USER MOD reduce.3.24.130724 H: found=0, std=0, add=677, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 702 hydrogens (24 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 173 CYS SG : rot -48:sc= 1.2 USER MOD Set 1.2: A 215 SER OG : rot 7:sc= 1.44! USER MOD Set 2.1: A 198 TYR OH : rot 165:sc= -0.6 USER MOD Set 2.2: A 205 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 SER OG : rot 33:sc= 0.123 USER MOD Single : A 153 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 163 ASN : amide:sc= -0.0153 X(o=-0.015,f=-0.16) USER MOD Single : A 164 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 165 GLN : amide:sc=-0.00244 K(o=-0.0024,f=-1.5) USER MOD Single : A 167 THR OG1 : rot 180:sc= -1.31 USER MOD Single : A 176 THR OG1 : rot 180:sc=-0.00344 USER MOD Single : A 180 SER OG : rot 15:sc= 0.31 USER MOD Single : A 182 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 183 LYS NZ :NH3+ 155:sc= -0.233 (180deg=-0.982) USER MOD Single : A 186 MET CE :methyl 175:sc= -2.04 (180deg=-2.38) USER MOD Single : A 187 MET CE :methyl 152:sc= -1.86! (180deg=-2.3!) USER MOD Single : A 194 CYS SG : rot 180:sc= -1.22 USER MOD Single : A 195 CYS SG : rot 94:sc= -2.07! USER MOD Single : A 201 GLN : amide:sc= -1.63! K(o=-1.6!,f=-1.1) USER MOD Single : A 206 LYS NZ :NH3+ -134:sc= -0.0458 (180deg=-0.328) USER MOD Single : A 212 THR OG1 : rot -150:sc= 0.0405 USER MOD Single : A 218 THR OG1 : rot 96:sc= 1.11 USER MOD Single : A 223 HIS : no HD1:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 229 ASN : amide:sc= -1.13 K(o=-1.1,f=-0.038) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 151 22.333 -4.078 -3.937 1.00 5.02 N ATOM 2 CA SER A 151 21.913 -2.782 -3.369 1.00 4.35 C ATOM 3 C SER A 151 22.447 -2.626 -1.946 1.00 3.18 C ATOM 4 O SER A 151 22.276 -3.513 -1.111 1.00 3.19 O ATOM 5 CB SER A 151 20.389 -2.692 -3.381 1.00 5.00 C ATOM 6 OG SER A 151 19.881 -2.876 -4.694 1.00 5.63 O ATOM 0 HA SER A 151 22.323 -1.975 -3.976 1.00 4.35 H new ATOM 0 HB2 SER A 151 19.971 -3.447 -2.716 1.00 5.00 H new ATOM 0 HB3 SER A 151 20.075 -1.721 -2.998 1.00 5.00 H new ATOM 0 HG SER A 151 20.455 -3.503 -5.182 1.00 5.63 H new ATOM 12 N PRO A 152 23.117 -1.494 -1.657 1.00 2.66 N ATOM 13 CA PRO A 152 23.712 -1.228 -0.341 1.00 2.06 C ATOM 14 C PRO A 152 22.667 -0.928 0.731 1.00 1.62 C ATOM 15 O PRO A 152 22.932 -1.060 1.926 1.00 1.74 O ATOM 16 CB PRO A 152 24.576 0.006 -0.597 1.00 2.74 C ATOM 17 CG PRO A 152 23.913 0.699 -1.731 1.00 3.37 C ATOM 18 CD PRO A 152 23.368 -0.389 -2.604 1.00 3.38 C ATOM 0 HA PRO A 152 24.261 -2.090 0.038 1.00 2.06 H new ATOM 0 HB2 PRO A 152 24.625 0.645 0.284 1.00 2.74 H new ATOM 0 HB3 PRO A 152 25.600 -0.272 -0.846 1.00 2.74 H new ATOM 0 HG2 PRO A 152 23.117 1.355 -1.378 1.00 3.37 H new ATOM 0 HG3 PRO A 152 24.621 1.323 -2.277 1.00 3.37 H new ATOM 0 HD2 PRO A 152 22.454 -0.078 -3.110 1.00 3.38 H new ATOM 0 HD3 PRO A 152 24.079 -0.677 -3.378 1.00 3.38 H new ATOM 26 N GLN A 153 21.485 -0.516 0.300 1.00 1.46 N ATOM 27 CA GLN A 153 20.401 -0.208 1.218 1.00 1.24 C ATOM 28 C GLN A 153 19.171 -1.029 0.876 1.00 0.99 C ATOM 29 O GLN A 153 18.976 -1.414 -0.279 1.00 1.20 O ATOM 30 CB GLN A 153 20.065 1.281 1.178 1.00 1.63 C ATOM 31 CG GLN A 153 21.129 2.151 1.819 1.00 2.17 C ATOM 32 CD GLN A 153 20.830 3.631 1.688 1.00 2.74 C ATOM 33 OE1 GLN A 153 20.167 4.216 2.541 1.00 3.30 O ATOM 34 NE2 GLN A 153 21.316 4.246 0.625 1.00 3.28 N ATOM 0 H GLN A 153 21.252 -0.387 -0.685 1.00 1.46 H new ATOM 0 HA GLN A 153 20.726 -0.462 2.227 1.00 1.24 H new ATOM 0 HB2 