USER MOD reduce.3.24.130724 H: found=0, std=0, add=436, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 429 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 147 CYS SG : rot 148:sc= 1.34 USER MOD Set 1.2: A 150 CYS SG : rot -47:sc= 0.368 USER MOD Set 1.3: A 168 CYS SG : rot -23:sc= 0.601 USER MOD Set 1.4: A 171 CYS SG : rot 3:sc= 1 USER MOD Set 2.1: A 120 CYS SG : rot 158:sc= 0.744 USER MOD Set 2.2: A 123 CYS SG : rot -63:sc= 0.514 USER MOD Set 2.3: A 141 HIS : no HD1:sc= 0.453 K(o=1.1,f=-0.28) USER MOD Set 2.4: A 144 CYS SG : rot 139:sc= -0.655 USER MOD Single : A 119 LYS NZ :NH3+ 170:sc=-0.00457 (180deg=-0.0989) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 LYS NZ :NH3+ 153:sc= 0 (180deg=-0.735) USER MOD Single : A 138 LYS NZ :NH3+ -149:sc= 0 (180deg=-0.079) USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 ASN : amide:sc= 0 X(o=0,f=-0.025) USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 153 SER OG : rot -160:sc= 0 USER MOD Single : A 156 SER OG : rot 180:sc= 0 USER MOD Single : A 157 THR OG1 : rot -11:sc= 0.00742 USER MOD Single : A 158 THR OG1 : rot 180:sc= 0 USER MOD Single : A 160 THR OG1 : rot 180:sc= 0 USER MOD Single : A 162 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 TYR OH : rot 180:sc= 0 USER MOD Single : A 169 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 172 TYR OH : rot 180:sc= 0 USER MOD Single : A 174 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0361) USER MOD Single : A 175 ASN : amide:sc= 0 X(o=0,f=-0.009) USER MOD ----------------------------------------------------------------- ATOM 11 N GLU A 118 -2.224 -12.680 -5.117 1.00 0.00 N ATOM 12 CA GLU A 118 -1.331 -11.797 -5.817 1.00 0.00 C ATOM 13 C GLU A 118 -0.037 -11.854 -5.055 1.00 0.00 C ATOM 14 O GLU A 118 0.220 -12.828 -4.348 1.00 0.00 O ATOM 15 CB GLU A 118 -1.898 -10.358 -5.950 1.00 0.00 C ATOM 16 CG GLU A 118 -1.534 -9.693 -7.292 1.00 0.00 C ATOM 17 CD GLU A 118 -2.105 -8.278 -7.361 1.00 0.00 C ATOM 18 OE1 GLU A 118 -3.351 -8.131 -7.242 1.00 0.00 O ATOM 19 OE2 GLU A 118 -1.301 -7.322 -7.539 1.00 0.00 O ATOM 0 HA GLU A 118 -1.188 -12.110 -6.851 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -2.983 -10.389 -5.848 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -1.518 -9.746 -5.132 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -0.450 -9.660 -7.406 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -1.923 -10.289 -8.117 1.00 0.00 H new ATOM 26 N LYS A 119 0.829 -10.828 -5.210 1.00 0.00 N ATOM 27 CA LYS A 119 2.149 -10.811 -4.631 1.00 0.00 C ATOM 28 C LYS A 119 2.264 -9.626 -3.722 1.00 0.00 C ATOM 29 O LYS A 119 1.569 -8.625 -3.888 1.00 0.00 O ATOM 30 CB LYS A 119 3.298 -10.806 -5.673 1.00 0.00 C ATOM 31 CG LYS A 119 3.528 -9.515 -6.488 1.00 0.00 C ATOM 32 CD LYS A 119 2.389 -9.089 -7.431 1.00 0.00 C ATOM 33 CE LYS A 119 2.719 -7.859 -8.292 1.00 0.00 C ATOM 34 NZ LYS A 119 3.831 -8.133 -9.232 1.00 0.00 N ATOM 0 H LYS A 119 0.609 -9.991 -5.749 1.00 0.00 H new ATOM 0 HA LYS A 119 2.266 -11.742 -4.076 1.00 0.00 H new ATOM 0 HB2 LYS A 119 4.225 -11.041 -5.150 1.00 0.00 H new ATOM 0 HB3 LYS A 119 3.115 -11.618 -6.377 1.00 0.00 H new ATOM 0 HG2 LYS A 119 3.717 -8.699 -5.790 1.00 0.00 H new ATOM 0 HG3 LYS A 119 4.433 -9.642 -7.082 1.00 0.00 H new ATOM 0 HD2 LYS A 119 2.143 -9.924 -8.087 1.00 0.00 H new ATOM 0 HD3 LYS A 119 1.500 -8.877 -6.838 1.00 0.00 H new ATOM 0 HE2 LYS A 119 1.834 -7.559 -8.853 1.00 0.00 H new ATOM 0 HE3 LYS A 119 2.986 -7.023 -7.646 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 3.915 -7.347 -9.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 4.720 -8.229 -8.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 3.640 -9.015 -9.748 1.00 0.00 H new ATOM 48 N CYS A 120 3.164 -9.739 -2.718 1.00 0.00 N ATOM 49 CA CYS A 120 3.469 -8.701 -1.770 1.00 0.00 C ATOM 50 C CYS A 120 4.722 -8.010 -2.236 1.00 0.00 C ATOM 51 O CYS A 120 5.739 -8.651 -2.501 1.00 0.00 O ATOM 52 CB CYS A 120 3.660 -9.232 -0.330 1.00 0.00 C ATOM 53 SG CYS A 120 3.682 -7.903 0.913 1.00 0.00 S ATOM 0 H CYS A 120 3.702 -10.591 -2.561 1.00 0.00 H new ATOM 0 HA CYS A 120 2.624 -8.013 -1.727 1.00 0.00 H new ATOM 0 HB2 CYS A 120 2.856 -9.930 -0.095 1.00 0.00 H new ATOM 0 HB3 CYS A 120 4.594 -9.791 -0.274 1.00 0.00 H new ATOM 0 HG CYS A 120 3.374 -8.393 2.077 1.00 0.00 H new ATOM 58 N SER A 121 4.645 -6.665 -2.369 1.00 0.00 N ATOM 59 CA SER A 121 5.703 -5.820 -2.872 1.00 0.00 C ATOM 60 C SER A 121 6.799 -5.640 -1.843 1.00 0.00 C ATOM 61 O SER A 121 7.967 -5.493 -2.202 1.00 0.00 O ATOM 62 CB SER A 121 5.138 -4.426 -3.258 1.00 0.00 C ATOM 63 OG SER A 121 6.088 -3.626 -3.956 1.00 0.00 O ATOM 0 H SER A 121 3.808 -6.141 -2.115 1.00 0.00 H new ATOM 0 HA SER A 121 6.123 -6.307 -3.752 1.00 0.00 H new ATOM 0 HB2 SER A 121 4.252 -4.556 -3.879 1.00 0.00 H new ATOM 0 HB3 SER A 121 4.821 -3.903 -2.355 1.00 0.00 H new ATOM 0 HG SER A 121 5.686 -2.760 -4.178 1.00 0.00 H new ATOM 69 N ARG A 122 6.437 -5.633 -0.538 1.00 0.00 N ATOM 70 CA ARG A 122 7.319 -5.225 0.530 1.00 0.00 C ATOM 71 C ARG A 122 8.280 -6.315 0.907 1.00 0.00 C ATOM 72 O ARG A 122 9.493 -6.128 0.821 1.00 0.00 O ATOM 73 CB ARG A 122 6.522 -4.842 1.800 1.00 0.00 C ATOM 74 CG ARG A 122 7.356 -4.381 3.012 1.00 0.00 C ATOM 75 CD ARG A 122 8.266 -3.176 2.730 1.00 0.00 C ATOM 76 NE ARG A 122 9.041 -2.846 3.972 1.00 0.00 N ATOM 77 CZ ARG A 122 10.219 -3.456 4.311 1.00 0.00 C ATOM 78 NH1 ARG A 122 10.772 -4.425 3.524 1.00 0.00 N ATOM 79 NH2 ARG A 122 10.853 -3.086 5.462 1.00 0.00 N ATOM 0 H ARG A 122 5.512 -5.917 -0.216 1.00 0.00 H new ATOM 0 HA ARG A 122 7.869 -4.363 0.154 1.00 0.00 H new ATOM 0 HB2 ARG A 122 5.825 -4.045 1.540 1.00 0.00 H new ATOM 0 HB3 ARG A 122 5.924 -5.702 2.102 1.00 0.00 H new ATOM 0 HG2 ARG A 122 6.680 -4.128 3.829 1.00 0.00 H new ATOM 0 HG3 ARG A 122 7.971 -5.214 3.354 1.00 0.00 H new ATOM 0 HD2 ARG A 122 8.948 -3.403 1.910 1.00 0.00 H new ATOM 0 HD3 ARG A 122 7.669 -2.318 2.420 1.00 0.00 H new ATOM 0 HE ARG A 122 8.671 -2.130 4.596 1.00 0.00 H new ATOM 0 HH11 ARG A 122 10.307 -4.709 2.662 1.00 0.00 H new ATOM 0 HH12 ARG A 122 11.651 -4.865 3.798 1.00 0.00 H new ATOM 0 HH21 ARG A 122 10.448 -2.363 6.057 1.00 0.00 H new ATOM 0 HH22 ARG A 122 11.731 -3.532 5.727 1.00 0.00 H new ATOM 93 N CYS A 123 7.751 -7.474 1.362 1.00 0.00 N ATOM 94 CA CYS A 123 8.532 -8.445 2.090 1.00 0.00 C ATOM 95 C CYS A 123 9.178 -9.424 1.142 1.00 0.00 C ATOM 96 O CYS A 123 10.099 -10.143 