USER MOD reduce.3.24.130724 H: found=0, std=0, add=805, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 803 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 187 HIS : no HD1:sc= -0.0317 K(o=1.2,f=0.66) USER MOD Set 1.2: A 191 THR OG1 : rot 107:sc= 1.27 USER MOD Set 2.1: A 170 ASN : amide:sc= 0.404 K(o=0.3,f=-8.5!) USER MOD Set 2.2: A 171 ASN : amide:sc= -0.104 X(o=0.3,f=0.51) USER MOD Set 3.1: A 163 TYR OH : rot 144:sc= 1.61 USER MOD Set 3.2: A 217 GLN : amide:sc= 0.269 K(o=1.9,f=-1.4!) USER MOD Set 4.1: A 153 ASN : amide:sc= 0.269 K(o=1.4,f=-3.3) USER MOD Set 4.2: A 157 TYR OH : rot 126:sc= 1.14 USER MOD Single : A 128 TYR OH : rot -154:sc= 1.24 USER MOD Single : A 129 MET CE :methyl -169:sc= -0.275 (180deg=-0.326) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 134 MET CE :methyl -169:sc= -0.914 (180deg=-1.45) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 140 HIS : no HD1:sc= -0.241 X(o=-0.24,f=-0.0093) USER MOD Single : A 143 ASN : amide:sc= -0.0329 X(o=-0.033,f=-0.033) USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD Single : A 149 TYR OH : rot 180:sc= 0 USER MOD Single : A 150 TYR OH : rot 180:sc= -0.0508 USER MOD Single : A 154 MET CE :methyl 164:sc=-0.00172 (180deg=-0.0896) USER MOD Single : A 155 TYR OH : rot 180:sc= 0 USER MOD Single : A 159 ASN : amide:sc= -0.0572 K(o=-0.057,f=-0.84) USER MOD Single : A 160 GLN : amide:sc= -0.779 X(o=-0.78,f=-0.63) USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 168 GLN : amide:sc= -0.469 X(o=-0.47,f=-0.47) USER MOD Single : A 169 TYR OH : rot 180:sc= 1.07 USER MOD Single : A 172 GLN : amide:sc= -1.39 K(o=-1.4,f=-0.0098) USER MOD Single : A 173 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 174 THR OG1 : rot 180:sc= 0 USER MOD Single : A 177 HIS : no HD1:sc= -0.0114 X(o=-0.011,f=0) USER MOD Single : A 181 ASN : amide:sc= -0.0953 X(o=-0.095,f=0) USER MOD Single : A 183 THR OG1 : rot 79:sc= 1.81 USER MOD Single : A 185 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 186 GLN : amide:sc= -0.0461 X(o=-0.046,f=-0.13) USER MOD Single : A 188 THR OG1 : rot -78:sc= 1.34 USER MOD Single : A 190 THR OG1 : rot 180:sc= 0 USER MOD Single : A 192 THR OG1 : rot 180:sc= 0 USER MOD Single : A 193 THR OG1 : rot 180:sc= 0 USER MOD Single : A 194 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 197 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 199 THR OG1 : rot 180:sc= 0.152 USER MOD Single : A 201 THR OG1 : rot 180:sc= 0 USER MOD Single : A 204 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 205 MET CE :methyl 153:sc= -0.646 (180deg=-1.62) USER MOD Single : A 206 MET CE :methyl -159:sc= -0.127 (180deg=-0.666) USER MOD Single : A 212 GLN : amide:sc= 0.802 K(o=0.8,f=-0.16) USER MOD Single : A 213 MET CE :methyl -159:sc= -0.25 (180deg=-0.946) USER MOD Single : A 216 THR OG1 : rot 77:sc= 1.2 USER MOD Single : A 218 TYR OH : rot 180:sc= 0 USER MOD Single : A 219 GLN : amide:sc= -0.122 X(o=-0.12,f=-0.31) USER MOD Single : A 222 SER OG : rot 180:sc= 0 USER MOD Single : A 225 TYR OH : rot 180:sc= 0 USER MOD Single : A 226 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 40 N GLY A 124 2.198 -16.529 -2.642 1.00 0.00 N ATOM 41 CA GLY A 124 2.545 -15.402 -3.489 1.00 0.00 C ATOM 42 C GLY A 124 3.883 -14.783 -3.097 1.00 0.00 C ATOM 43 O GLY A 124 4.809 -14.695 -3.901 1.00 0.00 O ATOM 0 HA2 GLY A 124 2.587 -15.729 -4.528 1.00 0.00 H new ATOM 0 HA3 GLY A 124 1.763 -14.646 -3.424 1.00 0.00 H new ATOM 47 N LEU A 125 3.980 -14.313 -1.854 1.00 0.00 N ATOM 48 CA LEU A 125 5.102 -13.518 -1.366 1.00 0.00 C ATOM 49 C LEU A 125 6.410 -14.309 -1.250 1.00 0.00 C ATOM 50 O LEU A 125 7.467 -13.877 -1.698 1.00 0.00 O ATOM 51 CB LEU A 125 4.696 -12.865 -0.036 1.00 0.00 C ATOM 52 CG LEU A 125 4.558 -13.754 1.221 1.00 0.00 C ATOM 53 CD1 LEU A 125 4.188 -12.875 2.416 1.00 0.00 C ATOM 54 CD2 LEU A 125 3.479 -14.834 1.101 1.00 0.00 C ATOM 0 H LEU A 125 3.265 -14.479 -1.145 1.00 0.00 H new ATOM 0 HA LEU A 125 5.321 -12.746 -2.103 1.00 0.00 H new ATOM 0 HB2 LEU A 125 5.429 -12.090 0.188 1.00 0.00 H new ATOM 0 HB3 LEU A 125 3.740 -12.365 -0.193 1.00 0.00 H new ATOM 0 HG LEU A 125 5.519 -14.253 1.344 1.00 0.00 H new ATOM 0 HD11 LEU A 125 4.089 -13.495 3.307 1.00 0.00 H new ATOM 0 HD12 LEU A 125 4.969 -12.132 2.576 1.00 0.00 H new ATOM 0 HD13 LEU A 125 3.242 -12.371 2.218 1.00 0.00 H new ATOM 0 HD21 LEU A 125 3.443 -15.416 2.022 1.00 0.00 H new ATOM 0 HD22 LEU A 125 2.511 -14.364 0.931 1.00 0.00 H new ATOM 0 HD23 LEU A 125 3.714 -15.492 0.265 1.00 0.00 H new ATOM 66 N GLY A 126 6.360 -15.468 -0.617 1.00 0.00 N ATOM 67 CA GLY A 126 7.502 -16.267 -0.221 1.00 0.00 C ATOM 68 C GLY A 126 8.047 -15.788 1.116 1.00 0.00 C ATOM 69 O GLY A 126 7.785 -16.416 2.148 1.00 0.00 O ATOM 0 H GLY A 126 5.474 -15.898 -0.352 1.00 0.00 H new ATOM 0 HA2 GLY A 126 7.213 -17.315 -0.148 1.00 0.00 H new ATOM 0 HA3 GLY A 126 8.280 -16.203 -0.982 1.00 0.00 H new ATOM 73 N GLY A 127 8.781 -14.672 1.090 1.00 0.00 N ATOM 74 CA GLY A 127 9.603 -14.209 2.204 1.00 0.00 C ATOM 75 C GLY A 127 9.676 -12.689 2.348 1.00 0.00 C ATOM 76 O GLY A 127 10.651 -12.179 2.899 1.00 0.00 O ATOM 0 H GLY A 127 8.819 -14.056 0.278 1.00 0.00 H new ATOM 0 HA2 GLY A 127 9.210 -14.631 3.129 1.00 0.00 H new ATOM 0 HA3 GLY A 127 10.613 -14.599 2.080 1.00 0.00 H new ATOM 80 N TYR A 128 8.680 -11.951 1.843 1.00 0.00 N ATOM 81 CA TYR A 128 8.638 -10.486 1.900 1.00 0.00 C ATOM 82 C TYR A 128 8.696 -9.992 3.352 1.00 0.00 C ATOM 83 O TYR A 128 8.411 -10.732 4.300 1.00 0.00 O ATOM 84 CB TYR A 128 7.380 -9.953 1.167 1.00 0.00 C ATOM 85 CG TYR A 128 7.310 -10.020 -0.366 1.00 0.00 C ATOM 86 CD1 TYR A 128 7.983 -11.009 -1.114 1.00 0.00 C ATOM 87 CD2 TYR A 128 6.503 -9.095 -1.067 1.00 0.00 C ATOM 88 CE1 TYR A 128 7.925 -11.018 -2.520 1.00 0.00 C ATOM 89 CE2 TYR A 128 6.401 -9.132 -2.472 1.00 0.00 C ATOM 90 CZ TYR A 128 7.112 -10.099 -3.216 1.00 0.00 C ATOM 91 OH TYR A 128 7.063 -10.133 -4.580 1.00 0.00 O ATOM 0 H TYR A 128 7.870 -12.361 1.377 1.00 0.00 H new ATOM 0 HA TYR A 128 9.516 -10.093 1.388 1.00 0.00 H new ATOM 0 HB2 TYR A 128 6.520 -10.498 1.557 1.00 0.00 H new ATOM 0 HB3 TYR A 128 7.253 -8.909 1.454 1.00 0.00 H new ATOM 0 HD1 TYR A 128 8.551 -11.770 -0.600 1.00 0.00 H new ATOM 0 HD2 TYR A 128 5.954 -8.346 -0.515 1.00 0.00 H new ATOM 0 HE1 TYR A 128 8.510 -11.738 -3.073 1.00 0.00 H new ATOM 0 HE2 TYR A 128 5.775 -8.416 -2.983 1.00 0.00 H new ATOM 0 HH TYR A 128 6.829 -9.245 -4.921 1.00 0.00 H new ATOM 101 N MET A 129 9.064 -8.723 3.525 1.00 0.00 N ATOM 102 CA MET A 129 8.925 -8.011 4.772 1.00 0.00 C ATOM 103 C MET A 129 7.601 -7.247 4.798 1.00 0.00 C ATOM 104 O MET A 129 6.982 -7.019 3.756 1.00 0.00 O ATOM 105 CB MET A 129 10.143 -7.114 5.047 1.00 0.00 C ATOM 106 CG MET A 129 10.135 -5.732 4.383 1.00 0.00 C ATOM 107 SD MET A 129 10.789 -4.416 5.443 1.00 0.00 S ATOM 108 CE MET A 129 12.556 -4.658 5.139 1.00 0.00 C ATOM 0 H MET A 129 9.474 -8.159 2.780 1.00 0.00 H new ATOM 0 HA MET A 129 8.897 -8.732 5.589 1.00 0.00 H new ATOM 0 HB2 MET A 129 10.229 -6.975 6.125 1.00 0.00 H new ATOM 0 HB3 MET A 129 11.038 -7.644 4.722 1.00 0.00 H new ATOM 0 HG2 MET A 129 10.723 -5.775 3.466 1.00 0.00 H new ATOM 0 HG3 MET A 129 9.114 -5.482 4.095 1.00 0.00 H new ATOM 0 HE1 MET A 129 13.132 -4.069 5.853 1.00 0.00 H new ATOM 0 HE2 MET A 129 12.804 -5.713 5.255 1.00 0.00 H new ATOM 0 HE3 MET A 129 12.798 -4.338 4.126 1.00 0.00 H new ATOM 118 N LEU A 130 7.202 -6.790 5.981 1.00 0.00 N ATOM 119 CA LEU A 130 5.996 -6.010 6.214 1.00 0.00 C ATOM 120 C LEU A 130 6.451 -4.653 6.761 1.00 0.00 C ATOM 121 O LEU A 130 7.073 -4.578 7.823 1.00 0.00 O ATOM 122 CB LEU A 130 5.062 -6.810 7.146 1.00 0.00 C ATOM 123 CG LEU A 130 3.591 -6.360 7.210 1.00 0.00 C ATOM 124 CD1 LEU A 130 3.424 -4.900 7.588 1.00 0.00 C ATOM 125 CD2 LEU A 130 2.794 -6.605 5.927 1.00 0.00 C ATOM 0 H LEU A 130 7.732 -6.961 6.835 1.00 0.00 H new ATOM 0 HA LEU A 130 5.411 -5.820 5.314 1.00 0.00 H new ATOM 0 HB2 LEU A 130 5.084 -7.854 6.834 1.00 0.00 H new ATOM 0 HB3 LEU A 130 5.473 -6.770 8.155 1.00 0.00 H new ATOM 0 HG LEU A 130 3.186 -6.996 7.997 1.00 0.00 H new ATOM 0 HD11 LEU A 130 2.363 -4.650 7.615 1.00 0.00 H new ATOM 0 HD12 LEU A 130 3.862 -4.726 8.571 1.00 0.00 H new ATOM 0 HD13 LEU A 130 3.926 -4.274 6.851 1.00 0.00 H new ATOM 0 HD21 LEU A 130 1.770 -6.258 6.063 1.00 0.00 H new ATOM 0 HD22 LEU A 130 3.255 -6.061 5.103 1.00 0.00 H new ATOM 0 HD23 LEU A 130 2.789 -7.671 5.700 1.00 0.00 H new ATOM 137 N GLY A 131 6.202 -3.593 5.995 1.00 0.00 N ATOM 138 CA GLY A 131 6.552 -2.203 6.271 1.00 0.00 C ATOM 139 C GLY A 131 5.931 -1.688 7.565 1.00 0.00 C ATOM 140 O GLY A 131 5.158 -2.383 8.223 1.00 0.00 O ATOM 0 H GLY A 131 5.717 -3.691 5.103 1.00 0.00 H new ATOM 0 HA2 GLY A 131 7.636 -2.110 6.331 1.00 0.00 H new ATOM 0 HA3 GLY A 131 6.224 -1.578 5.441 1.00 0.00 H new ATOM 144 N SER A 132 6.250 -0.450 7.935 1.00 0.00 N ATOM 145 CA SER A 132 5.672 0.135 9.127 1.00 0.00 C ATOM 146 C SER A 132 4.255 0.597 8.869 1.00 0.00 C ATOM 147 O SER A 132 3.910 1.082 7.787 1.00 0.00 O ATOM 148 CB SER A 132 6.543 1.288 9.618 1.00 0.00 C ATOM 149 OG SER A 132 6.174 1.771 10.891 1.00 0.00 O ATOM 0 H SER A 132 6.897 0.155 7.430 1.00 0.00 H new ATOM 0 HA SER A 132 5.634 -0.627 9.906 1.00 0.00 H new ATOM 0 HB2 SER A 132 7.582 0.960 9.650 1.00 0.00 H new ATOM 0 HB3 SER A 132 6.489 2.105 8.899 1.00 0.00 H new ATOM 0 HG SER A 132 6.770 2.505 11.148 1.00 0.00 H new ATOM 155 N ALA A 133 3.476 0.487 9.938 1.00 0.00 N ATOM 156 CA ALA A 133 2.173 1.098 10.052 1.00 0.00 C ATOM 157 C ALA A 133 2.324 2.610 10.100 1.00 0.00 C ATOM 158 O ALA A 133 3.074 3.155 10.921 1.00 0.00 O ATOM 159 CB ALA A 133 1.407 0.608 11.274 1.00 0.00 C ATOM 0 H ALA A 133 3.747 -0.044 10.766 1.00 0.00 H new ATOM 0 HA ALA A 133 1.594 0.808 9.175 1.00 0.00 H new ATOM 0 HB1 ALA A 133 0.434 1.098 11.314 1.00 0.00 H new ATOM 0 HB2 ALA A 133 1.268 -0.471 11.208 1.00 0.00 H new ATOM 0 HB3 ALA A 133 1.970 0.846 12.176 1.00 0.00 H new ATOM 165 N MET A 134 1.563 3.260 9.239 1.00 0.00 N ATOM 166 CA MET A 134 1.473 4.695 9.059 1.00 0.00 C ATOM 167 C MET A 134 0.026 5.137 9.281 1.00 0.00 C ATOM 168 O MET A 134 -0.836 4.336 9.648 1.00 0.00 O ATOM 169 CB MET A 134 1.995 5.031 7.655 1.00 0.00 C ATOM 170 CG MET A 134 1.248 4.272 6.545 1.00 0.00 C ATOM 171 SD MET A 134 2.260 3.112 5.573 1.00 0.00 S ATOM 172 CE MET A 134 3.289 4.280 4.656 1.00 0.00 C ATOM 0 H MET A 134 0.946 2.759 8.600 1.00 0.00 H new ATOM 0 HA MET A 134 2.083 5.236 9.782 1.00 0.00 H new ATOM 0 HB2 MET A 134 1.899 6.103 7.484 1.00 0.00 H new ATOM 0 HB3 MET A 134 3.057 4.793 7.600 1.00 0.00 H new ATOM 0 HG2 MET A 134 0.425 3.718 6.997 1.00 0.00 H new ATOM 0 HG3 MET A 134 0.806 5.000 5.865 1.00 0.00 H new ATOM 0 HE1 MET A 134 3.830 3.750 3.872 1.00 0.00 H new ATOM 0 HE2 MET A 134 2.658 5.047 4.207 1.00 0.00 H new ATOM 0 HE3 MET A 134 4.001 4.749 5.335 1.00 0.00 H new ATOM 182 N SER A 135 -0.253 6.416 9.051 1.00 0.00 N ATOM 183 CA SER A 135 -1.574 7.009 9.197 1.00 0.00 C ATOM 184 C SER A 135 -2.352 6.999 7.877 1.00 0.00 C ATOM 185 O SER A 135 -3.470 7.517 7.810 1.00 0.00 O ATOM 186 CB SER A 135 -1.358 8.445 9.667 1.00 0.00 C ATOM 187 OG SER A 135 -1.811 8.604 10.997 1.00 0.00 O ATOM 0 H SER A 135 0.455 7.086 8.750 1.00 0.00 H new ATOM 0 HA SER A 135 -2.165 6.434 9.910 1.00 0.00 H new ATOM 0 HB2 SER A 135 -0.300 8.699 9.604 1.00 0.00 H new ATOM 0 HB3 SER A 135 -1.891 9.133 9.010 1.00 0.00 H new ATOM 0 HG SER A 135 -1.664 9.529 11.284 1.00 0.00 H new ATOM 193 N ARG A 136 -1.752 6.446 6.815 1.00 0.00 N ATOM 194 CA ARG A 136 -2.124 6.599 5.414 1.00 0.00 C ATOM 195 C ARG A 136 -1.963 8.058 4.955 1.00 0.00 C ATOM 196 O ARG A 136 -1.990 8.966 5.792 1.00 0.00 O ATOM 197 CB ARG A 136 -3.566 6.076 5.249 1.00 0.00 C ATOM 198 CG ARG A 136 -3.761 5.162 4.045 1.00 0.00 C ATOM 199 CD ARG A 136 -4.707 4.016 4.426 1.00 0.00 C ATOM 200 NE ARG A 136 -5.365 3.440 3.244 1.00 0.00 N ATOM 201 CZ ARG A 136 -4.902 2.454 2.468 1.00 0.00 C ATOM 202 NH1 ARG A 136 -3.740 1.863 2.711 1.00 0.00 N ATOM 203 NH2 ARG A 136 -5.617 2.043 1.423 1.00 0.00 N ATOM 0 H ARG A 136 -0.939 5.840 6.926 1.00 0.00 H new ATOM 0 HA ARG A 136 -1.461 6.017 4.773 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -3.851 5.536 6.152 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -4.242 