GLN A 153 19.930 1.589 0.141 1.00 1.63 H new ATOM 0 HB3 GLN A 153 19.115 1.446 1.686 1.00 1.63 H new ATOM 0 HG2 GLN A 153 21.216 1.894 2.875 1.00 2.17 H new ATOM 0 HG3 GLN A 153 22.094 1.937 1.359 1.00 2.17 H new ATOM 0 HE21 GLN A 153 21.862 3.724 -0.061 1.00 3.28 H new ATOM 0 HE22 GLN A 153 21.145 5.243 0.490 1.00 3.28 H new ATOM 43 N LYS A 154 18.350 -1.303 1.875 1.00 0.80 N ATOM 44 CA LYS A 154 17.119 -2.049 1.668 1.00 0.67 C ATOM 45 C LYS A 154 15.913 -1.157 1.938 1.00 0.54 C ATOM 46 O LYS A 154 15.505 -0.978 3.086 1.00 0.62 O ATOM 47 CB LYS A 154 17.078 -3.282 2.574 1.00 0.87 C ATOM 48 CG LYS A 154 15.814 -4.121 2.419 1.00 0.98 C ATOM 49 CD LYS A 154 15.703 -4.742 1.036 1.00 1.30 C ATOM 50 CE LYS A 154 16.749 -5.823 0.825 1.00 1.78 C ATOM 51 NZ LYS A 154 16.683 -6.407 -0.542 1.00 2.33 N ATOM 0 H LYS A 154 18.514 -1.019 2.841 1.00 0.80 H new ATOM 0 HA LYS A 154 17.087 -2.382 0.631 1.00 0.67 H new ATOM 0 HB2 LYS A 154 17.945 -3.907 2.360 1.00 0.87 H new ATOM 0 HB3 LYS A 154 17.164 -2.961 3.612 1.00 0.87 H new ATOM 0 HG2 LYS A 154 15.809 -4.910 3.171 1.00 0.98 H new ATOM 0 HG3 LYS A 154 14.940 -3.497 2.606 1.00 0.98 H new ATOM 0 HD2 LYS A 154 14.708 -5.167 0.906 1.00 1.30 H new ATOM 0 HD3 LYS A 154 15.821 -3.968 0.278 1.00 1.30 H new ATOM 0 HE2 LYS A 154 17.741 -5.404 0.992 1.00 1.78 H new ATOM 0 HE3 LYS A 154 16.608 -6.612 1.563 1.00 1.78 H new ATOM 0 HZ1 LYS A 154 17.414 -7.140 -0.642 1.00 2.33 H new ATOM 0 HZ2 LYS A 154 15.745 -6.830 -0.694 1.00 2.33 H new ATOM 0 HZ3 LYS A 154 16.844 -5.659 -1.247 1.00 2.33 H new ATOM 65 N PRO A 155 15.338 -0.569 0.881 1.00 0.42 N ATOM 66 CA PRO A 155 14.170 0.300 1.002 1.00 0.38 C ATOM 67 C PRO A 155 12.873 -0.493 1.136 1.00 0.33 C ATOM 68 O PRO A 155 12.753 -1.595 0.596 1.00 0.33 O ATOM 69 CB PRO A 155 14.190 1.053 -0.317 1.00 0.40 C ATOM 70 CG PRO A 155 14.716 0.057 -1.282 1.00 0.39 C ATOM 71 CD PRO A 155 15.777 -0.696 -0.528 1.00 0.43 C ATOM 0 HA PRO A 155 14.208 0.935 1.887 1.00 0.38 H new ATOM 0 HB2 PRO A 155 13.194 1.395 -0.598 1.00 0.40 H new ATOM 0 HB3 PRO A 155 14.828 1.936 -0.265 1.00 0.40 H new ATOM 0 HG2 PRO A 155 13.928 -0.612 -1.627 1.00 0.39 H new ATOM 0 HG3 PRO A 155 15.130 0.544 -2.165 1.00 0.39 H new ATOM 0 HD2 PRO A 155 15.832 -1.739 -0.841 1.00 0.43 H new ATOM 0 HD3 PRO A 155 16.766 -0.264 -0.683 1.00 0.43 H new ATOM 79 N ILE A 156 11.902 0.071 1.839 1.00 0.33 N ATOM 80 CA ILE A 156 10.625 -0.594 2.056 1.00 0.29 C ATOM 81 C ILE A 156 9.468 0.408 2.115 1.00 0.29 C ATOM 82 O ILE A 156 9.638 1.542 2.554 1.00 0.37 O ATOM 83 CB ILE A 156 10.643 -1.452 3.346 1.00 0.31 C ATOM 84 CG1 ILE A 156 11.371 -0.737 4.491 1.00 0.38 C ATOM 85 CG2 ILE A 156 11.268 -2.819 3.088 1.00 0.37 C ATOM 86 CD1 ILE A 156 10.511 0.248 5.258 1.00 0.79 C ATOM 0 H ILE A 156 11.975 0.992 2.271 1.00 0.33 H new ATOM 0 HA ILE A 156 10.467 -1.253 1.202 1.00 0.29 H new ATOM 0 HB ILE A 156 9.606 -1.599 3.649 1.00 0.31 H new ATOM 0 HG12 ILE A 156 11.754 -1.485 5.186 1.00 0.38 H new ATOM 0 HG13 ILE A 156 12.233 -0.209 4.084 1.00 0.38 H new ATOM 0 HG21 ILE A 156 11.267 -3.399 4.011 1.00 0.37 H new ATOM 0 HG22 ILE A 156 10.691 -3.345 2.328 1.00 0.37 H new ATOM 0 HG23 ILE A 156 12.293 -2.691 2.741 1.00 0.37 H new ATOM 0 HD11 ILE A 156 11.103 0.709 6.049 1.00 0.79 H new ATOM 0 HD12 ILE A 156 10.149 1.020 4.579 1.00 0.79 H new ATOM 0 HD13 ILE A 156 9.662 -0.276 5.698 1.00 0.79 H new ATOM 98 N VAL A 157 8.302 -0.017 1.650 1.00 0.25 N ATOM 99 CA VAL A 157 7.088 0.773 1.738 1.00 0.27 C ATOM 100 C VAL A 157 6.058 0.002 2.554 1.00 0.21 C