1.530 1.00 0.00 O ATOM 97 CB CYS A 123 7.688 -9.187 3.164 1.00 0.00 C ATOM 98 SG CYS A 123 6.234 -10.088 2.525 1.00 0.00 S ATOM 0 H CYS A 123 6.776 -7.742 1.225 1.00 0.00 H new ATOM 0 HA CYS A 123 9.316 -7.903 2.619 1.00 0.00 H new ATOM 0 HB2 CYS A 123 8.333 -9.894 3.685 1.00 0.00 H new ATOM 0 HB3 CYS A 123 7.349 -8.460 3.903 1.00 0.00 H new ATOM 0 HG CYS A 123 5.404 -9.245 1.985 1.00 0.00 H new ATOM 103 N GLY A 124 8.728 -9.445 -0.136 1.00 0.00 N ATOM 104 CA GLY A 124 9.363 -10.199 -1.189 1.00 0.00 C ATOM 105 C GLY A 124 8.676 -11.513 -1.392 1.00 0.00 C ATOM 106 O GLY A 124 8.993 -12.238 -2.334 1.00 0.00 O ATOM 0 H GLY A 124 7.905 -8.927 -0.444 1.00 0.00 H new ATOM 0 HA2 GLY A 124 9.342 -9.626 -2.116 1.00 0.00 H new ATOM 0 HA3 GLY A 124 10.411 -10.366 -0.941 1.00 0.00 H new ATOM 110 N ASP A 125 7.708 -11.847 -0.507 1.00 0.00 N ATOM 111 CA ASP A 125 6.939 -13.065 -0.574 1.00 0.00 C ATOM 112 C ASP A 125 5.689 -12.743 -1.345 1.00 0.00 C ATOM 113 O ASP A 125 5.588 -11.685 -1.966 1.00 0.00 O ATOM 114 CB ASP A 125 6.554 -13.605 0.830 1.00 0.00 C ATOM 115 CG ASP A 125 7.821 -13.841 1.655 1.00 0.00 C ATOM 116 OD1 ASP A 125 8.645 -14.699 1.241 1.00 0.00 O ATOM 117 OD2 ASP A 125 7.980 -13.167 2.707 1.00 0.00 O ATOM 0 H ASP A 125 7.452 -11.251 0.280 1.00 0.00 H new ATOM 0 HA ASP A 125 7.536 -13.842 -1.052 1.00 0.00 H new ATOM 0 HB2 ASP A 125 5.904 -12.893 1.339 1.00 0.00 H new ATOM 0 HB3 ASP A 125 5.993 -14.535 0.732 1.00 0.00 H new ATOM 122 N SER A 126 4.708 -13.669 -1.327 1.00 0.00 N ATOM 123 CA SER A 126 3.419 -13.465 -1.932 1.00 0.00 C ATOM 124 C SER A 126 2.437 -13.375 -0.806 1.00 0.00 C ATOM 125 O SER A 126 2.724 -13.795 0.315 1.00 0.00 O ATOM 126 CB SER A 126 3.003 -14.616 -2.875 1.00 0.00 C ATOM 127 OG SER A 126 3.877 -14.679 -3.992 1.00 0.00 O ATOM 0 H SER A 126 4.811 -14.581 -0.882 1.00 0.00 H new ATOM 0 HA SER A 126 3.451 -12.564 -2.545 1.00 0.00 H new ATOM 0 HB2 SER A 126 3.023 -15.563 -2.335 1.00 0.00 H new ATOM 0 HB3 SER A 126 1.978 -14.465 -3.215 1.00 0.00 H new ATOM 0 HG SER A 126 3.603 -15.413 -4.580 1.00 0.00 H new ATOM 133 N VAL A 127 1.243 -12.805 -1.090 1.00 0.00 N ATOM 134 CA VAL A 127 0.168 -12.747 -0.135 1.00 0.00 C ATOM 135 C VAL A 127 -1.037 -13.238 -0.887 1.00 0.00 C ATOM 136 O VAL A 127 -1.391 -12.725 -1.946 1.00 0.00 O ATOM 137 CB VAL A 127 -0.004 -11.380 0.524 1.00 0.00 C ATOM 138 CG1 VAL A 127 -0.372 -10.265 -0.475 1.00 0.00 C ATOM 139 CG2 VAL A 127 -1.017 -11.496 1.675 1.00 0.00 C ATOM 0 H VAL A 127 1.022 -12.380 -1.991 1.00 0.00 H new ATOM 0 HA VAL A 127 0.367 -13.374 0.734 1.00 0.00 H new ATOM 0 HB VAL A 127 0.961 -11.076 0.931 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -0.479 -9.320 0.058 1.00 0.00 H new ATOM 0 HG12 VAL A 127 0.415 -10.172 -1.223 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -1.312 -10.513 -0.967 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -1.143 -10.522 2.148 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -1.976 -11.836 1.283 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -0.651 -12.212 2.411 1.00 0.00 H new ATOM 149 N TYR A 128 -1.651 -14.324 -0.367 1.00 0.00 N ATOM 150 CA TYR A 128 -2.645 -15.077 -1.083 1.00 0.00 C ATOM 151 C TYR A 128 -3.651 -15.491 -0.051 1.00 0.00 C ATOM 152 O TYR A 128 -4.527 -14.708 0.315 1.00 0.00 O ATOM 153 CB TYR A 128 -2.075 -16.263 -1.939 1.00 0.00 C ATOM 154 CG TYR A 128 -0.994 -17.107 -1.282 1.00 0.00 C ATOM 155 CD1 TYR A 128 0.316 -16.616 -1.132 1.00 0.00 C ATOM 156 CD2 TYR A 128 -1.266 -18.422 -0.859 1.00 0.00 C ATOM 157 CE1 TYR A 128 1.311 -17.387 -0.523 1.00 0.00 C ATOM 158 CE2 TYR A 128 -0.275 -19.200 -0.247 1.00 0.00 C ATOM 159 CZ TYR A 128 1.015 -18.680 -0.073 1.00 0.00 C ATOM 160 OH TYR A 128 2.017 -19.462 0.544 1.00 0.00 O ATOM 0 H TYR A 128 -1.454 -14.685 0.566 1.00 0.00 H new ATOM 0 HA TYR A 128 -3.108 -14.464 -1.856 1.00 0.00 H new ATOM 0 HB2 TYR A 128 -2.903 -16.918 -2.211 1.00 0.00 H new ATOM 0 HB3 TYR A 128 -1.674 -15.854 -2.866 1.00 0.00 H new ATOM 0 HD1 TYR A 128 0.557 -15.627 -1.493 1.00 0.00 H new ATOM 0 HD2 TYR A 128 -2.252 -18.836 -1.008 1.00 0.00 H new ATOM 0 HE1 TYR A 128 2.306 -16.986 -0.400 1.00 0.00 H new ATOM 0 HE2 TYR A 128 -0.505 -20.200 0.091 1.00 0.00 H new ATOM 0 HH TYR A 128 1.643 -20.332 0.797 1.00 0.00 H new ATOM 170 N ALA A 129 -3.525 -16.733 0.467 1.00 0.00 N ATOM 171 CA ALA A 129 -4.333 -17.276 1.528 1.00 0.00 C ATOM 172 C ALA A 129 -3.539 -17.184 2.804 1.00 0.00 C ATOM 173 O ALA A 129 -3.774 -17.939 3.748 1.00 0.00 O ATOM 174 CB ALA A 129 -4.684 -18.755 1.269 1.00 0.00 C ATOM 0 H ALA A 129 -2.824 -17.393 0.129 1.00 0.00 H new ATOM 0 HA ALA A 129 -5.264 -16.713 1.590 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -5.294 -19.133 2.089 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -5.239 -18.839 0.335 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -3.767 -19.340 1.200 1.00 0.00 H new ATOM 180 N ALA A 130 -2.584 -16.222 2.859 1.00 0.00 N ATOM 181 CA ALA A 130 -1.773 -15.933 4.011 1.00 0.00 C ATOM 182 C ALA A 130 -2.571 -14.994 4.875 1.00 0.00 C ATOM 183 O ALA A 130 -3.460 -15.435 5.602 1.00 0.00 O ATOM 184 CB ALA A 130 -0.415 -15.313 3.617 1.00 0.00 C ATOM 0 H ALA A 130 -2.370 -15.621 2.063 1.00 0.00 H new ATOM 0 HA ALA A 130 -1.534 -16.851 4.548 1.00 0.00 H new ATOM 0 HB1 ALA A 130 0.167 -15.110 4.516 1.00 0.00 H new ATOM 0 HB2 ALA A 130 0.132 -16.009 2.980 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -0.583 -14.382 3.076 1.00 0.00 H new ATOM 190 N GLU A 131 -2.280 -13.675 4.806 1.00 0.00 N ATOM 191 CA GLU A 131 -3.026 -12.675 5.520 1.00 0.00 C ATOM 192 C GLU A 131 -3.150 -11.521 4.576 1.00 0.00 C ATOM 193 O GLU A 131 -2.440 -10.525 4.712 1.00 0.00 O ATOM 194 CB GLU A 131 -2.329 -12.180 6.816 1.00 0.00 C ATOM 195 CG GLU A 131 -2.205 -13.271 7.894 1.00 0.00 C ATOM 196 CD GLU A 131 -1.591 -12.682 9.163 1.00 0.00 C ATOM 197 OE1 GLU A 131 -0.437 -12.182 9.089 1.00 0.00 O ATOM 198 OE2 GLU A 131 -2.269 -12.729 10.224 1.00 0.00 O ATOM 0 H GLU A 131 -1.515 -13.298 4.246 1.00 0.00 H new ATOM 0 HA GLU A 131 -3.979 -13.100 5.835 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -1.334 -11.810 6.567 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -2.889 -11.338 7.223 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -3.187 -13.689 8.115 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -1.586 -14.089 7.526 1.00 0.00 H new ATOM 205 N LYS A 132 -4.073 -11.619 3.585 1.00 0.00 N