOM 549 CB LYS B 115 -3.352 -3.672 -5.845 1.00 0.00 C ATOM 550 CG LYS B 115 -2.222 -3.292 -4.885 1.00 0.00 C ATOM 551 CD LYS B 115 -0.894 -3.252 -5.644 1.00 0.00 C ATOM 552 CE LYS B 115 0.111 -2.391 -4.875 1.00 0.00 C ATOM 553 NZ LYS B 115 0.716 -1.391 -5.799 1.00 0.00 N ATOM 0 H LYS B 115 -3.503 -1.253 -6.467 1.00 0.00 H new ATOM 0 HA LYS B 115 -5.441 -3.212 -6.102 1.00 0.00 H new ATOM 0 HB2 LYS B 115 -3.583 -4.733 -5.749 1.00 0.00 H new ATOM 0 HB3 LYS B 115 -3.039 -3.506 -6.876 1.00 0.00 H new ATOM 0 HG2 LYS B 115 -2.425 -2.320 -4.436 1.00 0.00 H new ATOM 0 HG3 LYS B 115 -2.165 -4.014 -4.071 1.00 0.00 H new ATOM 0 HD2 LYS B 115 -0.503 -4.262 -5.767 1.00 0.00 H new ATOM 0 HD3 LYS B 115 -1.047 -2.845 -6.644 1.00 0.00 H new ATOM 0 HE2 LYS B 115 -0.386 -1.884 -4.048 1.00 0.00 H new ATOM 0 HE3 LYS B 115 0.889 -3.020 -4.442 1.00 0.00 H new ATOM 0 HZ1 LYS B 115 1.399 -0.805 -5.278 1.00 0.00 H new ATOM 0 HZ2 LYS B 115 1.203 -1.885 -6.574 1.00 0.00 H new ATOM 0 HZ3 LYS B 115 -0.032 -0.784 -6.192 1.00 0.00 H new ATOM 567 N GLY B 116 -6.061 -3.403 -3.679 1.00 0.00 N ATOM 568 CA GLY B 116 -6.409 -3.517 -2.234 1.00 0.00 C ATOM 569 C GLY B 116 -7.605 -2.616 -1.914 1.00 0.00 C ATOM 570 O GLY B 116 -8.048 -2.538 -0.786 1.00 0.00 O ATOM 0 H GLY B 116 -6.782 -3.721 -4.327 1.00 0.00 H new ATOM 0 HA2 GLY B 116 -6.646 -4.552 -1.989 1.00 0.00 H new ATOM 0 HA3 GLY B 116 -5.554 -3.232 -1.621 1.00 0.00 H new ATOM 574 N GLU B 117 -8.130 -1.934 -2.895 1.00 0.00 N ATOM 575 CA GLU B 117 -9.295 -1.039 -2.640 1.00 0.00 C ATOM 576 C GLU B 117 -10.597 -1.814 -2.857 1.00 0.00 C ATOM 577 O GLU B 117 -10.851 -2.330 -3.927 1.00 0.00 O ATOM 578 CB GLU B 117 -9.242 0.147 -3.603 1.00 0.00 C ATOM 579 CG GLU B 117 -9.645 1.423 -2.861 1.00 0.00 C ATOM 580 CD GLU B 117 -8.392 2.119 -2.324 1.00 0.00 C ATOM 581 OE1 GLU B 117 -7.788 2.869 -3.073 1.00 0.00 O ATOM 582 OE2 GLU B 117 -8.060 1.891 -1.173 1.00 0.00 O ATOM 0 H GLU B 117 -7.803 -1.958 -3.861 1.00 0.00 H new ATOM 0 HA GLU B 117 -9.257 -0.678 -1.612 1.00 0.00 H new ATOM 0 HB2 GLU B 117 -8.237 0.253 -4.012 1.00 0.00 H new ATOM 0 HB3 GLU B 117 -9.912 -0.024 -4.445 1.00 0.00 H new ATOM 0 HG2 GLU B 117 -10.186 2.091 -3.532 1.00 0.00 H new ATOM 0 HG3 GLU B 117 -10.320 1.181 -2.040 1.00 0.00 H new ATOM 589 N LYS B 118 -11.425 -1.897 -1.851 1.00 0.00 N ATOM 590 CA LYS B 118 -12.711 -2.635 -2.002 1.00 0.00 C ATOM 591 C LYS B 118 -13.641 -1.845 -2.928 1.00 0.00 C ATOM 592 O LYS B 118 -13.497 -0.650 -3.093 1.00 0.00 O ATOM 593 CB LYS B 118 -13.371 -2.795 -0.630 1.00 0.00 C ATOM 594 CG LYS B 118 -12.960 -4.134 -0.016 1.00 0.00 C ATOM 595 CD LYS B 118 -11.488 -4.076 0.398 1.00 0.00 C ATOM 596 CE LYS B 118 -11.386 -4.066 1.926 1.00 0.00 C ATOM 597 NZ LYS B 118 -10.350 -5.046 2.360 1.00 0.00 N ATOM 0 H LYS B 118 -11.266 -1.486 -0.931 1.00 0.00 H new ATOM 0 HA LYS B 118 -12.520 -3.620 -2.429 1.00 0.00 H new ATOM 0 HB2 LYS B 118 -13.074 -1.976 0.025 1.00 0.00 H new ATOM 0 HB3 LYS B 118 -14.455 -2.746 -0.729 1.00 0.00 H new ATOM 0 HG2 LYS B 118 -13.584 -4.356 0.850 1.00 0.00 H new ATOM 0 HG3 LYS B 118 -13.115 -4.939 -0.735 1.00 0.00 H new ATOM 0 HD2 LYS B 118 -10.951 -4.934 -0.007 1.00 0.00 H new ATOM 0 HD3 LYS B 118 -11.018 -3.183 -0.014 1.00 0.00 H new ATOM 0 HE2 LYS B 118 -11.127 -3.067 2.278 1.00 0.00 H new ATOM 0 HE3 LYS B 118 -12.350 -4.320 2.367 1.00 0.00 H new ATOM 0 HZ1 LYS B 118 -10.280 -5.040 3.398 1.00 0.00 H new ATOM 0 HZ2 LYS B 118 -10.615 -5.998 2.036 1.00 0.00 H new ATOM 0 HZ3 LYS B 118 -9.431 -4.784 1.949 1.00 0.00 H new ATOM 611 N PHE B 119 -14.590 -2.502 -3.539 1.00 0.00 N ATOM 612 CA PHE B 119 -15.520 -1.780 -4.456 1.00 0.00 C ATOM 613 C PHE B 119 -16.898 -2.444 -4.428 1.00 0.00 C ATOM 614 O PHE B 119 -17.017 -3.653 -4.458 1.00 0.00 O ATOM 615 CB PHE B 119 -14.966 -1.828 -5.881 1.00 0.00 C ATOM 616 CG PHE B 119 -13.970 -0.710 -6.069 1.00 0.00 C ATOM 617 CD1 PHE B 119 -14.412 0.617 -6.143 1.00 0.00 C ATOM 618 CD2 PHE B 119 -12.605 -1.000 -6.170 1.00 0.00 C ATOM 619 CE1 PHE B 119 -13.487 1.653 -6.317 1.00 0.00 C ATOM 620 CE2 PHE B 119 -11.680 0.036 -6.341 1.00 0.00 C ATOM 621 CZ PHE B 119 -12.122 1.362 -6.415 1.00 0.00 C ATOM 0 H PHE B 119 -14.762 -3.503 -3.444 1.00 0.00 H new ATOM 0 HA PHE B 119 -15.612 -0.744 -4.130 1.00 0.00 H new ATOM 0 HB2 PHE B 119 -14.488 -2.790 -6.065 1.00 0.00 H new ATOM 0 HB3 PHE B 119 -15.778 -1.732 -6.602 1.00 0.00 H new ATOM 0 HD1 PHE B 119 -15.466 0.841 -6.066 1.00 0.00 H new ATOM 0 HD2 PHE B 119 -12.265 -2.024 -6.116 1.00 0.00 H new ATOM 0 HE1 PHE B 119 -13.827 2.676 -6.376 1.00 0.00 H new ATOM 0 HE2 PHE B 119 -10.626 -0.187 -6.416 1.00 0.00 H new ATOM 0 HZ PHE B 119 -11.408 2.162 -6.548 1.00 0.00 H new ATOM 631 N GLN B 120 -17.944 -1.661 -4.378 1.00 0.00 N ATOM 632 CA GLN B 120 -19.314 -2.247 -4.357 1.00 0.00 C ATOM 633 C GLN B 120 -19.870 -2.285 -5.782 1.00 0.00 C ATOM 634 O GLN B 120 -20.394 -1.308 -6.279 1.00 0.00 O ATOM 635 CB GLN B 120 -20.223 -1.382 -3.480 1.00 0.00 C ATOM 636 CG GLN B 120 -20.516 -2.112 -2.168 1.00 0.00 C ATOM 637 CD GLN B 120 -22.015 -2.044 -1.873 1.00 0.00 C ATOM 638 OE1 GLN B 120 -22.800 -1.684 -2.728 1.00 0.00 O ATOM 639 NE2 GLN B 120 -22.451 -2.377 -0.688 1.00 0.00 N ATOM 0 H GLN B 120 -17.907 -0.642 -4.351 1.00 0.00 H new ATOM 0 HA GLN B 120 -19.273 -3.259 -3.953 1.00 0.00 H new ATOM 0 HB2 GLN B 120 -19.744 -0.424 -3.276 1.00 0.00 H new ATOM 0 HB3 GLN B 120 -21.154 -1.167 -4.004 1.00 0.00 H new ATOM 0 HG2 GLN B 120 -20.195 -3.151 -2.238 1.00 0.00 H new ATOM 0 HG3 GLN B 120 -19.953 -1.658 -1.353 1.00 0.00 H new ATOM 0 HE21 GLN B 120 -21.794 -2.679 0.031 1.00 0.00 H new ATOM 0 HE22 GLN B 120 -23.449 -2.335 -0.481 1.00 0.00 H new ATOM 648 N ILE B 121 -19.760 -3.404 -6.444 1.00 0.00 N ATOM 649 CA ILE B 121 -20.284 -3.498 -7.837 1.00 0.00 C ATOM 650 C ILE B 121 -21.812 -3.560 -7.806 1.00 0.00 C ATOM 651 O ILE B 121 -22.396 -4.461 -7.238 1.00 0.00 O ATOM 652 CB ILE B 121 -19.736 -4.762 -8.503 1.00 0.00 C ATOM 653 CG1 ILE B 121 -18.210 -4.671 -8.591 1.00 0.00 C ATOM 654 CG2 ILE B 121 -20.317 -4.890 -9.912 1.00 0.00 C ATOM 655 CD1 ILE B 121 -17.815 -3.386 -9.319 1.00 0.00 C ATOM 0 H ILE B 121 -19.331 -4.256 -6.082 1.00 0.00 H new ATOM 0 HA ILE B 121 -19.968 -2.622 -8.403 1.00 0.00 H new ATOM 0 HB ILE B 121 -20.017 -5.634 -7.912 1.00 0.00 H new ATOM 0 HG12 ILE B 121 -17.776 -4.683 -7.591 1.00 0.00 H new ATOM 0 HG13 ILE B 121 -17.814 -5.538 -9.120 1.00 0.00 H new ATOM 0 HG21 ILE B 121 -19.926 -5.790 -10.386 1.00 0.00 H new ATOM 0 HG22 ILE B 121 -21.404 -4.953 -9.853 1.00 0.00 H new ATOM 0 HG23 ILE B 121 -20.036 -4.018 -10.502 1.00 0.00 H new ATOM 0 HD11 ILE B 121 -16.729 -3.322 -9.381 1.00 0.00 H new ATOM 0 HD12 ILE B 121 -18.236 -3.393 -10.324 1.00 0.00 H new ATOM 0 HD13 ILE B 121 -18.198 -2.525 -8.771 1.00 0.00 H new ATOM 667 N LEU B 122 -22.464 -2.606 -8.414 1.00 0.00 N ATOM 668 CA LEU B 122 -23.955 -2.609 -8.419 1.00 0.00 C ATOM 669 C LEU B 122 -24.458 -2.954 -9.821 1.00 0.00 C ATOM 670 O LEU B 122 -25.373 -3.735 -9.990 1.00 0.00 O ATOM 671 CB LEU B 122 -24.473 -1.223 -8.020 1.00 0.00 C ATOM 672 CG LEU B 122 -23.509 -0.583 -7.019 1.00 0.00 C ATOM 673 CD1 LEU B 122 -23.860 0.896 -6.847 1.00 0.00 C ATOM 674 CD2 LEU B 122 -23.632 -1.294 -5.670 1.00 0.00 C ATOM 0 H LEU B 122 -22.029 -1.826 -8.907 1.00 0.00 H new ATOM 0 HA LEU B 122 -24.318 -3.351 -7.707 1.00 0.00 H new ATOM 0 HB2 LEU B 122 -24.568 -0.591 -8.903 1.00 0.00 H new ATOM 0 HB3 LEU B 122 -25.467 -1.308 -7.580 1.00 0.00 H new ATOM 0 HG LEU B 122 -22.488 -0.674 -7.388 1.00 0.00 H new ATOM 0 HD11 LEU B 122 -23.173 1.352 -6.134 1.00 0.00 H new ATOM 0 HD12 LEU B 122 -23.776 1.404 -7.808 1.00 0.00 H new ATOM 0 HD13 LEU B 122 -24.881 0.987 -6.477 1.00 0.00 H new ATOM 0 HD21 LEU B 122 -22.946 -0.840 -4.955 1.00 0.00 H new ATOM 0 HD22 LEU B 122 -24.654 -1.201 -5.302 1.00 0.00 H new ATOM 0 HD23 LEU B 122 -23.384 -2.349 -5.791 1.00 0.00 H new ATOM 686 N ASN B 123 -23.865 -2.375 -10.827 1.00 0.00 N ATOM 687 CA ASN B 123 -24.308 -2.667 -12.221 1.00 0.00 C ATOM 688 C ASN B 123 -23.128 -3.215 -13.026 1.00 0.00 C ATOM 689 O ASN B 123 -22.297 -2.473 -13.511 1.00 0.00 O ATOM 690 CB ASN B 