ATOM 101 O VAL A 157 5.745 -1.151 2.255 1.00 0.25 O ATOM 102 CB VAL A 157 6.496 1.114 0.349 1.00 0.38 C ATOM 103 CG1 VAL A 157 5.179 1.871 0.500 1.00 1.05 C ATOM 104 CG2 VAL A 157 7.475 1.930 -0.488 1.00 0.91 C ATOM 0 H VAL A 157 8.174 -0.923 1.200 1.00 0.25 H new ATOM 0 HA VAL A 157 7.341 1.718 2.219 1.00 0.27 H new ATOM 0 HB VAL A 157 6.308 0.174 -0.170 1.00 0.38 H new ATOM 0 HG11 VAL A 157 4.777 2.102 -0.486 1.00 1.05 H new ATOM 0 HG12 VAL A 157 4.466 1.254 1.047 1.00 1.05 H new ATOM 0 HG13 VAL A 157 5.353 2.797 1.048 1.00 1.05 H new ATOM 0 HG21 VAL A 157 7.028 2.152 -1.457 1.00 0.91 H new ATOM 0 HG22 VAL A 157 7.706 2.862 0.028 1.00 0.91 H new ATOM 0 HG23 VAL A 157 8.392 1.360 -0.634 1.00 0.91 H new ATOM 114 N ARG A 158 5.547 0.644 3.584 1.00 0.21 N ATOM 115 CA ARG A 158 4.646 0.005 4.529 1.00 0.21 C ATOM 116 C ARG A 158 3.199 0.347 4.207 1.00 0.21 C ATOM 117 O ARG A 158 2.803 1.506 4.252 1.00 0.32 O ATOM 118 CB ARG A 158 4.991 0.451 5.947 1.00 0.26 C ATOM 119 CG ARG A 158 6.424 0.126 6.350 1.00 0.29 C ATOM 120 CD ARG A 158 6.941 1.056 7.431 1.00 0.49 C ATOM 121 NE ARG A 158 7.213 2.406 6.930 1.00 1.36 N ATOM 122 CZ ARG A 158 7.395 3.468 7.719 1.00 1.81 C ATOM 123 NH1 ARG A 158 7.319 3.337 9.034 1.00 1.70 N ATOM 124 NH2 ARG A 158 7.657 4.660 7.196 1.00 2.87 N ATOM 0 H ARG A 158 5.743 1.623 3.792 1.00 0.21 H new ATOM 0 HA ARG A 158 4.765 -1.076 4.453 1.00 0.21 H new ATOM 0 HB2 ARG A 158 4.832 1.526 6.031 1.00 0.26 H new ATOM 0 HB3 ARG A 158 4.307 -0.028 6.647 1.00 0.26 H new ATOM 0 HG2 ARG A 158 6.475 -0.904 6.704 1.00 0.29 H new ATOM 0 HG3 ARG A 158 7.070 0.195 5.475 1.00 0.29 H new ATOM 0 HD2 ARG A 158 6.210 1.112 8.237 1.00 0.49 H new ATOM 0 HD3 ARG A 158 7.854 0.640 7.857 1.00 0.49 H new ATOM 0 HE ARG A 158 7.266 2.542 5.921 1.00 1.36 H new ATOM 0 HH11 ARG A 158 7.121 2.425 9.445 1.00 1.70 H new ATOM 0 HH12 ARG A 158 7.458 4.148 9.636 1.00 1.70 H new ATOM 0 HH21 ARG A 158 7.721 4.770 6.184 1.00 2.87 H new ATOM 0 HH22 ARG A 158 7.795 5.466 7.806 1.00 2.87 H new ATOM 138 N VAL A 159 2.421 -0.664 3.868 1.00 0.20 N ATOM 139 CA VAL A 159 1.026 -0.459 3.495 1.00 0.21 C ATOM 140 C VAL A 159 0.083 -0.919 4.597 1.00 0.23 C ATOM 141 O VAL A 159 0.085 -2.086 4.972 1.00 0.36 O ATOM 142 CB VAL A 159 0.648 -1.233 2.221 1.00 0.28 C ATOM 143 CG1 VAL A 159 -0.532 -0.572 1.539 1.00 0.42 C ATOM 144 CG2 VAL A 159 1.831 -1.358 1.271 1.00 0.35 C ATOM 0 H VAL A 159 2.727 -1.637 3.842 1.00 0.20 H new ATOM 0 HA VAL A 159 0.923 0.612 3.323 1.00 0.21 H new ATOM 0 HB VAL A 159 0.361 -2.244 2.511 1.00 0.28 H new ATOM 0 HG11 VAL A 159 -0.790 -1.129 0.638 1.00 0.42 H new ATOM 0 HG12 VAL A 159 -1.385 -0.562 2.217 1.00 0.42 H new ATOM 0 HG13 VAL A 159 -0.270 0.451 1.270 1.00 0.42 H new ATOM 0 HG21 VAL A 159 1.527 -1.911 0.382 1.00 0.35 H new ATOM 0 HG22 VAL A 159 2.172 -0.364 0.981 1.00 0.35 H new ATOM 0 HG23 VAL A 159 2.643 -1.889 1.768 1.00 0.35 H new ATOM 154 N PHE A 160 -0.726 -0.012 5.101 1.00 0.22 N ATOM 155 CA PHE A 160 -1.752 -0.359 6.072 1.00 0.22 C ATOM 156 C PHE A 160 -2.888 -1.122 5.385 1.00 0.24 C ATOM 157 O PHE A 160 -3.694 -0.520 4.682 1.00 0.28 O ATOM 158 CB PHE A 160 -2.313 0.910 6.724 1.00 0.25 C ATOM 159 CG PHE A 160 -1.393 1.567 7.717 1.00 0.30 C ATOM 160 CD1 PHE A 160 -0.256 2.244 7.304 1.00 0.38 C ATOM 161 CD2 PHE A 160 -1.683 1.521 9.069 1.00 0.48 C ATOM 162 CE1 PHE A 160 0.573 2.861 8.223 1.00 0.46 C ATOM 163 CE2 PHE A 160 -0.856 2.132 9.992 1.00 0.58 C ATOM 164 CZ PHE A 160 0.272 2.802 9.567 1.00 0.51 C ATOM 0 H PHE A 160 -0.696 0.978 4.855 1.00 