6.927 5.160 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -4.173 5.726 3.209 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -2.801 4.763 3.718 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -4.147 3.239 4.946 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -5.462 4.383 5.121 1.00 0.00 H new ATOM 0 HE ARG A 136 -6.270 3.834 2.989 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -3.174 2.158 3.507 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -3.412 1.113 2.102 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -6.515 2.480 1.216 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -5.267 1.291 0.829 1.00 0.00 H new ATOM 217 N PRO A 137 -1.701 8.326 3.671 1.00 0.00 N ATOM 218 CA PRO A 137 -2.049 9.600 3.070 1.00 0.00 C ATOM 219 C PRO A 137 -3.541 9.621 2.730 1.00 0.00 C ATOM 220 O PRO A 137 -4.205 8.577 2.653 1.00 0.00 O ATOM 221 CB PRO A 137 -1.136 9.737 1.849 1.00 0.00 C ATOM 222 CG PRO A 137 -0.760 8.304 1.469 1.00 0.00 C ATOM 223 CD PRO A 137 -1.003 7.467 2.730 1.00 0.00 C ATOM 0 HA PRO A 137 -1.897 10.450 3.735 1.00 0.00 H new ATOM 0 HB2 PRO A 137 -1.648 10.241 1.029 1.00 0.00 H new ATOM 0 HB3 PRO A 137 -0.251 10.328 2.083 1.00 0.00 H new ATOM 0 HG2 PRO A 137 -1.368 7.946 0.638 1.00 0.00 H new ATOM 0 HG3 PRO A 137 0.281 8.243 1.152 1.00 0.00 H new ATOM 0 HD2 PRO A 137 -1.597 6.582 2.499 1.00 0.00 H new ATOM 0 HD3 PRO A 137 -0.060 7.117 3.151 1.00 0.00 H new ATOM 231 N LEU A 138 -4.061 10.826 2.518 1.00 0.00 N ATOM 232 CA LEU A 138 -5.422 11.123 2.137 1.00 0.00 C ATOM 233 C LEU A 138 -5.389 11.713 0.726 1.00 0.00 C ATOM 234 O LEU A 138 -5.446 12.924 0.514 1.00 0.00 O ATOM 235 CB LEU A 138 -6.106 12.010 3.208 1.00 0.00 C ATOM 236 CG LEU A 138 -7.425 11.374 3.659 1.00 0.00 C ATOM 237 CD1 LEU A 138 -8.083 12.064 4.858 1.00 0.00 C ATOM 238 CD2 LEU A 138 -8.449 11.334 2.526 1.00 0.00 C ATOM 0 H LEU A 138 -3.499 11.671 2.617 1.00 0.00 H new ATOM 0 HA LEU A 138 -6.043 10.228 2.098 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -5.443 12.135 4.064 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -6.293 13.004 2.802 1.00 0.00 H new ATOM 0 HG LEU A 138 -7.138 10.367 3.963 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -9.010 11.550 5.110 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -7.407 12.032 5.712 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -8.301 13.102 4.606 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -9.371 10.876 2.885 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -8.656 12.349 2.187 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -8.052 10.748 1.697 1.00 0.00 H new ATOM 250 N ILE A 139 -5.260 10.832 -0.266 1.00 0.00 N ATOM 251 CA ILE A 139 -5.267 11.212 -1.674 1.00 0.00 C ATOM 252 C ILE A 139 -6.732 11.406 -1.998 1.00 0.00 C ATOM 253 O ILE A 139 -7.570 10.570 -1.653 1.00 0.00 O ATOM 254 CB ILE A 139 -4.634 10.143 -2.593 1.00 0.00 C ATOM 255 CG1 ILE A 139 -3.238 9.806 -2.057 1.00 0.00 C ATOM 256 CG2 ILE A 139 -4.459 10.598 -4.055 1.00 0.00 C ATOM 257 CD1 ILE A 139 -2.647 8.586 -2.753 1.00 0.00 C ATOM 0 H ILE A 139 -5.147 9.830 -0.112 1.00 0.00 H new ATOM 0 HA ILE A 139 -4.666 12.106 -1.844 1.00 0.00 H new ATOM 0 HB ILE A 139 -5.316 9.292 -2.588 1.00 0.00 H new ATOM 0 HG12 ILE A 139 -2.577 10.661 -2.199 1.00 0.00 H new ATOM 0 HG13 ILE A 139 -3.295 9.621 -0.984 1.00 0.00 H new ATOM 0 HG21 ILE A 139 -4.009 9.793 -4.635 1.00 0.00 H new ATOM 0 HG22 ILE A 139 -5.432 10.849 -4.477 1.00 0.00 H new ATOM 0 HG23 ILE A 139 -3.812 11.475 -4.088 1.00 0.00 H new ATOM 0 HD11 ILE A 139 -1.657 8.379 -2.346 1.00 0.00 H new ATOM 0 HD12 ILE A 139 -3.294 7.725 -2.589 1.00 0.00 H new ATOM 0 HD13 ILE A 139 -2.566 8.781 -3.822 1.00 0.00 H new ATOM 269 N HIS A 140 -7.027 12.538 -2.612 1.00 0.00 N ATOM 270 CA HIS A 140 -8.373 12.850 -3.045 1.00 0.00 C ATOM 271 C HIS A 140 -8.597 12.225 -4.420 1.00 0.00 C ATOM 272 O HIS A 140 -7.665 12.042 -5.206 1.00 0.00 O ATOM 273 CB HIS A 140 -8.608 14.364 -3.056 1.00 0.00 C ATOM 274 CG HIS A 140 -7.901 15.086 -4.172 1.00 0.00 C ATOM 275 ND1 HIS A 140 -6.634 15.618 -4.131 1.00 0.00 N ATOM 276 CD2 HIS A 140 -8.380 15.254 -5.440 1.00 0.00 C ATOM 277 CE1 HIS A 140 -6.348 16.084 -5.360 1.00 0.00 C ATOM 278 NE2 HIS A 140 -7.391 15.889 -6.189 1.00 0.00 N ATOM 0 H HIS A 140 -6.341 13.263 -2.823 1.00 0.00 H new ATOM 0 HA HIS A 140 -9.097 12.432 -2.345 1.00 0.00 H new ATOM 0 HB2 HIS A 140 -9.678 14.554 -3.135 1.00 0.00 H new ATOM 0 HB3 HIS A 140 -8.280 14.779 -2.103 1.00 0.00 H new ATOM 0 HD2 HIS A 140 -9.352 14.949 -5.798 1.00 0.00 H new ATOM 0 HE1 HIS A 140 -5.415 16.548 -5.642 1.00 0.00 H new ATOM 0 HE2 HIS A 140 -7.446 16.154 -7.172 1.00 0.00 H new ATOM 286 N PHE A 141 -9.865 11.973 -4.733 1.00 0.00 N ATOM 287 CA PHE A 141 -10.286 11.324 -5.971 1.00 0.00 C ATOM 288 C PHE A 141 -11.247 12.220 -6.740 1.00 0.00 C ATOM 289 O PHE A 141 -11.154 12.337 -7.958 1.00 0.00 O ATOM 290 CB PHE A 141 -10.941 9.984 -5.625 1.00 0.00 C ATOM 291 CG PHE A 141 -10.019 9.056 -4.870 1.00 0.00 C ATOM 292 CD1 PHE A 141 -9.155 8.225 -5.595 1.00 0.00 C ATOM 293 CD2 PHE A 141 -9.975 9.061 -3.461 1.00 0.00 C ATOM 294 CE1 PHE A 141 -8.243 7.409 -4.916 1.00 0.00 C ATOM 295 CE2 PHE A 141 -9.035 8.260 -2.792 1.00 0.00 C ATOM 296 CZ PHE A 141 -8.156 7.442 -3.516 1.00 0.00 C ATOM 0 H PHE A 141 -10.643 12.219 -4.122 1.00 0.00 H new ATOM 0 HA PHE A 141 -9.421 11.147 -6.610 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -11.834 10.166 -5.027 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -11.266 9.496 -6.544 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -9.193 8.214 -6.674 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -10.661 9.678 -2.899 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -7.599 6.747 -5.476 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -8.989 8.274 -1.713 1.00 0.00 H new ATOM 0 HZ PHE A 141 -7.419 6.843 -3.001 1.00 0.00 H new ATOM 306 N GLY A 142 -12.116 12.922 -6.012 1.00 0.00 N ATOM 307 CA GLY A 142 -13.201 13.704 -6.554 1.00 0.00 C ATOM 308 C GLY A 142 -13.673 14.691 -5.507 1.00 0.00 C ATOM 309 O GLY A 142 -14.873 14.816 -5.277 1.00 0.00 O ATOM 0 H GLY A 142 -12.072 12.956 -4.993 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -12.873 14.233 -7.448 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -14.022 13.052 -6.853 1.00 0.00 H new ATOM 313 N ASN A 143 -12.716 15.376 -4.870 1.00 0.00 N ATOM 314 CA ASN A 143 -12.944 16.434 -3.885 1.00 0.00 C ATOM 315 C ASN A 143 -13.724 15.895 -2.699 1.00 0.00 C ATOM 316 O ASN A 143 -13.875 14.684 -2.559 1.00 0.00 O ATOM 317 CB ASN A 143 -13.651 17.656 -4.508 1.00 0.00 C ATOM 318 CG ASN A 143 -13.223 17.930 -5.937 1.00 0.00 C ATOM 319 OD1 ASN A 143 -14.063 17.963 -6.837 1.00 0.00 O ATOM 320 ND2 ASN A 143 -11.930 18.016 -6.200 1.00 0.00 N ATOM 0 H ASN A 143 -11.725 15.200 -5.034 1.00 0.00 H new ATOM 0 HA ASN A 143 -11.971 16.775 -3.532 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -14.729 17.496 -4.483 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -13.445 18.536 -3.899 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -11.611 18.112 -7.164 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -11.252 17.987 -5.439 1.00 0.00 H new ATOM 327 N ASP A 144 -14.229 16.794 -1.858 1.00 0.00 N ATOM 328 CA ASP A 144 -15.010 16.520 -0.656 1.00 0.00 C ATOM 329 C ASP A 144 -16.084 15.448 -0.817 1.00 0.00 C ATOM 330 O ASP A 144 -16.407 14.811 0.187 1.00 0.00 O ATOM 331 CB ASP A 144 -15.584 17.839 -0.110 1.00 0.00 C ATOM 332 CG ASP A 144 -14.670 18.408 0.970 1.00 0.00 C ATOM 333 OD1 ASP A 144 -14.534 17.789 2.047 1.00 0.00 O ATOM 334 OD2 ASP A 144 -13.965 19.408 0.725 1.00 0.00 O ATOM 0 H ASP A 144 -14.095 17.794 -2.007 1.00 0.00 H new ATOM 0 HA ASP A 144 -14.324 16.086 0.071 1.00 0.00 H new ATOM 0 HB2 ASP A 144 -15.692 18.559 -0.921 1.00 0.00 H new ATOM 0 HB3 ASP A 144 -16.580 17.668 0.300 1.00 0.00 H new ATOM 339 N TYR A 145 -16.567 15.196 -2.038 1.00 0.00 N ATOM 340 CA TYR A 145 -17.386 14.058 -2.396 1.00 0.00 C ATOM 341 C TYR A 145 -16.670 12.747 -2.096 1.00 0.00 C ATOM 342 O TYR A 145 -16.971 12.092 -1.097 1.00 0.00 O ATOM 343 CB TYR A 145 -17.819 14.180 -3.867 1.00 0.00 C ATOM 344 CG TYR A 145 -19.127 13.500 -4.207 1.00 0.00 C ATOM 345 CD1 TYR A 145 -19.180 12.113 -4.450 1.00 0.00 C ATOM 346 CD2 TYR A 145 -20.283 14.282 -4.357 1.00 0.00 C ATOM 347 CE1 TYR A 145 -20.384 11.512 -4.866 1.00 0.00 C ATOM 348 CE2 TYR A 145 -21.489 13.689 -4.768 1.00 0.00 C ATOM 349 CZ TYR A 145 -21.546 12.304 -5.037 1.00 0.00 C ATOM 350 OH TYR A 145 -22.721 11.752 -5.440 1.00 0.00 O ATOM 0 H TYR A 145 -16.384 15.812 -2.830 1.00 0.00 H new ATOM 0 HA TYR A 145 -18.288 14.052 -1.784 1.00 0.00 H new ATOM 0 HB2 TYR A 145 -17.900 15.237 -4.120 1.00 0.00 H new ATOM 0 HB3 TYR A 145 -17.034 13.761 -4.497 1.00 0.00 H new ATOM 0 HD1 TYR A 145 -18.295 11.509 -4.317 1.00 0.00 H new ATOM 0 HD2 TYR A 145 -20.246 15.342 -4.156 1.00 0.00 H new ATOM 0 HE1 TYR A 145 -20.421 10.449 -5.054 1.00 0.00 H new ATOM 0 HE2 TYR A 145 -22.376 14.295 -4.879 1.00 0.00 H new ATOM 0 HH TYR A 145 -23.407 12.450 -5.500 1.00 0.00 H new ATOM 360 N GLU A 146 -15.735 12.346 -2.956 1.00 0.00 N ATOM 361 CA GLU A 146 -15.097 11.037 -2.813 1.00 0.00 C ATOM 362 C GLU A 146 -14.024 11.048 -1.729 1.00 0.00 C ATOM 363 O GLU A 146 -13.537 9.990 -1.345 1.00 0.00 O ATOM 364 CB GLU A 146 -14.501 10.515 -4.124 1.00 0.00 C ATOM 365 CG GLU A 146 -15.541 10.402 -5.235 1.00 0.00 C ATOM 366 CD GLU A 146 -15.039 9.599 -6.432 1.00 0.00 C ATOM 367 OE1 GLU A 146 -14.096 10.054 -7.117 1.00 0.00 O ATOM 368 OE2 GLU A 146 -15.652 8.544 -6.719 1.00 0.00 O ATOM 0 H GLU A 146 -15.406 12.898 -3.748 1.00 0.00 H new ATOM 0 HA GLU A 146 -15.895 10.355 -2.518 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -13.701 11.181 -4.446 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -14.051 9.537 -3.951 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -16.441 9.931 -4.838 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -15.823 11.401 -5.566 1.00 0.00 H new ATOM 375 N ASP A 147 -13.649 12.225 -1.230 1.00 0.00 N ATOM 376 CA ASP A 147 -12.638 12.369 -0.185 1.00 0.00 C ATOM 377 C ASP A 147 -13.220 11.828 1.114 1.00 0.00 C ATOM 378 O ASP A 147 -12.609 10.983 1.777 1.00 0.00 O ATOM 379 CB ASP A 147 -12.239 13.843 -0.059 1.00 0.00 C ATOM 380 CG ASP A 147 -10.942 14.093 0.699 1.00 0.00 C ATOM 381 OD1 ASP A 147 -10.845 13.735 1.892 1.00 0.00 O ATOM 382 OD2 ASP A 147 -10.032 14.728 0.103 1.00 0.00 O ATOM 0 H ASP A 147 -14.042 13.113 -1.543 1.00 0.00 H new ATOM 0 HA ASP A 147 -11.737 11.806 -0.429 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -12.146 14.266 -1.059 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -13.045 14.381 0.441 1.00 0.00 H new ATOM 387 N ARG A 148 -14.470 12.220 1.417 1.00 0.00 N ATOM 388 CA ARG A 148 -15.157 11.645 2.560 1.00 0.00 C ATOM 389 C ARG A 148 -15.506 10.192 2.279 1.00 0.00 C ATOM 390 O ARG A 148 -15.379 9.390 3.192 1.00 0.00 O ATOM 391 CB ARG A 148 -16.371 12.475 2.994 1.00 0.00 C ATOM 392 CG ARG A 148 -17.695 12.035 2.361 1.00 0.00 C ATOM 393 CD ARG A 148 -18.685 13.183 2.296 1.00 0.00 C ATOM 394 NE ARG A 148 -19.045 13.473 0.907 1.00 0.00 N ATOM 395 CZ ARG A 148 -19.847 14.451 0.497 1.00 0.00 C ATOM 396 NH1 ARG A 148 -20.030 15.531 1.247 1.00 0.00 N ATOM 397 NH2 ARG A 148 -20.460 14.331 -0.670 1.00 0.00 N ATOM 0 H ARG A 148 -15.004 12.915 0.895 1.00 0.00 H new ATOM 0 HA ARG A 148 -14.478 11.668 3.413 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -16.465 12.420 4.079 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -16.191 13.520 2.742 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -17.511 11.654 1.357 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -18.122 11.216 2.940 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -19.580 12.931 2.865 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -18.253 14.070 2.758 1.00 0.00 H new ATOM 0 HE ARG A 148 -18.644 12.870 0.189 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -19.554 15.615 2.145 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -20.647 16.277 0.925 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -20.314 13.498 -1.240 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -21.079 15.072 -1.000 1.00 0.00 H