ATOM 206 CA LYS A 132 -4.307 -10.514 2.686 1.00 0.00 C ATOM 207 C LYS A 132 -5.340 -9.627 3.317 1.00 0.00 C ATOM 208 O LYS A 132 -6.387 -10.087 3.772 1.00 0.00 O ATOM 209 CB LYS A 132 -4.741 -10.894 1.258 1.00 0.00 C ATOM 210 CG LYS A 132 -4.471 -9.729 0.290 1.00 0.00 C ATOM 211 CD LYS A 132 -5.129 -9.839 -1.087 1.00 0.00 C ATOM 212 CE LYS A 132 -4.468 -10.800 -2.085 1.00 0.00 C ATOM 213 NZ LYS A 132 -4.744 -12.217 -1.761 1.00 0.00 N ATOM 0 H LYS A 132 -4.646 -12.445 3.409 1.00 0.00 H new ATOM 0 HA LYS A 132 -3.348 -10.014 2.548 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -4.199 -11.781 0.930 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -5.801 -11.146 1.248 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -4.809 -8.805 0.760 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -3.394 -9.640 0.151 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -6.164 -10.151 -0.947 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -5.153 -8.845 -1.534 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -4.828 -10.582 -3.090 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -3.391 -10.633 -2.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -4.701 -12.787 -2.630 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -4.034 -12.563 -1.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -5.691 -12.299 -1.340 1.00 0.00 H new ATOM 227 N VAL A 133 -5.031 -8.318 3.339 1.00 0.00 N ATOM 228 CA VAL A 133 -5.907 -7.263 3.755 1.00 0.00 C ATOM 229 C VAL A 133 -5.761 -6.258 2.652 1.00 0.00 C ATOM 230 O VAL A 133 -4.716 -6.173 2.007 1.00 0.00 O ATOM 231 CB VAL A 133 -5.560 -6.647 5.107 1.00 0.00 C ATOM 232 CG1 VAL A 133 -6.039 -7.606 6.217 1.00 0.00 C ATOM 233 CG2 VAL A 133 -4.047 -6.366 5.226 1.00 0.00 C ATOM 0 H VAL A 133 -4.115 -7.975 3.049 1.00 0.00 H new ATOM 0 HA VAL A 133 -6.922 -7.629 3.907 1.00 0.00 H new ATOM 0 HB VAL A 133 -6.064 -5.686 5.209 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -5.799 -7.182 7.192 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -7.117 -7.746 6.137 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -5.539 -8.568 6.107 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -3.834 -5.927 6.201 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -3.494 -7.299 5.119 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -3.743 -5.672 4.442 1.00 0.00 H new ATOM 243 N ILE A 134 -6.844 -5.502 2.377 1.00 0.00 N ATOM 244 CA ILE A 134 -6.884 -4.555 1.293 1.00 0.00 C ATOM 245 C ILE A 134 -7.176 -3.241 1.953 1.00 0.00 C ATOM 246 O ILE A 134 -8.028 -3.154 2.836 1.00 0.00 O ATOM 247 CB ILE A 134 -7.931 -4.910 0.236 1.00 0.00 C ATOM 248 CG1 ILE A 134 -7.581 -6.291 -0.386 1.00 0.00 C ATOM 249 CG2 ILE A 134 -8.010 -3.800 -0.837 1.00 0.00 C ATOM 250 CD1 ILE A 134 -8.584 -6.792 -1.430 1.00 0.00 C ATOM 0 H ILE A 134 -7.709 -5.547 2.916 1.00 0.00 H new ATOM 0 HA ILE A 134 -5.945 -4.540 0.739 1.00 0.00 H new ATOM 0 HB ILE A 134 -8.916 -4.981 0.698 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -6.596 -6.227 -0.849 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -7.510 -7.028 0.414 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -8.759 -4.067 -1.582 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -8.287 -2.857 -0.365 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -7.039 -3.692 -1.321 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -8.260 -7.761 -1.810 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -9.567 -6.892 -0.971 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -8.639 -6.080 -2.253 1.00 0.00 H new ATOM 262 N GLY A 135 -6.449 -2.184 1.522 1.00 0.00 N ATOM 263 CA GLY A 135 -6.646 -0.835 1.978 1.00 0.00 C ATOM 264 C GLY A 135 -7.572 -0.200 0.994 1.00 0.00 C ATOM 265 O GLY A 135 -8.775 -0.109 1.231 1.00 0.00 O ATOM 0 H GLY A 135 -5.701 -2.272 0.834 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -7.072 -0.820 2.981 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -5.699 -0.297 2.026 1.00 0.00 H new ATOM 269 N ALA A 136 -7.008 0.247 -0.150 1.00 0.00 N ATOM 270 CA ALA A 136 -7.747 0.883 -1.209 1.00 0.00 C ATOM 271 C ALA A 136 -8.080 -0.162 -2.234 1.00 0.00 C ATOM 272 O ALA A 136 -9.253 -0.456 -2.457 1.00 0.00 O ATOM 273 CB ALA A 136 -6.950 2.022 -1.863 1.00 0.00 C ATOM 0 H ALA A 136 -6.010 0.164 -0.345 1.00 0.00 H new ATOM 0 HA ALA A 136 -8.652 1.326 -0.793 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -7.545 2.474 -2.656 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -6.712 2.777 -1.113 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -6.026 1.625 -2.284 1.00 0.00 H new ATOM 279 N GLY A 137 -7.051 -0.764 -2.876 1.00 0.00 N ATOM 280 CA GLY A 137 -7.300 -1.786 -3.857 1.00 0.00 C ATOM 281 C GLY A 137 -6.001 -2.374 -4.304 1.00 0.00 C ATOM 282 O GLY A 137 -5.744 -2.457 -5.505 1.00 0.00 O ATOM 0 H GLY A 137 -6.066 -0.548 -2.720 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -7.937 -2.563 -3.435 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -7.833 -1.365 -4.709 1.00 0.00 H new ATOM 286 N LYS A 138 -5.154 -2.812 -3.342 1.00 0.00 N ATOM 287 CA LYS A 138 -3.890 -3.449 -3.633 1.00 0.00 C ATOM 288 C LYS A 138 -3.708 -4.559 -2.620 1.00 0.00 C ATOM 289 O LYS A 138 -4.329 -4.508 -1.559 1.00 0.00 O ATOM 290 CB LYS A 138 -2.694 -2.468 -3.537 1.00 0.00 C ATOM 291 CG LYS A 138 -2.465 -1.668 -4.828 1.00 0.00 C ATOM 292 CD LYS A 138 -1.251 -0.732 -4.754 1.00 0.00 C ATOM 293 CE LYS A 138 -0.891 -0.130 -6.118 1.00 0.00 C ATOM 294 NZ LYS A 138 0.256 0.800 -6.005 1.00 0.00 N ATOM 0 H LYS A 138 -5.348 -2.723 -2.345 1.00 0.00 H new ATOM 0 HA LYS A 138 -3.909 -3.823 -4.657 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -2.865 -1.775 -2.713 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -1.790 -3.029 -3.299 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -2.330 -2.362 -5.658 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -3.356 -1.079 -5.046 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -1.459 0.073 -4.049 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -0.394 -1.283 -4.366 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -0.648 -0.929 -6.819 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -1.753 0.399 -6.524 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 0.166 1.550 -6.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 0.266 1.225 -5.