0.22 H new ATOM 0 HA PHE A 160 -1.305 -0.990 6.840 1.00 0.22 H new ATOM 0 HB2 PHE A 160 -2.553 1.629 5.941 1.00 0.25 H new ATOM 0 HB3 PHE A 160 -3.248 0.661 7.225 1.00 0.25 H new ATOM 0 HD1 PHE A 160 -0.015 2.290 6.252 1.00 0.38 H new ATOM 0 HD2 PHE A 160 -2.567 1.001 9.407 1.00 0.48 H new ATOM 0 HE1 PHE A 160 1.454 3.388 7.888 1.00 0.46 H new ATOM 0 HE2 PHE A 160 -1.093 2.085 11.045 1.00 0.58 H new ATOM 0 HZ PHE A 160 0.919 3.280 10.287 1.00 0.51 H new ATOM 174 N LEU A 161 -2.936 -2.441 5.560 1.00 0.27 N ATOM 175 CA LEU A 161 -4.030 -3.240 4.997 1.00 0.33 C ATOM 176 C LEU A 161 -5.355 -2.885 5.661 1.00 0.33 C ATOM 177 O LEU A 161 -5.384 -2.371 6.783 1.00 0.37 O ATOM 178 CB LEU A 161 -3.826 -4.762 5.159 1.00 0.49 C ATOM 179 CG LEU A 161 -2.495 -5.352 4.693 1.00 0.72 C ATOM 180 CD1 LEU A 161 -1.911 -4.540 3.568 1.00 1.46 C ATOM 181 CD2 LEU A 161 -1.525 -5.451 5.850 1.00 0.98 C ATOM 0 H LEU A 161 -2.241 -2.977 6.080 1.00 0.27 H new ATOM 0 HA LEU A 161 -4.040 -3.001 3.934 1.00 0.33 H new ATOM 0 HB2 LEU A 161 -3.951 -5.007 6.214 1.00 0.49 H new ATOM 0 HB3 LEU A 161 -4.625 -5.268 4.617 1.00 0.49 H new ATOM 0 HG LEU A 161 -2.680 -6.358 4.316 1.00 0.72 H new ATOM 0 HD11 LEU A 161 -0.964 -4.980 3.255 1.00 1.46 H new ATOM 0 HD12 LEU A 161 -2.604 -4.533 2.727 1.00 1.46 H new ATOM 0 HD13 LEU A 161 -1.741 -3.518 3.907 1.00 1.46 H new ATOM 0 HD21 LEU A 161 -0.583 -5.873 5.500 1.00 0.98 H new ATOM 0 HD22 LEU A 161 -1.347 -4.457 6.261 1.00 0.98 H new ATOM 0 HD23 LEU A 161 -1.945 -6.094 6.623 1.00 0.98 H new ATOM 193 N PRO A 162 -6.465 -3.146 4.956 1.00 0.38 N ATOM 194 CA PRO A 162 -7.819 -3.046 5.503 1.00 0.43 C ATOM 195 C PRO A 162 -7.944 -3.652 6.899 1.00 0.42 C ATOM 196 O PRO A 162 -7.221 -4.591 7.244 1.00 0.40 O ATOM 197 CB PRO A 162 -8.641 -3.868 4.519 1.00 0.49 C ATOM 198 CG PRO A 162 -7.936 -3.721 3.216 1.00 0.50 C ATOM 199 CD PRO A 162 -6.477 -3.518 3.534 1.00 0.46 C ATOM 0 HA PRO A 162 -8.133 -2.008 5.612 1.00 0.43 H new ATOM 0 HB2 PRO A 162 -8.694 -4.913 4.824 1.00 0.49 H new ATOM 0 HB3 PRO A 162 -9.666 -3.502 4.457 1.00 0.49 H new ATOM 0 HG2 PRO A 162 -8.078 -4.607 2.597 1.00 0.50 H new ATOM 0 HG3 PRO A 162 -8.331 -2.874 2.655 1.00 0.50 H new ATOM 0 HD2 PRO A 162 -5.901 -4.426 3.355 1.00 0.46 H new ATOM 0 HD3 PRO A 162 -6.040 -2.735 2.914 1.00 0.46 H new ATOM 207 N ASN A 163 -8.871 -3.103 7.683 1.00 0.51 N ATOM 208 CA ASN A 163 -9.111 -3.528 9.066 1.00 0.54 C ATOM 209 C ASN A 163 -7.995 -3.011 9.974 1.00 0.48 C ATOM 210 O ASN A 163 -7.894 -3.393 11.137 1.00 0.53 O ATOM 211 CB ASN A 163 -9.252 -5.058 9.165 1.00 0.60 C ATOM 212 CG ASN A 163 -9.981 -5.507 10.419 1.00 1.26 C ATOM 213 OD1 ASN A 163 -9.370 -5.791 11.449 1.00 2.08 O ATOM 214 ND2 ASN A 163 -11.299 -5.600 10.335 1.00 1.86 N ATOM 0 H ASN A 163 -9.482 -2.346 7.377 1.00 0.51 H new ATOM 0 HA ASN A 163 -10.055 -3.098 9.401 1.00 0.54 H new ATOM 0 HB2 ASN A 163 -9.787 -5.425 8.289 1.00 0.60 H new ATOM 0 HB3 ASN A 163 -8.261 -5.511 9.146 1.00 0.60 H new ATOM 0 HD21 ASN A 163 -11.840 -5.915 11.140 1.00 1.86 H new ATOM 0 HD22 ASN A 163 -11.773 -5.356 9.465 1.00 1.86 H new ATOM 221 N LYS A 164 -7.175 -2.114 9.413 1.00 0.48 N ATOM 222 CA LYS A 164 -6.121 -1.408 10.148 1.00 0.52 C ATOM 223 C LYS A 164 -4.902 -2.292 10.420 1.00 0.44 C ATOM 224 O LYS A 164 -4.227 -2.139 11.442 1.00 0.52 O ATOM 225 CB LYS A 164 -6.662 -0.822 11.460 1.00 0.69 C ATOM 226 CG LYS A 164 -7.758 0.211 11.253 1.00 0.88 C ATOM 227 CD LYS A 164 -7.213 1.526 10.714 1.00 1.22 C ATOM 228 CE LYS A 164 -6.261 2.181 11.701 1.00 2.04 C ATOM 