new ATOM 411 N TYR A 149 -15.907 9.851 1.045 1.00 0.00 N ATOM 412 CA TYR A 149 -16.315 8.494 0.718 1.00 0.00 C ATOM 413 C TYR A 149 -15.159 7.573 1.060 1.00 0.00 C ATOM 414 O TYR A 149 -15.345 6.579 1.747 1.00 0.00 O ATOM 415 CB TYR A 149 -16.712 8.351 -0.759 1.00 0.00 C ATOM 416 CG TYR A 149 -17.363 7.014 -1.066 1.00 0.00 C ATOM 417 CD1 TYR A 149 -16.580 5.856 -1.259 1.00 0.00 C ATOM 418 CD2 TYR A 149 -18.766 6.915 -1.077 1.00 0.00 C ATOM 419 CE1 TYR A 149 -17.195 4.596 -1.395 1.00 0.00 C ATOM 420 CE2 TYR A 149 -19.385 5.667 -1.246 1.00 0.00 C ATOM 421 CZ TYR A 149 -18.607 4.496 -1.372 1.00 0.00 C ATOM 422 OH TYR A 149 -19.218 3.282 -1.468 1.00 0.00 O ATOM 0 H TYR A 149 -15.954 10.504 0.263 1.00 0.00 H new ATOM 0 HA TYR A 149 -17.201 8.231 1.296 1.00 0.00 H new ATOM 0 HB2 TYR A 149 -17.399 9.154 -1.025 1.00 0.00 H new ATOM 0 HB3 TYR A 149 -15.826 8.470 -1.382 1.00 0.00 H new ATOM 0 HD1 TYR A 149 -15.504 5.936 -1.303 1.00 0.00 H new ATOM 0 HD2 TYR A 149 -19.369 7.803 -0.955 1.00 0.00 H new ATOM 0 HE1 TYR A 149 -16.591 3.709 -1.516 1.00 0.00 H new ATOM 0 HE2 TYR A 149 -20.463 5.602 -1.280 1.00 0.00 H new ATOM 0 HH TYR A 149 -20.190 3.401 -1.434 1.00 0.00 H new ATOM 432 N TYR A 150 -13.952 7.938 0.633 1.00 0.00 N ATOM 433 CA TYR A 150 -12.739 7.218 0.947 1.00 0.00 C ATOM 434 C TYR A 150 -12.526 7.159 2.459 1.00 0.00 C ATOM 435 O TYR A 150 -12.392 6.067 3.015 1.00 0.00 O ATOM 436 CB TYR A 150 -11.584 7.917 0.220 1.00 0.00 C ATOM 437 CG TYR A 150 -10.227 7.365 0.572 1.00 0.00 C ATOM 438 CD1 TYR A 150 -9.900 6.040 0.259 1.00 0.00 C ATOM 439 CD2 TYR A 150 -9.298 8.181 1.229 1.00 0.00 C ATOM 440 CE1 TYR A 150 -8.652 5.515 0.629 1.00 0.00 C ATOM 441 CE2 TYR A 150 -8.072 7.651 1.666 1.00 0.00 C ATOM 442 CZ TYR A 150 -7.766 6.298 1.406 1.00 0.00 C ATOM 443 OH TYR A 150 -6.614 5.772 1.892 1.00 0.00 O ATOM 0 H TYR A 150 -13.796 8.759 0.049 1.00 0.00 H new ATOM 0 HA TYR A 150 -12.799 6.183 0.610 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -11.736 7.827 -0.856 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -11.607 8.981 0.457 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -10.610 5.420 -0.269 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -9.525 9.223 1.401 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -8.370 4.519 0.322 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -7.369 8.275 2.197 1.00 0.00 H new ATOM 0 HH TYR A 150 -6.131 6.456 2.401 1.00 0.00 H new ATOM 453 N ARG A 151 -12.510 8.303 3.151 1.00 0.00 N ATOM 454 CA ARG A 151 -12.212 8.308 4.582 1.00 0.00 C ATOM 455 C ARG A 151 -13.273 7.603 5.423 1.00 0.00 C ATOM 456 O ARG A 151 -12.984 7.267 6.565 1.00 0.00 O ATOM 457 CB ARG A 151 -11.874 9.728 5.073 1.00 0.00 C ATOM 458 CG ARG A 151 -13.049 10.535 5.623 1.00 0.00 C ATOM 459 CD ARG A 151 -12.676 12.016 5.751 1.00 0.00 C ATOM 460 NE ARG A 151 -11.698 12.243 6.836 1.00 0.00 N ATOM 461 CZ ARG A 151 -11.702 13.272 7.695 1.00 0.00 C ATOM 462 NH1 ARG A 151 -12.544 14.285 7.551 1.00 0.00 N ATOM 463 NH2 ARG A 151 -10.845 13.281 8.707 1.00 0.00 N ATOM 0 H ARG A 151 -12.697 9.222 2.749 1.00 0.00 H new ATOM 0 HA ARG A 151 -11.315 7.705 4.726 1.00 0.00 H new ATOM 0 HB2 ARG A 151 -11.113 9.653 5.850 1.00 0.00 H new ATOM 0 HB3 ARG A 151 -11.431 10.283 4.246 1.00 0.00 H new ATOM 0 HG2 ARG A 151 -13.911 10.427 4.964 1.00 0.00 H new ATOM 0 HG3 ARG A 151 -13.342 10.143 6.597 1.00 0.00 H new ATOM 0 HD2 ARG A 151 -12.261 12.369 4.807 1.00 0.00 H new ATOM 0 HD3 ARG A 151 -13.575 12.602 5.943 1.00 0.00 H new ATOM 0 HE ARG A 151 -10.953 11.554 6.940 1.00 0.00 H new ATOM 0 HH11 ARG A 151 -13.206 14.292 6.775 1.00 0.00 H new ATOM 0 HH12 ARG A 151 -12.530 15.058 8.216 1.00 0.00 H new ATOM 0 HH21 ARG A 151 -10.190 12.509 8.827 1.00 0.00 H new ATOM 0 HH22 ARG A 151 -10.841 14.060 9.365 1.00 0.00 H new ATOM 477 N GLU A 152 -14.454 7.328 4.876 1.00 0.00 N ATOM 478 CA GLU A 152 -15.529 6.620 5.555 1.00 0.00 C ATOM 479 C GLU A 152 -15.235 5.126 5.615 1.00 0.00 C ATOM 480 O GLU A 152 -15.734 4.444 6.514 1.00 0.00 O ATOM 481 CB GLU A 152 -16.852 6.797 4.799 1.00 0.00 C ATOM 482 CG GLU A 152 -17.615 8.087 5.130 1.00 0.00 C ATOM 483 CD GLU A 152 -19.040 7.765 5.575 1.00 0.00 C ATOM 484 OE1 GLU A 152 -19.790 7.106 4.811 1.00 0.00 O ATOM 485 OE2 GLU A 152 -19.411 8.109 6.719 1.00 0.00 O ATOM 0 H GLU A 152 -14.694 7.600 3.923 1.00 0.00 H new ATOM 0 HA GLU A 152 -15.605 7.034 6.561 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -16.648 6.777 3.728 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -17.496 5.945 5.017 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -17.096 8.632 5.918 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -17.639 8.737 4.256 1.00 0.00 H new ATOM 492 N ASN A 153 -14.445 4.605 4.673 1.00 0.00 N ATOM 493 CA ASN A 153 -14.192 3.180 4.533 1.00 0.00 C ATOM 494 C ASN A 153 -12.716 2.858 4.678 1.00 0.00 C ATOM 495 O ASN A 153 -12.346 1.687 4.706 1.00 0.00 O ATOM 496 CB ASN A 153 -14.747 2.639 3.211 1.00 0.00 C ATOM 497 CG ASN A 153 -14.058 3.222 1.987 1.00 0.00 C ATOM 498 OD1 ASN A 153 -12.872 3.034 1.760 1.00 0.00 O ATOM 499 ND2 ASN A 153 -14.767 3.986 1.190 1.00 0.00 N ATOM 0 H ASN A 153 -13.959 5.174 3.980 1.00 0.00 H new ATOM 0 HA ASN A 153 -14.720 2.678 5.344 1.00 0.00 H new ATOM 0 HB2 ASN A 153 -14.641 1.554 3.197 1.00 0.00 H new ATOM 0 HB3 ASN A 153 -15.814 2.856 3.157 1.00 0.00 H new ATOM 0 HD21 ASN A 153 -14.328 4.424 0.380 1.00 0.00 H new ATOM 0 HD22 ASN A 153 -15.757 4.142 1.381 1.00 0.00 H new ATOM 506 N MET A 154 -11.862 3.863 4.873 1.00 0.00 N ATOM 507 CA MET A 154 -10.436 3.636 4.958 1.00 0.00 C ATOM 508 C MET A 154 -10.005 2.732 6.121 1.00 0.00 C ATOM 509 O MET A 154 -8.890 2.227 6.112 1.00 0.00 O ATOM 510 CB MET A 154 -9.744 4.998 4.990 1.00 0.00 C ATOM 511 CG MET A 154 -9.907 5.677 6.361 1.00 0.00 C ATOM 512 SD MET A 154 -8.331 5.768 7.251 1.00 0.00 S ATOM 513 CE MET A 154 -7.539 7.043 6.240 1.00 0.00 C ATOM 0 H MET A 154 -12.142 4.839 4.974 1.00 0.00 H new ATOM 0 HA MET A 154 -10.127 3.074 4.077 1.00 0.00 H new ATOM 0 HB2 MET A 154 -8.684 4.875 4.767 1.00 0.00 H new ATOM 0 HB3 MET A 154 -10.161 5.638 4.213 1.00 0.00 H new ATOM 0 HG2 MET A 154 -10.307 6.682 6.225 1.00 0.00 H new ATOM 0 HG3 MET A 154 -10.631 5.123 6.958 1.00 0.00 H new ATOM 0 HE1 MET A 154 -6.681 7.450 6.775 1.00 0.00 H new ATOM 0 HE2 MET A 154 -7.206 6.606 5.299 1.00 0.00 H new ATOM 0 HE3 MET A 154 -8.252 7.842 6.037 1.00 0.00 H new ATOM 523 N TYR A 155 -10.897 2.462 7.076 1.00 0.00 N ATOM 524 CA TYR A 155 -10.705 1.571 8.209 1.00 0.00 C ATOM 525 C TYR A 155 -10.439 0.132 7.750 1.00 0.00 C ATOM 526 O TYR A 155 -9.854 -0.662 8.489 1.00 0.00 O ATOM 527 CB TYR A 155 -11.985 1.624 9.062 1.00 0.00 C ATOM 528 CG TYR A 155 -12.420 3.027 9.458 1.00 0.00 C ATOM 529 CD1 TYR A 155 -13.198 3.800 8.574 1.00 0.00 C ATOM 530 CD2 TYR A 155 -12.010 3.584 10.682 1.00 0.00 C ATOM 531 CE1 TYR A 155 -13.478 5.144 8.865 1.00 0.00 C ATOM 532 CE2 TYR A 155 -12.348 4.910 11.003 1.00 0.00 C ATOM 533 CZ TYR A 155 -13.051 5.716 10.083 1.00 0.00 C ATOM 534 OH TYR A 155 -13.293 7.025 10.376 1.00 0.00 O ATOM 0 H TYR A 155 -11.824 2.887 7.074 1.00 0.00 H new ATOM 0 HA TYR A 155 -9.837 1.891 8.785 1.00 0.00 H new ATOM 0 HB2 TYR A 155 -12.795 1.148 8.509 1.00 0.00 H new ATOM 0 HB3 TYR A 155 -11.828 1.037 9.967 1.00 0.00 H new ATOM 0 HD1 TYR A 155 -13.581 3.356 7.667 1.00 0.00 H new ATOM 0 HD2 TYR A 155 -11.434 2.992 11.377 1.00 0.00 H new ATOM 0 HE1 TYR A 155 -14.024 5.745 8.152 1.00 0.00 H new ATOM 0 HE2 TYR A 155 -12.067 5.316 11.963 1.00 0.00 H new ATOM 0 HH TYR A 155 -12.925 7.236 11.259 1.00 0.00 H new ATOM 544 N ARG A 156 -10.899 -0.218 6.546 1.00 0.00 N ATOM 545 CA ARG A 156 -10.829 -1.551 5.942 1.00 0.00 C ATOM 546 C ARG A 156 -9.476 -1.830 5.319 1.00 0.00 C ATOM 547 O ARG A 156 -9.097 -2.981 5.126 1.00 0.00 O ATOM 548 CB ARG A 156 -11.873 -1.614 4.820 1.00 0.00 C ATOM 549 CG ARG A 156 -13.243 -1.279 5.393 1.00 0.00 C ATOM 550 CD ARG A 156 -14.361 -1.498 4.374 1.00 0.00 C ATOM 551 NE ARG A 156 -15.669 -1.615 5.034 1.00 0.00 N ATOM 552 CZ ARG A 156 -16.464 -2.694 5.074 1.00 0.00 C ATOM 553 NH1 ARG A 156 -16.087 -3.855 4.544 1.00 0.00 N ATOM 554 NH2 ARG A 156 -17.652 -2.607 5.654 1.00 0.00 N ATOM 0 H ARG A 156 -11.355 0.458 5.933 1.00 0.00 H new ATOM 0 HA ARG A 156 -11.006 -2.287 6.727 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -11.615 -0.912 4.027 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -11.885 -2.608 4.374 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -13.428 -1.896 6.272 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -13.253 -0.241 5.724 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -14.380 -0.668 3.668 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -14.160 -2.401 3.798 1.00 0.00 H new ATOM 0 HE ARG A 156 -16.010 -0.783 5.515 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -15.175 -3.938 4.095 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -16.710 -4.662 4.587 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -17.955 -1.724 6.065 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -18.263 -3.423 5.689 1.00 0.00 H new ATOM 568 N TYR A 157 -8.813 -0.756 4.937 1.00 0.00 N ATOM 569 CA TYR A 157 -7.596 -0.767 4.144 1.00 0.00 C ATOM 570 C TYR A 157 -6.359 -1.100 4.990 1.00 0.00 C ATOM 571 O TYR A 157 -6.462 -1.152 6.213 1.00 0.00 O ATOM 572 CB TYR A 157 -7.436 0.613 3.515 1.00 0.00 C ATOM 573 CG TYR A 157 -8.370 0.981 2.377 1.00 0.00 C ATOM 574 CD1 TYR A 157 -8.858 0.007 1.485 1.00 0.00 C ATOM 575 CD2 TYR A 157 -8.753 2.323 2.199 1.00 0.00 C ATOM 576 CE1 TYR A 157 -9.859 0.334 0.553 1.00 0.00 C ATOM 577 CE2 TYR A 157 -9.834 2.625 1.357 1.00 0.00 C ATOM 578 CZ TYR A 157 -10.403 1.632 0.537 1.00 0.00 C ATOM 579 OH TYR A 157 -11.466 1.935 -0.248 1.00 0.00 O ATOM 0 H TYR A 157 -9.118 0.186 5.180 1.00 0.00 H new ATOM 0 HA TYR A 157 -7.677 -1.542 3.382 1.00 0.00 H new ATOM 0 HB2 TYR A 157 -7.557 1.357 4.302 1.00 0.00 H new ATOM 0 HB3 TYR A 157 -6.412 0.699 3.150 1.00 0.00 H new ATOM 0 HD1 TYR A 157 -8.461 -0.997 1.517 1.00 0.00 H new ATOM 0 HD2 TYR A 157 -8.220 3.114 2.706 1.00 0.00 H new ATOM 0 HE1 TYR A 157 -10.209 -0.409 -0.148 1.00 0.00 H new ATOM 0 HE2 TYR A 157 -10.233 3.628 1.338 1.00 0.00 H new ATOM 0 HH TYR A 157 -12.176 2.328 0.301 1.00 0.00 H new ATOM 589 N PRO A 158 -5.174 -1.349 4.385 1.00 0.00 N ATOM 590 CA PRO A 158 -3.995 -1.657 5.180 1.00 0.00 C ATOM 591 C PRO A 158 -3.376 -0.382 5.765 1.00 0.00 C ATOM 592 O PRO A 158 -3.382 0.671 5.119 1.00 0.00 O ATOM 593 CB PRO A 158 -3.025 -2.350 4.228 1.00 0.00 C ATOM 594 CG PRO A 158 -3.375 -1.779 2.866 1.00 0.00 C ATOM 595 CD PRO A 158 -4.863 -1.451 2.958 1.00 0.00 C ATOM 0 HA PRO A 158 -4.242 -2.292 6.031 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -1.988 -2.142 4.493 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -3.149 -3.433 4.251 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -2.786 -0.889 2.646 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -3.176 -2.498 2.071 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -5.088 -0.517 2.443 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -5.462 -2.228 2.484 1.00 0.00 H new ATOM 603 N ASN A 159 -2.736 -0.494 6.927 1.00 0.00 N ATOM 604 CA ASN A 159 -1.979 0.603 7.528 1.00 0.00 C ATOM 605 C ASN A 159 -0.519 0.554 7.098 1.00 0.00 C ATOM 606 O ASN A 159 0.218 1.472 7.415 1.00 0.00 O ATOM 607 CB ASN A 159 -2.027 0.503 9.063 1.00 0.00 C ATOM 608 CG ASN A 159 -2.855 1.576 9.753 1.00 0.00 C ATOM 609 OD1 ASN A 159 -3.724 2.206 9.157 1.00 0.00 O ATOM 610 ND2 ASN A 159 -2.630 1.765 11.042 1.00 0.00 N ATOM 0 H ASN A 159 -2.728 -1.351 7.480 1.00 0.00 H new ATOM 0 HA ASN A 159 -2.431 1.537 7.193 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -2.426 -0.474 9.336 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -1.008 0.549 9.447 1.00 0.00 H new ATOM 0 HD21 ASN A 159 -3.184 2.446 11.562 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -1.903 1.230 11.517 1.00 0.00 H new ATOM 617 N GLN A 160 -0.074 -0.528 6.461 1.00 0.00 N ATOM 618 CA GLN A 160 1.321 -0.852 6.191 1.00 0.00 C ATOM 619 C GLN A 160 1.407 -1.322 4.725 1.00 0.00 C ATOM 620 O GLN A 160 0.422 -1.238 3.981 1.00 0.00 O ATOM 621 CB GLN A 160 1.797 -1.952 7.149 1.00 0.00 C ATOM 622 CG GLN A 160 1.176 -2.053 