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 1.142 0.278 -6.160 1.00 0.00 H new ATOM 308 N PRO A 139 -2.891 -5.584 -2.889 1.00 0.00 N ATOM 309 CA PRO A 139 -2.600 -6.655 -1.945 1.00 0.00 C ATOM 310 C PRO A 139 -1.632 -6.167 -0.895 1.00 0.00 C ATOM 311 O PRO A 139 -0.689 -5.453 -1.234 1.00 0.00 O ATOM 312 CB PRO A 139 -1.940 -7.739 -2.808 1.00 0.00 C ATOM 313 CG PRO A 139 -1.285 -6.968 -3.956 1.00 0.00 C ATOM 314 CD PRO A 139 -2.275 -5.834 -4.198 1.00 0.00 C ATOM 0 HA PRO A 139 -3.487 -7.013 -1.422 1.00 0.00 H new ATOM 0 HB2 PRO A 139 -1.203 -8.305 -2.239 1.00 0.00 H new ATOM 0 HB3 PRO A 139 -2.675 -8.454 -3.178 1.00 0.00 H new ATOM 0 HG2 PRO A 139 -0.298 -6.594 -3.683 1.00 0.00 H new ATOM 0 HG3 PRO A 139 -1.156 -7.590 -4.842 1.00 0.00 H new ATOM 0 HD2 PRO A 139 -1.771 -4.943 -4.574 1.00 0.00 H new ATOM 0 HD3 PRO A 139 -3.023 -6.114 -4.940 1.00 0.00 H new ATOM 322 N TRP A 140 -1.874 -6.523 0.387 1.00 0.00 N ATOM 323 CA TRP A 140 -1.076 -6.057 1.492 1.00 0.00 C ATOM 324 C TRP A 140 -1.107 -7.118 2.551 1.00 0.00 C ATOM 325 O TRP A 140 -2.143 -7.731 2.785 1.00 0.00 O ATOM 326 CB TRP A 140 -1.571 -4.744 2.156 1.00 0.00 C ATOM 327 CG TRP A 140 -1.809 -3.577 1.217 1.00 0.00 C ATOM 328 CD1 TRP A 140 -3.001 -2.999 0.884 1.00 0.00 C ATOM 329 CD2 TRP A 140 -0.793 -2.840 0.512 1.00 0.00 C ATOM 330 NE1 TRP A 140 -2.803 -1.943 0.031 1.00 0.00 N ATOM 331 CE2 TRP A 140 -1.452 -1.827 -0.216 1.00 0.00 C ATOM 332 CE3 TRP A 140 0.590 -2.983 0.454 1.00 0.00 C ATOM 333 CZ2 TRP A 140 -0.735 -0.936 -1.006 1.00 0.00 C ATOM 334 CZ3 TRP A 140 1.312 -2.081 -0.341 1.00 0.00 C ATOM 335 CH2 TRP A 140 0.658 -1.065 -1.053 1.00 0.00 C ATOM 0 H TRP A 140 -2.635 -7.144 0.662 1.00 0.00 H new ATOM 0 HA TRP A 140 -0.086 -5.852 1.085 1.00 0.00 H new ATOM 0 HB2 TRP A 140 -2.500 -4.955 2.685 1.00 0.00 H new ATOM 0 HB3 TRP A 140 -0.840 -4.440 2.905 1.00 0.00 H new ATOM 0 HD1 TRP A 140 -3.965 -3.328 1.242 1.00 0.00 H new ATOM 0 HE1 TRP A 140 -3.533 -1.344 -0.355 1.00 0.00 H new ATOM 0 HE3 TRP A 140 1.092 -3.765 1.004 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 -1.239 -0.164 -1.569 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 2.386 -2.170 -0.406 1.00 0.00 H new ATOM 0 HH2 TRP A 140 1.237 -0.373 -1.646 1.00 0.00 H new ATOM 346 N HIS A 141 0.042 -7.346 3.233 1.00 0.00 N ATOM 347 CA HIS A 141 0.065 -7.964 4.541 1.00 0.00 C ATOM 348 C HIS A 141 -0.173 -6.831 5.493 1.00 0.00 C ATOM 349 O HIS A 141 0.061 -5.669 5.160 1.00 0.00 O ATOM 350 CB HIS A 141 1.375 -8.657 4.983 1.00 0.00 C ATOM 351 CG HIS A 141 1.718 -9.913 4.238 1.00 0.00 C ATOM 352 ND1 HIS A 141 2.862 -10.076 3.495 1.00 0.00 N ATOM 353 CD2 HIS A 141 1.102 -11.118 4.296 1.00 0.00 C ATOM 354 CE1 HIS A 141 2.921 -11.347 3.114 1.00 0.00 C ATOM 355 NE2 HIS A 141 1.870 -11.999 3.586 1.00 0.00 N ATOM 0 H HIS A 141 0.965 -7.100 2.876 1.00 0.00 H new ATOM 0 HA HIS A 141 -0.671 -8.768 4.523 1.00 0.00 H new ATOM 0 HB2 HIS A 141 2.197 -7.950 4.869 1.00 0.00 H new ATOM 0 HB3 HIS A 141 1.302 -8.892 6.045 1.00 0.00 H new ATOM 0 HD2 HIS A 141 0.177 -11.341 4.807 1.00 0.00 H new ATOM 0 HE1 HIS A 141 3.705 -11.782 2.512 1.00 0.00 H new ATOM 0 HE2 HIS A 141 1.668 -12.989 3.444 1.00 0.00 H new ATOM 363 N LYS A 142 -0.710 -7.141 6.693 1.00 0.00 N ATOM 364 CA LYS A 142 -1.073 -6.148 7.675 1.00 0.00 C ATOM 365 C LYS A 142 0.116 -5.508 8.368 1.00 0.00 C ATOM 366 O LYS A 142 -0.063 -4.625 9.205 1.00 0.00 O ATOM 367 CB LYS A 142 -2.029 -6.728 8.744 1.00 0.00 C ATOM 368 CG LYS A 142 -1.418 -7.847 9.605 1.00 0.00 C ATOM 369 CD LYS A 142 -2.415 -8.437 10.613 1.00 0.00 C ATOM 370 CE LYS A 142 -1.767 -9.459 11.555 1.00 0.00 C ATOM 371 NZ LYS A 142 -2.766 -10.042 12.479 1.00 0.00 N ATOM 0 H LYS A 142 -0.897 -8.099 6.990 1.00 0.00 H new ATOM 0 HA LYS A 142 -1.580 -5.368 7.107 1.00 0.00 H new ATOM 0 HB2 LYS A 142 -2.355 -5.920 9.399 1.00 0.00 H new ATOM 0 HB3 LYS A 142 -2.919 -7.114 8.247 1.00 0.00 H new ATOM 0 HG2 LYS A 142 -1.054 -8.642 8.954 1.00 0.00 H new ATOM 0 HG3 LYS A 142 -0.555 -7.455 10.143 1.00 0.00 H new ATOM 0 HD2 LYS A 142 -2.850 -7.630 11.203 1.00 0.00 H new ATOM 0 HD3 LYS A 142 -3.233 -8.914 10.073 1.00 0.00 H new ATOM 0 HE2 LYS A 142 -1.301 -10.253 10.971 1.00 0.00 H new ATOM 0 HE3 LYS A 142 -0.974 -8.978 12.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 -2.300 -10.730 13.105 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 -3.192 -9.286 13.052 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 -3.509 -10.521 11.930 1.00 0.00 H new ATOM 385 N ASN A 143 1.351 -5.939 8.017 1.00 0.00 N ATOM 386 CA ASN A 143 2.600 -5.387 8.480 1.00 0.00 C ATOM 387 C ASN A 143 3.223 -4.629 7.326 1.00 0.00 C ATOM 388 O ASN A 143 4.022 -3.717 7.530 1.00 0.00 O ATOM 389 CB ASN A 143 3.555 -6.530 8.925 1.00 0.00 C ATOM 390 CG ASN A 143 4.823 -5.991 9.609 1.00 0.00 C ATOM 391 OD1 ASN A 143 4.750 -5.421 10.704 1.00 0.00 O ATOM 392 ND2 ASN A 143 6.000 -6.182 8.937 1.00 0.00 N ATOM 0 H ASN A 143 1.485 -6.718 7.373 1.00 0.00 H new ATOM 0 HA ASN A 143 2.430 -4.727 9.331 1.00 0.00 H new ATOM 0 HB2 ASN A 143 3.029 -7.195 9.610 1.00 0.00 H new ATOM 0 HB3 ASN A 143 3.837 -7.125 8.056 1.00 0.00 H new ATOM 0 HD21 ASN A 143 6.876 -5.847 9.338 1.00 0.00 H new ATOM 0 HD22 ASN A 143 6.001 -6.660 8.036 1.00 0.00 H new ATOM 399 N CYS A 144 2.873 -5.023 6.083 1.00 0.00 N ATOM 400 CA CYS A 144 3.504 -4.601 4.856 1.00 0.00 C ATOM 401 C CYS A 144 2.714 -3.519 4.151 1.00 0.00 C ATOM 402 O CYS A 144 2.713 -3.485 2.921 1.00 0.00 O ATOM 403 CB CYS A 144 3.629 -5.782 3.858 1.00 0.00 C ATOM 404 SG CYS A 144 4.698 -7.155 4.409 1.00 0.00 S ATOM 0 H CYS A 144 2.105 -5.674 5.922 1.00 0.00 H new ATOM 0 HA CYS A 144 4.485 -4.223 5.145 1.00 0.00 H new ATOM 0 HB2 CYS A 144 2.632 -6.176 3.659 1.00 0.00 H new ATOM 0 HB3 CYS A 144 4.015 -5.399 2.913 1.00 0.00 H new ATOM 0 HG CYS A 144 4.147 -8.289 4.091 1.00 0.00 H new ATOM 409 N PHE A 145 2.005 -2.607 4.869 1.00 0.00 N ATOM 410 CA PHE A 145 1.183 -1.601 4.215 1.00 0.00 C ATOM 411 C PHE A 145 2.078 -0.482 3.749 1.00 0.00 C ATOM 412 O PHE A 145 2.428 0.389 4.537 1.00 0.00 O ATOM 413 CB PHE A 145 0.127 -0.953 5.156 1.00 0.00 C ATOM 414 CG PHE A 145 -1.168 -1.718 5.186 1.00 0.00 C ATOM 415 CD1 PHE A 145 -2.081 -1.572 4.127 1.00 0.00 C ATOM 416 CD2 PHE A 145 -1.542 -2.496 6.295 1.00 0.00 C ATOM 417 CE1 PHE A 145 -3.346 -2.167 4.182 1.00 0.00 C ATOM 418 CE2 PHE A 145 -2.808 -3.091 6.354 1.00 0.00 C ATOM 419 CZ PHE A 145 -3.710 -2.929 5.296 1.00 0.00 C ATOM 0 H PHE A 145 1.998 -2.563 5.888 1.00 0.00 H new ATOM 0 HA PHE