229 NZ LYS A 164 -5.950 3.588 11.331 1.00 2.74 N ATOM 0 H LYS A 164 -7.226 -1.856 8.427 1.00 0.48 H new ATOM 0 HA LYS A 164 -5.790 -0.591 9.508 1.00 0.52 H new ATOM 0 HB2 LYS A 164 -7.048 -1.632 12.079 1.00 0.69 H new ATOM 0 HB3 LYS A 164 -5.840 -0.364 12.011 1.00 0.69 H new ATOM 0 HG2 LYS A 164 -8.501 -0.184 10.560 1.00 0.88 H new ATOM 0 HG3 LYS A 164 -8.268 0.392 12.199 1.00 0.88 H new ATOM 0 HD2 LYS A 164 -6.695 1.347 9.772 1.00 1.22 H new ATOM 0 HD3 LYS A 164 -8.040 2.203 10.500 1.00 1.22 H new ATOM 0 HE2 LYS A 164 -6.701 2.158 12.698 1.00 2.04 H new ATOM 0 HE3 LYS A 164 -5.336 1.606 11.747 1.00 2.04 H new ATOM 0 HZ1 LYS A 164 -5.298 3.995 12.031 1.00 2.74 H new ATOM 0 HZ2 LYS A 164 -5.506 3.610 10.391 1.00 2.74 H new ATOM 0 HZ3 LYS A 164 -6.829 4.144 11.312 1.00 2.74 H new ATOM 243 N GLN A 165 -4.611 -3.216 9.510 1.00 0.36 N ATOM 244 CA GLN A 165 -3.374 -3.985 9.585 1.00 0.37 C ATOM 245 C GLN A 165 -2.282 -3.197 8.897 1.00 0.33 C ATOM 246 O GLN A 165 -2.552 -2.159 8.299 1.00 0.38 O ATOM 247 CB GLN A 165 -3.519 -5.338 8.887 1.00 0.42 C ATOM 248 CG GLN A 165 -4.918 -5.906 8.934 1.00 0.50 C ATOM 249 CD GLN A 165 -5.383 -6.222 10.348 1.00 0.66 C ATOM 250 OE1 GLN A 165 -5.946 -5.377 11.034 1.00 1.33 O ATOM 251 NE2 GLN A 165 -5.157 -7.449 10.787 1.00 1.33 N ATOM 0 H GLN A 165 -5.210 -3.449 8.718 1.00 0.36 H new ATOM 0 HA GLN A 165 -3.134 -4.163 10.633 1.00 0.37 H new ATOM 0 HB2 GLN A 165 -3.215 -5.232 7.845 1.00 0.42 H new ATOM 0 HB3 GLN A 165 -2.833 -6.049 9.348 1.00 0.42 H new ATOM 0 HG2 GLN A 165 -5.609 -5.195 8.481 1.00 0.50 H new ATOM 0 HG3 GLN A 165 -4.956 -6.815 8.333 1.00 0.50 H new ATOM 0 HE21 GLN A 165 -4.685 -8.126 10.188 1.00 1.33 H new ATOM 0 HE22 GLN A 165 -5.454 -7.718 11.725 1.00 1.33 H new ATOM 260 N ARG A 166 -1.055 -3.662 8.973 1.00 0.34 N ATOM 261 CA ARG A 166 0.005 -3.004 8.251 1.00 0.32 C ATOM 262 C ARG A 166 1.061 -3.991 7.793 1.00 0.41 C ATOM 263 O ARG A 166 1.536 -4.824 8.562 1.00 0.79 O ATOM 264 CB ARG A 166 0.631 -1.897 9.083 1.00 0.40 C ATOM 265 CG ARG A 166 1.389 -0.909 8.255 1.00 0.95 C ATOM 266 CD ARG A 166 2.261 -0.036 9.122 1.00 0.96 C ATOM 267 NE ARG A 166 3.186 -0.818 9.939 1.00 1.54 N ATOM 268 CZ ARG A 166 4.306 -0.331 10.465 1.00 1.82 C ATOM 269 NH1 ARG A 166 4.666 0.925 10.232 1.00 1.62 N ATOM 270 NH2 ARG A 166 5.072 -1.107 11.221 1.00 2.49 N ATOM 0 H ARG A 166 -0.772 -4.477 9.517 1.00 0.34 H new ATOM 0 HA ARG A 166 -0.439 -2.553 7.363 1.00 0.32 H new ATOM 0 HB2 ARG A 166 -0.152 -1.377 9.635 1.00 0.40 H new ATOM 0 HB3 ARG A 166 1.302 -2.338 9.820 1.00 0.40 H new ATOM 0 HG2 ARG A 166 2.005 -1.436 7.527 1.00 0.95 H new ATOM 0 HG3 ARG A 166 0.691 -0.289 7.693 1.00 0.95 H new ATOM 0 HD2 ARG A 166 2.827 0.650 8.491 1.00 0.96 H new ATOM 0 HD3 ARG A 166 1.632 0.573 9.771 1.00 0.96 H new ATOM 0 HE ARG A 166 2.959 -1.796 10.117 1.00 1.54 H new ATOM 0 HH11 ARG A 166 4.082 1.523 9.647 1.00 1.62 H new ATOM 0 HH12 ARG A 166 5.526 1.293 10.638 1.00 1.62 H new ATOM 0 HH21 ARG A 166 4.801 -2.074 11.397 1.00 2.49 H new ATOM 0 HH22 ARG A 166 5.932 -0.736 11.626 1.00 2.49 H new ATOM 284 N THR A 167 1.393 -3.888 6.528 1.00 0.25 N ATOM 285 CA THR A 167 2.426 -4.688 5.913 1.00 0.27 C ATOM 286 C THR A 167 3.571 -3.781 5.507 1.00 0.25 C ATOM 287 O THR A 167 3.507 -2.568 5.707 1.00 0.31 O ATOM 288 CB THR A 167 1.897 -5.386 4.640 1.00 0.35 C ATOM 289 OG1 THR A 167 2.778 -6.437 4.234 1.00 0.50 O ATOM 290 CG2 THR A 167 1.774 -4.386 3.508 1.00 0.52 C ATOM 0 H THR A 167 0.945 -3.234 5.886 1.00 0.25 H new ATOM 0 HA THR A 167 2.752 -5.442 