8.555 1.00 0.00 C ATOM 623 CD GLN A 160 0.431 -3.361 8.832 1.00 0.00 C ATOM 624 OE1 GLN A 160 0.511 -3.887 9.937 1.00 0.00 O ATOM 625 NE2 GLN A 160 -0.280 -3.934 7.872 1.00 0.00 N ATOM 0 H GLN A 160 -0.712 -1.238 6.102 1.00 0.00 H new ATOM 0 HA GLN A 160 1.963 0.016 6.344 1.00 0.00 H new ATOM 0 HB2 GLN A 160 1.638 -2.909 6.652 1.00 0.00 H new ATOM 0 HB3 GLN A 160 2.873 -1.833 7.275 1.00 0.00 H new ATOM 0 HG2 GLN A 160 1.967 -1.937 9.296 1.00 0.00 H new ATOM 0 HG3 GLN A 160 0.485 -1.221 8.693 1.00 0.00 H new ATOM 0 HE21 GLN A 160 -0.345 -3.494 6.954 1.00 0.00 H new ATOM 0 HE22 GLN A 160 -0.762 -4.815 8.051 1.00 0.00 H new ATOM 634 N VAL A 161 2.532 -1.902 4.302 1.00 0.00 N ATOM 635 CA VAL A 161 2.702 -2.486 2.966 1.00 0.00 C ATOM 636 C VAL A 161 3.569 -3.749 3.037 1.00 0.00 C ATOM 637 O VAL A 161 4.383 -3.865 3.947 1.00 0.00 O ATOM 638 CB VAL A 161 3.324 -1.444 2.013 1.00 0.00 C ATOM 639 CG1 VAL A 161 2.347 -0.316 1.656 1.00 0.00 C ATOM 640 CG2 VAL A 161 4.601 -0.804 2.581 1.00 0.00 C ATOM 0 H VAL A 161 3.365 -1.981 4.886 1.00 0.00 H new ATOM 0 HA VAL A 161 1.725 -2.772 2.578 1.00 0.00 H new ATOM 0 HB VAL A 161 3.573 -2.010 1.116 1.00 0.00 H new ATOM 0 HG11 VAL A 161 2.835 0.389 0.983 1.00 0.00 H new ATOM 0 HG12 VAL A 161 1.469 -0.737 1.166 1.00 0.00 H new ATOM 0 HG13 VAL A 161 2.041 0.202 2.565 1.00 0.00 H new ATOM 0 HG21 VAL A 161 4.993 -0.080 1.867 1.00 0.00 H new ATOM 0 HG22 VAL A 161 4.369 -0.300 3.519 1.00 0.00 H new ATOM 0 HG23 VAL A 161 5.347 -1.578 2.760 1.00 0.00 H new ATOM 650 N TYR A 162 3.443 -4.677 2.085 1.00 0.00 N ATOM 651 CA TYR A 162 4.311 -5.838 1.926 1.00 0.00 C ATOM 652 C TYR A 162 5.318 -5.626 0.795 1.00 0.00 C ATOM 653 O TYR A 162 4.908 -5.348 -0.334 1.00 0.00 O ATOM 654 CB TYR A 162 3.442 -7.025 1.518 1.00 0.00 C ATOM 655 CG TYR A 162 3.017 -7.989 2.599 1.00 0.00 C ATOM 656 CD1 TYR A 162 3.956 -8.543 3.492 1.00 0.00 C ATOM 657 CD2 TYR A 162 1.741 -8.553 2.500 1.00 0.00 C ATOM 658 CE1 TYR A 162 3.635 -9.670 4.266 1.00 0.00 C ATOM 659 CE2 TYR A 162 1.422 -9.694 3.254 1.00 0.00 C ATOM 660 CZ TYR A 162 2.360 -10.258 4.149 1.00 0.00 C ATOM 661 OH TYR A 162 2.064 -11.390 4.843 1.00 0.00 O ATOM 0 H TYR A 162 2.706 -4.636 1.381 1.00 0.00 H new ATOM 0 HA TYR A 162 4.840 -6.002 2.865 1.00 0.00 H new ATOM 0 HB2 TYR A 162 2.541 -6.634 1.045 1.00 0.00 H new ATOM 0 HB3 TYR A 162 3.982 -7.590 0.758 1.00 0.00 H new ATOM 0 HD1 TYR A 162 4.935 -8.095 3.582 1.00 0.00 H new ATOM 0 HD2 TYR A 162 1.003 -8.112 1.846 1.00 0.00 H new ATOM 0 HE1 TYR A 162 4.363 -10.084 4.948 1.00 0.00 H new ATOM 0 HE2 TYR A 162 0.447 -10.147 3.149 1.00 0.00 H new ATOM 0 HH TYR A 162 1.143 -11.661 4.649 1.00 0.00 H new ATOM 671 N TYR A 163 6.611 -5.856 1.044 1.00 0.00 N ATOM 672 CA TYR A 163 7.651 -5.823 0.010 1.00 0.00 C ATOM 673 C TYR A 163 8.938 -6.474 0.526 1.00 0.00 C ATOM 674 O TYR A 163 9.073 -6.644 1.729 1.00 0.00 O ATOM 675 CB TYR A 163 7.889 -4.372 -0.424 1.00 0.00 C ATOM 676 CG TYR A 163 8.461 -3.414 0.615 1.00 0.00 C ATOM 677 CD1 TYR A 163 7.743 -3.073 1.781 1.00 0.00 C ATOM 678 CD2 TYR A 163 9.711 -2.813 0.376 1.00 0.00 C ATOM 679 CE1 TYR A 163 8.313 -2.216 2.737 1.00 0.00 C ATOM 680 CE2 TYR A 163 10.297 -1.974 1.333 1.00 0.00 C ATOM 681 CZ TYR A 163 9.606 -1.693 2.526 1.00 0.00 C ATOM 682 OH TYR A 163 10.187 -0.918 3.471 1.00 0.00 O ATOM 0 H TYR A 163 6.968 -6.072 1.975 1.00 0.00 H new ATOM 0 HA TYR A 163 7.323 -6.394 -0.858 1.00 0.00 H new ATOM 0 HB2 TYR A 163 8.564 -4.383 -1.280 1.00 0.00 H new ATOM 0 HB3 TYR A 163 6.940 -3.964 -0.772 1.00 0.00 H new ATOM 0 HD1 TYR A 163 6.752 -3.472 1.939 1.00 0.00 H new ATOM 0 HD2 TYR A 163 10.224 -3.001 -0.556 1.00 0.00 H new ATOM 0 HE1 TYR A 163 7.763 -1.958 3.630 1.00 0.00 H new ATOM 0 HE2 TYR A 163 11.273 -1.546 1.156 1.00 0.00 H new ATOM 0 HH TYR A 163 11.150 -1.098 3.495 1.00 0.00 H new ATOM 692 N ARG A 164 9.895 -6.878 -0.323 1.00 0.00 N ATOM 693 CA ARG A 164 11.229 -7.255 0.166 1.00 0.00 C ATOM 694 C ARG A 164 12.010 -5.972 0.514 1.00 0.00 C ATOM 695 O ARG A 164 11.643 -4.944 -0.051 1.00 0.00 O ATOM 696 CB ARG A 164 11.969 -8.035 -0.933 1.00 0.00 C ATOM 697 CG ARG A 164 11.213 -9.258 -1.493 1.00 0.00 C ATOM 698 CD ARG A 164 10.708 -9.040 -2.929 1.00 0.00 C ATOM 699 NE ARG A 164 9.546 -8.150 -3.034 1.00 0.00 N ATOM 700 CZ ARG A 164 9.055 -7.648 -4.176 1.00 0.00 C ATOM 701 NH1 ARG A 164 9.653 -7.839 -5.347 1.00 0.00 N ATOM 702 NH2 ARG A 164 7.923 -6.959 -4.136 1.00 0.00 N ATOM 0 H ARG A 164 9.774 -6.951 -1.333 1.00 0.00 H new ATOM 0 HA ARG A 164 11.142 -7.882 1.053 1.00 0.00 H new ATOM 0 HB2 ARG A 164 12.186 -7.354 -1.756 1.00 0.00 H new ATOM 0 HB3 ARG A 164 12.927 -8.371 -0.536 1.00 0.00 H new ATOM 0 HG2 ARG A 164 11.871 -10.127 -1.472 1.00 0.00 H new ATOM 0 HG3 ARG A 164 10.366 -9.484 -0.845 1.00 0.00 H new ATOM 0 HD2 ARG A 164 11.520 -8.629 -3.528 1.00 0.00 H new ATOM 0 HD3 ARG A 164 10.450 -10.007 -3.361 1.00 0.00 H new ATOM 0 HE ARG A 164 9.073 -7.892 -2.168 1.00 0.00 H new ATOM 0 HH11 ARG A 164 10.514 -8.383 -5.397 1.00 0.00 H new ATOM 0 HH12 ARG A 164 9.251 -7.442 -6.196 1.00 0.00 H new ATOM 0 HH21 ARG A 164 7.442 -6.819 -3.247 1.00 0.00 H new ATOM 0 HH22 ARG A 164 7.533 -6.569 -4.994 1.00 0.00 H new ATOM 716 N PRO A 165 13.084 -5.999 1.325 1.00 0.00 N ATOM 717 CA PRO A 165 13.962 -4.843 1.539 1.00 0.00 C ATOM 718 C PRO A 165 14.663 -4.396 0.257 1.00 0.00 C ATOM 719 O PRO A 165 14.807 -5.188 -0.679 1.00 0.00 O ATOM 720 CB PRO A 165 15.020 -5.278 2.555 1.00 0.00 C ATOM 721 CG PRO A 165 14.922 -6.799 2.620 1.00 0.00 C ATOM 722 CD PRO A 165 13.516 -7.129 2.125 1.00 0.00 C ATOM 0 HA PRO A 165 13.365 -4.000 1.886 1.00 0.00 H new ATOM 0 HB2 PRO A 165 16.016 -4.962 2.244 1.00 0.00 H new ATOM 0 HB3 PRO A 165 14.834 -4.831 3.531 1.00 0.00 H new ATOM 0 HG2 PRO A 165 15.681 -7.270 1.995 1.00 0.00 H new ATOM 0 HG3 PRO A 165 15.077 -7.161 3.636 1.00 0.00 H new ATOM 0 HD2 PRO A 165 13.518 -8.045 1.533 1.00 0.00 H new ATOM 0 HD3 PRO A 165 12.838 -7.292 2.963 1.00 0.00 H new ATOM 730 N VAL A 166 15.168 -3.155 0.243 1.00 0.00 N ATOM 731 CA VAL A 166 15.771 -2.520 -0.940 1.00 0.00 C ATOM 732 C VAL A 166 16.958 -3.301 -1.503 1.00 0.00 C ATOM 733 O VAL A 166 17.227 -3.218 -2.699 1.00 0.00 O ATOM 734 CB VAL A 166 16.167 -1.059 -0.682 1.00 0.00 C ATOM 735 CG1 VAL A 166 14.913 -0.284 -0.302 1.00 0.00 C ATOM 736 CG2 VAL A 166 17.246 -0.886 0.390 1.00 0.00 C ATOM 0 H VAL A 166 15.170 -2.553 1.066 1.00 0.00 H new ATOM 0 HA VAL A 166 14.987 -2.531 -1.697 1.00 0.00 H new ATOM 0 HB VAL A 166 16.609 -0.672 -1.600 1.00 0.00 H new ATOM 0 HG11 VAL A 166 15.172 0.758 -0.114 1.00 0.00 H new ATOM 0 HG12 VAL A 166 14.191 -0.337 -1.117 1.00 0.00 H new ATOM 0 HG13 VAL A 166 14.476 -0.717 0.598 1.00 0.00 H new ATOM 0 HG21 VAL A 166 17.470 0.174 0.513 1.00 0.00 H new ATOM 0 HG22 VAL A 166 16.888 -1.294 1.335 1.00 0.00 H new ATOM 0 HG23 VAL A 166 18.149 -1.415 0.086 1.00 0.00 H new ATOM 746 N ASP A 167 17.585 -4.102 -0.642 1.00 0.00 N ATOM 747 CA ASP A 167 18.724 -5.006 -0.840 1.00 0.00 C ATOM 748 C ASP A 167 18.739 -5.768 -2.176 1.00 0.00 C ATOM 749 O ASP A 167 19.811 -6.133 -2.662 1.00 0.00 O ATOM 750 CB ASP A 167 18.727 -5.990 0.346 1.00 0.00 C ATOM 751 CG ASP A 167 19.453 -7.303 0.054 1.00 0.00 C ATOM 752 OD1 ASP A 167 20.696 -7.365 0.161 1.00 0.00 O ATOM 753 OD2 ASP A 167 18.757 -8.301 -0.244 1.00 0.00 O ATOM 0 H ASP A 167 17.271 -4.139 0.328 1.00 0.00 H new ATOM 0 HA ASP A 167 19.626 -4.395 -0.882 1.00 0.00 H new ATOM 0 HB2 ASP A 167 19.196 -5.509 1.204 1.00 0.00 H new ATOM 0 HB3 ASP A 167 17.697 -6.209 0.627 1.00 0.00 H new ATOM 758 N GLN A 168 17.589 -5.988 -2.814 1.00 0.00 N ATOM 759 CA GLN A 168 17.440 -6.919 -3.928 1.00 0.00 C ATOM 760 C GLN A 168 16.677 -6.331 -5.118 1.00 0.00 C ATOM 761 O GLN A 168 16.135 -7.099 -5.921 1.00 0.00 O ATOM 762 CB GLN A 168 16.843 -8.225 -3.382 1.00 0.00 C ATOM 763 CG GLN A 168 15.427 -8.102 -2.794 1.00 0.00 C ATOM 764 CD GLN A 168 15.232 -9.081 -1.642 1.00 0.00 C ATOM 765 OE1 GLN A 168 14.726 -10.190 -1.827 1.00 0.00 O ATOM 766 NE2 GLN A 168 15.618 -8.684 -0.441 1.00 0.00 N ATOM 0 H GLN A 168 16.721 -5.515 -2.565 1.00 0.00 H new ATOM 0 HA GLN A 168 18.420 -7.134 -4.354 1.00 0.00 H new ATOM 0 HB2 GLN A 168 16.823 -8.961 -4.186 1.00 0.00 H new ATOM 0 HB3 GLN A 168 17.507 -8.615 -2.610 1.00 0.00 H new ATOM 0 HG2 GLN A 168 15.261 -7.083 -2.443 1.00 0.00 H new ATOM 0 HG3 GLN A 168 14.688 -8.296 -3.571 1.00 0.00 H new ATOM 0 HE21 GLN A 168 16.034 -7.761 -0.318 1.00 0.00 H new ATOM 0 HE22 GLN A 168 15.500 -9.301 0.362 1.00 0.00 H new ATOM 775 N TYR A 169 16.626 -5.004 -5.273 1.00 0.00 N ATOM 776 CA TYR A 169 15.915 -4.370 -6.383 1.00 0.00 C ATOM 777 C TYR A 169 16.853 -3.626 -7.316 1.00 0.00 C ATOM 778 O TYR A 169 17.932 -3.164 -6.950 1.00 0.00 O ATOM 779 CB TYR A 169 14.864 -3.392 -5.866 1.00 0.00 C ATOM 780 CG TYR A 169 13.742 -4.026 -5.081 1.00 0.00 C ATOM 781 CD1 TYR A 169 12.579 -4.564 -5.673 1.00 0.00 C ATOM 782 CD2 TYR A 169 13.870 -4.005 -3.695 1.00 0.00 C ATOM 783 CE1 TYR A 169 11.522 -5.015 -4.851 1.00 0.00 C ATOM 784 CE2 TYR A 169 12.803 -4.374 -2.884 1.00 0.00 C ATOM 785 CZ TYR A 169 11.620 -4.875 -3.449 1.00 0.00 C ATOM 786 OH TYR A 169 10.598 -5.203 -2.620 1.00 0.00 O ATOM 0 H TYR A 169 17.074 -4.345 -4.636 1.00 0.00 H new ATOM 0 HA TYR A 169 15.436 -5.175 -6.940 1.00 0.00 H new ATOM 0 HB2 TYR A 169 15.356 -2.651 -5.236 1.00 0.00 H new ATOM 0 HB3 TYR A 169 14.438 -2.856 -6.714 1.00 0.00 H new ATOM 0 HD1 TYR A 169 12.498 -4.631 -6.748 1.00 0.00 H new ATOM 0 HD2 TYR A 169 14.804 -3.700 -3.247 1.00 0.00 H new ATOM 0 HE1 TYR A 169 10.644 -5.464 -5.292 1.00 0.00 H new ATOM 0 HE2 TYR A 169 12.885 -4.274 -1.812 1.00 0.00 H new ATOM 0 HH TYR A 169 10.863 -5.035 -1.692 1.00 0.00 H new ATOM 796 N ASN A 170 16.385 -3.438 -8.543 1.00 0.00 N ATOM 797 CA ASN A 170 16.867 -2.453 -9.493 1.00 0.00 C ATOM 798 C ASN A 170 16.238 -1.095 -9.183 1.00 0.00 C ATOM 799 O ASN A 170 16.969 -0.220 -8.718 1.00 0.00 O ATOM 800 CB ASN A 170 16.637 -2.896 -10.948 1.00 0.00 C ATOM 801 CG ASN A 170 15.239 -3.415 -11.286 1.00 0.00 C ATOM 802 OD1 ASN A 170 14.506 -3.914 -10.433 1.00 0.00 O ATOM 803 ND2 ASN A 170 14.832 -3.310 -12.533 1.00 0.00 N ATOM 0 H ASN A 170 15.620 -3.999 -8.918 1.00 0.00 H new ATOM 0 HA ASN A 170 17.948 -2.358 -9.386 1.00 0.00 H new ATOM 0 HB2 ASN A 170 16.855 -2.051 -11.601 1.00 0.00 H new ATOM 0 HB3 ASN A 170 17.359 -3.678 -11.186 1.00 0.00 H new ATOM 0 HD21 ASN A 170 13.905 -3.643 -12.797 1.00 0.00 H new ATOM 0 HD22 ASN A 170 15.444 -2.895 -13.236 1.00 0.00 H new ATOM 810 N ASN A 171 14.928 -0.891 -9.394 1.00 0.00 N ATOM 811 CA ASN A 171 14.305 0.432 -9.277 1.00 0.00 C ATOM 812 C ASN A 171 13.111 0.324 -8.352 1.00 0.00 C ATOM 813 O ASN A 171 12.413 -0.696 -8.386 1.00 0.00 O ATOM 814 CB ASN A 171 13.740 0.953 -10.617 1.00 0.00 C ATOM 815 CG ASN A 171 14.613 0.720 -11.830 1.00 0.00 C ATOM 816 OD1 ASN A 171 15.491 1.512 -12.154 1.00 0.00 O ATOM 817 ND2 ASN A 171 14.344 -0.347 -12.557 1.00 0.00 N ATOM 0 H ASN A 171 14.277 -1.634 -9.649 1.00 0.00 H new ATOM 0 HA ASN A 171 15.081 1.108 -8.919 1.00 0.00 H new ATOM 0 HB2 ASN A 171 12.773 0.480 -10.791 1.00 0.00 H new ATOM 0 HB3 ASN A 171 13.559 2.024 -10.522 1.00 0.00 H new ATOM 0 HD21 ASN A 171 14.872 -0.529 -13.411 1.00 0.00 H new ATOM 0 HD22 ASN A 171 13.608 -0.991 -12.265 1.00 0.00 H new ATOM 824 N GLN A 172 12.727 1.429 -7.709 1.00 0.00 N ATOM 825 CA GLN A 172 11.437 1.479 -7.036 1.00 0.00 C ATOM 826 C GLN A 172 10.283 1.208 -8.014 1.00 0.00 C ATOM 827 O GLN A 172 9.203 0.817 -7.598 1.00 0.00 O ATOM 828 CB GLN A 172 11.201 2.826 -6.318 1.00 0.00 C ATOM 829 CG GLN A 172 10.913 3.972 -7.300 1.00 0.00 C ATOM 830 CD GLN A 172 9.497 4.562 -7.289 1.00 0.00 C ATOM 831 OE1 GLN A 172 9.294 5.754 -7.071 1.00 0.00 O ATOM 832 NE2 GLN A 172 8.477 3.782 -7.591 1.00 0.00 N ATOM 0 H GLN A 172 13.281 2.283 -7.643 1.00 0.00 H new ATOM 0 HA GLN A 172 11.458 0.692 -6.282 1.00 0.00 H new ATOM 0 HB2 GLN A 172 10.364 2.724 -5.627 1.00 0.00 H new ATOM 0 HB3 GLN A 172 12.078 3.075 -5.721 1.00 0.00 H new ATOM 0 HG2 GLN A 172 11.617 4.778 -7.095 1.00 0.00 H new ATOM 0 HG3 GLN A 172 11.123 3.614 -8.308 1.00 0.00 H new ATOM 0 HE21 GLN A 172 8.630 2.790 -7.775 1.00 0.00 H new ATOM 0 HE22 GLN A 172 7.535 4.170 -7.641 1.00 0.00 H new ATOM 841 N ASN A 173 10.451 1.485 -9.311 