A 145 0.661 -2.109 3.405 1.00 0.00 H new ATOM 0 HB2 PHE A 145 0.533 -0.894 6.166 1.00 0.00 H new ATOM 0 HB3 PHE A 145 -0.066 0.069 4.830 1.00 0.00 H new ATOM 0 HD1 PHE A 145 -1.802 -0.993 3.259 1.00 0.00 H new ATOM 0 HD2 PHE A 145 -0.846 -2.636 7.109 1.00 0.00 H new ATOM 0 HE1 PHE A 145 -4.040 -2.038 3.365 1.00 0.00 H new ATOM 0 HE2 PHE A 145 -3.089 -3.676 7.217 1.00 0.00 H new ATOM 0 HZ PHE A 145 -4.685 -3.392 5.340 1.00 0.00 H new ATOM 429 N ARG A 146 2.470 -0.465 2.450 1.00 0.00 N ATOM 430 CA ARG A 146 3.353 0.560 1.944 1.00 0.00 C ATOM 431 C ARG A 146 2.541 1.703 1.425 1.00 0.00 C ATOM 432 O ARG A 146 1.326 1.622 1.276 1.00 0.00 O ATOM 433 CB ARG A 146 4.309 0.143 0.799 1.00 0.00 C ATOM 434 CG ARG A 146 5.052 -1.172 1.057 1.00 0.00 C ATOM 435 CD ARG A 146 6.001 -1.543 -0.092 1.00 0.00 C ATOM 436 NE ARG A 146 7.135 -0.562 -0.127 1.00 0.00 N ATOM 437 CZ ARG A 146 8.279 -0.786 -0.842 1.00 0.00 C ATOM 438 NH1 ARG A 146 8.442 -1.930 -1.569 1.00 0.00 N ATOM 439 NH2 ARG A 146 9.273 0.150 -0.824 1.00 0.00 N ATOM 0 H ARG A 146 2.179 -1.154 1.756 1.00 0.00 H new ATOM 0 HA ARG A 146 3.978 0.810 2.801 1.00 0.00 H new ATOM 0 HB2 ARG A 146 3.736 0.050 -0.124 1.00 0.00 H new ATOM 0 HB3 ARG A 146 5.039 0.937 0.642 1.00 0.00 H new ATOM 0 HG2 ARG A 146 5.622 -1.089 1.983 1.00 0.00 H new ATOM 0 HG3 ARG A 146 4.327 -1.974 1.200 1.00 0.00 H new ATOM 0 HD2 ARG A 146 6.383 -2.554 0.047 1.00 0.00 H new ATOM 0 HD3 ARG A 146 5.465 -1.532 -1.041 1.00 0.00 H new ATOM 0 HE ARG A 146 7.050 0.305 0.403 1.00 0.00 H new ATOM 0 HH11 ARG A 146 7.704 -2.634 -1.585 1.00 0.00 H new ATOM 0 HH12 ARG A 146 9.302 -2.081 -2.097 1.00 0.00 H new ATOM 0 HH21 ARG A 146 9.158 1.006 -0.281 1.00 0.00 H new ATOM 0 HH22 ARG A 146 10.131 -0.007 -1.354 1.00 0.00 H new ATOM 453 N CYS A 147 3.254 2.798 1.120 1.00 0.00 N ATOM 454 CA CYS A 147 2.767 3.962 0.444 1.00 0.00 C ATOM 455 C CYS A 147 3.025 3.715 -1.017 1.00 0.00 C ATOM 456 O CYS A 147 4.038 3.121 -1.381 1.00 0.00 O ATOM 457 CB CYS A 147 3.522 5.215 0.917 1.00 0.00 C ATOM 458 SG CYS A 147 2.883 6.731 0.188 1.00 0.00 S ATOM 0 H CYS A 147 4.242 2.877 1.362 1.00 0.00 H new ATOM 0 HA CYS A 147 1.710 4.133 0.646 1.00 0.00 H new ATOM 0 HB2 CYS A 147 3.457 5.284 2.003 1.00 0.00 H new ATOM 0 HB3 CYS A 147 4.578 5.114 0.666 1.00 0.00 H new ATOM 0 HG CYS A 147 3.019 7.710 1.033 1.00 0.00 H new ATOM 463 N ALA A 148 2.076 4.124 -1.887 1.00 0.00 N ATOM 464 CA ALA A 148 2.183 3.898 -3.310 1.00 0.00 C ATOM 465 C ALA A 148 2.803 5.097 -3.984 1.00 0.00 C ATOM 466 O ALA A 148 3.239 5.001 -5.130 1.00 0.00 O ATOM 467 CB ALA A 148 0.817 3.627 -3.955 1.00 0.00 C ATOM 0 H ALA A 148 1.227 4.615 -1.606 1.00 0.00 H new ATOM 0 HA ALA A 148 2.812 3.018 -3.444 1.00 0.00 H new ATOM 0 HB1 ALA A 148 0.946 3.463 -5.025 1.00 0.00 H new ATOM 0 HB2 ALA A 148 0.371 2.741 -3.503 1.00 0.00 H new ATOM 0 HB3 ALA A 148 0.163 4.484 -3.796 1.00 0.00 H new ATOM 473 N LYS A 149 2.870 6.251 -3.275 1.00 0.00 N ATOM 474 CA LYS A 149 3.411 7.486 -3.789 1.00 0.00 C ATOM 475 C LYS A 149 4.876 7.495 -3.473 1.00 0.00 C ATOM 476 O LYS A 149 5.706 7.396 -4.377 1.00 0.00 O ATOM 477 CB LYS A 149 2.706 8.729 -3.178 1.00 0.00 C ATOM 478 CG LYS A 149 3.010 10.099 -3.822 1.00 0.00 C ATOM 479 CD LYS A 149 4.300 10.784 -3.343 1.00 0.00 C ATOM 480 CE LYS A 149 4.369 12.267 -3.728 1.00 0.00 C ATOM 481 NZ LYS A 149 5.589 12.903 -3.179 1.00 0.00 N ATOM 0 H LYS A 149 2.537 6.327 -2.314 1.00 0.00 H new ATOM 0 HA LYS A 149 3.244 7.542 -4.865 1.00 0.00 H new ATOM 0 HB2 LYS A 149 1.630 8.565 -3.226 1.00 0.00 H new ATOM 0 HB3 LYS A 149 2.974 8.785 -2.123 1.00 0.00 H new ATOM 0 HG2 LYS A 149 3.069 9.968 -4.902 1.00 0.00 H new ATOM 0 HG3 LYS A 149 2.171 10.767 -3.627 1.00 0.00 H new ATOM 0 HD2 LYS A 149 4.373 10.692 -2.259 1.00 0.00 H new ATOM 0 HD3 LYS A 149 5.160 10.264 -3.766 1.00 0.00 H new ATOM 0 HE2 LYS A 149 4.361 12.365 -4.814 1.00 0.00 H new ATOM 0 HE3 LYS A 149 3.485 12.785 -3.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 5.611 13.906 -3.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 5.583 12.828 -2.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 6.431 12.422 -3.555 1.00 0.00 H new ATOM 495 N CYS A 150 5.227 7.628 -2.171 1.00 0.00 N ATOM 496 CA CYS A 150 6.577 7.892 -1.748 1.00 0.00 C ATOM 497 C CYS A 150 7.317 6.616 -1.419 1.00 0.00 C ATOM 498 O CYS A 150 8.547 6.596 -1.438 1.00 0.00 O ATOM 499 CB CYS A 150 6.643 8.944 -0.603 1.00 0.00 C ATOM 500 SG CYS A 150 6.118 8.425 1.067 1.00 0.00 S ATOM 0 H CYS A 150 4.562 7.551 -1.401 1.00 0.00 H new ATOM 0 HA CYS A 150 7.097 8.343 -2.593 1.00 0.00 H new ATOM 0 HB2 CYS A 150 7.671 9.300 -0.535 1.00 0.00 H new ATOM 0 HB3 CYS A 150 6.030 9.796 -0.896 1.00 0.00 H new ATOM 0 HG CYS A 150 4.981 7.800 0.990 1.00 0.00 H new ATOM 505 N GLY A 151 6.582 5.508 -1.139 1.00 0.00 N ATOM 506 CA GLY A 151 7.169 4.202 -0.934 1.00 0.00 C ATOM 507 C GLY A 151 7.559 3.952 0.493 1.00 0.00 C ATOM 508 O GLY A 151 8.239 2.967 0.780 1.00 0.00 O ATOM 0 H GLY A 151 5.566 5.519 -1.054 1.00 0.00 H new ATOM 0 HA2 GLY A 151 6.460 3.437 -1.250 1.00 0.00 H new ATOM 0 HA3 GLY A 151 8.050 4.102 -1.568 1.00 0.00 H new ATOM 512 N LYS A 152 7.135 4.840 1.427 1.00 0.00 N ATOM 513 CA LYS A 152 7.391 4.717 2.842 1.00 0.00 C ATOM 514 C LYS A 152 6.567 3.583 3.388 1.00 0.00 C ATOM 515 O LYS A 152 5.345 3.574 3.253 1.00 0.00 O ATOM 516 CB LYS A 152 7.010 6.009 3.603 1.00 0.00 C ATOM 517 CG LYS A 152 7.248 5.984 5.121 1.00 0.00 C ATOM 518 CD LYS A 152 6.797 7.286 5.799 1.00 0.00 C ATOM 519 CE LYS A 152 6.967 7.258 7.324 1.00 0.00 C ATOM 520 NZ LYS A 152 6.488 8.520 7.933 1.00 0.00 N ATOM 0 H LYS A 152 6.595 5.672 1.188 1.00 0.00 H new ATOM 0 HA LYS A 152 8.457 4.534 2.980 1.00 0.00 H new ATOM 0 HB2 LYS A 152 7.576 6.839 3.179 1.00 0.00 H new ATOM 0 HB3 LYS A 152 5.955 6.217 3.423 1.00 0.00 H new ATOM 0 HG2 LYS A 152 6.709 5.143 5.558 1.00 0.00 H new ATOM 0 HG3 LYS A 152 8.308 5.821 5.319 1.00 0.00 H new ATOM 0 HD2 LYS A 152 7.369 8.119 5.390 1.00 0.00 H new ATOM 0 HD3 LYS A 152 5.750 7.470 5.559 1.00 0.00 H new ATOM 0 HE2 LYS A 152 6.414 6.416 7.740 1.00 0.00 H new ATOM 0 HE3 LYS A 152 8.017 7.105 7.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 6.613 8.477 8.