6.630 1.00 0.27 H new ATOM 0 HB THR A 167 0.918 -5.806 4.871 1.00 0.35 H new ATOM 0 HG1 THR A 167 2.424 -6.867 3.428 1.00 0.50 H new ATOM 0 HG21 THR A 167 1.400 -4.890 2.617 1.00 0.52 H new ATOM 0 HG22 THR A 167 1.081 -3.595 3.795 1.00 0.52 H new ATOM 0 HG23 THR A 167 2.752 -3.953 3.297 1.00 0.52 H new ATOM 298 N VAL A 168 4.611 -4.368 4.943 1.00 0.25 N ATOM 299 CA VAL A 168 5.620 -3.609 4.239 1.00 0.27 C ATOM 300 C VAL A 168 6.362 -4.491 3.243 1.00 0.25 C ATOM 301 O VAL A 168 6.838 -5.580 3.575 1.00 0.30 O ATOM 302 CB VAL A 168 6.594 -2.861 5.163 1.00 0.39 C ATOM 303 CG1 VAL A 168 6.504 -3.336 6.578 1.00 0.73 C ATOM 304 CG2 VAL A 168 7.989 -2.901 4.623 1.00 0.88 C ATOM 0 H VAL A 168 4.776 -5.374 4.961 1.00 0.25 H new ATOM 0 HA VAL A 168 5.087 -2.831 3.692 1.00 0.27 H new ATOM 0 HB VAL A 168 6.294 -1.813 5.183 1.00 0.39 H new ATOM 0 HG11 VAL A 168 7.210 -2.779 7.194 1.00 0.73 H new ATOM 0 HG12 VAL A 168 5.492 -3.177 6.952 1.00 0.73 H new ATOM 0 HG13 VAL A 168 6.744 -4.398 6.621 1.00 0.73 H new ATOM 0 HG21 VAL A 168 8.656 -2.364 5.298 1.00 0.88 H new ATOM 0 HG22 VAL A 168 8.317 -3.937 4.538 1.00 0.88 H new ATOM 0 HG23 VAL A 168 8.012 -2.431 3.640 1.00 0.88 H new ATOM 314 N VAL A 169 6.414 -4.009 2.015 1.00 0.26 N ATOM 315 CA VAL A 169 7.165 -4.642 0.944 1.00 0.26 C ATOM 316 C VAL A 169 8.385 -3.798 0.608 1.00 0.28 C ATOM 317 O VAL A 169 8.335 -2.577 0.718 1.00 0.29 O ATOM 318 CB VAL A 169 6.320 -4.794 -0.329 1.00 0.32 C ATOM 319 CG1 VAL A 169 5.395 -5.987 -0.200 1.00 1.17 C ATOM 320 CG2 VAL A 169 5.524 -3.528 -0.601 1.00 1.31 C ATOM 0 H VAL A 169 5.931 -3.157 1.729 1.00 0.26 H new ATOM 0 HA VAL A 169 7.459 -5.632 1.292 1.00 0.26 H new ATOM 0 HB VAL A 169 6.990 -4.960 -1.173 1.00 0.32 H new ATOM 0 HG11 VAL A 169 4.800 -6.086 -1.108 1.00 1.17 H new ATOM 0 HG12 VAL A 169 5.986 -6.891 -0.053 1.00 1.17 H new ATOM 0 HG13 VAL A 169 4.733 -5.843 0.654 1.00 1.17 H new ATOM 0 HG21 VAL A 169 4.933 -3.658 -1.507 1.00 1.31 H new ATOM 0 HG22 VAL A 169 4.860 -3.328 0.240 1.00 1.31 H new ATOM 0 HG23 VAL A 169 6.208 -2.689 -0.731 1.00 1.31 H new ATOM 330 N PRO A 170 9.508 -4.426 0.240 1.00 0.31 N ATOM 331 CA PRO A 170 10.667 -3.702 -0.281 1.00 0.32 C ATOM 332 C PRO A 170 10.271 -2.768 -1.421 1.00 0.28 C ATOM 333 O PRO A 170 9.364 -3.081 -2.196 1.00 0.33 O ATOM 334 CB PRO A 170 11.579 -4.816 -0.794 1.00 0.40 C ATOM 335 CG PRO A 170 11.212 -6.013 0.013 1.00 0.59 C ATOM 336 CD PRO A 170 9.749 -5.874 0.336 1.00 0.39 C ATOM 0 HA PRO A 170 11.138 -3.069 0.471 1.00 0.32 H new ATOM 0 HB2 PRO A 170 11.425 -4.994 -1.858 1.00 0.40 H new ATOM 0 HB3 PRO A 170 12.630 -4.558 -0.663 1.00 0.40 H new ATOM 0 HG2 PRO A 170 11.401 -6.930 -0.544 1.00 0.59 H new ATOM 0 HG3 PRO A 170 11.808 -6.065 0.924 1.00 0.59 H new ATOM 0 HD2 PRO A 170 9.129 -6.431 -0.367 1.00 0.39 H new ATOM 0 HD3 PRO A 170 9.521 -6.253 1.332 1.00 0.39 H new ATOM 344 N ALA A 171 10.932 -1.617 -1.508 1.00 0.24 N ATOM 345 CA ALA A 171 10.659 -0.661 -2.577 1.00 0.21 C ATOM 346 C ALA A 171 11.116 -1.229 -3.912 1.00 0.24 C ATOM 347 O ALA A 171 12.192 -0.902 -4.412 1.00 0.35 O ATOM 348 CB ALA A 171 11.345 0.671 -2.312 1.00 0.21 C ATOM 0 H ALA A 171 11.658 -1.324 -0.854 1.00 0.24 H new ATOM 0 HA ALA A 171 9.584 -0.486 -2.610 1.00 0.21 H new ATOM 0 HB1 ALA A 171 11.123 1.362 -3.125 1.00 0.21 H new ATOM 0 HB2 ALA A 171 10.981 1.087 -1.372 1.00 0.21 H new ATOM 0 HB3 ALA A 171 12.422 0.519 -2.248 1.00 0.21 H new ATOM 354 N ARG A 172 10.294 -2.105 -4.458 1.00 0.26 N ATOM 355 CA ARG A 172 10.570 -2.741 -5.725 1.00 0.29 C ATOM 