1.00 0.00 N ATOM 842 CA ASN A 173 9.341 1.525 -10.258 1.00 0.00 C ATOM 843 C ASN A 173 8.900 0.136 -10.674 1.00 0.00 C ATOM 844 O ASN A 173 7.852 -0.017 -11.291 1.00 0.00 O ATOM 845 CB ASN A 173 9.716 2.382 -11.473 1.00 0.00 C ATOM 846 CG ASN A 173 8.930 3.681 -11.401 1.00 0.00 C ATOM 847 OD1 ASN A 173 7.801 3.747 -11.875 1.00 0.00 O ATOM 848 ND2 ASN A 173 9.458 4.701 -10.747 1.00 0.00 N ATOM 0 H ASN A 173 11.359 1.687 -9.729 1.00 0.00 H new ATOM 0 HA ASN A 173 8.488 1.985 -9.759 1.00 0.00 H new ATOM 0 HB2 ASN A 173 10.787 2.586 -11.478 1.00 0.00 H new ATOM 0 HB3 ASN A 173 9.488 1.851 -12.397 1.00 0.00 H new ATOM 0 HD21 ASN A 173 8.925 5.562 -10.629 1.00 0.00 H new ATOM 0 HD22 ASN A 173 10.399 4.627 -10.360 1.00 0.00 H new ATOM 855 N THR A 174 9.686 -0.873 -10.311 1.00 0.00 N ATOM 856 CA THR A 174 9.207 -2.261 -10.364 1.00 0.00 C ATOM 857 C THR A 174 8.688 -2.733 -9.004 1.00 0.00 C ATOM 858 O THR A 174 7.695 -3.460 -8.932 1.00 0.00 O ATOM 859 CB THR A 174 10.259 -3.175 -11.000 1.00 0.00 C ATOM 860 OG1 THR A 174 9.599 -4.280 -11.578 1.00 0.00 O ATOM 861 CG2 THR A 174 11.341 -3.680 -10.050 1.00 0.00 C ATOM 0 H THR A 174 10.645 -0.765 -9.981 1.00 0.00 H new ATOM 0 HA THR A 174 8.339 -2.312 -11.021 1.00 0.00 H new ATOM 0 HB THR A 174 10.782 -2.567 -11.738 1.00 0.00 H new ATOM 0 HG1 THR A 174 10.259 -4.875 -11.992 1.00 0.00 H new ATOM 0 HG21 THR A 174 12.036 -4.318 -10.596 1.00 0.00 H new ATOM 0 HG22 THR A 174 11.881 -2.832 -9.630 1.00 0.00 H new ATOM 0 HG23 THR A 174 10.880 -4.252 -9.245 1.00 0.00 H new ATOM 869 N PHE A 175 9.339 -2.288 -7.928 1.00 0.00 N ATOM 870 CA PHE A 175 8.980 -2.563 -6.548 1.00 0.00 C ATOM 871 C PHE A 175 7.554 -2.101 -6.263 1.00 0.00 C ATOM 872 O PHE A 175 6.748 -2.922 -5.851 1.00 0.00 O ATOM 873 CB PHE A 175 9.999 -1.880 -5.629 1.00 0.00 C ATOM 874 CG PHE A 175 9.444 -1.289 -4.352 1.00 0.00 C ATOM 875 CD1 PHE A 175 8.853 -2.107 -3.378 1.00 0.00 C ATOM 876 CD2 PHE A 175 9.425 0.107 -4.187 1.00 0.00 C ATOM 877 CE1 PHE A 175 8.272 -1.510 -2.251 1.00 0.00 C ATOM 878 CE2 PHE A 175 8.837 0.694 -3.063 1.00 0.00 C ATOM 879 CZ PHE A 175 8.293 -0.125 -2.073 1.00 0.00 C ATOM 0 H PHE A 175 10.168 -1.699 -8.006 1.00 0.00 H new ATOM 0 HA PHE A 175 9.006 -3.636 -6.360 1.00 0.00 H new ATOM 0 HB2 PHE A 175 10.767 -2.607 -5.366 1.00 0.00 H new ATOM 0 HB3 PHE A 175 10.491 -1.086 -6.191 1.00 0.00 H new ATOM 0 HD1 PHE A 175 8.846 -3.181 -3.495 1.00 0.00 H new ATOM 0 HD2 PHE A 175 9.872 0.737 -4.942 1.00 0.00 H new ATOM 0 HE1 PHE A 175 7.799 -2.133 -1.506 1.00 0.00 H new ATOM 0 HE2 PHE A 175 8.804 1.769 -2.962 1.00 0.00 H new ATOM 0 HZ PHE A 175 7.889 0.311 -1.171 1.00 0.00 H new ATOM 889 N VAL A 176 7.236 -0.817 -6.452 1.00 0.00 N ATOM 890 CA VAL A 176 5.960 -0.236 -6.047 1.00 0.00 C ATOM 891 C VAL A 176 4.835 -0.965 -6.763 1.00 0.00 C ATOM 892 O VAL A 176 3.912 -1.432 -6.103 1.00 0.00 O ATOM 893 CB VAL A 176 5.931 1.280 -6.339 1.00 0.00 C ATOM 894 CG1 VAL A 176 4.545 1.891 -6.080 1.00 0.00 C ATOM 895 CG2 VAL A 176 6.956 2.038 -5.486 1.00 0.00 C ATOM 0 H VAL A 176 7.866 -0.148 -6.895 1.00 0.00 H new ATOM 0 HA VAL A 176 5.828 -0.355 -4.972 1.00 0.00 H new ATOM 0 HB VAL A 176 6.179 1.384 -7.395 1.00 0.00 H new ATOM 0 HG11 VAL A 176 4.571 2.959 -6.298 1.00 0.00 H new ATOM 0 HG12 VAL A 176 3.808 1.407 -6.722 1.00 0.00 H new ATOM 0 HG13 VAL A 176 4.271 1.741 -5.036 1.00 0.00 H new ATOM 0 HG21 VAL A 176 6.907 3.102 -5.718 1.00 0.00 H new ATOM 0 HG22 VAL A 176 6.733 1.887 -4.430 1.00 0.00 H new ATOM 0 HG23 VAL A 176 7.957 1.665 -5.703 1.00 0.00 H new ATOM 905 N HIS A 177 4.930 -1.117 -8.087 1.00 0.00 N ATOM 906 CA HIS A 177 3.898 -1.813 -8.846 1.00 0.00 C ATOM 907 C HIS A 177 3.644 -3.229 -8.304 1.00 0.00 C ATOM 908 O HIS A 177 2.509 -3.703 -8.347 1.00 0.00 O ATOM 909 CB HIS A 177 4.293 -1.858 -10.330 1.00 0.00 C ATOM 910 CG HIS A 177 4.252 -0.526 -11.043 1.00 0.00 C ATOM 911 ND1 HIS A 177 4.818 -0.277 -12.274 1.00 0.00 N ATOM 912 CD2 HIS A 177 3.658 0.637 -10.619 1.00 0.00 C ATOM 913 CE1 HIS A 177 4.605 1.011 -12.579 1.00 0.00 C ATOM 914 NE2 HIS A 177 3.905 1.604 -11.599 1.00 0.00 N ATOM 0 H HIS A 177 5.707 -0.769 -8.649 1.00 0.00 H new ATOM 0 HA HIS A 177 2.964 -1.261 -8.738 1.00 0.00 H new ATOM 0 HB2 HIS A 177 5.301 -2.265 -10.410 1.00 0.00 H new ATOM 0 HB3 HIS A 177 3.628 -2.550 -10.847 1.00 0.00 H new ATOM 0 HD2 HIS A 177 3.105 0.778 -9.702 1.00 0.00 H new ATOM 0 HE1 HIS A 177 4.946 1.499 -13.480 1.00 0.00 H new ATOM 0 HE2 HIS A 177 3.608 2.580 -11.574 1.00 0.00 H new ATOM 922 N ASP A 178 4.672 -3.890 -7.755 1.00 0.00 N ATOM 923 CA ASP A 178 4.504 -5.237 -7.212 1.00 0.00 C ATOM 924 C ASP A 178 3.968 -5.190 -5.794 1.00 0.00 C ATOM 925 O ASP A 178 3.058 -5.928 -5.454 1.00 0.00 O ATOM 926 CB ASP A 178 5.841 -5.961 -7.166 1.00 0.00 C ATOM 927 CG ASP A 178 5.635 -7.457 -6.927 1.00 0.00 C ATOM 928 OD1 ASP A 178 5.057 -8.112 -7.829 1.00 0.00 O ATOM 929 OD2 ASP A 178 6.124 -7.955 -5.887 1.00 0.00 O ATOM 0 H ASP A 178 5.618 -3.516 -7.677 1.00 0.00 H new ATOM 0 HA ASP A 178 3.802 -5.759 -7.863 1.00 0.00 H new ATOM 0 HB2 ASP A 178 6.376 -5.807 -8.103 1.00 0.00 H new ATOM 0 HB3 ASP A 178 6.460 -5.542 -6.373 1.00 0.00 H new ATOM 934 N CYS A 179 4.531 -4.313 -4.968 1.00 0.00 N ATOM 935 CA CYS A 179 4.109 -4.029 -3.608 1.00 0.00 C ATOM 936 C CYS A 179 2.614 -3.761 -3.574 1.00 0.00 C ATOM 937 O CYS A 179 1.927 -4.302 -2.712 1.00 0.00 O ATOM 938 CB CYS A 179 4.826 -2.775 -3.091 1.00 0.00 C ATOM 939 SG CYS A 179 4.027 -2.100 -1.613 1.00 0.00 S ATOM 0 H CYS A 179 5.337 -3.754 -5.248 1.00 0.00 H new ATOM 0 HA CYS A 179 4.353 -4.890 -2.985 1.00 0.00 H new ATOM 0 HB2 CYS A 179 5.864 -3.018 -2.863 1.00 0.00 H new ATOM 0 HB3 CYS A 179 4.841 -2.017 -3.874 1.00 0.00 H new ATOM 944 N VAL A 180 2.123 -2.915 -4.477 1.00 0.00 N ATOM 945 CA VAL A 180 0.711 -2.575 -4.575 1.00 0.00 C ATOM 946 C VAL A 180 -0.068 -3.863 -4.796 1.00 0.00 C ATOM 947 O VAL A 180 -0.956 -4.170 -4.001 1.00 0.00 O ATOM 948 CB VAL A 180 0.526 -1.503 -5.674 1.00 0.00 C ATOM 949 CG1 VAL A 180 -0.940 -1.280 -6.041 1.00 0.00 C ATOM 950 CG2 VAL A 180 1.090 -0.147 -5.218 1.00 0.00 C ATOM 0 H VAL A 180 2.705 -2.442 -5.169 1.00 0.00 H new ATOM 0 HA VAL A 180 0.319 -2.127 -3.662 1.00 0.00 H new ATOM 0 HB VAL A 180 1.063 -1.882 -6.544 1.00 0.00 H new ATOM 0 HG11 VAL A 180 -1.009 -0.517 -6.817 1.00 0.00 H new ATOM 0 HG12 VAL A 180 -1.369 -2.212 -6.409 1.00 0.00 H new ATOM 0 HG13 VAL A 180 -1.490 -0.951 -5.159 1.00 0.00 H new ATOM 0 HG21 VAL A 180 0.948 0.590 -6.008 1.00 0.00 H new ATOM 0 HG22 VAL A 180 0.568 0.180 -4.318 1.00 0.00 H new ATOM 0 HG23 VAL A 180 2.154 -0.249 -5.004 1.00 0.00 H new ATOM 960 N ASN A 181 0.337 -4.647 -5.798 1.00 0.00 N ATOM 961 CA ASN A 181 -0.256 -5.941 -6.088 1.00 0.00 C ATOM 962 C ASN A 181 -0.272 -6.837 -4.859 1.00 0.00 C ATOM 963 O ASN A 181 -1.329 -7.340 -4.506 1.00 0.00 O ATOM 964 CB ASN A 181 0.447 -6.603 -7.288 1.00 0.00 C ATOM 965 CG ASN A 181 -0.298 -6.318 -8.574 1.00 0.00 C ATOM 966 OD1 ASN A 181 -0.565 -7.209 -9.376 1.00 0.00 O ATOM 967 ND2 ASN A 181 -0.682 -5.075 -8.790 1.00 0.00 N ATOM 0 H ASN A 181 1.094 -4.393 -6.433 1.00 0.00 H new ATOM 0 HA ASN A 181 -1.298 -5.785 -6.367 1.00 0.00 H new ATOM 0 HB2 ASN A 181 1.469 -6.233 -7.365 1.00 0.00 H new ATOM 0 HB3 ASN A 181 0.509 -7.680 -7.130 1.00 0.00 H new ATOM 0 HD21 ASN A 181 -1.208 -4.843 -9.632 1.00 0.00 H new ATOM 0 HD22 ASN A 181 -0.453 -4.346 -8.115 1.00 0.00 H new ATOM 974 N ILE A 182 0.863 -7.065 -4.202 1.00 0.00 N ATOM 975 CA ILE A 182 0.957 -8.015 -3.112 1.00 0.00 C ATOM 976 C ILE A 182 0.236 -7.506 -1.876 1.00 0.00 C ATOM 977 O ILE A 182 -0.444 -8.298 -1.235 1.00 0.00 O ATOM 978 CB ILE A 182 2.444 -8.320 -2.856 1.00 0.00 C ATOM 979 CG1 ILE A 182 3.142 -8.914 -4.098 1.00 0.00 C ATOM 980 CG2 ILE A 182 2.648 -9.262 -1.664 1.00 0.00 C ATOM 981 CD1 ILE A 182 2.262 -9.689 -5.089 1.00 0.00 C ATOM 0 H ILE A 182 1.741 -6.592 -4.416 1.00 0.00 H new ATOM 0 HA ILE A 182 0.456 -8.946 -3.379 1.00 0.00 H new ATOM 0 HB ILE A 182 2.901 -7.358 -2.624 1.00 0.00 H new ATOM 0 HG12 ILE A 182 3.623 -8.099 -4.638 1.00 0.00 H new ATOM 0 HG13 ILE A 182 3.934 -9.580 -3.755 1.00 0.00 H new ATOM 0 HG21 ILE A 182 3.713 -9.447 -1.524 1.00 0.00 H new ATOM 0 HG22 ILE A 182 2.238 -8.804 -0.764 1.00 0.00 H new ATOM 0 HG23 ILE A 182 2.138 -10.206 -1.855 1.00 0.00 H new ATOM 0 HD11 ILE A 182 2.875 -10.052 -5.914 1.00 0.00 H new ATOM 0 HD12 ILE A 182 1.800 -10.535 -4.581 1.00 0.00 H new ATOM 0 HD13 ILE A 182 1.485 -9.031 -5.477 1.00 0.00 H new ATOM 993 N THR A 183 0.361 -6.231 -1.526 1.00 0.00 N ATOM 994 CA THR A 183 -0.315 -5.656 -0.379 1.00 0.00 C ATOM 995 C THR A 183 -1.818 -5.844 -0.577 1.00 0.00 C ATOM 996 O THR A 183 -2.445 -6.485 0.265 1.00 0.00 O ATOM 997 CB THR A 183 0.099 -4.190 -0.190 1.00 0.00 C ATOM 998 OG1 THR A 183 1.502 -4.096 -0.044 1.00 0.00 O ATOM 999 CG2 THR A 183 -0.546 -3.576 1.052 1.00 0.00 C ATOM 0 H THR A 183 0.940 -5.565 -2.038 1.00 0.00 H new ATOM 0 HA THR A 183 -0.028 -6.160 0.544 1.00 0.00 H new ATOM 0 HB THR A 183 -0.236 -3.647 -1.074 1.00 0.00 H new ATOM 0 HG1 THR A 183 1.928 -4.165 -0.924 1.00 0.00 H new ATOM 0 HG21 THR A 183 -0.229 -2.538 1.151 1.00 0.00 H new ATOM 0 HG22 THR A 183 -1.631 -3.616 0.956 1.00 0.00 H new ATOM 0 HG23 THR A 183 -0.239 -4.135 1.936 1.00 0.00 H new ATOM 1007 N VAL A 184 -2.379 -5.346 -1.686 1.00 0.00 N ATOM 1008 CA VAL A 184 -3.797 -5.513 -2.001 1.00 0.00 C ATOM 1009 C VAL A 184 -4.159 -6.996 -2.028 1.00 0.00 C ATOM 1010 O VAL A 184 -5.037 -7.410 -1.282 1.00 0.00 O ATOM 1011 CB VAL A 184 -4.112 -4.814 -3.343 1.00 0.00 C ATOM 1012 CG1 VAL A 184 -5.481 -5.189 -3.935 1.00 0.00 C ATOM 1013 CG2 VAL A 184 -4.002 -3.284 -3.207 1.00 0.00 C ATOM 0 H VAL A 184 -1.861 -4.817 -2.387 1.00 0.00 H new ATOM 0 HA VAL A 184 -4.407 -5.046 -1.228 1.00 0.00 H new ATOM 0 HB VAL A 184 -3.360 -5.178 -4.043 1.00 0.00 H new ATOM 0 HG11 VAL A 184 -5.628 -4.658 -4.876 1.00 0.00 H new ATOM 0 HG12 VAL A 184 -5.518 -6.263 -4.115 1.00 0.00 H new ATOM 0 HG13 VAL A 184 -6.269 -4.911 -3.235 1.00 0.00 H new ATOM 0 HG21 VAL A 184 -4.228 -2.816 -4.165 1.00 0.00 H new ATOM 0 HG22 VAL A 184 -4.710 -2.934 -2.456 1.00 0.00 H new ATOM 0 HG23 VAL A 184 -2.990 -3.018 -2.903 1.00 0.00 H new ATOM 1023 N LYS A 185 -3.505 -7.814 -2.853 1.00 0.00 N ATOM 1024 CA LYS A 185 -3.875 -9.211 -3.036 1.00 0.00 C ATOM 1025 C LYS A 185 -3.827 -9.956 -1.714 1.00 0.00 C ATOM 1026 O LYS A 185 -4.794 -10.620 -1.382 1.00 0.00 O ATOM 1027 CB LYS A 185 -2.988 -9.854 -4.111 1.00 0.00 C ATOM 1028 CG LYS A 185 -3.519 -11.229 -4.533 1.00 0.00 C ATOM 1029 CD LYS A 185 -2.682 -11.870 -5.649 1.00 0.00 C ATOM 1030 CE LYS A 185 -1.216 -12.061 -5.246 1.00 0.00 C ATOM 1031 NZ LYS A 185 -0.463 -12.814 -6.265 1.00 0.00 N ATOM 0 H LYS A 185 -2.703 -7.523 -3.412 1.00 0.00 H new ATOM 0 HA LYS A 185 -4.905 -9.270 -3.389 1.00 0.00 H new ATOM 0 HB2 LYS A 185 -2.938 -9.200 -4.981 1.00 0.00 H new ATOM 0 HB3 LYS A 185 -1.972 -9.957 -3.731 1.00 0.00 H new ATOM 0 HG2 LYS A 185 -3.530 -11.891 -3.667 1.00 0.00 H new ATOM 0 HG3 LYS A 185 -4.550 -11.128 -4.870 1.00 0.00 H new ATOM 0 HD2 LYS A 185 -3.112 -12.836 -5.912 1.00 0.00 H new ATOM 0 HD3 LYS A 185 -2.732 -11.245 -6.541 1.00 0.00 H new ATOM 0 HE2 LYS A 185 -0.750 -11.087 -5.096 1.00 0.00 H new ATOM 0 HE3 LYS A 185 -1.166 -12.589 -4.293 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 0.524 -12.923 -5.957 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 -0.892 -13.753 -6.