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 7.033 9.319 7.551 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 5.480 8.652 7.712 1.00 0.00 H new ATOM 534 N SER A 153 7.242 2.588 4.008 1.00 0.00 N ATOM 535 CA SER A 153 6.601 1.403 4.520 1.00 0.00 C ATOM 536 C SER A 153 6.055 1.694 5.888 1.00 0.00 C ATOM 537 O SER A 153 6.701 2.348 6.707 1.00 0.00 O ATOM 538 CB SER A 153 7.526 0.161 4.550 1.00 0.00 C ATOM 539 OG SER A 153 8.734 0.397 5.266 1.00 0.00 O ATOM 0 H SER A 153 8.251 2.606 4.157 1.00 0.00 H new ATOM 0 HA SER A 153 5.793 1.148 3.835 1.00 0.00 H new ATOM 0 HB2 SER A 153 6.994 -0.673 5.007 1.00 0.00 H new ATOM 0 HB3 SER A 153 7.765 -0.135 3.528 1.00 0.00 H new ATOM 0 HG SER A 153 9.406 -0.266 5.002 1.00 0.00 H new ATOM 545 N LEU A 154 4.813 1.225 6.124 1.00 0.00 N ATOM 546 CA LEU A 154 4.053 1.492 7.316 1.00 0.00 C ATOM 547 C LEU A 154 3.623 0.143 7.814 1.00 0.00 C ATOM 548 O LEU A 154 3.571 -0.827 7.053 1.00 0.00 O ATOM 549 CB LEU A 154 2.785 2.351 7.061 1.00 0.00 C ATOM 550 CG LEU A 154 3.006 3.571 6.128 1.00 0.00 C ATOM 551 CD1 LEU A 154 1.665 4.140 5.646 1.00 0.00 C ATOM 552 CD2 LEU A 154 3.876 4.680 6.747 1.00 0.00 C ATOM 0 H LEU A 154 4.315 0.635 5.458 1.00 0.00 H new ATOM 0 HA LEU A 154 4.665 2.057 8.019 1.00 0.00 H new ATOM 0 HB2 LEU A 154 2.013 1.715 6.628 1.00 0.00 H new ATOM 0 HB3 LEU A 154 2.405 2.707 8.019 1.00 0.00 H new ATOM 0 HG LEU A 154 3.566 3.193 5.273 1.00 0.00 H new ATOM 0 HD11 LEU A 154 1.846 4.994 4.994 1.00 0.00 H new ATOM 0 HD12 LEU A 154 1.121 3.372 5.096 1.00 0.00 H new ATOM 0 HD13 LEU A 154 1.075 4.458 6.505 1.00 0.00 H new ATOM 0 HD21 LEU A 154 3.984 5.498 6.034 1.00 0.00 H new ATOM 0 HD22 LEU A 154 3.401 5.051 7.655 1.00 0.00 H new ATOM 0 HD23 LEU A 154 4.859 4.278 6.990 1.00 0.00 H new ATOM 564 N GLU A 155 3.294 0.060 9.125 1.00 0.00 N ATOM 565 CA GLU A 155 2.899 -1.169 9.767 1.00 0.00 C ATOM 566 C GLU A 155 1.473 -1.460 9.387 1.00 0.00 C ATOM 567 O GLU A 155 1.232 -2.189 8.429 1.00 0.00 O ATOM 568 CB GLU A 155 3.079 -1.125 11.306 1.00 0.00 C ATOM 569 CG GLU A 155 2.805 -2.476 11.996 1.00 0.00 C ATOM 570 CD GLU A 155 3.071 -2.353 13.495 1.00 0.00 C ATOM 571 OE1 GLU A 155 2.355 -1.559 14.161 1.00 0.00 O ATOM 572 OE2 GLU A 155 3.991 -3.056 13.994 1.00 0.00 O ATOM 0 H GLU A 155 3.303 0.864 9.753 1.00 0.00 H new ATOM 0 HA GLU A 155 3.551 -1.972 9.423 1.00 0.00 H new ATOM 0 HB2 GLU A 155 4.096 -0.808 11.536 1.00 0.00 H new ATOM 0 HB3 GLU A 155 2.409 -0.372 11.721 1.00 0.00 H new ATOM 0 HG2 GLU A 155 1.772 -2.780 11.824 1.00 0.00 H new ATOM 0 HG3 GLU A 155 3.441 -3.250 11.567 1.00 0.00 H new ATOM 579 N SER A 156 0.498 -0.869 10.118 1.00 0.00 N ATOM 580 CA SER A 156 -0.913 -1.066 9.896 1.00 0.00 C ATOM 581 C SER A 156 -1.401 0.012 8.959 1.00 0.00 C ATOM 582 O SER A 156 -0.607 0.678 8.295 1.00 0.00 O ATOM 583 CB SER A 156 -1.713 -1.073 11.228 1.00 0.00 C ATOM 584 OG SER A 156 -1.526 0.123 11.979 1.00 0.00 O ATOM 0 H SER A 156 0.698 -0.233 10.890 1.00 0.00 H new ATOM 0 HA SER A 156 -1.075 -2.045 9.444 1.00 0.00 H new ATOM 0 HB2 SER A 156 -2.774 -1.201 11.011 1.00 0.00 H new ATOM 0 HB3 SER A 156 -1.405 -1.928 11.829 1.00 0.00 H new ATOM 0 HG SER A 156 -2.049 0.075 12.807 1.00 0.00 H new ATOM 590 N THR A 157 -2.742 0.201 8.890 1.00 0.00 N ATOM 591 CA THR A 157 -3.364 1.231 8.096 1.00 0.00 C ATOM 592 C THR A 157 -3.391 2.467 8.953 1.00 0.00 C ATOM 593 O THR A 157 -4.231 2.604 9.842 1.00 0.00 O ATOM 594 CB THR A 157 -4.779 0.881 7.653 1.00 0.00 C ATOM 595 OG1 THR A 157 -4.773 -0.359 6.957 1.00 0.00 O ATOM 596 CG2 THR A 157 -5.342 1.972 6.717 1.00 0.00 C ATOM 0 H THR A 157 -3.410 -0.377 9.400 1.00 0.00 H new ATOM 0 HA THR A 157 -2.793 1.367 7.177 1.00 0.00 H new ATOM 0 HB THR A 157 -5.406 0.810 8.542 1.00 0.00 H new ATOM 0 HG1 THR A 157 -3.849 -0.622 6.766 1.00 0.00 H new ATOM 0 HG21 THR A 157 -6.353 1.703 6.412 1.00 0.00 H new ATOM 0 HG22 THR A 157 -5.363 2.927 7.242 1.00 0.00 H new ATOM 0 HG23 THR A 157 -4.708 2.057 5.835 1.00 0.00 H new ATOM 604 N THR A 158 -2.435 3.389 8.698 1.00 0.00 N ATOM 605 CA THR A 158 -2.363 4.667 9.361 1.00 0.00 C ATOM 606 C THR A 158 -2.132 5.625 8.225 1.00 0.00 C ATOM 607 O THR A 158 -1.134 6.344 8.173 1.00 0.00 O ATOM 608 CB THR A 158 -1.255 4.751 10.408 1.00 0.00 C ATOM 609 OG1 THR A 158 -1.329 3.633 11.286 1.00 0.00 O ATOM 610 CG2 THR A 158 -1.409 6.040 11.244 1.00 0.00 C ATOM 0 H THR A 158 -1.693 3.244 8.014 1.00 0.00 H new ATOM 0 HA THR A 158 -3.264 4.878 9.936 1.00 0.00 H new ATOM 0 HB THR A 158 -0.295 4.757 9.891 1.00 0.00 H new ATOM 0 HG1 THR A 158 -0.614 3.693 11.953 1.00 0.00 H new ATOM 0 HG21 THR A 158 -0.613 6.089 11.987 1.00 0.00 H new ATOM 0 HG22 THR A 158 -1.347 6.909 10.588 1.00 0.00 H new ATOM 0 HG23 THR A 158 -2.376 6.034 11.747 1.00 0.00 H new ATOM 618 N LEU A 159 -3.076 5.623 7.257 1.00 0.00 N ATOM 619 CA LEU A 159 -2.983 6.451 6.087 1.00 0.00 C ATOM 620 C LEU A 159 -4.330 6.493 5.439 1.00 0.00 C ATOM 621 O LEU A 159 -5.242 5.758 5.816 1.00 0.00 O ATOM 622 CB LEU A 159 -1.910 6.036 5.044 1.00 0.00 C ATOM 623 CG LEU A 159 -2.052 4.683 4.299 1.00 0.00 C ATOM 624 CD1 LEU A 159 -0.971 4.610 3.202 1.00 0.00 C ATOM 625 CD2 LEU A 159 -1.989 3.439 5.205 1.00 0.00 C ATOM 0 H LEU A 159 -3.913 5.040 7.287 1.00 0.00 H new ATOM 0 HA LEU A 159 -2.654 7.430 6.436 1.00 0.00 H new ATOM 0 HB2 LEU A 159 -1.867 6.821 4.289 1.00 0.00 H new ATOM 0 HB3 LEU A 159 -0.946 6.029 5.552 1.00 0.00 H new ATOM 0 HG LEU A 159 -3.054 4.662 3.870 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -1.057 3.663 2.668 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -1.106 5.435 2.502 1.00 0.00 H new ATOM 0 HD13 LEU A 159 0.016 4.680 3.659 1.00 0.00 H new ATOM 0 HD21 LEU A 159 -2.097 2.541 4.597 1.00 0.00 H new ATOM 0 HD22 LEU A 159 -1.030 3.414 5.722 1.00 0.00 H new ATOM 0 HD23 LEU A 159 -2.795 3.481 5.937 1.00 0.00 H new ATOM 637 N THR A 160 -4.472 7.397 4.440 1.00 0.00 N ATOM 638 CA THR A 160 -5.698 7.627 3.720 1.00 0.00 C ATOM 639 C THR A 160 -5.695 6.732 2.505 1.00 0.00 C ATOM 640 O THR A 160 -4.645 6.365 1.974 1.00 0.00 O ATOM 641 CB THR A 160 -5.892 9.103 3.369 1.00 0.00 C ATOM 642 OG1 THR A 160 -7.176 9.359 2.808 1.00 0.00 O ATOM 643 CG2 THR A 160 -4.786 9.615 2.421 1.00 0.00 C ATOM 0 H THR A 160 -3.704 7.989 4.123 1.00 0.00 H new ATOM 0 HA THR A 160 -6.552 7.377 4.349 1.00 0.00 H new ATOM 0 HB THR A 160 -5.822 9.651 4.309 1.00 0.00 H new ATOM 0 HG1 THR A 160 -7.258 10.313 2.600 1.00 0.00 H new ATOM 0 HG21 THR A 160 -4.959 10.667 2.195 1.00 0.00 H new ATOM 0 HG22 THR A 160 -3.814 9.502 2.901 1.00 0.00 H new ATOM 0 HG23 THR A 160 -4.803 9.038 1.497 1.00 0.00 H new ATOM 651 N GLU A 161 -6.916 6.347 2.071 1.00 0.00 N