356 C ARG A 172 10.596 -1.714 -6.849 1.00 0.27 C ATOM 357 O ARG A 172 9.574 -1.120 -7.194 1.00 0.27 O ATOM 358 CB ARG A 172 9.521 -3.820 -5.981 1.00 0.33 C ATOM 359 CG ARG A 172 9.738 -5.081 -5.160 1.00 0.46 C ATOM 360 CD ARG A 172 11.017 -5.796 -5.569 1.00 0.56 C ATOM 361 NE ARG A 172 10.960 -6.268 -6.954 1.00 1.33 N ATOM 362 CZ ARG A 172 11.868 -5.977 -7.889 1.00 1.81 C ATOM 363 NH1 ARG A 172 12.896 -5.178 -7.608 1.00 1.58 N ATOM 364 NH2 ARG A 172 11.744 -6.485 -9.108 1.00 2.81 N ATOM 0 H ARG A 172 9.414 -2.394 -4.031 1.00 0.26 H new ATOM 0 HA ARG A 172 11.555 -3.207 -5.692 1.00 0.29 H new ATOM 0 HB2 ARG A 172 8.533 -3.416 -5.758 1.00 0.33 H new ATOM 0 HB3 ARG A 172 9.528 -4.079 -7.040 1.00 0.33 H new ATOM 0 HG2 ARG A 172 9.785 -4.824 -4.102 1.00 0.46 H new ATOM 0 HG3 ARG A 172 8.888 -5.751 -5.288 1.00 0.46 H new ATOM 0 HD2 ARG A 172 11.864 -5.121 -5.450 1.00 0.56 H new ATOM 0 HD3 ARG A 172 11.188 -6.642 -4.904 1.00 0.56 H new ATOM 0 HE ARG A 172 10.173 -6.859 -7.223 1.00 1.33 H new ATOM 0 HH11 ARG A 172 12.994 -4.783 -6.673 1.00 1.58 H new ATOM 0 HH12 ARG A 172 13.585 -4.961 -8.328 1.00 1.58 H new ATOM 0 HH21 ARG A 172 10.957 -7.096 -9.328 1.00 2.81 H new ATOM 0 HH22 ARG A 172 12.435 -6.265 -9.825 1.00 2.81 H new ATOM 378 N CYS A 173 11.780 -1.501 -7.401 1.00 0.30 N ATOM 379 CA CYS A 173 11.974 -0.506 -8.440 1.00 0.32 C ATOM 380 C CYS A 173 11.475 -1.017 -9.781 1.00 0.31 C ATOM 381 O CYS A 173 11.855 -2.102 -10.226 1.00 0.41 O ATOM 382 CB CYS A 173 13.451 -0.131 -8.531 1.00 0.40 C ATOM 383 SG CYS A 173 14.142 0.533 -6.998 1.00 1.44 S ATOM 0 H CYS A 173 12.626 -2.009 -7.143 1.00 0.30 H new ATOM 0 HA CYS A 173 11.396 0.381 -8.181 1.00 0.32 H new ATOM 0 HB2 CYS A 173 14.021 -1.013 -8.821 1.00 0.40 H new ATOM 0 HB3 CYS A 173 13.579 0.606 -9.324 1.00 0.40 H new ATOM 0 HG CYS A 173 13.352 1.453 -6.529 1.00 1.44 H new ATOM 389 N GLY A 174 10.609 -0.238 -10.411 1.00 0.30 N ATOM 390 CA GLY A 174 10.090 -0.607 -11.707 1.00 0.33 C ATOM 391 C GLY A 174 8.838 -1.447 -11.602 1.00 0.30 C ATOM 392 O GLY A 174 8.485 -2.169 -12.535 1.00 0.43 O ATOM 0 H GLY A 174 10.256 0.646 -10.044 1.00 0.30 H new ATOM 0 HA2 GLY A 174 9.874 0.295 -12.280 1.00 0.33 H new ATOM 0 HA3 GLY A 174 10.851 -1.160 -12.258 1.00 0.33 H new ATOM 396 N VAL A 175 8.156 -1.355 -10.471 1.00 0.25 N ATOM 397 CA VAL A 175 6.931 -2.105 -10.272 1.00 0.28 C ATOM 398 C VAL A 175 5.837 -1.198 -9.737 1.00 0.26 C ATOM 399 O VAL A 175 6.109 -0.204 -9.056 1.00 0.35 O ATOM 400 CB VAL A 175 7.137 -3.307 -9.321 1.00 0.35 C ATOM 401 CG1 VAL A 175 7.039 -2.890 -7.879 1.00 0.69 C ATOM 402 CG2 VAL A 175 6.130 -4.409 -9.591 1.00 0.97 C ATOM 0 H VAL A 175 8.430 -0.770 -9.681 1.00 0.25 H new ATOM 0 HA VAL A 175 6.630 -2.499 -11.243 1.00 0.28 H new ATOM 0 HB VAL A 175 8.140 -3.689 -9.514 1.00 0.35 H new ATOM 0 HG11 VAL A 175 7.189 -3.759 -7.238 1.00 0.69 H new ATOM 0 HG12 VAL A 175 7.804 -2.144 -7.663 1.00 0.69 H new ATOM 0 HG13 VAL A 175 6.053 -2.465 -7.689 1.00 0.69 H new ATOM 0 HG21 VAL A 175 6.304 -5.237 -8.905 1.00 0.97 H new ATOM 0 HG22 VAL A 175 5.121 -4.023 -9.445 1.00 0.97 H new ATOM 0 HG23 VAL A 175 6.240 -4.759 -10.617 1.00 0.97 H new ATOM 412 N THR A 176 4.606 -1.535 -10.058 1.00 0.22 N ATOM 413 CA THR A 176 3.476 -0.742 -9.640 1.00 0.25 C ATOM 414 C THR A 176 2.990 -1.164 -8.261 1.00 0.23 C ATOM 415 O THR A 176 3.284 -2.280 -7.801 1.00 0.25 O ATOM 416 CB THR A 176 2.320 -0.864 -10.648 1.00 0.31 C ATOM 417 OG1 THR A 176 1.971 -2.245 -10.823 1.00 0.47 O ATOM 418 CG2 THR A 176 2.707 -0.262 -11.991 1.00 