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 -0.489 -12.298 -7.168 1.00 0.00 H new ATOM 1045 N GLN A 186 -2.764 -9.838 -0.920 1.00 0.00 N ATOM 1046 CA GLN A 186 -2.676 -10.508 0.377 1.00 0.00 C ATOM 1047 C GLN A 186 -3.686 -9.960 1.388 1.00 0.00 C ATOM 1048 O GLN A 186 -3.984 -10.613 2.390 1.00 0.00 O ATOM 1049 CB GLN A 186 -1.277 -10.306 0.968 1.00 0.00 C ATOM 1050 CG GLN A 186 -0.192 -11.073 0.202 1.00 0.00 C ATOM 1051 CD GLN A 186 -0.336 -12.569 0.429 1.00 0.00 C ATOM 1052 OE1 GLN A 186 -0.340 -13.023 1.570 1.00 0.00 O ATOM 1053 NE2 GLN A 186 -0.476 -13.350 -0.625 1.00 0.00 N ATOM 0 H GLN A 186 -1.944 -9.279 -1.155 1.00 0.00 H new ATOM 0 HA GLN A 186 -2.891 -11.562 0.200 1.00 0.00 H new ATOM 0 HB2 GLN A 186 -1.036 -9.243 0.964 1.00 0.00 H new ATOM 0 HB3 GLN A 186 -1.277 -10.629 2.009 1.00 0.00 H new ATOM 0 HG2 GLN A 186 -0.265 -10.852 -0.863 1.00 0.00 H new ATOM 0 HG3 GLN A 186 0.794 -10.743 0.529 1.00 0.00 H new ATOM 0 HE21 GLN A 186 -0.469 -12.948 -1.562 1.00 0.00 H new ATOM 0 HE22 GLN A 186 -0.591 -14.356 -0.503 1.00 0.00 H new ATOM 1062 N HIS A 187 -4.172 -8.743 1.174 1.00 0.00 N ATOM 1063 CA HIS A 187 -5.304 -8.220 1.918 1.00 0.00 C ATOM 1064 C HIS A 187 -6.581 -8.936 1.459 1.00 0.00 C ATOM 1065 O HIS A 187 -7.342 -9.431 2.292 1.00 0.00 O ATOM 1066 CB HIS A 187 -5.379 -6.686 1.788 1.00 0.00 C ATOM 1067 CG HIS A 187 -6.065 -6.030 2.956 1.00 0.00 C ATOM 1068 ND1 HIS A 187 -5.532 -5.049 3.770 1.00 0.00 N ATOM 1069 CD2 HIS A 187 -7.327 -6.307 3.403 1.00 0.00 C ATOM 1070 CE1 HIS A 187 -6.455 -4.744 4.698 1.00 0.00 C ATOM 1071 NE2 HIS A 187 -7.550 -5.502 4.519 1.00 0.00 N ATOM 0 H HIS A 187 -3.792 -8.096 0.483 1.00 0.00 H new ATOM 0 HA HIS A 187 -5.184 -8.420 2.983 1.00 0.00 H new ATOM 0 HB2 HIS A 187 -4.370 -6.285 1.694 1.00 0.00 H new ATOM 0 HB3 HIS A 187 -5.910 -6.430 0.871 1.00 0.00 H new ATOM 0 HD2 HIS A 187 -8.020 -7.015 2.973 1.00 0.00 H new ATOM 0 HE1 HIS A 187 -6.335 -4.001 5.472 1.00 0.00 H new ATOM 0 HE2 HIS A 187 -8.392 -5.490 5.095 1.00 0.00 H new ATOM 1079 N THR A 188 -6.795 -9.038 0.152 1.00 0.00 N ATOM 1080 CA THR A 188 -7.936 -9.672 -0.480 1.00 0.00 C ATOM 1081 C THR A 188 -8.020 -11.148 -0.071 1.00 0.00 C ATOM 1082 O THR A 188 -9.076 -11.588 0.376 1.00 0.00 O ATOM 1083 CB THR A 188 -7.852 -9.397 -1.992 1.00 0.00 C ATOM 1084 OG1 THR A 188 -8.221 -8.049 -2.210 1.00 0.00 O ATOM 1085 CG2 THR A 188 -8.774 -10.277 -2.820 1.00 0.00 C ATOM 0 H THR A 188 -6.138 -8.658 -0.529 1.00 0.00 H new ATOM 0 HA THR A 188 -8.884 -9.254 -0.142 1.00 0.00 H new ATOM 0 HB THR A 188 -6.831 -9.613 -2.306 1.00 0.00 H new ATOM 0 HG1 THR A 188 -9.197 -7.966 -2.169 1.00 0.00 H new ATOM 0 HG21 THR A 188 -8.663 -10.029 -3.876 1.00 0.00 H new ATOM 0 HG22 THR A 188 -8.514 -11.324 -2.664 1.00 0.00 H new ATOM 0 HG23 THR A 188 -9.807 -10.110 -2.515 1.00 0.00 H new ATOM 1093 N VAL A 189 -6.908 -11.886 -0.100 1.00 0.00 N ATOM 1094 CA VAL A 189 -6.783 -13.349 -0.021 1.00 0.00 C ATOM 1095 C VAL A 189 -7.267 -14.009 1.277 1.00 0.00 C ATOM 1096 O VAL A 189 -7.138 -15.216 1.469 1.00 0.00 O ATOM 1097 CB VAL A 189 -5.313 -13.705 -0.367 1.00 0.00 C ATOM 1098 CG1 VAL A 189 -4.360 -13.779 0.837 1.00 0.00 C ATOM 1099 CG2 VAL A 189 -5.179 -14.961 -1.206 1.00 0.00 C ATOM 0 H VAL A 189 -5.994 -11.442 -0.186 1.00 0.00 H new ATOM 0 HA VAL A 189 -7.478 -13.775 -0.744 1.00 0.00 H new ATOM 0 HB VAL A 189 -4.997 -12.850 -0.965 1.00 0.00 H new ATOM 0 HG11 VAL A 189 -3.358 -14.034 0.493 1.00 0.00 H new ATOM 0 HG12 VAL A 189 -4.336 -12.813 1.342 1.00 0.00 H new ATOM 0 HG13 VAL A 189 -4.710 -14.543 1.532 1.00 0.00 H new ATOM 0 HG21 VAL A 189 -4.125 -15.151 -1.411 1.00 0.00 H new ATOM 0 HG22 VAL A 189 -5.602 -15.807 -0.664 1.00 0.00 H new ATOM 0 HG23 VAL A 189 -5.714 -14.829 -2.147 1.00 0.00 H new ATOM 1109 N THR A 190 -7.832 -13.219 2.170 1.00 0.00 N ATOM 1110 CA THR A 190 -8.262 -13.572 3.504 1.00 0.00 C ATOM 1111 C THR A 190 -9.574 -12.854 3.779 1.00 0.00 C ATOM 1112 O THR A 190 -10.581 -13.487 4.086 1.00 0.00 O ATOM 1113 CB THR A 190 -7.117 -13.292 4.489 1.00 0.00 C ATOM 1114 OG1 THR A 190 -7.482 -13.502 5.836 1.00 0.00 O ATOM 1115 CG2 THR A 190 -6.536 -11.879 4.437 1.00 0.00 C ATOM 0 H THR A 190 -8.015 -12.237 1.962 1.00 0.00 H new ATOM 0 HA THR A 190 -8.475 -14.634 3.623 1.00 0.00 H new ATOM 0 HB THR A 190 -6.366 -14.006 4.153 1.00 0.00 H new ATOM 0 HG1 THR A 190 -6.716 -13.311 6.416 1.00 0.00 H new ATOM 0 HG21 THR A 190 -5.735 -11.788 5.171 1.00 0.00 H new ATOM 0 HG22 THR A 190 -6.139 -11.685 3.441 1.00 0.00 H new ATOM 0 HG23 THR A 190 -7.319 -11.155 4.662 1.00 0.00 H new ATOM 1123 N THR A 191 -9.637 -11.545 3.550 1.00 0.00 N ATOM 1124 CA THR A 191 -10.847 -10.771 3.648 1.00 0.00 C ATOM 1125 C THR A 191 -11.923 -11.261 2.663 1.00 0.00 C ATOM 1126 O THR A 191 -13.105 -11.038 2.906 1.00 0.00 O ATOM 1127 CB THR A 191 -10.451 -9.323 3.467 1.00 0.00 C ATOM 1128 OG1 THR A 191 -9.202 -9.034 4.076 1.00 0.00 O ATOM 1129 CG2 THR A 191 -11.442 -8.346 4.059 1.00 0.00 C ATOM 0 H THR A 191 -8.823 -10.991 3.286 1.00 0.00 H new ATOM 0 HA THR A 191 -11.321 -10.891 4.622 1.00 0.00 H new ATOM 0 HB THR A 191 -10.408 -9.199 2.385 1.00 0.00 H new ATOM 0 HG1 THR A 191 -8.517 -8.926 3.383 1.00 0.00 H new ATOM 0 HG21 THR A 191 -11.093 -7.327 3.892 1.00 0.00 H new ATOM 0 HG22 THR A 191 -12.413 -8.480 3.583 1.00 0.00 H new ATOM 0 HG23 THR A 191 -11.535 -8.526 5.130 1.00 0.00 H new ATOM 1137 N THR A 192 -11.545 -12.022 1.630 1.00 0.00 N ATOM 1138 CA THR A 192 -12.415 -12.752 0.715 1.00 0.00 C ATOM 1139 C THR A 192 -13.464 -13.537 1.510 1.00 0.00 C ATOM 1140 O THR A 192 -14.663 -13.458 1.253 1.00 0.00 O ATOM 1141 CB THR A 192 -11.518 -13.599 -0.212 1.00 0.00 C ATOM 1142 OG1 THR A 192 -12.203 -14.179 -1.295 1.00 0.00 O ATOM 1143 CG2 THR A 192 -10.756 -14.705 0.511 1.00 0.00 C ATOM 0 H THR A 192 -10.559 -12.149 1.400 1.00 0.00 H new ATOM 0 HA THR A 192 -12.997 -12.091 0.072 1.00 0.00 H new ATOM 0 HB THR A 192 -10.808 -12.864 -0.592 1.00 0.00 H new ATOM 0 HG1 THR A 192 -11.575 -14.698 -1.839 1.00 0.00 H new ATOM 0 HG21 THR A 192 -10.148 -15.257 -0.206 1.00 0.00 H new ATOM 0 HG22 THR A 192 -10.111 -14.265 1.271 1.00 0.00 H new ATOM 0 HG23 THR A 192 -11.464 -15.385 0.985 1.00 0.00 H new ATOM 1151 N THR A 193 -13.013 -14.196 2.572 1.00 0.00 N ATOM 1152 CA THR A 193 -13.724 -15.144 3.391 1.00 0.00 C ATOM 1153 C THR A 193 -14.484 -14.401 4.486 1.00 0.00 C ATOM 1154 O THR A 193 -15.270 -14.991 5.227 1.00 0.00 O ATOM 1155 CB THR A 193 -12.626 -16.087 3.908 1.00 0.00 C ATOM 1156 OG1 THR A 193 -13.005 -17.429 3.726 1.00 0.00 O ATOM 1157 CG2 THR A 193 -12.232 -15.850 5.357 1.00 0.00 C ATOM 0 H THR A 193 -12.057 -14.062 2.902 1.00 0.00 H new ATOM 0 HA THR A 193 -14.489 -15.717 2.868 1.00 0.00 H new ATOM 0 HB THR A 193 -11.741 -15.861 3.313 1.00 0.00 H new ATOM 0 HG1 THR A 193 -12.295 -18.017 4.058 1.00 0.00 H new ATOM 0 HG21 THR A 193 -11.453 -16.557 5.642 1.00 0.00 H new ATOM 0 HG22 THR A 193 -11.859 -14.832 5.471 1.00 0.00 H new ATOM 0 HG23 THR A 193 -13.102 -15.991 5.998 1.00 0.00 H new ATOM 1165 N LYS A 194 -14.203 -13.103 4.629 1.00 0.00 N ATOM 1166 CA LYS A 194 -14.928 -12.195 5.477 1.00 0.00 C ATOM 1167 C LYS A 194 -16.059 -11.529 4.685 1.00 0.00 C ATOM 1168 O LYS A 194 -16.797 -10.722 5.245 1.00 0.00 O ATOM 1169 CB LYS A 194 -13.972 -11.163 6.100 1.00 0.00 C ATOM 1170 CG LYS A 194 -12.754 -11.851 6.740 1.00 0.00 C ATOM 1171 CD LYS A 194 -11.842 -10.834 7.434 1.00 0.00 C ATOM 1172 CE LYS A 194 -10.568 -11.463 8.012 1.00 0.00 C ATOM 1173 NZ LYS A 194 -10.723 -11.924 9.407 1.00 0.00 N ATOM 0 H LYS A 194 -13.433 -12.654 4.133 1.00 0.00 H new ATOM 0 HA LYS A 194 -15.382 -12.750 6.298 1.00 0.00 H new ATOM 0 HB2 LYS A 194 -13.637 -10.464 5.334 1.00 0.00 H new ATOM 0 HB3 LYS A 194 -14.502 -10.580 6.854 1.00 0.00 H new ATOM 0 HG2 LYS A 194 -13.091 -12.593 7.463 1.00 0.00 H new ATOM 0 HG3 LYS A 194 -12.191 -12.385 5.974 1.00 0.00 H new ATOM 0 HD2 LYS A 194 -11.565 -10.057 6.721 1.00 0.00 H new ATOM 0 HD3 LYS A 194 -12.396 -10.347 8.237 1.00 0.00 H new ATOM 0 HE2 LYS A 194 -10.273 -12.307 7.389 1.00 0.00 H new ATOM 0 HE3 LYS A 194 -9.759 -10.735 7.966 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 -9.828 -12.338 9.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 -10.976 -11.118 10.013 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 -11.474 -12.641 9.454 1.00 0.00 H new ATOM 1187 N GLY A 195 -16.156 -11.808 3.381 1.00 0.00 N ATOM 1188 CA GLY A 195 -17.162 -11.286 2.463 1.00 0.00 C ATOM 1189 C GLY A 195 -16.642 -10.134 1.615 1.00 0.00 C ATOM 1190 O GLY A 195 -17.345 -9.659 0.728 1.00 0.00 O ATOM 0 H GLY A 195 -15.499 -12.436 2.918 1.00 0.00 H new ATOM 0 HA2 GLY A 195 -17.502 -12.089 1.809 1.00 0.00 H new ATOM 0 HA3 GLY A 195 -18.028 -10.950 3.033 1.00 0.00 H new ATOM 1194 N GLU A 196 -15.407 -9.718 1.862 1.00 0.00 N ATOM 1195 CA GLU A 196 -14.628 -8.663 1.232 1.00 0.00 C ATOM 1196 C GLU A 196 -15.263 -7.276 1.087 1.00 0.00 C ATOM 1197 O GLU A 196 -14.717 -6.322 1.639 1.00 0.00 O ATOM 1198 CB GLU A 196 -13.999 -9.150 -0.080 1.00 0.00 C ATOM 1199 CG GLU A 196 -12.529 -8.754 0.003 1.00 0.00 C ATOM 1200 CD GLU A 196 -11.733 -8.931 -1.278 1.00 0.00 C ATOM 1201 OE1 GLU A 196 -12.084 -9.781 -2.126 1.00 0.00 O ATOM 1202 OE2 GLU A 196 -10.697 -8.232 -1.346 1.00 0.00 O ATOM 0 H GLU A 196 -14.863 -10.168 2.598 1.00 0.00 H new ATOM 0 HA GLU A 196 -13.854 -8.466 1.973 1.00 0.00 H new ATOM 0 HB2 GLU A 196 -14.109 -10.229 -0.192 1.00 0.00 H new ATOM 0 HB3 GLU A 196 -14.482 -8.689 -0.942 1.00 0.00 H new ATOM 0 HG2 GLU A 196 -12.468 -7.709 0.307 1.00 0.00 H new ATOM 0 HG3 GLU A 196 -12.056 -9.342 0.789 1.00 0.00 H new ATOM 1209 N ASN A 197 -16.364 -7.136 0.342 1.00 0.00 N ATOM 1210 CA ASN A 197 -17.121 -5.898 0.072 1.00 0.00 C ATOM 1211 C ASN A 197 -16.377 -4.820 -0.698 1.00 0.00 C ATOM 1212 O ASN A 197 -16.802 -3.672 -0.807 1.00 0.00 O ATOM 1213 CB ASN A 197 -17.710 -5.334 1.367 1.00 0.00 C ATOM 1214 CG ASN A 197 -19.037 -5.994 1.673 1.00 0.00 C ATOM 1215 OD1 ASN A 197 -20.086 -5.372 1.533 1.00 0.00 O ATOM 1216 ND2 ASN A 197 -19.030 -7.254 2.061 1.00 0.00 N ATOM 0 H ASN A 197 -16.784 -7.940 -0.124 1.00 0.00 H new ATOM 0 HA ASN A 197 -17.919 -6.207 -0.603 1.00 0.00 H new ATOM 0 HB2 ASN A 197 -17.016 -5.498 2.191 1.00 0.00 H new ATOM 0 HB3 ASN A 197 -17.845 -4.256 1.274 1.00 0.00 H new ATOM 0 HD21 ASN A 197 -19.910 -7.734 2.252 1.00 0.00 H new ATOM 0 HD22 ASN A 197 -18.145 -7.749 2.170 1.00 0.00 H new ATOM 1223 N PHE A 198 -15.262 -5.224 -1.242 1.00 0.00 N ATOM 1224 CA PHE A 198 -14.349 -4.435 -2.023 1.00 0.00 C ATOM 1225 C PHE A 198 -14.754 -4.498 -3.489 1.00 0.00 C ATOM 1226 O PHE A 198 -14.618 -5.524 -4.156 1.00 0.00 O ATOM 1227 CB PHE A 198 -12.944 -4.948 -1.711 1.00 0.00 C ATOM 1228 CG PHE A 198 -12.302 -4.419 -0.437 1.00 0.00 C ATOM 1229 CD1 PHE A 198 -12.778 -3.279 0.257 1.00 0.00 C ATOM 1230 CD2 PHE A 198 -11.127 -5.048 0.012 1.00 0.00 C ATOM 1231 CE1 PHE A 198 -12.076 -2.764 1.359 1.00 0.00 C ATOM 1232 CE2 PHE A 198 -10.456 -4.544 1.142 1.00 0.00 C ATOM 1233 CZ PHE A 198 -10.911 -3.399 1.808 1.00 0.00 C ATOM 0 H PHE A 198 -14.944 -6.188 -1.143 1.00 0.00 H new ATOM 0 HA PHE A 198 -14.370 -3.374 -1.776 1.00 0.00 H new ATOM 0 HB2 PHE A 198 -12.983 -6.036 -1.649 1.00 0.00 H new ATOM 0 HB3 PHE A 198 -12.295 -4.700 -2.550 1.00 0.00 H new ATOM 0 HD1 PHE A 198 -13.691 -2.801 -0.065 1.00 0.00 H new ATOM 0 HD2 PHE A 198 -10.742 -5.913 -0.507 1.00 0.00 H new ATOM 0 HE1 PHE A 198 -12.435 -1.877 1.861 1.00 0.00 H new ATOM 0 HE2 PHE A 198 -9.573 -5.050 1.503 1.00 0.00 H new ATOM 0 HZ PHE A 198 -10.370 -3.010 2.658 1.00 0.00 H new ATOM 1243 N THR A 199 -15.273 -3.374 -3.963 1.00 0.00 N ATOM 1244 CA THR A 199 -15.503 -3.027 -5.351 1.00 0.00 C ATOM 1245 C THR A 199 -14.171 -2.586 -5.955 1.00 0.00 C ATOM 1246 O THR A 199 -13.265 -2.158 -5.240 1.00 0.00 O ATOM 1247 CB THR A 199 -16.494 -1.842 -5.362 1.00 0.00 C ATOM 1248 OG1 THR A 199 -16.256 -0.989 -4.256 1.00 0.00 O ATOM 1249 CG2 THR A 199 -17.936 -2.334 -5.244 1.00 0.00 C ATOM 0 H THR A 199 -15.566 -2.626 -3.335 1.00 0.00 H new ATOM 0 HA THR A 199 -15.903 -3.865 -5.921 1.00 0.00 H new ATOM 0 HB THR A 199 -16.348 -1.312 -6.303 1.00 0.00 H new ATOM 0 HG1 THR A 199 -16.890 -0.242 -4.277 1.00 0.00 H new ATOM 0 HG21 THR A 199 -18.614 -1.480 -5.254 1.00 0.00 H new ATOM 0 HG22 THR A 199 -18.166 -2.990 -6.083 1.00 0.00 H new ATOM 0 HG23 THR A 199 -18.058 -2.883 -4.310 1.00 0.00 H new ATOM 1257 N GLU A 200 -14.060 -2.596 -7.280 1.00 0.00 N ATOM 1258 CA GLU A 200 -12.917 -2.148 -8.014 1.00 0.00 C ATOM 1259 C GLU A 200 -12.656 -0.659 -7.785 1.00 0.00 C ATOM 1260 O GLU A 200 -11.521 -0.213 -7.885 1.00 0.00 O ATOM 1261 CB GLU A 200 -13.209 -2.425 -9.490 1.00 0.00 C ATOM 1262 CG GLU A 200 -11.890 -2.581 -10.231 1.00 0.00 C ATOM 1263 CD GLU A 200 -11.448 -4.035 -10.363 1.00 0.00 C ATOM 1264 OE1 GLU A 200 -11.973 -4.714 -11.270 1.00 0.00 O ATOM 1265 OE2 GLU A 200 -10.550 -4.495 -9.619 1.00 0.00 O ATOM 0 H GLU A 200 -14.808 -2.936 -7.884 1.00 0.00 H new ATOM 0 HA GLU A 200 -12.021 -2.673 -7.684 1.00 0.00 H new ATOM 0 HB2 GLU A 200 -13.809 -3.330 -9.593 1.00 0.00 H new ATOM 0 HB3 GLU A 200 -13.789 -1.608 -9.920 1.00 0.00 