123 -24.817 -1.381 -12.873 1.00 0.00 C ATOM 691 CG ASN B 123 -25.842 -1.729 -13.954 1.00 0.00 C ATOM 692 OD1 ASN B 123 -26.902 -2.242 -13.659 1.00 0.00 O ATOM 693 ND2 ASN B 123 -25.569 -1.468 -15.203 1.00 0.00 N ATOM 0 H ASN B 123 -23.093 -1.713 -10.746 1.00 0.00 H new ATOM 0 HA ASN B 123 -25.109 -3.406 -12.201 1.00 0.00 H new ATOM 0 HB2 ASN B 123 -25.270 -0.734 -12.122 1.00 0.00 H new ATOM 0 HB3 ASN B 123 -23.985 -0.828 -13.310 1.00 0.00 H new ATOM 0 HD21 ASN B 123 -26.246 -1.695 -15.931 1.00 0.00 H new ATOM 0 HD22 ASN B 123 -24.678 -1.037 -15.451 1.00 0.00 H new ATOM 700 N SER B 124 -23.047 -4.510 -13.174 1.00 0.00 N ATOM 701 CA SER B 124 -21.918 -5.100 -13.946 1.00 0.00 C ATOM 702 C SER B 124 -22.444 -5.692 -15.256 1.00 0.00 C ATOM 703 O SER B 124 -21.846 -6.578 -15.831 1.00 0.00 O ATOM 704 CB SER B 124 -21.258 -6.202 -13.119 1.00 0.00 C ATOM 705 OG SER B 124 -22.240 -6.830 -12.306 1.00 0.00 O ATOM 0 H SER B 124 -23.713 -5.183 -12.794 1.00 0.00 H new ATOM 0 HA SER B 124 -21.187 -4.323 -14.169 1.00 0.00 H new ATOM 0 HB2 SER B 124 -20.790 -6.935 -13.776 1.00 0.00 H new ATOM 0 HB3 SER B 124 -20.468 -5.782 -12.496 1.00 0.00 H new ATOM 0 HG SER B 124 -21.821 -7.539 -11.775 1.00 0.00 H new ATOM 711 N SER B 125 -23.557 -5.207 -15.735 1.00 0.00 N ATOM 712 CA SER B 125 -24.112 -5.744 -17.009 1.00 0.00 C ATOM 713 C SER B 125 -23.069 -5.595 -18.115 1.00 0.00 C ATOM 714 O SER B 125 -22.806 -6.513 -18.865 1.00 0.00 O ATOM 715 CB SER B 125 -25.372 -4.965 -17.389 1.00 0.00 C ATOM 716 OG SER B 125 -26.457 -5.403 -16.582 1.00 0.00 O ATOM 0 H SER B 125 -24.104 -4.464 -15.300 1.00 0.00 H new ATOM 0 HA SER B 125 -24.364 -6.797 -16.881 1.00 0.00 H new ATOM 0 HB2 SER B 125 -25.208 -3.896 -17.250 1.00 0.00 H new ATOM 0 HB3 SER B 125 -25.603 -5.117 -18.443 1.00 0.00 H new ATOM 0 HG SER B 125 -27.266 -4.904 -16.822 1.00 0.00 H new ATOM 722 N GLU B 126 -22.473 -4.441 -18.219 1.00 0.00 N ATOM 723 CA GLU B 126 -21.444 -4.224 -19.272 1.00 0.00 C ATOM 724 C GLU B 126 -20.424 -5.362 -19.230 1.00 0.00 C ATOM 725 O GLU B 126 -20.124 -5.902 -18.184 1.00 0.00 O ATOM 726 CB GLU B 126 -20.733 -2.891 -19.024 1.00 0.00 C ATOM 727 CG GLU B 126 -21.155 -1.881 -20.093 1.00 0.00 C ATOM 728 CD GLU B 126 -21.003 -0.462 -19.543 1.00 0.00 C ATOM 729 OE1 GLU B 126 -20.176 -0.272 -18.666 1.00 0.00 O ATOM 730 OE2 GLU B 126 -21.715 0.413 -20.010 1.00 0.00 O ATOM 0 H GLU B 126 -22.655 -3.637 -17.619 1.00 0.00 H new ATOM 0 HA GLU B 126 -21.924 -4.203 -20.250 1.00 0.00 H new ATOM 0 HB2 GLU B 126 -20.982 -2.513 -18.033 1.00 0.00 H new ATOM 0 HB3 GLU B 126 -19.653 -3.033 -19.049 1.00 0.00 H new ATOM 0 HG2 GLU B 126 -20.542 -2.004 -20.986 1.00 0.00 H new ATOM 0 HG3 GLU B 126 -22.189 -2.059 -20.389 1.00 0.00 H new ATOM 737 N GLY B 127 -19.888 -5.734 -20.361 1.00 0.00 N ATOM 738 CA GLY B 127 -18.888 -6.839 -20.384 1.00 0.00 C ATOM 739 C GLY B 127 -17.477 -6.251 -20.465 1.00 0.00 C ATOM 740 O GLY B 127 -16.542 -6.911 -20.872 1.00 0.00 O ATOM 0 H GLY B 127 -20.099 -5.321 -21.269 1.00 0.00 H new ATOM 0 HA2 GLY B 127 -18.987 -7.452 -19.488 1.00 0.00 H new ATOM 0 HA3 GLY B 127 -19.071 -7.491 -21.238 1.00 0.00 H new ATOM 744 N ASP B 128 -17.316 -5.014 -20.082 1.00 0.00 N ATOM 745 CA ASP B 128 -15.965 -4.387 -20.139 1.00 0.00 C ATOM 746 C ASP B 128 -15.770 -3.472 -18.927 1.00 0.00 C ATOM 747 O ASP B 128 -14.693 -3.387 -18.371 1.00 0.00 O ATOM 748 CB ASP B 128 -15.835 -3.562 -21.422 1.00 0.00 C ATOM 749 CG ASP B 128 -16.220 -4.424 -22.625 1.00 0.00 C ATOM 750 OD1 ASP B 128 -17.387 -4.760 -22.738 1.00 0.00 O ATOM 751 OD2 ASP B 128 -15.341 -4.733 -23.413 1.00 0.00 O ATOM 0 H ASP B 128 -18.061 -4.411 -19.732 1.00 0.00 H new ATOM 0 HA ASP B 128 -15.206 -5.170 -20.130 1.00 0.00 H new ATOM 0 HB2 ASP B 128 -16.479 -2.684 -21.369 1.00 0.00 H new ATOM 0 HB3 ASP B 128 -14.813 -3.201 -21.533 1.00 0.00 H new ATOM 756 N TRP B 129 -16.798 -2.781 -18.514 1.00 0.00 N ATOM 757 CA TRP B 129 -16.655 -1.872 -17.344 1.00 0.00 C ATOM 758 C TRP B 129 -17.857 -2.026 -16.409 1.00 0.00 C ATOM 759 O TRP B 129 -18.990 -2.103 -16.843 1.00 