ATOM 652 CA GLU A 161 -7.156 5.462 0.964 1.00 0.00 C ATOM 653 C GLU A 161 -7.687 6.323 -0.140 1.00 0.00 C ATOM 654 O GLU A 161 -8.375 7.314 0.106 1.00 0.00 O ATOM 655 CB GLU A 161 -8.216 4.373 1.282 1.00 0.00 C ATOM 656 CG GLU A 161 -7.711 3.188 2.137 1.00 0.00 C ATOM 657 CD GLU A 161 -7.169 3.620 3.500 1.00 0.00 C ATOM 658 OE1 GLU A 161 -7.969 4.139 4.322 1.00 0.00 O ATOM 659 OE2 GLU A 161 -5.945 3.434 3.733 1.00 0.00 O ATOM 0 H GLU A 161 -7.777 6.669 2.514 1.00 0.00 H new ATOM 0 HA GLU A 161 -6.232 4.942 0.712 1.00 0.00 H new ATOM 0 HB2 GLU A 161 -9.052 4.843 1.800 1.00 0.00 H new ATOM 0 HB3 GLU A 161 -8.604 3.982 0.342 1.00 0.00 H new ATOM 0 HG2 GLU A 161 -8.527 2.481 2.285 1.00 0.00 H new ATOM 0 HG3 GLU A 161 -6.928 2.662 1.591 1.00 0.00 H new ATOM 666 N LYS A 162 -7.364 5.950 -1.397 1.00 0.00 N ATOM 667 CA LYS A 162 -7.855 6.632 -2.563 1.00 0.00 C ATOM 668 C LYS A 162 -8.074 5.530 -3.554 1.00 0.00 C ATOM 669 O LYS A 162 -7.158 5.179 -4.292 1.00 0.00 O ATOM 670 CB LYS A 162 -6.842 7.668 -3.108 1.00 0.00 C ATOM 671 CG LYS A 162 -7.335 8.469 -4.322 1.00 0.00 C ATOM 672 CD LYS A 162 -6.286 9.474 -4.821 1.00 0.00 C ATOM 673 CE LYS A 162 -6.755 10.279 -6.039 1.00 0.00 C ATOM 674 NZ LYS A 162 -5.700 11.217 -6.490 1.00 0.00 N ATOM 0 H LYS A 162 -6.752 5.162 -1.608 1.00 0.00 H new ATOM 0 HA LYS A 162 -8.757 7.206 -2.348 1.00 0.00 H new ATOM 0 HB2 LYS A 162 -6.589 8.364 -2.308 1.00 0.00 H new ATOM 0 HB3 LYS A 162 -5.923 7.149 -3.381 1.00 0.00 H new ATOM 0 HG2 LYS A 162 -7.590 7.782 -5.129 1.00 0.00 H new ATOM 0 HG3 LYS A 162 -8.248 9.002 -4.057 1.00 0.00 H new ATOM 0 HD2 LYS A 162 -6.037 10.162 -4.013 1.00 0.00 H new ATOM 0 HD3 LYS A 162 -5.372 8.939 -5.077 1.00 0.00 H new ATOM 0 HE2 LYS A 162 -7.015 9.600 -6.851 1.00 0.00 H new ATOM 0 HE3 LYS A 162 -7.658 10.835 -5.787 1.00 0.00 H new ATOM 0 HZ1 LYS A 162 -6.040 11.751 -7.315 1.00 0.00 H new ATOM 0 HZ2 LYS A 162 -5.471 11.878 -5.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 162 -4.848 10.681 -6.751 1.00 0.00 H new ATOM 688 N GLU A 163 -9.310 4.959 -3.548 1.00 0.00 N ATOM 689 CA GLU A 163 -9.764 3.729 -4.181 1.00 0.00 C ATOM 690 C GLU A 163 -9.009 3.304 -5.417 1.00 0.00 C ATOM 691 O GLU A 163 -9.256 3.791 -6.519 1.00 0.00 O ATOM 692 CB GLU A 163 -11.276 3.752 -4.506 1.00 0.00 C ATOM 693 CG GLU A 163 -12.147 3.997 -3.259 1.00 0.00 C ATOM 694 CD GLU A 163 -13.624 3.974 -3.647 1.00 0.00 C ATOM 695 OE1 GLU A 163 -14.101 2.900 -4.103 1.00 0.00 O ATOM 696 OE2 GLU A 163 -14.298 5.028 -3.490 1.00 0.00 O ATOM 0 H GLU A 163 -10.075 5.408 -3.045 1.00 0.00 H new ATOM 0 HA GLU A 163 -9.551 2.984 -3.415 1.00 0.00 H new ATOM 0 HB2 GLU A 163 -11.474 4.532 -5.242 1.00 0.00 H new ATOM 0 HB3 GLU A 163 -11.560 2.804 -4.962 1.00 0.00 H new ATOM 0 HG2 GLU A 163 -11.947 3.232 -2.508 1.00 0.00 H new ATOM 0 HG3 GLU A 163 -11.894 4.958 -2.811 1.00 0.00 H new ATOM 703 N GLY A 164 -8.025 2.399 -5.212 1.00 0.00 N ATOM 704 CA GLY A 164 -7.077 2.010 -6.213 1.00 0.00 C ATOM 705 C GLY A 164 -5.791 1.751 -5.496 1.00 0.00 C ATOM 706 O GLY A 164 -5.271 0.639 -5.528 1.00 0.00 O ATOM 0 H GLY A 164 -7.888 1.925 -4.319 1.00 0.00 H new ATOM 0 HA2 GLY A 164 -7.414 1.118 -6.742 1.00 0.00 H new ATOM 0 HA3 GLY A 164 -6.955 2.795 -6.959 1.00 0.00 H new ATOM 710 N GLU A 165 -5.237 2.800 -4.841 1.00 0.00 N ATOM 711 CA GLU A 165 -3.952 2.729 -4.191 1.00 0.00 C ATOM 712 C GLU A 165 -3.955 3.679 -3.024 1.00 0.00 C ATOM 713 O GLU A 165 -4.754 4.611 -2.963 1.00 0.00 O ATOM 714 CB GLU A 165 -2.797 3.061 -5.165 1.00 0.00 C ATOM 715 CG GLU A 165 -2.925 4.429 -5.861 1.00 0.00 C ATOM 716 CD GLU A 165 -1.934 4.509 -7.023 1.00 0.00 C ATOM 717 OE1 GLU A 165 -0.705 4.403 -6.769 1.00 0.00 O ATOM 718 OE2 GLU A 165 -2.396 4.680 -8.183 1.00 0.00 O ATOM 0 H GLU A 165 -5.688 3.711 -4.762 1.00 0.00 H new ATOM 0 HA GLU A 165 -3.785 1.709 -3.844 1.00 0.00 H new ATOM 0 HB2 GLU A 165 -1.856 3.033 -4.616 1.00 0.00 H new ATOM 0 HB3 GLU A 165 -2.745 2.283 -5.927 1.00 0.00 H new ATOM 0 HG2 GLU A 165 -3.942 4.568 -6.227 1.00 0.00 H new ATOM 0 HG3 GLU A 165 -2.730 5.230 -5.148 1.00 0.00 H new ATOM 725 N ILE A 166 -3.062 3.430 -2.035 1.00 0.00 N ATOM 726 CA ILE A 166 -3.021 4.154 -0.782 1.00 0.00 C ATOM 727 C ILE A 166 -1.811 5.049 -0.799 1.00 0.00 C ATOM 728 O ILE A 166 -0.796 4.704 -1.397 1.00 0.00 O ATOM 729 CB ILE A 166 -3.004 3.229 0.430 1.00 0.00 C ATOM 730 CG1 ILE A 166 -1.812 2.241 0.424 1.00 0.00 C ATOM 731 CG2 ILE A 166 -4.346 2.476 0.449 1.00 0.00 C ATOM 732 CD1 ILE A 166 -1.871 1.202 1.550 1.00 0.00 C ATOM 0 H ILE A 166 -2.347 2.706 -2.106 1.00 0.00 H new ATOM 0 HA ILE A 166 -3.931 4.746 -0.687 1.00 0.00 H new ATOM 0 HB ILE A 166 -2.874 3.827 1.332 1.00 0.00 H new ATOM 0 HG12 ILE A 166 -1.784 1.724 -0.535 1.00 0.00 H new ATOM 0 HG13 ILE A 166 -0.883 2.805 0.509 1.00 0.00 H new ATOM 0 HG21 ILE A 166 -4.373 1.802 1.305 1.00 0.00 H new ATOM 0 HG22 ILE A 166 -5.164 3.192 0.526 1.00 0.00 H new ATOM 0 HG23 ILE A 166 -4.453 1.900 -0.470 1.00 0.00 H new ATOM 0 HD11 ILE A 166 -1.005 0.544 1.484 1.00 0.00 H new ATOM 0 HD12 ILE A 166 -1.868 1.710 2.514 1.00 0.00 H new ATOM 0 HD13 ILE A 166 -2.783 0.612 1.454 1.00 0.00 H new ATOM 744 N TYR A 167 -1.913 6.242 -0.163 1.00 0.00 N ATOM 745 CA TYR A 167 -0.893 7.275 -0.190 1.00 0.00 C ATOM 746 C TYR A 167 -0.852 7.840 1.202 1.00 0.00 C ATOM 747 O TYR A 167 -1.897 7.928 1.843 1.00 0.00 O ATOM 748 CB TYR A 167 -1.222 8.491 -1.100 1.00 0.00 C ATOM 749 CG TYR A 167 -1.384 8.187 -2.568 1.00 0.00 C ATOM 750 CD1 TYR A 167 -0.560 7.275 -3.248 1.00 0.00 C ATOM 751 CD2 TYR A 167 -2.315 8.934 -3.314 1.00 0.00 C ATOM 752 CE1 TYR A 167 -0.636 7.139 -4.640 1.00 0.00 C ATOM 753 CE2 TYR A 167 -2.404 8.792 -4.704 1.00 0.00 C ATOM 754 CZ TYR A 167 -1.557 7.900 -5.370 1.00 0.00 C ATOM 755 OH TYR A 167 -1.620 7.788 -6.777 1.00 0.00 O ATOM 0 H TYR A 167 -2.730 6.501 0.390 1.00 0.00 H new ATOM 0 HA TYR A 167 0.022 6.814 -0.561 1.00 0.00 H new ATOM 0 HB2 TYR A 167 -2.142 8.952 -0.740 1.00 0.00 H new ATOM 0 HB3 TYR A 167 -0.429 9.231 -0.987 1.00 0.00 H new ATOM 0 HD1 TYR A 167 0.141 6.671 -2.691 1.00 0.00 H new ATOM 0 HD2 TYR A 167 -2.970 9.627 -2.807 1.00 0.00 H new ATOM 0 HE1 TYR A 167 0.017 6.446 -5.151 1.00 0.00 H new ATOM 0 HE2 TYR A 167 -3.126 9.371 -5.261 1.00 0.00 H new ATOM 0 HH TYR A 167 -2.315 8.386 -7.122 1.00 0.00 H new ATOM 765 N CYS A 168 0.356 8.179 1.738 1.00 0.00 N ATOM 766 CA CYS A 168 0.507 8.354 3.166 1.00 0.00 C ATOM 767 C CYS A 168 