H new ATOM 0 HG2 GLU A 200 -11.984 -2.144 -11.225 1.00 0.00 H new ATOM 0 HG3 GLU A 200 -11.117 -2.018 -9.708 1.00 0.00 H new ATOM 1272 N THR A 201 -13.688 0.126 -7.488 1.00 0.00 N ATOM 1273 CA THR A 201 -13.525 1.524 -7.118 1.00 0.00 C ATOM 1274 C THR A 201 -12.900 1.667 -5.721 1.00 0.00 C ATOM 1275 O THR A 201 -12.127 2.601 -5.501 1.00 0.00 O ATOM 1276 CB THR A 201 -14.878 2.225 -7.281 1.00 0.00 C ATOM 1277 OG1 THR A 201 -15.114 2.334 -8.677 1.00 0.00 O ATOM 1278 CG2 THR A 201 -14.946 3.602 -6.625 1.00 0.00 C ATOM 0 H THR A 201 -14.658 -0.191 -7.498 1.00 0.00 H new ATOM 0 HA THR A 201 -12.815 2.019 -7.780 1.00 0.00 H new ATOM 0 HB THR A 201 -15.640 1.634 -6.774 1.00 0.00 H new ATOM 0 HG1 THR A 201 -15.975 2.777 -8.830 1.00 0.00 H new ATOM 0 HG21 THR A 201 -15.935 4.033 -6.785 1.00 0.00 H new ATOM 0 HG22 THR A 201 -14.761 3.505 -5.555 1.00 0.00 H new ATOM 0 HG23 THR A 201 -14.191 4.253 -7.066 1.00 0.00 H new ATOM 1286 N ASP A 202 -13.174 0.751 -4.789 1.00 0.00 N ATOM 1287 CA ASP A 202 -12.597 0.842 -3.443 1.00 0.00 C ATOM 1288 C ASP A 202 -11.167 0.303 -3.499 1.00 0.00 C ATOM 1289 O ASP A 202 -10.234 0.971 -3.052 1.00 0.00 O ATOM 1290 CB ASP A 202 -13.481 0.148 -2.386 1.00 0.00 C ATOM 1291 CG ASP A 202 -14.634 1.042 -1.881 1.00 0.00 C ATOM 1292 OD1 ASP A 202 -15.297 1.726 -2.703 1.00 0.00 O ATOM 1293 OD2 ASP A 202 -14.929 1.033 -0.664 1.00 0.00 O ATOM 0 H ASP A 202 -13.784 -0.053 -4.937 1.00 0.00 H new ATOM 0 HA ASP A 202 -12.560 1.882 -3.119 1.00 0.00 H new ATOM 0 HB2 ASP A 202 -13.897 -0.765 -2.811 1.00 0.00 H new ATOM 0 HB3 ASP A 202 -12.861 -0.148 -1.540 1.00 0.00 H new ATOM 1298 N ILE A 203 -10.966 -0.822 -4.194 1.00 0.00 N ATOM 1299 CA ILE A 203 -9.661 -1.347 -4.589 1.00 0.00 C ATOM 1300 C ILE A 203 -8.844 -0.253 -5.289 1.00 0.00 C ATOM 1301 O ILE A 203 -7.657 -0.120 -5.002 1.00 0.00 O ATOM 1302 CB ILE A 203 -9.869 -2.608 -5.465 1.00 0.00 C ATOM 1303 CG1 ILE A 203 -10.416 -3.811 -4.656 1.00 0.00 C ATOM 1304 CG2 ILE A 203 -8.624 -3.026 -6.266 1.00 0.00 C ATOM 1305 CD1 ILE A 203 -9.358 -4.539 -3.812 1.00 0.00 C ATOM 0 H ILE A 203 -11.738 -1.411 -4.507 1.00 0.00 H new ATOM 0 HA ILE A 203 -9.085 -1.648 -3.714 1.00 0.00 H new ATOM 0 HB ILE A 203 -10.625 -2.308 -6.191 1.00 0.00 H new ATOM 0 HG12 ILE A 203 -11.211 -3.460 -3.998 1.00 0.00 H new ATOM 0 HG13 ILE A 203 -10.866 -4.524 -5.347 1.00 0.00 H new ATOM 0 HG21 ILE A 203 -8.851 -3.916 -6.853 1.00 0.00 H new ATOM 0 HG22 ILE A 203 -8.332 -2.216 -6.934 1.00 0.00 H new ATOM 0 HG23 ILE A 203 -7.806 -3.243 -5.579 1.00 0.00 H new ATOM 0 HD11 ILE A 203 -9.825 -5.367 -3.278 1.00 0.00 H new ATOM 0 HD12 ILE A 203 -8.574 -4.924 -4.464 1.00 0.00 H new ATOM 0 HD13 ILE A 203 -8.924 -3.843 -3.094 1.00 0.00 H new ATOM 1317 N LYS A 204 -9.450 0.577 -6.148 1.00 0.00 N ATOM 1318 CA LYS A 204 -8.756 1.685 -6.803 1.00 0.00 C ATOM 1319 C LYS A 204 -8.246 2.662 -5.769 1.00 0.00 C ATOM 1320 O LYS A 204 -7.078 3.040 -5.853 1.00 0.00 O ATOM 1321 CB LYS A 204 -9.665 2.446 -7.774 1.00 0.00 C ATOM 1322 CG LYS A 204 -9.524 1.974 -9.220 1.00 0.00 C ATOM 1323 CD LYS A 204 -10.566 2.676 -10.095 1.00 0.00 C ATOM 1324 CE LYS A 204 -10.221 4.131 -10.423 1.00 0.00 C ATOM 1325 NZ LYS A 204 -11.397 4.842 -10.966 1.00 0.00 N ATOM 0 H LYS A 204 -10.434 0.497 -6.406 1.00 0.00 H new ATOM 0 HA LYS A 204 -7.931 1.249 -7.366 1.00 0.00 H new ATOM 0 HB2 LYS A 204 -10.702 2.329 -7.459 1.00 0.00 H new ATOM 0 HB3 LYS A 204 -9.434 3.510 -7.721 1.00 0.00 H new ATOM 0 HG2 LYS A 204 -8.521 2.191 -9.587 1.00 0.00 H new ATOM 0 HG3 LYS A 204 -9.657 0.894 -9.275 1.00 0.00 H new ATOM 0 HD2 LYS A 204 -10.678 2.121 -11.026 1.00 0.00 H new ATOM 0 HD3 LYS A 204 -11.531 2.647 -9.588 1.00 0.00 H new ATOM 0 HE2 LYS A 204 -9.868 4.637 -9.524 1.00 0.00 H new ATOM 0 HE3 LYS A 204 -9.406 4.162 -11.147 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 -11.139 5.826 -11.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 -11.717 4.370 -11.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 -12.164 4.831 -10.264 1.00 0.00 H new ATOM 1339 N MET A 205 -9.105 3.120 -4.848 1.00 0.00 N ATOM 1340 CA MET A 205 -8.667 4.021 -3.790 1.00 0.00 C ATOM 1341 C MET A 205 -7.555 3.384 -2.956 1.00 0.00 C ATOM 1342 O MET A 205 -6.676 4.102 -2.478 1.00 0.00 O ATOM 1343 CB MET A 205 -9.826 4.490 -2.891 1.00 0.00 C ATOM 1344 CG MET A 205 -10.915 5.238 -3.665 1.00 0.00 C ATOM 1345 SD MET A 205 -12.310 5.925 -2.721 1.00 0.00 S ATOM 1346 CE MET A 205 -13.047 7.049 -3.954 1.00 0.00 C ATOM 0 H MET A 205 -10.096 2.881 -4.819 1.00 0.00 H new ATOM 0 HA MET A 205 -8.270 4.910 -4.281 1.00 0.00 H new ATOM 0 HB2 MET A 205 -10.268 3.625 -2.396 1.00 0.00 H new ATOM 0 HB3 MET A 205 -9.433 5.139 -2.108 1.00 0.00 H new ATOM 0 HG2 MET A 205 -10.440 6.058 -4.204 1.00 0.00 H new ATOM 0 HG3 MET A 205 -11.321 4.558 -4.414 1.00 0.00 H new ATOM 0 HE1 MET A 205 -14.110 7.169 -3.747 1.00 0.00 H new ATOM 0 HE2 MET A 205 -12.555 8.020 -3.901 1.00 0.00 H new ATOM 0 HE3 MET A 205 -12.917 6.630 -4.952 1.00 0.00 H new ATOM 1356 N MET A 206 -7.548 2.058 -2.794 1.00 0.00 N ATOM 1357 CA MET A 206 -6.449 1.372 -2.141 1.00 0.00 C ATOM 1358 C MET A 206 -5.182 1.440 -2.988 1.00 0.00 C ATOM 1359 O MET A 206 -4.157 1.877 -2.482 1.00 0.00 O ATOM 1360 CB MET A 206 -6.790 -0.091 -1.824 1.00 0.00 C ATOM 1361 CG MET A 206 -6.104 -0.528 -0.522 1.00 0.00 C ATOM 1362 SD MET A 206 -5.507 -2.218 -0.405 1.00 0.00 S ATOM 1363 CE MET A 206 -6.988 -3.026 -1.036 1.00 0.00 C ATOM 0 H MET A 206 -8.298 1.443 -3.110 1.00 0.00 H new ATOM 0 HA MET A 206 -6.273 1.887 -1.197 1.00 0.00 H new ATOM 0 HB2 MET A 206 -7.870 -0.208 -1.731 1.00 0.00 H new ATOM 0 HB3 MET A 206 -6.469 -0.732 -2.645 1.00 0.00 H new ATOM 0 HG2 MET A 206 -5.257 0.137 -0.352 1.00 0.00 H new ATOM 0 HG3 MET A 206 -6.806 -0.365 0.296 1.00 0.00 H new ATOM 0 HE1 MET A 206 -6.999 -4.068 -0.715 1.00 0.00 H new ATOM 0 HE2 MET A 206 -7.872 -2.518 -0.650 1.00 0.00 H new ATOM 0 HE3 MET A 206 -6.991 -2.982 -2.125 1.00 0.00 H new ATOM 1373 N GLU A 207 -5.198 1.016 -4.250 1.00 0.00 N ATOM 1374 CA GLU A 207 -3.991 0.997 -5.071 1.00 0.00 C ATOM 1375 C GLU A 207 -3.379 2.396 -5.192 1.00 0.00 C ATOM 1376 O GLU A 207 -2.165 2.543 -5.048 1.00 0.00 O ATOM 1377 CB GLU A 207 -4.275 0.385 -6.446 1.00 0.00 C ATOM 1378 CG GLU A 207 -4.451 -1.134 -6.344 1.00 0.00 C ATOM 1379 CD GLU A 207 -4.405 -1.822 -7.716 1.00 0.00 C ATOM 1380 OE1 GLU A 207 -5.122 -1.369 -8.640 1.00 0.00 O ATOM 1381 OE2 GLU A 207 -3.637 -2.791 -7.895 1.00 0.00 O ATOM 0 H GLU A 207 -6.035 0.681 -4.726 1.00 0.00 H new ATOM 0 HA GLU A 207 -3.256 0.365 -4.574 1.00 0.00 H new ATOM 0 HB2 GLU A 207 -5.175 0.832 -6.868 1.00 0.00 H new ATOM 0 HB3 GLU A 207 -3.456 0.615 -7.127 1.00 0.00 H new ATOM 0 HG2 GLU A 207 -3.668 -1.546 -5.708 1.00 0.00 H new ATOM 0 HG3 GLU A 207 -5.403 -1.355 -5.861 1.00 0.00 H new ATOM 1388 N ARG A 208 -4.219 3.430 -5.340 1.00 0.00 N ATOM 1389 CA ARG A 208 -3.836 4.837 -5.365 1.00 0.00 C ATOM 1390 C ARG A 208 -2.900 5.205 -4.224 1.00 0.00 C ATOM 1391 O ARG A 208 -2.025 6.054 -4.388 1.00 0.00 O ATOM 1392 CB ARG A 208 -5.105 5.689 -5.219 1.00 0.00 C ATOM 1393 CG ARG A 208 -4.993 7.019 -5.944 1.00 0.00 C ATOM 1394 CD ARG A 208 -5.543 6.899 -7.364 1.00 0.00 C ATOM 1395 NE ARG A 208 -5.944 8.220 -7.846 1.00 0.00 N ATOM 1396 CZ ARG A 208 -7.036 8.520 -8.561 1.00 0.00 C ATOM 1397 NH1 ARG A 208 -7.836 7.566 -9.034 1.00 0.00 N ATOM 1398 NH2 ARG A 208 -7.349 9.794 -8.770 1.00 0.00 N ATOM 0 H ARG A 208 -5.224 3.297 -5.450 1.00 0.00 H new ATOM 0 HA ARG A 208 -3.319 5.020 -6.307 1.00 0.00 H new ATOM 0 HB2 ARG A 208 -5.959 5.135 -5.610 1.00 0.00 H new ATOM 0 HB3 ARG A 208 -5.299 5.869 -4.162 1.00 0.00 H new ATOM 0 HG2 ARG A 208 -5.543 7.786 -5.398 1.00 0.00 H new ATOM 0 HG3 ARG A 208 -3.951 7.336 -5.976 1.00 0.00 H new ATOM 0 HD2 ARG A 208 -4.786 6.474 -8.024 1.00 0.00 H new ATOM 0 HD3 ARG A 208 -6.396 6.221 -7.379 1.00 0.00 H new ATOM 0 HE ARG A 208 -5.325 8.997 -7.613 1.00 0.00 H new ATOM 0 HH11 ARG A 208 -7.622 6.585 -8.854 1.00 0.00 H new ATOM 0 HH12 ARG A 208 -8.663 7.816 -9.576 1.00 0.00 H new ATOM 0 HH21 ARG A 208 -6.760 10.533 -8.387 1.00 0.00 H new ATOM 0 HH22 ARG A 208 -8.179 10.033 -9.313 1.00 0.00 H new ATOM 1412 N VAL A 209 -3.154 4.629 -3.051 1.00 0.00 N ATOM 1413 CA VAL A 209 -2.627 5.095 -1.788 1.00 0.00 C ATOM 1414 C VAL A 209 -1.532 4.156 -1.302 1.00 0.00 C ATOM 1415 O VAL A 209 -0.514 4.612 -0.781 1.00 0.00 O ATOM 1416 CB VAL A 209 -3.831 5.296 -0.846 1.00 0.00 C ATOM 1417 CG1 VAL A 209 -4.248 4.081 -0.032 1.00 0.00 C ATOM 1418 CG2 VAL A 209 -3.558 6.416 0.147 1.00 0.00 C ATOM 0 H VAL A 209 -3.748 3.805 -2.960 1.00 0.00 H new ATOM 0 HA VAL A 209 -2.120 6.058 -1.855 1.00 0.00 H new ATOM 0 HB VAL A 209 -4.647 5.526 -1.532 1.00 0.00 H new ATOM 0 HG11 VAL A 209 -5.103 4.338 0.593 1.00 0.00 H new ATOM 0 HG12 VAL A 209 -4.522 3.269 -0.705 1.00 0.00 H new ATOM 0 HG13 VAL A 209 -3.418 3.764 0.600 1.00 0.00 H new ATOM 0 HG21 VAL A 209 -4.421 6.540 0.802 1.00 0.00 H new ATOM 0 HG22 VAL A 209 -2.682 6.166 0.745 1.00 0.00 H new ATOM 0 HG23 VAL A 209 -3.376 7.345 -0.393 1.00 0.00 H new ATOM 1428 N VAL A 210 -1.703 2.855 -1.541 1.00 0.00 N ATOM 1429 CA VAL A 210 -0.686 1.835 -1.320 1.00 0.00 C ATOM 1430 C VAL A 210 0.561 2.177 -2.148 1.00 0.00 C ATOM 1431 O VAL A 210 1.665 1.993 -1.640 1.00 0.00 O ATOM 1432 CB VAL A 210 -1.282 0.432 -1.597 1.00 0.00 C ATOM 1433 CG1 VAL A 210 -0.232 -0.682 -1.523 1.00 0.00 C ATOM 1434 CG2 VAL A 210 -2.333 0.096 -0.519 1.00 0.00 C ATOM 0 H VAL A 210 -2.578 2.475 -1.903 1.00 0.00 H new ATOM 0 HA VAL A 210 -0.362 1.815 -0.279 1.00 0.00 H new ATOM 0 HB VAL A 210 -1.703 0.474 -2.601 1.00 0.00 H new ATOM 0 HG11 VAL A 210 -0.706 -1.643 -1.725 1.00 0.00 H new ATOM 0 HG12 VAL A 210 0.546 -0.498 -2.264 1.00 0.00 H new ATOM 0 HG13 VAL A 210 0.211 -0.699 -0.527 1.00 0.00 H new ATOM 0 HG21 VAL A 210 -2.752 -0.891 -0.714 1.00 0.00 H new ATOM 0 HG22 VAL A 210 -1.861 0.102 0.464 1.00 0.00 H new ATOM 0 HG23 VAL A 210 -3.130 0.840 -0.543 1.00 0.00 H new ATOM 1444 N GLU A 211 0.395 2.758 -3.344 1.00 0.00 N ATOM 1445 CA GLU A 211 1.458 3.374 -4.134 1.00 0.00 C ATOM 1446 C GLU A 211 2.317 4.272 -3.238 1.00 0.00 C ATOM 1447 O GLU A 211 3.503 4.010 -3.031 1.00 0.00 O ATOM 1448 CB GLU A 211 0.815 4.148 -5.304 1.00 0.00 C ATOM 1449 CG GLU A 211 1.768 5.095 -6.053 1.00 0.00 C ATOM 1450 CD GLU A 211 1.029 5.942 -7.094 1.00 0.00 C ATOM 1451 OE1 GLU A 211 0.660 5.412 -8.164 1.00 0.00 O ATOM 1452 OE2 GLU A 211 0.810 7.153 -6.836 1.00 0.00 O ATOM 0 H GLU A 211 -0.516 2.811 -3.799 1.00 0.00 H new ATOM 0 HA GLU A 211 2.122 2.617 -4.552 1.00 0.00 H new ATOM 0 HB2 GLU A 211 0.406 3.430 -6.015 1.00 0.00 H new ATOM 0 HB3 GLU A 211 -0.024 4.729 -4.920 1.00 0.00 H new ATOM 0 HG2 GLU A 211 2.265 5.751 -5.338 1.00 0.00 H new ATOM 0 HG3 GLU A 211 2.546 4.512 -6.545 1.00 0.00 H new ATOM 1459 N GLN A 212 1.714 5.328 -2.683 1.00 0.00 N ATOM 1460 CA GLN A 212 2.432 6.373 -1.976 1.00 0.00 C ATOM 1461 C GLN A 212 3.084 5.822 -0.718 1.00 0.00 C ATOM 1462 O GLN A 212 4.235 6.152 -0.444 1.00 0.00 O ATOM 1463 CB GLN A 212 1.465 7.502 -1.618 1.00 0.00 C ATOM 1464 CG GLN A 212 0.825 8.184 -2.799 1.00 0.00 C ATOM 1465 CD GLN A 212 1.812 9.018 -3.550 1.00 0.00 C ATOM 1466 OE1 GLN A 212 2.561 9.815 -2.994 1.00 0.00 O ATOM 1467 NE2 GLN A 212 1.848 8.839 -4.838 1.00 0.00 N ATOM 0 H GLN A 212 0.705 5.475 -2.717 1.00 0.00 H new ATOM 0 HA GLN A 212 3.219 6.760 -2.623 1.00 0.00 H new ATOM 0 HB2 GLN A 212 0.679 7.099 -0.979 1.00 0.00 H new ATOM 0 HB3 GLN A 212 2.001 8.248 -1.032 1.00 0.00 H new ATOM 0 HG2 GLN A 212 0.398 7.435 -3.466 1.00 0.00 H new ATOM 0 HG3 GLN A 212 0.002 8.812 -2.456 1.00 0.00 H new ATOM 0 HE21 GLN A 212 1.215 8.171 -5.278 1.00 0.00 H new ATOM 0 HE22 GLN A 212 2.509 9.367 -5.408 1.00 0.00 H new ATOM 1476 N MET A 213 2.375 4.995 0.054 1.00 0.00 N ATOM 1477 CA MET A 213 2.914 4.335 1.227 1.00 0.00 C ATOM 1478 C MET A 213 4.145 3.509 0.871 1.00 0.00 C ATOM 1479 O MET A 213 5.136 3.599 1.590 1.00 0.00 O ATOM 1480 CB MET A 213 1.819 3.442 1.847 1.00 0.00 C ATOM 1481 CG MET A 213 0.618 4.261 2.348 1.00 0.00 C ATOM 1482 SD MET A 213 -0.500 3.506 3.568 1.00 0.00 S ATOM 1483 CE MET A 213 -0.429 1.740 3.191 1.00 0.00 C ATOM 0 H MET A 213 1.397 4.767 -0.128 1.00 0.00 H new ATOM 0 HA MET A 213 3.224 5.088 1.952 1.00 0.00 H new