0.00 O ATOM 760 CB TRP B 129 -16.570 -0.426 -17.834 1.00 0.00 C ATOM 761 CG TRP B 129 -15.214 -0.181 -18.413 1.00 0.00 C ATOM 762 CD1 TRP B 129 -14.748 -0.731 -19.557 1.00 0.00 C ATOM 763 CD2 TRP B 129 -14.143 0.659 -17.894 1.00 0.00 C ATOM 764 NE1 TRP B 129 -13.457 -0.284 -19.774 1.00 0.00 N ATOM 765 CE2 TRP B 129 -13.040 0.576 -18.776 1.00 0.00 C ATOM 766 CE3 TRP B 129 -14.022 1.477 -16.757 1.00 0.00 C ATOM 767 CZ2 TRP B 129 -11.859 1.278 -18.538 1.00 0.00 C ATOM 768 CZ3 TRP B 129 -12.835 2.186 -16.514 1.00 0.00 C ATOM 769 CH2 TRP B 129 -11.755 2.087 -17.403 1.00 0.00 C ATOM 0 H TRP B 129 -17.727 -2.807 -18.935 1.00 0.00 H new ATOM 0 HA TRP B 129 -15.747 -2.130 -16.799 1.00 0.00 H new ATOM 0 HB2 TRP B 129 -17.338 -0.238 -18.584 1.00 0.00 H new ATOM 0 HB3 TRP B 129 -16.756 0.262 -17.009 1.00 0.00 H new ATOM 0 HD1 TRP B 129 -15.294 -1.408 -20.197 1.00 0.00 H new ATOM 0 HE1 TRP B 129 -12.883 -0.556 -20.572 1.00 0.00 H new ATOM 0 HE3 TRP B 129 -14.848 1.560 -16.066 1.00 0.00 H new ATOM 0 HZ2 TRP B 129 -11.030 1.197 -19.226 1.00 0.00 H new ATOM 0 HZ3 TRP B 129 -12.753 2.811 -15.637 1.00 0.00 H new ATOM 0 HH2 TRP B 129 -10.844 2.635 -17.211 1.00 0.00 H new ATOM 780 N TRP B 130 -17.616 -2.071 -15.127 1.00 0.00 N ATOM 781 CA TRP B 130 -18.737 -2.217 -14.155 1.00 0.00 C ATOM 782 C TRP B 130 -18.900 -0.913 -13.370 1.00 0.00 C ATOM 783 O TRP B 130 -18.037 -0.059 -13.384 1.00 0.00 O ATOM 784 CB TRP B 130 -18.417 -3.348 -13.173 1.00 0.00 C ATOM 785 CG TRP B 130 -18.553 -4.674 -13.851 1.00 0.00 C ATOM 786 CD1 TRP B 130 -19.109 -4.876 -15.067 1.00 0.00 C ATOM 787 CD2 TRP B 130 -18.134 -5.984 -13.369 1.00 0.00 C ATOM 788 NE1 TRP B 130 -19.062 -6.228 -15.361 1.00 0.00 N ATOM 789 CE2 TRP B 130 -18.469 -6.951 -14.345 1.00 0.00 C ATOM 790 CE3 TRP B 130 -17.504 -6.421 -12.190 1.00 0.00 C ATOM 791 CZ2 TRP B 130 -18.186 -8.305 -14.157 1.00 0.00 C ATOM 792 CZ3 TRP B 130 -17.218 -7.781 -11.998 1.00 0.00 C ATOM 793 CH2 TRP B 130 -17.558 -8.722 -12.980 1.00 0.00 C ATOM 0 H TRP B 130 -16.687 -2.013 -14.709 1.00 0.00 H new ATOM 0 HA TRP B 130 -19.656 -2.444 -14.695 1.00 0.00 H new ATOM 0 HB2 TRP B 130 -17.404 -3.230 -12.789 1.00 0.00 H new ATOM 0 HB3 TRP B 130 -19.090 -3.298 -12.317 1.00 0.00 H new ATOM 0 HD1 TRP B 130 -19.522 -4.108 -15.704 1.00 0.00 H new ATOM 0 HE1 TRP B 130 -19.421 -6.640 -16.222 1.00 0.00 H new ATOM 0 HE3 TRP B 130 -17.238 -5.704 -11.427 1.00 0.00 H new ATOM 0 HZ2 TRP B 130 -18.451 -9.026 -14.916 1.00 0.00 H new ATOM 0 HZ3 TRP B 130 -16.733 -8.105 -11.089 1.00 0.00 H new ATOM 0 HH2 TRP B 130 -17.335 -9.768 -12.827 1.00 0.00 H new ATOM 804 N GLU B 131 -19.990 -0.765 -12.669 1.00 0.00 N ATOM 805 CA GLU B 131 -20.202 0.468 -11.866 1.00 0.00 C ATOM 806 C GLU B 131 -19.861 0.140 -10.407 1.00 0.00 C ATOM 807 O GLU B 131 -20.633 -0.484 -9.705 1.00 0.00 O ATOM 808 CB GLU B 131 -21.671 0.920 -12.018 1.00 0.00 C ATOM 809 CG GLU B 131 -22.283 1.284 -10.660 1.00 0.00 C ATOM 810 CD GLU B 131 -23.438 2.268 -10.864 1.00 0.00 C ATOM 811 OE1 GLU B 131 -23.177 3.373 -11.309 1.00 0.00 O ATOM 812 OE2 GLU B 131 -24.563 1.898 -10.572 1.00 0.00 O ATOM 0 H GLU B 131 -20.745 -1.449 -12.619 1.00 0.00 H new ATOM 0 HA GLU B 131 -19.565 1.284 -12.206 1.00 0.00 H new ATOM 0 HB2 GLU B 131 -21.722 1.780 -12.685 1.00 0.00 H new ATOM 0 HB3 GLU B 131 -22.253 0.123 -12.480 1.00 0.00 H new ATOM 0 HG2 GLU B 131 -22.642 0.385 -10.159 1.00 0.00 H new ATOM 0 HG3 GLU B 131 -21.524 1.727 -10.015 1.00 0.00 H new ATOM 819 N ALA B 132 -18.705 0.538 -9.951 1.00 0.00 N ATOM 820 CA ALA B 132 -18.317 0.226 -8.548 1.00 0.00 C ATOM 821 C ALA B 132 -18.492 1.461 -7.665 1.00 0.00 C ATOM 822 O ALA B 132 -18.282 2.580 -8.091 1.00 0.00 O ATOM 823 CB ALA B 132 -16.853 -0.219 -8.512 1.00 0.00 C ATOM 0 H ALA B 132 -18.015 1.064 -10.488 1.00 0.00 H new ATOM 0 HA ALA B 132 -18.956 -0.573 -8.173 1.00 0.00 H new ATOM 0 HB1 ALA B 132 -16.567 -0.448 -7.485 1.00 0.00 H new ATOM 0 HB2 ALA B 132 -16.728 -1.108 -9.130 1.00 0.00 H new ATOM 0 HB3 ALA B 132 -16.220 0.581 -8.895 1.00 0.00 H new ATOM 829 N ARG B 133 -18.868 1.263 -6.433 1.00 0.00 N ATOM 830 CA ARG B 133 -19.054 2.415 -5.509 1.00 0.00 C ATOM 831 C ARG B 133 -17.959 2.377 -4.441 1.00 0.00 C ATOM 832 O ARG B 133 -17.941 1.511 -3.588 1.00 0.00 O ATOM 833 CB ARG B 133 -20.428 2.315 -4.844 1.00 0.00 C ATOM 834 CG ARG B 133 -20.717 3.597 -4.059 1.00 0.00 C ATOM 835 CD ARG B 133 -20.097 3.497 -2.663 1.00 0.00 C ATOM 836 NE ARG B 133 -20.363 2.144 -2.096 1.00 0.00 N ATOM 837 CZ ARG B 133 -21.466 1.917 -1.435 1.00 0.00 C ATOM 838 NH1 ARG B 133 -21.573 2.304 -0.193 1.00 0.00 N ATOM 839 NH2 ARG B 133 -22.462 1.306 -2.016 1.00 0.00 N ATOM 0 H ARG B 133 -19.055 0.347 -6.024 1.00 0.00 H new ATOM 0 HA ARG B 133 -18.992 3.351 -6.064 1.00 0.00 H new ATOM 0 HB2 ARG B 133 -21.198 2.159 -5.600 1.00 0.00 H new ATOM 0 HB3 ARG B 133 -20.458 1.454 -4.176 1.00 0.00 H new ATOM 0 HG2 ARG B 133 -20.309 4.459 -4.588 1.00 0.00 H new ATOM 0 HG3 ARG B 133 -21.793 3.752 -3.980 1.00 0.00 H new ATOM 0 HD2 ARG B 133 -19.023 3.676 -2.717 1.00 0.00 H new ATOM 0 HD3 ARG B 133 -20.515 4.264 -2.012 1.00 0.00 H new ATOM 0 HE ARG B 133 -19.683 1.395 -2.225 1.00 0.00 H new ATOM 0 HH11 ARG B 133 -20.795 2.783 0.261 1.00 0.00 H new ATOM 0 HH12 ARG B 133 -22.434 2.127 0.324 1.00 0.00 H new ATOM 0 HH21 ARG B 133 -22.379 1.005 -2.987 1.00 0.00 H new ATOM 0 HH22 ARG B 133 -23.323 1.129 -1.499 1.00 0.00 H new ATOM 853 N SER B 134 -17.041 3.304 -4.485 1.00 0.00 N ATOM 854 CA SER B 134 -15.944 3.315 -3.475 1.00 0.00 C ATOM 855 C SER B 134 -16.543 3.390 -2.071 1.00 0.00 C ATOM 856 O SER B 134 -17.088 4.399 -1.670 1.00 0.00 O ATOM 857 CB SER B 134 -15.044 4.528 -3.711 1.00 0.00 C ATOM 858 OG SER B 134 -15.848 5.650 -4.050 1.00 0.00 O ATOM 0 H SER B 134 -17.003 4.054 -5.176 1.00 0.00 H new ATOM 0 HA SER B 134 -15.355 2.403 -3.570 1.00 0.00 H new ATOM 0 HB2 SER B 134 -14.460 4.742 -2.816 1.00 0.00 H new ATOM 0 HB3 SER B 134 -14.335 4.319 -4.512 1.00 0.00 H new ATOM 0 HG SER B 134 -15.467 6.459 -3.649 1.00 0.00 H new ATOM 864 N LEU B 135 -16.446 2.329 -1.317 1.00 0.00 N ATOM 865 CA LEU B 135 -17.010 2.340 0.062 1.00 0.00 C ATOM 866 C LEU B 135 -16.134 3.212 0.965 1.00 0.00 C ATOM 867 O LEU B 135 -16.468 3.473 2.104 1.00 0.00 O ATOM 868 CB LEU B 135 -17.042 0.911 0.608 1.00 0.00 C ATOM 869 CG LEU B 135 -18.110 0.104 -0.134 1.00 0.00 C ATOM 870 CD1 LEU B 135 -17.468 -1.129 -0.772 1.00 0.00 C ATOM 871 CD2 LEU B 135 -19.190 -0.339 0.854 1.00 0.00 C ATOM 0 H LEU B 135 -16.000 1.455 -1.597 1.00 0.00 H new ATOM 0 HA LEU B 135 -18.022 2.744 0.039 1.00 0.00 H new ATOM 0 HB2 LEU B 135 -16.066 0.442 0.485 1.00 0.00 H new ATOM 0 HB3 LEU B 135 -17.258 0.923 1.676 1.00 0.00 H new ATOM 0 HG LEU B 135 -18.558 0.723 -0.911 1.00 0.00 H new ATOM 0 HD11 LEU B 135 -18.229 -1.703 -1.300 1.00 0.00 H new ATOM 0 HD12 LEU B 135 -16.697 -0.815 -1.476 1.00 0.00 H new ATOM 0 HD13 LEU B 135 -17.020 -1.749 0.005 1.00 0.00 H new ATOM 0 HD21 LEU B 135 -19.951 -0.914 0.327 1.00 0.00 H new ATOM 0 HD22 LEU B 135 -18.741 -0.958 1.631 1.00 0.00 H new ATOM 0 HD23 LEU B 135 -19.649 0.539 1.309 1.00 0.00 H new ATOM 883 N THR B 136 -15.015 3.667 0.468 1.00 0.00 N ATOM 884 CA THR B 136 -14.121 4.522 1.299 1.00 0.00 C ATOM 885 C THR B 136 -14.508 5.992 1.114 1.00 0.00 C ATOM 886 O THR B 136 -15.029 6.623 2.011 1.00 0.00 O ATOM 887 CB THR B 136 -12.669 4.315 0.860 1.00 0.00 C ATOM 888 OG1 THR B 136 -12.333 2.941 0.981 1.00 0.00 O ATOM 889 CG2 THR B 136 -11.740 5.150 1.742 1.00 0.00 C ATOM 0 H THR B 136 -14.682 3.483 -0.478 1.00 0.00 H new ATOM 0 HA THR B 136 -14.225 4.249 2.349 1.00 0.00 H new ATOM 0 HB THR B 136 -12.555 4.628 -0.178 1.00 0.00 H new ATOM 0 HG1 THR B 136 -11.404 2.805 0.699 1.00 0.00 H new ATOM 0 HG21 THR B 136 -10.707 5.000 1.427 1.00 0.00 H new ATOM 0 HG22 THR B 136 -11.999 6.205 1.647 1.00 0.00 H new ATOM 0 HG23 THR B 136 -11.850 4.841 2.781 1.00 0.00 H new ATOM 897 N THR B 137 -14.257 6.540 -0.043 1.00 0.00 N ATOM 898 CA THR B 137 -14.612 7.966 -0.285 1.00 0.00 C ATOM 899 C THR B 137 -16.134 8.113 -0.307 1.00 0.00 C ATOM 900 O THR B 137 -16.673 9.150 0.028 1.00 0.00 O ATOM 901 CB THR B 137 -14.040 8.415 -1.631 1.00 0.00 C ATOM 902 OG1 THR B 137 -14.388 7.468 -2.631 1.00 0.00 O ATOM 903 CG2 THR B 137 -12.518 8.519 -1.530 1.00 0.00 C ATOM 0 H THR B 137 -13.821 6.061 -0.831 1.00 0.00 H new ATOM 0 HA THR B 137 -14.195 8.584 0.511 1.00 0.00 H new ATOM 0 HB THR B 137 -14.451 9.389 -1.895 1.00 0.00 H new ATOM 0 HG1 THR B 137 -14.024 7.755 -3.494 1.00 0.00 H new ATOM 0 HG21 THR B 137 -12.111 8.839 -2.489 1.00 0.00 H new ATOM 0 HG22 THR B 137 -12.253 9.246 -0.763 1.00 0.00 H new ATOM 0 HG23 THR B 137 -12.104 7.546 -1.266 1.00 0.00 H new ATOM 911 N GLY B 138 -16.832 7.082 -0.698 1.00 0.00 N ATOM 912 CA GLY B 138 -18.318 7.163 -0.742 1.00 0.00 C ATOM 913 C GLY B 138 -18.770 7.555 -2.151 1.00 0.00 C ATOM 914 O GLY B 138 -19.946 7.708 -2.415 1.00 0.00 O ATOM 0 H GLY B 138 -16.437 6.188 -0.989 1.00 0.00 H new ATOM 0 HA2 GLY B 138 -18.753 6.203 -0.464 1.00 0.00 H new ATOM 0 HA3 GLY B 138 -18.674 7.896 -0.018 1.00 0.00 H new ATOM 918 N GLU B 139 -17.846 7.721 -3.059 1.00 0.00 N ATOM 919 CA GLU B 139 -18.228 8.104 -4.448 1.00 0.00 C ATOM 920 C GLU B 139 -18.494 6.842 -5.273 1.00 0.00 C ATOM 921 O GLU B 139 -18.292 5.735 -4.815 1.00 0.00 O ATOM 922 CB GLU B 139 -17.089 8.899 -5.088 1.00 0.00 C ATOM 923 CG GLU B 139 -16.701 10.063 -4.173 1.00 0.00 C ATOM 924 CD GLU B 139 -17.538 11.293 -4.528 1.00 0.00 C ATOM 925 OE1 GLU B 139 -18.216 11.251 -5.541 1.00 0.00 O ATOM 926 OE2 GLU B 139 -17.487 12.256 -3.781 1.00 0.00 O ATOM 0 H GLU B 139 -16.845 7.608 -2.899 1.00 0.00 H new ATOM 0 HA GLU B 139 -19.130 8.716 -4.420 1.00 0.00 H new ATOM 0 HB2 GLU B 139 -16.228 8.251 -5.255 1.00 0.00 H new ATOM 0 HB3 GLU B 139 -17.398 9.276 -6.063 1.00 0.00 H new ATOM 0 HG2 GLU B 139 -16.862 9.789 -3.130 1.00 0.00 H new ATOM 0 HG3 GLU B 139 -15.640 10.288 -4.283 1.00 0.00 H new ATOM 933 N THR B 140 -18.947 7.000 -6.488 1.00 0.00 N ATOM 934 CA THR B 140 -19.224 5.809 -7.340 1.00 0.00 C ATOM 935 C THR B 140 -18.931 6.146 -8.803 1.00 0.00 C ATOM 936 O THR B 140 -18.857 7.298 -9.183 1.00 0.00 O ATOM 937 CB THR B 140 -20.694 5.404 -7.193 1.00 0.00 C ATOM 938 OG1 THR B 140 -20.905 4.154 -7.834 1.00 0.00 O ATOM 939 CG2 THR B 140 -21.586 6.465 -7.838 1.00 0.00 C ATOM 0 H THR B 140 -19.137 7.901 -6.926 1.00 0.00 H new ATOM 0 HA THR B 140 -18.587 4.983 -7.024 1.00 0.00 H new ATOM 0 HB THR B 140 -20.943 5.318 -6.135 1.00 0.00 H new ATOM 0 HG1 THR B 140 -20.053 3.674 -7.904 1.00 0.00 H new ATOM 0 HG21 THR B 140 -22.631 6.175 -7.732 1.00 0.00 H new ATOM 0 HG22 THR B 140 -21.424 7.424 -7.346 1.00 0.00 H new ATOM 0 HG23 THR B 140 -21.339 6.553 -8.896 1.00 0.00 H new ATOM 947 N GLY B 141 -18.763 5.149 -9.628 1.00 0.00 N ATOM 948 CA GLY B 141 -18.476 5.412 -11.066 1.00 0.00 C ATOM 949 C GLY B 141 -18.286 4.082 -11.799 1.00 0.00 C ATOM 950 O GLY B 141 -18.831 3.066 -11.413 1.00 0.00 O ATOM 0 H GLY B 141 -18.812 4.164 -9.368 1.00 0.00 H new ATOM 0 HA2 GLY B 141 -19.296 5.973 -11.515 1.00 0.00 H new ATOM 0 HA3 GLY B 141 -17.580 6.024 -11.163 1.00 0.00 H new ATOM 954 N TYR B 142 -17.516 4.080 -12.852 1.00 0.00 N ATOM 955 CA TYR B 142 -17.299 2.813 -13.605 1.00 0.00 C ATOM 956 C TYR B 142 -15.802 2.509 -13.696 1.00 0.00 C ATOM 957 O TYR B 142 -15.005 3.349 -14.064 1.00 0.00 O ATOM 958 CB TYR B 142 -17.872 2.954 -15.015 1.00 0.00 C ATOM 959 CG TYR B 142 -19.307 3.418 -14.935 1.00 0.00 C ATOM 960 CD1 TYR B 142 -19.597 4.723 -14.516 1.00 0.00 C ATOM 961 CD2 TYR B 142 -20.345 2.547 -15.282 1.00 0.00 C ATOM 962 CE1 TYR B 142 -20.927 5.154 -14.443 1.00 0.00 C ATOM 963 CE2 TYR B 142 -21.675 2.979 -15.210 1.00 0.00 C ATOM 964 CZ TYR B 142 -21.966 4.282 -14.791 1.00 0.00 C ATOM 965 OH TYR B 142 -23.277 4.708 -14.720 1.00 0.00 O ATOM 0 H TYR B 142 -17.030 4.897 -13.222 1.00 0.00 H new ATOM 0 HA TYR B 142 -17.800 1.998 -13.083 1.00 0.00 H new ATOM 0 HB2 TYR B 142 -17.280 3.667 -15.589 1.00 0.00 H new ATOM 0 HB3 TYR B 142 -17.817 1.999 -15.538 1.00 0.00 H new ATOM 0 HD1 TYR B 142 -18.795 5.396 -14.250 1.00 0.00 H new ATOM 0 HD2 TYR B 142 -20.121 1.541 -15.605 1.00 0.00 H new ATOM 0 HE1 TYR B 142 -21.152 6.159 -14.118 1.00 0.00 H new ATOM 0 HE2 TYR B 142 -22.476 2.306 -15.478 1.00 0.00 H new ATOM 0 HH TYR B 142 -23.873 3.981 -14.997 1.00 0.00 H new ATOM 975 N ILE B 143 -15.420 1.303 -13.374 1.00 0.00 N ATOM 976 CA ILE B 143 -13.982 0.922 -13.450 1.00 0.00 C ATOM 977 C ILE B 143 -13.862 -0.371 -14.259 1.00 0.00 C ATOM 978 O ILE B 143 -14.845 -1.050 -14.478 1.00 0.00 O ATOM 979 CB ILE B 143 -13.436 0.698 -12.037 1.00 0.00 C ATOM 980 CG1 ILE B 143 -14.324 -0.306 -11.301 1.00 0.00 C ATOM 981 CG2 ILE B 143 -13.431 2.024 -11.277 1.00 0.00 C ATOM 982 CD1 ILE B 143 -13.444 -1.340 -10.595 1.00 0.00 C ATOM 0 H ILE B 143 -16.046 0.562 -13.060 1.00 0.00 H new ATOM 0 HA ILE B 143 -13.410 1.716 -13.930 1.00 0.00 H new ATOM 0 HB ILE B 143 -12.420 0.309 -12.098 1.00 0.00 H new ATOM 0 HG12 ILE B 143 -14.951 0.211 -10.575 1.00 0.00 H new ATOM 0 HG13 ILE B 143 -14.993 -0.801 -12.005 1.00 0.00 H new ATOM 0 HG21 ILE B 143 -13.042 1.865 -10.271 1.00 0.00 H new ATOM 0 HG22 ILE B 143 -12.799 2.741 -11.801 1.00 0.00 H new ATOM 0 HG23 ILE B 143 -14.448 2.412 -11.216 1.00 0.00 H new ATOM 0 HD11 ILE B 143 -14.075 -2.057 -10.070 1.00 0.00 H new ATOM 0 HD12 ILE B 143 -12.836 -1.864 -11.332 1.00 0.00 H new ATOM 0 HD13 ILE B 143 -12.794 -0.837 -9.880 1.00 0.00 H new ATOM 994 N PRO B 144 -12.663 -0.675 -14.680 1.00 0.00 N ATOM 995 CA PRO B 144 -12.404 -1.889 -15.470 1.00 0.00 C ATOM 996 C PRO B 144 -12.883 -3.127 -14.709 1.00 0.00 C ATOM 997 O PRO B 144 -12.430 -3.412 -13.618 1.00 0.00 O ATOM 998 CB PRO B 144 -10.884 -1.918 -15.655 1.00 0.00 C ATOM 999 CG PRO B 144 -10.301 -0.672 -14.937 1.00 0.00 C ATOM 1000 CD PRO B 144 -11.475 0.153 -14.407 1.00 0.00 C ATOM 0 HA PRO B 144 -12.930 -1.886 -16.425 1.00 0.00 H new ATOM 0 HB2 PRO B 144 -10.465 -2.833 -15.236 1.00 0.00 H new ATOM 0 HB3 PRO B 144 -10.627 -1.905 -16.714 1.00 0.00 H new ATOM 0 HG2 PRO B 144 -9.646 -0.974 -14.120 1.00 0.00 H new ATOM 0 HG3 PRO B 144 -9.699 -0.081 -15.627 1.00 0.00 H new ATOM 0 HD2 PRO B 144 -11.369 0.355 -13.341 1.00 0.00 H new ATOM 0 HD3 PRO B 144 -11.540 1.118 -14.909 1.00 0.00 H new ATOM 1008 N SER B 145 -13.796 -3.862 -15.278 1.00 0.00 N ATOM 1009 CA SER B 145 -14.307 -5.081 -14.591 1.00 0.00 C ATOM 1010 C SER B 145 -13.192 -6.126 -14.513 1.00 0.00 C ATOM 1011 O SER B 145 -13.165 -6.956 -13.625 1.00 0.00 O ATOM 1012 CB SER B 145 -15.490 -5.653 -15.377 1.00 0.00 C ATOM 1013 OG SER B 145 -15.474 -5.131 -16.699 1.00 0.00 O ATOM 0 H SER B 145 -14.211 -3.672 -16.190 1.00 0.00 H new ATOM 0 HA SER B 145 -14.633 -4.821 -13.584 1.00 0.00 H new ATOM 0 HB2 SER B 145 -15.432 -6.741 -15.403 1.00 0.00 H new ATOM 0 HB3 SER B 145 -16.427 -5.396 -14.884 1.00 0.00 H new ATOM 0 HG SER B 145 -16.230 -5.497 -17.204 1.00 0.00 H new ATOM 1019 N ASN B 146 -12.267 -6.092 -15.434 1.00 0.00 N ATOM 1020 CA ASN B 146 -11.155 -7.084 -15.410 1.00 0.00 C ATOM 1021 C ASN B 146 -10.185 -6.735 -14.279 1.00 0.00 C ATOM 1022 O ASN B 146 -9.257 -7.468 -13.997 1.00 0.00 O ATOM 1023 CB ASN B 146 -10.414 -7.048 -16.749 1.00 0.00 C ATOM 1024 CG ASN B 146 -9.172 -7.937 -16.670 1.00 0.00 C ATOM 1025 OD1 ASN B 146 -7.990 -7.398 -16.798 1.00 0.00 O flip ATOM 1026 ND2 ASN B 146 -9.277 -9.134 -16.491 1.00 0.00 N flip ATOM 0 H ASN B 146 -12.234 -5.421 -16.201 1.00 0.00 H new ATOM 0 HA ASN B 146 -11.560 -8.082 -15.245 1.00 0.00 H new ATOM 0 HB2 ASN B 146 -11.070 -7.392 -17.549 1.00 0.00 H new ATOM 0 HB3 ASN B 146 -10.127 -6.025 -16.990 1.00 0.00 H new ATOM 0 HD21 ASN B 146 -10.200 -9.556 -16.391 1.00 0.00 H new ATOM 0 HD22 ASN B 146 -8.442 -9.717 -16.441 1.00 0.00 H new ATOM 1033 N TYR B 147 -10.391 -5.621 -13.631 1.00 0.00 N ATOM 1034 CA TYR B 147 -9.480 -5.225 -12.520 1.00 0.00 C ATOM 1035 C TYR B 147 -10.169 -5.477 -11.177 1.00 0.00 C ATOM 1036 O TYR B 147 -9.768 -4.951 -10.158 1.00 0.00 O ATOM 1037 CB TYR B 147 -9.144 -3.736 -12.643 1.00 0.00 C ATOM 1038 CG TYR B 147 -7.977 -3.545 -13.586 1.00 0.00 C ATOM 1039 CD1 TYR B 147 -7.713 -4.494 -14.582 1.00 0.00 C ATOM 1040 CD2 TYR B 147 -7.161 -2.414 -13.464 1.00 0.00 C ATOM 1041 CE1 TYR B 147 -6.633 -4.311 -15.455 1.00 0.00 C ATOM 1042 CE2 TYR B 147 -6.084 -2.230 -14.337 1.00 0.00 C ATOM 1043 CZ TYR B 147 -5.819 -3.179 -15.332 1.00 0.00 C ATOM 1044 OH TYR B 147 -4.755 -2.996 -16.193 1.00 0.00 O ATOM 0 H TYR B 147 -11.151 -4.968 -13.823 1.00 0.00 H new ATOM 0 HA TYR B 147 -8.565 -5.814 -12.576 1.00 0.00 H new ATOM 0 HB2 TYR B 147 -10.012 -3.188 -13.010 1.00 0.00 H new ATOM 0 HB3 TYR B 147 -8.900 -3.328 -11.662 1.00 0.00 H new ATOM 0 HD1 TYR B 147 -8.342 -5.367 -14.677 1.00 0.00 H new ATOM 0 HD2 TYR B 147 -7.363 -1.683 -12.695 1.00 0.00 H new ATOM 0 HE1 TYR B 147 -6.429 -5.043 -16.222 1.00 0.00 H new ATOM 0 HE2 TYR B 147 -5.457 -1.356 -14.244 1.00 0.00 H new ATOM 0 HH TYR B 147 -4.712 -3.745 -16.824 1.00 0.00 H new ATOM 1054 N VAL B 148 -11.206 -6.273 -11.160 1.00 0.00 N ATOM 1055 CA VAL B 148 -11.906 -6.543 -9.872 1.00 0.00 C ATOM 1056 C VAL B 148 -12.225 -8.033 -9.752 1.00 0.00 C ATOM 1057 O VAL B 148 -12.410 -8.722 -10.736 1.00 0.00 O ATOM 1058 CB VAL B 148 -13.207 -5.741 -9.819 1.00 0.00 C ATOM 1059 CG1 VAL B 148 -12.915 -4.273 -10.130 1.00 0.00 C ATOM 1060 CG2 VAL B 148 -14.192 -6.295 -10.852 1.00 0.00 C ATOM 0 H VAL B 148 -11.595 -6.744 -11.977 1.00 0.00 H new ATOM 0 HA VAL B 148 -11.258 -6.247 -9.047 1.00 0.00 H new ATOM 0 HB VAL B 148 -13.642 -5.822 -8.823 1.00 0.00 H new ATOM 0 HG11 VAL B 148 -13.842 -3.702 -10.092 1.00 0.00 H new ATOM 0 HG12 VAL B 148 -12.215 -3.877 -9.394 1.00 0.00 H new ATOM 0 HG13 VAL B 148 -12.479 -4.192 -11.126 1.00 0.00 H new ATOM 0 HG21 VAL B 148 -15.119 -5.723 -10.814 1.00 0.00 H new ATOM 0 HG22 VAL B 148 -13.757 -6.216 -11.848 1.00 0.00 H new ATOM 0 HG23 VAL B 148 -14.402 -7.341 -10.630 1.00 0.00 H new ATOM 1070 N ALA B 149 -12.295 -8.532 -8.549 1.00 0.00 N ATOM 1071 CA ALA B 149 -12.607 -9.977 -8.354 1.00 0.00 C ATOM 1072 C ALA B 149 -13.392 -10.152 -7.050 1.00 0.00 C ATOM 1073 O ALA B 149 -13.220 -9.392 -6.119 1.00 0.00 O ATOM 1074 CB ALA B 149 -11.305 -10.777 -8.276 1.00 0.00 C ATOM 0 H ALA B 149 -12.149 -8.001 -7.690 1.00 0.00 H new ATOM 0 HA ALA B 149 -13.203 -10.338 -9.193 1.00 0.00 H new ATOM 0 HB1 ALA B 149 -11.535 -11.833 -8.133 1.00 0.00 H new ATOM 0 HB2 ALA B 149 -10.744 -10.650 -9.202 1.00 0.00 H new ATOM 0 HB3 ALA B 149 -10.708 -10.419 -7.437 1.00 0.00 H new ATOM 1080 N PRO B 150 -14.237 -11.153 -7.027 1.00 0.00 N ATOM 1081 CA PRO B 150 -15.066 -11.450 -5.847 1.00 0.00 C ATOM 1082 C PRO B 150 -14.177 -11.766 -4.640 1.00 0.00 C ATOM 1083 O PRO B 150 -13.105 -12.321 -4.775 1.00 0.00 O ATOM 1084 CB PRO B 150 -15.892 -12.682 -6.247 1.00 0.00 C ATOM 1085 CG PRO B 150 -15.497 -13.063 -7.696 1.00 0.00 C ATOM 1086 CD PRO B 150 -14.429 -12.064 -8.169 1.00 0.00 C ATOM 0 HA PRO B 150 -15.698 -10.609 -5.561 1.00 0.00 H new ATOM 0 HB2 PRO B 150 -15.697 -13.511 -5.567 1.00 0.00 H new ATOM 0 HB3 PRO B 150 -16.958 -12.464 -6.186 1.00 0.00 H new ATOM 0 HG2 PRO B 150 -15.110 -14.081 -7.731 1.00 0.00 H new ATOM 0 HG3 PRO B 150 -16.368 -13.030 -8.351 1.00 0.00 H new ATOM 0 HD2 PRO B 150 -13.501 -12.571 -8.431 1.00 0.00 H new ATOM 0 HD3 PRO B 150 -14.758 -11.523 -9.056 1.00 0.00 H new ATOM 1094 N VAL B 151 -14.616 -11.416 -3.462 1.00 0.00 N ATOM 1095 CA VAL B 151 -13.799 -11.696 -2.248 1.00 0.00 C ATOM 1096 C VAL B 151 -14.010 -13.148 -1.816 1.00 0.00 C ATOM 1097 O VAL B 151 -13.217 -13.631 -1.025 1.00 0.00 O ATOM 1098 CB VAL B 151 -14.230 -10.759 -1.118 1.00 0.00 C ATOM 1099 CG1 VAL B 151 -15.707 -10.993 -0.796 1.00 0.00 C ATOM 1100 CG2 VAL B 151 -13.386 -11.043 0.128 1.00 0.00 C ATOM 0 H VAL B 151 -15.505 -10.948 -3.288 1.00 0.00 H new ATOM 0 HA VAL B 151 -12.745 -11.534 -2.473 1.00 0.00 H new ATOM 0 HB VAL B 151 -14.086 -9.724 -1.429 1.00 0.00 H new ATOM 0 HG11 VAL B 151 -16.014 -10.325 0.009 1.00 0.00 H new ATOM 0 HG12 VAL B 151 -16.309 -10.793 -1.683 1.00 0.00 H new ATOM 0 HG13 VAL B 151 -15.852 -12.027 -0.485 1.00 0.00 H new ATOM 0 HG21 VAL B 151 -13.692 -10.376 0.934 1.00 0.00 H new ATOM 0 HG22 VAL B 151 -13.532 -12.078 0.438 1.00 0.00 H new ATOM 0 HG23 VAL B 151 -12.333 -10.877 -0.100 1.00 0.00 H new TER 1110 VAL B 151