0.454 9.794 3.588 1.00 0.00 C ATOM 768 O CYS A 168 0.464 10.717 2.774 1.00 0.00 O ATOM 769 CB CYS A 168 1.711 7.590 3.787 1.00 0.00 C ATOM 770 SG CYS A 168 3.374 8.293 3.558 1.00 0.00 S ATOM 0 H CYS A 168 1.207 8.328 1.195 1.00 0.00 H new ATOM 0 HA CYS A 168 -0.373 7.873 3.592 1.00 0.00 H new ATOM 0 HB2 CYS A 168 1.532 7.497 4.858 1.00 0.00 H new ATOM 0 HB3 CYS A 168 1.715 6.581 3.376 1.00 0.00 H new ATOM 0 HG CYS A 168 3.378 9.067 2.514 1.00 0.00 H new ATOM 775 N LYS A 169 0.368 9.981 4.925 1.00 0.00 N ATOM 776 CA LYS A 169 0.234 11.245 5.604 1.00 0.00 C ATOM 777 C LYS A 169 1.514 12.037 5.561 1.00 0.00 C ATOM 778 O LYS A 169 1.488 13.261 5.670 1.00 0.00 O ATOM 779 CB LYS A 169 -0.149 11.043 7.089 1.00 0.00 C ATOM 780 CG LYS A 169 -1.483 10.301 7.274 1.00 0.00 C ATOM 781 CD LYS A 169 -1.843 10.075 8.751 1.00 0.00 C ATOM 782 CE LYS A 169 -3.201 9.387 8.938 1.00 0.00 C ATOM 783 NZ LYS A 169 -3.485 9.148 10.372 1.00 0.00 N ATOM 0 H LYS A 169 0.394 9.196 5.576 1.00 0.00 H new ATOM 0 HA LYS A 169 -0.553 11.790 5.083 1.00 0.00 H new ATOM 0 HB2 LYS A 169 0.642 10.485 7.589 1.00 0.00 H new ATOM 0 HB3 LYS A 169 -0.211 12.016 7.577 1.00 0.00 H new ATOM 0 HG2 LYS A 169 -2.279 10.871 6.794 1.00 0.00 H new ATOM 0 HG3 LYS A 169 -1.430 9.338 6.767 1.00 0.00 H new ATOM 0 HD2 LYS A 169 -1.067 9.469 9.220 1.00 0.00 H new ATOM 0 HD3 LYS A 169 -1.854 11.035 9.268 1.00 0.00 H new ATOM 0 HE2 LYS A 169 -3.988 10.006 8.506 1.00 0.00 H new ATOM 0 HE3 LYS A 169 -3.209 8.439 8.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 169 -4.409 8.682 10.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 169 -2.745 8.538 10.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 169 -3.500 10.056 10.879 1.00 0.00 H new ATOM 797 N GLY A 170 2.667 11.342 5.403 1.00 0.00 N ATOM 798 CA GLY A 170 3.980 11.936 5.417 1.00 0.00 C ATOM 799 C GLY A 170 4.268 12.663 4.137 1.00 0.00 C ATOM 800 O GLY A 170 4.906 13.714 4.156 1.00 0.00 O ATOM 0 H GLY A 170 2.685 10.332 5.261 1.00 0.00 H new ATOM 0 HA2 GLY A 170 4.058 12.628 6.255 1.00 0.00 H new ATOM 0 HA3 GLY A 170 4.730 11.160 5.573 1.00 0.00 H new ATOM 804 N CYS A 171 3.799 12.112 2.992 1.00 0.00 N ATOM 805 CA CYS A 171 3.993 12.703 1.686 1.00 0.00 C ATOM 806 C CYS A 171 2.869 13.644 1.347 1.00 0.00 C ATOM 807 O CYS A 171 2.988 14.418 0.401 1.00 0.00 O ATOM 808 CB CYS A 171 4.144 11.656 0.558 1.00 0.00 C ATOM 809 SG CYS A 171 2.873 10.385 0.523 1.00 0.00 S ATOM 0 H CYS A 171 3.274 11.238 2.970 1.00 0.00 H new ATOM 0 HA CYS A 171 4.931 13.254 1.748 1.00 0.00 H new ATOM 0 HB2 CYS A 171 4.144 12.175 -0.401 1.00 0.00 H new ATOM 0 HB3 CYS A 171 5.116 11.173 0.659 1.00 0.00 H new ATOM 0 HG CYS A 171 1.993 10.626 1.449 1.00 0.00 H new ATOM 814 N TYR A 172 1.760 13.624 2.123 1.00 0.00 N ATOM 815 CA TYR A 172 0.695 14.598 1.997 1.00 0.00 C ATOM 816 C TYR A 172 1.104 15.858 2.716 1.00 0.00 C ATOM 817 O TYR A 172 0.695 16.953 2.332 1.00 0.00 O ATOM 818 CB TYR A 172 -0.649 14.104 2.599 1.00 0.00 C ATOM 819 CG TYR A 172 -1.510 13.344 1.611 1.00 0.00 C ATOM 820 CD1 TYR A 172 -0.998 12.603 0.523 1.00 0.00 C ATOM 821 CD2 TYR A 172 -2.906 13.399 1.779 1.00 0.00 C ATOM 822 CE1 TYR A 172 -1.861 11.961 -0.374 1.00 0.00 C ATOM 823 CE2 TYR A 172 -3.769 12.758 0.884 1.00 0.00 C ATOM 824 CZ TYR A 172 -3.248 12.033 -0.193 1.00 0.00 C ATOM 825 OH TYR A 172 -4.122 11.379 -1.090 1.00 0.00 O ATOM 0 H TYR A 172 1.596 12.925 2.848 1.00 0.00 H new ATOM 0 HA TYR A 172 0.537 14.771 0.932 1.00 0.00 H new ATOM 0 HB2 TYR A 172 -0.441 13.463 3.456 1.00 0.00 H new ATOM 0 HB3 TYR A 172 -1.208 14.962 2.972 1.00 0.00 H new ATOM 0 HD1 TYR A 172 0.070 12.531 0.381 1.00 0.00 H new ATOM 0 HD2 TYR A 172 -3.319 13.946 2.614 1.00 0.00 H new ATOM 0 HE1 TYR A 172 -1.455 11.408 -1.209 1.00 0.00 H new ATOM 0 HE2 TYR A 172 -4.838 12.823 1.024 1.00 0.00 H new ATOM 0 HH TYR A 172 -5.050 11.533 -0.814 1.00 0.00 H new ATOM 835 N ALA A 173 1.947 15.724 3.767 1.00 0.00 N ATOM 836 CA ALA A 173 2.461 16.829 4.536 1.00 0.00 C ATOM 837 C ALA A 173 3.592 17.492 3.796 1.00 0.00 C ATOM 838 O ALA A 173 3.745 18.711 3.856 1.00 0.00 O ATOM 839 CB ALA A 173 2.996 16.369 5.906 1.00 0.00 C ATOM 0 H ALA A 173 2.282 14.817 4.092 1.00 0.00 H new ATOM 0 HA ALA A 173 1.635 17.524 4.688 1.00 0.00 H new ATOM 0 HB1 ALA A 173 3.375 17.230 6.456 1.00 0.00 H new ATOM 0 HB2 ALA A 173 2.191 15.902 6.473 1.00 0.00 H new ATOM 0 HB3 ALA A 173 3.801 15.649 5.759 1.00 0.00 H new ATOM 845 N LYS A 174 4.411 16.687 3.076 1.00 0.00 N ATOM 846 CA LYS A 174 5.599 17.148 2.401 1.00 0.00 C ATOM 847 C LYS A 174 5.235 17.791 1.090 1.00 0.00 C ATOM 848 O LYS A 174 5.636 18.922 0.819 1.00 0.00 O ATOM 849 CB LYS A 174 6.552 15.961 2.120 1.00 0.00 C ATOM 850 CG LYS A 174 7.891 16.344 1.465 1.00 0.00 C ATOM 851 CD LYS A 174 8.811 15.131 1.255 1.00 0.00 C ATOM 852 CE LYS A 174 10.164 15.479 0.618 1.00 0.00 C ATOM 853 NZ LYS A 174 9.996 16.024 -0.750 1.00 0.00 N ATOM 0 H LYS A 174 4.242 15.688 2.960 1.00 0.00 H new ATOM 0 HA LYS A 174 6.095 17.874 3.045 1.00 0.00 H new ATOM 0 HB2 LYS A 174 6.758 15.449 3.060 1.00 0.00 H new ATOM 0 HB3 LYS A 174 6.040 15.248 1.474 1.00 0.00 H new ATOM 0 HG2 LYS A 174 7.699 16.821 0.504 1.00 0.00 H new ATOM 0 HG3 LYS A 174 8.400 17.079 2.089 1.00 0.00 H new ATOM 0 HD2 LYS A 174 8.987 14.650 2.217 1.00 0.00 H new ATOM 0 HD3 LYS A 174 8.299 14.404 0.624 1.00 0.00 H new ATOM 0 HE2 LYS A 174 10.683 16.208 1.240 1.00 0.00 H new ATOM 0 HE3 LYS A 174 10.790 14.588 0.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 174 10.930 16.169 -1.183 1.00 0.00 H new ATOM 0 HZ2 LYS A 174 9.448 15.354 -1.326 1.00 0.00 H new ATOM 0 HZ3 LYS A 174 9.492 16.932 -0.702 1.00 0.00 H new ATOM 867 N ASN A 175 4.444 17.074 0.260 1.00 0.00 N ATOM 868 CA ASN A 175 4.046 17.512 -1.055 1.00 0.00 C ATOM 869 C ASN A 175 2.580 17.953 -0.946 1.00 0.00 C ATOM 870 O ASN A 175 1.709 17.092 -0.652 1.00 0.00 O ATOM 871 CB ASN A 175 4.202 16.380 -2.107 1.00 0.00 C ATOM 872 CG ASN A 175 3.919 16.887 -3.530 1.00 0.00 C ATOM 873 OD1 ASN A 175 4.597 17.799 -4.017 1.00 0.00 O ATOM 874 ND2 ASN A 175 2.897 16.270 -4.198 1.00 0.00 N ATOM 0 H ASN A 175 4.068 16.159 0.511 1.00 0.00 H new ATOM 0 HA ASN A 175 4.682 18.331 -1.391 1.00 0.00 H new ATOM 0 HB2 ASN A 175 5.213 15.975 -2.059 1.00 0.00 H new ATOM 0 HB3 ASN A 175 3.520 15.564 -1.868 1.00 0.00 H new ATOM 0 HD21 ASN A 175 2.661 16.558 -5.148 1.00 0.00 H new ATOM 0 HD22 ASN A 175 2.371 15.522 -3.746 1.00 0.00 H new