ATOM 0 HB2 MET A 213 1.480 2.718 1.106 1.00 0.00 H new ATOM 0 HB3 MET A 213 2.241 2.875 2.676 1.00 0.00 H new ATOM 0 HG2 MET A 213 1.004 5.185 2.779 1.00 0.00 H new ATOM 0 HG3 MET A 213 0.021 4.539 1.479 1.00 0.00 H new ATOM 0 HE1 MET A 213 -1.313 1.246 3.594 1.00 0.00 H new ATOM 0 HE2 MET A 213 -0.395 1.600 2.111 1.00 0.00 H new ATOM 0 HE3 MET A 213 0.465 1.308 3.641 1.00 0.00 H new ATOM 1493 N CYS A 214 4.116 2.737 -0.218 1.00 0.00 N ATOM 1494 CA CYS A 214 5.275 1.958 -0.619 1.00 0.00 C ATOM 1495 C CYS A 214 6.424 2.849 -1.076 1.00 0.00 C ATOM 1496 O CYS A 214 7.551 2.648 -0.622 1.00 0.00 O ATOM 1497 CB CYS A 214 4.915 0.870 -1.637 1.00 0.00 C ATOM 1498 SG CYS A 214 5.307 -0.735 -0.889 1.00 0.00 S ATOM 0 H CYS A 214 3.306 2.639 -0.830 1.00 0.00 H new ATOM 0 HA CYS A 214 5.633 1.430 0.265 1.00 0.00 H new ATOM 0 HB2 CYS A 214 3.858 0.923 -1.896 1.00 0.00 H new ATOM 0 HB3 CYS A 214 5.477 1.009 -2.561 1.00 0.00 H new ATOM 1503 N ILE A 215 6.153 3.863 -1.901 1.00 0.00 N ATOM 1504 CA ILE A 215 7.160 4.843 -2.300 1.00 0.00 C ATOM 1505 C ILE A 215 7.803 5.412 -1.024 1.00 0.00 C ATOM 1506 O ILE A 215 9.024 5.396 -0.895 1.00 0.00 O ATOM 1507 CB ILE A 215 6.538 5.929 -3.207 1.00 0.00 C ATOM 1508 CG1 ILE A 215 6.037 5.353 -4.547 1.00 0.00 C ATOM 1509 CG2 ILE A 215 7.577 7.005 -3.542 1.00 0.00 C ATOM 1510 CD1 ILE A 215 5.074 6.287 -5.277 1.00 0.00 C ATOM 0 H ILE A 215 5.232 4.026 -2.309 1.00 0.00 H new ATOM 0 HA ILE A 215 7.942 4.377 -2.899 1.00 0.00 H new ATOM 0 HB ILE A 215 5.698 6.345 -2.650 1.00 0.00 H new ATOM 0 HG12 ILE A 215 6.893 5.148 -5.190 1.00 0.00 H new ATOM 0 HG13 ILE A 215 5.541 4.400 -4.363 1.00 0.00 H new ATOM 0 HG21 ILE A 215 7.123 7.762 -4.181 1.00 0.00 H new ATOM 0 HG22 ILE A 215 7.929 7.471 -2.621 1.00 0.00 H new ATOM 0 HG23 ILE A 215 8.419 6.548 -4.062 1.00 0.00 H new ATOM 0 HD11 ILE A 215 4.758 5.825 -6.212 1.00 0.00 H new ATOM 0 HD12 ILE A 215 4.202 6.472 -4.650 1.00 0.00 H new ATOM 0 HD13 ILE A 215 5.575 7.231 -5.490 1.00 0.00 H new ATOM 1522 N THR A 216 6.986 5.873 -0.073 1.00 0.00 N ATOM 1523 CA THR A 216 7.410 6.461 1.192 1.00 0.00 C ATOM 1524 C THR A 216 8.265 5.474 1.994 1.00 0.00 C ATOM 1525 O THR A 216 9.332 5.859 2.468 1.00 0.00 O ATOM 1526 CB THR A 216 6.171 6.935 1.991 1.00 0.00 C ATOM 1527 OG1 THR A 216 5.369 7.836 1.251 1.00 0.00 O ATOM 1528 CG2 THR A 216 6.627 7.703 3.233 1.00 0.00 C ATOM 0 H THR A 216 5.971 5.844 -0.171 1.00 0.00 H new ATOM 0 HA THR A 216 8.035 7.331 0.991 1.00 0.00 H new ATOM 0 HB THR A 216 5.599 6.040 2.235 1.00 0.00 H new ATOM 0 HG1 THR A 216 4.839 7.338 0.594 1.00 0.00 H new ATOM 0 HG21 THR A 216 5.755 8.037 3.795 1.00 0.00 H new ATOM 0 HG22 THR A 216 7.236 7.052 3.860 1.00 0.00 H new ATOM 0 HG23 THR A 216 7.216 8.569 2.930 1.00 0.00 H new ATOM 1536 N GLN A 217 7.840 4.215 2.142 1.00 0.00 N ATOM 1537 CA GLN A 217 8.599 3.188 2.843 1.00 0.00 C ATOM 1538 C GLN A 217 9.991 3.058 2.238 1.00 0.00 C ATOM 1539 O GLN A 217 10.986 3.013 2.957 1.00 0.00 O ATOM 1540 CB GLN A 217 7.862 1.839 2.750 1.00 0.00 C ATOM 1541 CG GLN A 217 6.989 1.547 3.975 1.00 0.00 C ATOM 1542 CD GLN A 217 7.770 1.459 5.285 1.00 0.00 C ATOM 1543 OE1 GLN A 217 7.230 1.782 6.340 1.00 0.00 O ATOM 1544 NE2 GLN A 217 9.004 0.989 5.264 1.00 0.00 N ATOM 0 H GLN A 217 6.949 3.882 1.773 1.00 0.00 H new ATOM 0 HA GLN A 217 8.695 3.474 3.890 1.00 0.00 H new ATOM 0 HB2 GLN A 217 7.238 1.833 1.856 1.00 0.00 H new ATOM 0 HB3 GLN A 217 8.593 1.039 2.633 1.00 0.00 H new ATOM 0 HG2 GLN A 217 6.234 2.328 4.065 1.00 0.00 H new ATOM 0 HG3 GLN A 217 6.459 0.608 3.816 1.00 0.00 H new ATOM 0 HE21 GLN A 217 9.435 0.726 4.377 1.00 0.00 H new ATOM 0 HE22 GLN A 217 9.526 0.889 6.134 1.00 0.00 H new ATOM 1553 N TYR A 218 10.061 3.005 0.914 1.00 0.00 N ATOM 1554 CA TYR A 218 11.308 2.803 0.216 1.00 0.00 C ATOM 1555 C TYR A 218 12.209 4.035 0.333 1.00 0.00 C ATOM 1556 O TYR A 218 13.425 3.871 0.373 1.00 0.00 O ATOM 1557 CB TYR A 218 10.951 2.377 -1.202 1.00 0.00 C ATOM 1558 CG TYR A 218 12.042 1.834 -2.112 1.00 0.00 C ATOM 1559 CD1 TYR A 218 12.983 2.700 -2.703 1.00 0.00 C ATOM 1560 CD2 TYR A 218 12.033 0.471 -2.474 1.00 0.00 C ATOM 1561 CE1 TYR A 218 13.901 2.208 -3.651 1.00 0.00 C ATOM 1562 CE2 TYR A 218 12.923 -0.020 -3.445 1.00 0.00 C ATOM 1563 CZ TYR A 218 13.864 0.848 -4.038 1.00 0.00 C ATOM 1564 OH TYR A 218 14.709 0.366 -4.990 1.00 0.00 O ATOM 0 H TYR A 218 9.251 3.102 0.301 1.00 0.00 H new ATOM 0 HA TYR A 218 11.914 2.012 0.657 1.00 0.00 H new ATOM 0 HB2 TYR A 218 10.175 1.615 -1.130 1.00 0.00 H new ATOM 0 HB3 TYR A 218 10.507 3.238 -1.701 1.00 0.00 H new ATOM 0 HD1 TYR A 218 13.000 3.744 -2.428 1.00 0.00 H new ATOM 0 HD2 TYR A 218 11.335 -0.203 -2.000 1.00 0.00 H new ATOM 0 HE1 TYR A 218 14.635 2.871 -4.084 1.00 0.00 H new ATOM 0 HE2 TYR A 218 12.887 -1.059 -3.736 1.00 0.00 H new ATOM 0 HH TYR A 218 14.540 -0.590 -5.124 1.00 0.00 H new ATOM 1574 N GLN A 219 11.658 5.250 0.500 1.00 0.00 N ATOM 1575 CA GLN A 219 12.462 6.416 0.878 1.00 0.00 C ATOM 1576 C GLN A 219 13.215 6.168 2.184 1.00 0.00 C ATOM 1577 O GLN A 219 14.383 6.541 2.296 1.00 0.00 O ATOM 1578 CB GLN A 219 11.648 7.708 1.059 1.00 0.00 C ATOM 1579 CG GLN A 219 10.890 8.145 -0.181 1.00 0.00 C ATOM 1580 CD GLN A 219 11.703 8.172 -1.469 1.00 0.00 C ATOM 1581 OE1 GLN A 219 12.871 8.557 -1.503 1.00 0.00 O ATOM 1582 NE2 GLN A 219 11.076 7.741 -2.546 1.00 0.00 N ATOM 0 H GLN A 219 10.664 5.445 0.379 1.00 0.00 H new ATOM 0 HA GLN A 219 13.147 6.554 0.041 1.00 0.00 H new ATOM 0 HB2 GLN A 219 10.938 7.566 1.874 1.00 0.00 H new ATOM 0 HB3 GLN A 219 12.322 8.510 1.360 1.00 0.00 H new ATOM 0 HG2 GLN A 219 10.041 7.476 -0.321 1.00 0.00 H new ATOM 0 HG3 GLN A 219 10.485 9.142 -0.006 1.00 0.00 H new ATOM 0 HE21 GLN A 219 10.107 7.429 -2.481 1.00 0.00 H new ATOM 0 HE22 GLN A 219 11.560 7.720 -3.444 1.00 0.00 H new ATOM 1591 N ARG A 220 12.537 5.572 3.173 1.00 0.00 N ATOM 1592 CA ARG A 220 13.123 5.306 4.483 1.00 0.00 C ATOM 1593 C ARG A 220 14.274 4.332 4.333 1.00 0.00 C ATOM 1594 O ARG A 220 15.361 4.563 4.856 1.00 0.00 O ATOM 1595 CB ARG A 220 12.104 4.726 5.477 1.00 0.00 C ATOM 1596 CG ARG A 220 10.727 5.398 5.511 1.00 0.00 C ATOM 1597 CD ARG A 220 10.762 6.940 5.523 1.00 0.00 C ATOM 1598 NE ARG A 220 9.806 7.519 6.481 1.00 0.00 N ATOM 1599 CZ ARG A 220 9.877 7.429 7.815 1.00 0.00 C ATOM 1600 NH1 ARG A 220 10.937 6.878 8.401 1.00 0.00 N ATOM 1601 NH2 ARG A 220 8.868 7.892 8.542 1.00 0.00 N ATOM 0 H ARG A 220 11.569 5.263 3.083 1.00 0.00 H new ATOM 0 HA ARG A 220 13.470 6.260 4.881 1.00 0.00 H new ATOM 0 HB2 ARG A 220 11.963 3.670 5.245 1.00 0.00 H new ATOM 0 HB3 ARG A 220 12.534 4.778 6.477 1.00 0.00 H new ATOM 0 HG2 ARG A 220 10.155 5.068 4.644 1.00 0.00 H new ATOM 0 HG3 ARG A 220 10.191 5.053 6.396 1.00 0.00 H new ATOM 0 HD2 ARG A 220 11.769 7.275 5.772 1.00 0.00 H new ATOM 0 HD3 ARG A 220 10.540 7.313 4.523 1.00 0.00 H new ATOM 0 HE ARG A 220 9.017 8.036 6.093 1.00 0.00 H new ATOM 0 HH11 ARG A 220 11.705 6.520 7.833 1.00 0.00 H new ATOM 0 HH12 ARG A 220 10.982 6.814 9.418 1.00 0.00 H new ATOM 0 HH21 ARG A 220 8.057 8.307 8.083 1.00 0.00 H new ATOM 0 HH22 ARG A 220 8.903 7.833 9.560 1.00 0.00 H new ATOM 1615 N GLU A 221 14.052 3.251 3.594 1.00 0.00 N ATOM 1616 CA GLU A 221 15.098 2.267 3.386 1.00 0.00 C ATOM 1617 C GLU A 221 16.259 2.841 2.589 1.00 0.00 C ATOM 1618 O GLU A 221 17.403 2.485 2.830 1.00 0.00 O ATOM 1619 CB GLU A 221 14.565 1.043 2.663 1.00 0.00 C ATOM 1620 CG GLU A 221 13.623 0.260 3.564 1.00 0.00 C ATOM 1621 CD GLU A 221 13.652 -1.258 3.353 1.00 0.00 C ATOM 1622 OE1 GLU A 221 14.677 -1.838 2.917 1.00 0.00 O ATOM 1623 OE2 GLU A 221 12.595 -1.850 3.658 1.00 0.00 O ATOM 0 H GLU A 221 13.166 3.038 3.135 1.00 0.00 H new ATOM 0 HA GLU A 221 15.454 1.979 4.375 1.00 0.00 H new ATOM 0 HB2 GLU A 221 14.041 1.348 1.757 1.00 0.00 H new ATOM 0 HB3 GLU A 221 15.394 0.407 2.353 1.00 0.00 H new ATOM 0 HG2 GLU A 221 13.874 0.474 4.603 1.00 0.00 H new ATOM 0 HG3 GLU A 221 12.606 0.617 3.402 1.00 0.00 H new ATOM 1630 N SER A 222 15.979 3.751 1.666 1.00 0.00 N ATOM 1631 CA SER A 222 16.996 4.461 0.901 1.00 0.00 C ATOM 1632 C SER A 222 17.922 5.266 1.831 1.00 0.00 C ATOM 1633 O SER A 222 19.092 5.468 1.499 1.00 0.00 O ATOM 1634 CB SER A 222 16.295 5.340 -0.145 1.00 0.00 C ATOM 1635 OG SER A 222 17.152 5.788 -1.179 1.00 0.00 O ATOM 0 H SER A 222 15.026 4.021 1.424 1.00 0.00 H new ATOM 0 HA SER A 222 17.640 3.753 0.379 1.00 0.00 H new ATOM 0 HB2 SER A 222 15.472 4.778 -0.586 1.00 0.00 H new ATOM 0 HB3 SER A 222 15.859 6.206 0.354 1.00 0.00 H new ATOM 0 HG SER A 222 16.643 6.339 -1.810 1.00 0.00 H new ATOM 1641 N GLU A 223 17.450 5.678 3.013 1.00 0.00 N ATOM 1642 CA GLU A 223 18.327 6.160 4.076 1.00 0.00 C ATOM 1643 C GLU A 223 19.020 4.967 4.729 1.00 0.00 C ATOM 1644 O GLU A 223 20.244 4.952 4.796 1.00 0.00 O ATOM 1645 CB GLU A 223 17.579 6.973 5.142 1.00 0.00 C ATOM 1646 CG GLU A 223 16.936 8.249 4.598 1.00 0.00 C ATOM 1647 CD GLU A 223 15.987 8.829 5.641 1.00 0.00 C ATOM 1648 OE1 GLU A 223 16.451 9.481 6.602 1.00 0.00 O ATOM 1649 OE2 GLU A 223 14.759 8.616 5.516 1.00 0.00 O ATOM 0 H GLU A 223 16.459 5.686 3.254 1.00 0.00 H new ATOM 0 HA GLU A 223 19.057 6.830 3.622 1.00 0.00 H new ATOM 0 HB2 GLU A 223 16.805 6.348 5.588 1.00 0.00 H new ATOM 0 HB3 GLU A 223 18.274 7.237 5.939 1.00 0.00 H new ATOM 0 HG2 GLU A 223 17.707 8.978 4.347 1.00 0.00 H new ATOM 0 HG3 GLU A 223 16.393 8.031 3.679 1.00 0.00 H new ATOM 1656 N ALA A 224 18.265 3.967 5.204 1.00 0.00 N ATOM 1657 CA ALA A 224 18.757 2.819 5.973 1.00 0.00 C ATOM 1658 C ALA A 224 19.878 2.036 5.277 1.00 0.00 C ATOM 1659 O ALA A 224 20.763 1.522 5.957 1.00 0.00 O ATOM 1660 CB ALA A 224 17.598 1.871 6.300 1.00 0.00 C ATOM 0 H ALA A 224 17.256 3.936 5.057 1.00 0.00 H new ATOM 0 HA ALA A 224 19.188 3.232 6.885 1.00 0.00 H new ATOM 0 HB1 ALA A 224 17.973 1.022 6.871 1.00 0.00 H new ATOM 0 HB2 ALA A 224 16.849 2.401 6.888 1.00 0.00 H new ATOM 0 HB3 ALA A 224 17.147 1.515 5.374 1.00 0.00 H new ATOM 1666 N TYR A 225 19.887 1.985 3.949 1.00 0.00 N ATOM 1667 CA TYR A 225 20.871 1.325 3.093 1.00 0.00 C ATOM 1668 C TYR A 225 22.219 2.055 3.139 1.00 0.00 C ATOM 1669 O TYR A 225 23.224 1.537 2.640 1.00 0.00 O ATOM 1670 CB TYR A 225 20.264 1.248 1.672 1.00 0.00 C ATOM 1671 CG TYR A 225 21.168 1.500 0.480 1.00 0.00 C ATOM 1672 CD1 TYR A 225 21.354 2.823 0.042 1.00 0.00 C ATOM 1673 CD2 TYR A 225 21.767 0.437 -0.223 1.00 0.00 C ATOM 1674 CE1 TYR A 225 22.136 3.092 -1.091 1.00 0.00 C ATOM 1675 CE2 TYR A 225 22.555 0.702 -1.362 1.00 0.00 C ATOM 1676 CZ TYR A 225 22.735 2.034 -1.803 1.00 0.00 C ATOM 1677 OH TYR A 225 23.529 2.328 -2.864 1.00 0.00 O ATOM 0 H TYR A 225 19.154 2.436 3.401 1.00 0.00 H new ATOM 0 HA TYR A 225 21.086 0.315 3.442 1.00 0.00 H new ATOM 0 HB2 TYR A 225 19.827 0.256 1.552 1.00 0.00 H new ATOM 0 HB3 TYR A 225 19.445 1.965 1.623 1.00 0.00 H new ATOM 0 HD1 TYR A 225 20.892 3.637 0.581 1.00 0.00 H new ATOM 0 HD2 TYR A 225 21.623 -0.580 0.110 1.00 0.00 H new ATOM 0 HE1 TYR A 225 22.279 4.111 -1.418 1.00 0.00 H new ATOM 0 HE2 TYR A 225 23.021 -0.112 -1.898 1.00 0.00 H new ATOM 0 HH TYR A 225 23.873 1.498 -3.255 1.00 0.00 H new ATOM 1687 N TYR A 226 22.237 3.258 3.717 1.00 0.00 N ATOM 1688 CA TYR A 226 23.334 4.200 3.679 1.00 0.00 C ATOM 1689 C TYR A 226 23.773 4.639 5.075 1.00 0.00 C ATOM 1690 O TYR A 226 24.905 4.362 5.463 1.00 0.00 O ATOM 1691 CB TYR A 226 22.861 5.392 2.846 1.00 0.00 C ATOM 1692 CG TYR A 226 23.936 6.382 2.476 1.00 0.00 C ATOM 1693 CD1 TYR A 226 25.110 5.936 1.847 1.00 0.00 C ATOM 1694 CD2 TYR A 226 23.725 7.752 2.691 1.00 0.00 C ATOM 1695 CE1 TYR A 226 26.031 6.860 1.331 1.00 0.00 C ATOM 1696 CE2 TYR A 226 24.652 8.686 2.191 1.00 0.00 C ATOM 1697 CZ TYR A 226 25.785 8.243 1.470 1.00 0.00 C ATOM 1698 OH TYR A 226 26.618 9.145 0.884 1.00 0.00 O ATOM 0 H TYR A 226 21.441 3.610 4.249 1.00 0.00 H new ATOM 0 HA TYR A 226 24.212 3.732 3.234 1.00 0.00 H new ATOM 0 HB2 TYR A 226 22.404 5.017 1.930 1.00 0.00 H new ATOM 0 HB3 TYR A 226 22.082 5.916 3.400 1.00 0.00 H new ATOM 0 HD1 TYR A 226 25.305 4.877 1.760 1.00 0.00 H new ATOM 0 HD2 TYR A 226 22.856 8.088 3.237 1.00 0.00 H new ATOM 0 HE1 TYR A 226 26.923 6.515 0.830 1.00 0.00 H new ATOM 0 HE2 TYR A 226 24.498 9.742 2.358 1.00 0.00 H new ATOM 0 HH TYR A 226 26.305 10.053 1.077 1.00 0.00 H new