0.40 C ATOM 0 H THR A 176 4.365 -2.358 -10.610 1.00 0.22 H new ATOM 0 HA THR A 176 3.805 0.296 -9.596 1.00 0.25 H new ATOM 0 HB THR A 176 1.463 -0.316 -10.255 1.00 0.31 H new ATOM 0 HG1 THR A 176 1.233 -2.317 -11.464 1.00 0.47 H new ATOM 0 HG21 THR A 176 1.874 -0.360 -12.687 1.00 0.40 H new ATOM 0 HG22 THR A 176 2.949 0.793 -11.861 1.00 0.40 H new ATOM 0 HG23 THR A 176 3.576 -0.787 -12.388 1.00 0.40 H new ATOM 426 N VAL A 177 2.272 -0.266 -7.597 1.00 0.25 N ATOM 427 CA VAL A 177 1.622 -0.580 -6.334 1.00 0.27 C ATOM 428 C VAL A 177 0.854 -1.891 -6.463 1.00 0.24 C ATOM 429 O VAL A 177 0.960 -2.767 -5.612 1.00 0.28 O ATOM 430 CB VAL A 177 0.650 0.546 -5.925 1.00 0.34 C ATOM 431 CG1 VAL A 177 -0.018 0.241 -4.594 1.00 1.20 C ATOM 432 CG2 VAL A 177 1.373 1.878 -5.863 1.00 1.39 C ATOM 0 H VAL A 177 2.126 0.692 -7.917 1.00 0.25 H new ATOM 0 HA VAL A 177 2.389 -0.676 -5.566 1.00 0.27 H new ATOM 0 HB VAL A 177 -0.129 0.607 -6.685 1.00 0.34 H new ATOM 0 HG11 VAL A 177 -0.697 1.053 -4.333 1.00 1.20 H new ATOM 0 HG12 VAL A 177 -0.579 -0.690 -4.674 1.00 1.20 H new ATOM 0 HG13 VAL A 177 0.743 0.141 -3.820 1.00 1.20 H new ATOM 0 HG21 VAL A 177 0.671 2.660 -5.573 1.00 1.39 H new ATOM 0 HG22 VAL A 177 2.177 1.822 -5.129 1.00 1.39 H new ATOM 0 HG23 VAL A 177 1.791 2.111 -6.842 1.00 1.39 H new ATOM 442 N ARG A 178 0.138 -2.021 -7.576 1.00 0.23 N ATOM 443 CA ARG A 178 -0.719 -3.165 -7.853 1.00 0.26 C ATOM 444 C ARG A 178 -0.071 -4.500 -7.504 1.00 0.23 C ATOM 445 O ARG A 178 -0.654 -5.305 -6.794 1.00 0.33 O ATOM 446 CB ARG A 178 -1.114 -3.132 -9.333 1.00 0.39 C ATOM 447 CG ARG A 178 -2.072 -4.231 -9.750 1.00 0.85 C ATOM 448 CD ARG A 178 -3.297 -4.252 -8.861 1.00 1.65 C ATOM 449 NE ARG A 178 -4.304 -5.211 -9.323 1.00 2.02 N ATOM 450 CZ ARG A 178 -5.623 -5.060 -9.159 1.00 2.82 C ATOM 451 NH1 ARG A 178 -6.106 -3.996 -8.521 1.00 3.53 N ATOM 452 NH2 ARG A 178 -6.459 -5.973 -9.637 1.00 3.28 N ATOM 0 H ARG A 178 0.138 -1.324 -8.320 1.00 0.23 H new ATOM 0 HA ARG A 178 -1.600 -3.085 -7.216 1.00 0.26 H new ATOM 0 HB2 ARG A 178 -1.569 -2.167 -9.554 1.00 0.39 H new ATOM 0 HB3 ARG A 178 -0.211 -3.204 -9.939 1.00 0.39 H new ATOM 0 HG2 ARG A 178 -2.374 -4.081 -10.787 1.00 0.85 H new ATOM 0 HG3 ARG A 178 -1.567 -5.196 -9.702 1.00 0.85 H new ATOM 0 HD2 ARG A 178 -3.000 -4.503 -7.843 1.00 1.65 H new ATOM 0 HD3 ARG A 178 -3.736 -3.255 -8.828 1.00 1.65 H new ATOM 0 HE ARG A 178 -3.977 -6.050 -9.802 1.00 2.02 H new ATOM 0 HH11 ARG A 178 -5.469 -3.289 -8.153 1.00 3.53 H new ATOM 0 HH12 ARG A 178 -7.113 -3.888 -8.400 1.00 3.53 H new ATOM 0 HH21 ARG A 178 -6.096 -6.789 -10.129 1.00 3.28 H new ATOM 0 HH22 ARG A 178 -7.465 -5.859 -9.512 1.00 3.28 H new ATOM 466 N ASP A 179 1.129 -4.715 -7.993 1.00 0.20 N ATOM 467 CA ASP A 179 1.841 -5.973 -7.781 1.00 0.19 C ATOM 468 C ASP A 179 2.327 -6.076 -6.350 1.00 0.17 C ATOM 469 O ASP A 179 2.070 -7.062 -5.643 1.00 0.18 O ATOM 470 CB ASP A 179 3.043 -6.063 -8.725 1.00 0.23 C ATOM 471 CG ASP A 179 3.775 -7.391 -8.623 1.00 0.32 C ATOM 472 OD1 ASP A 179 3.575 -8.250 -9.505 1.00 1.12 O ATOM 473 OD2 ASP A 179 4.560 -7.577 -7.668 1.00 1.19 O ATOM 0 H ASP A 179 1.645 -4.032 -8.548 1.00 0.20 H new ATOM 0 HA ASP A 179 1.151 -6.792 -7.985 1.00 0.19 H new ATOM 0 HB2 ASP A 179 2.705 -5.918 -9.751 1.00 0.23 H new ATOM 0 HB3 ASP A 179 3.737 -5.253 -8.500 1.00 0.23 H new ATOM 478 N SER A 180 2.998 -5.029 -5.923 1.00 0.17 N ATOM 479 CA SER A 180 3.668 -5.019 -4.644 1.00 0.18 C ATOM 480 C SER A 180 2.673 -5.250 -3.518 1.00 0.17 C ATOM 481 O SER A 180 2.833 -6.161 -2.690 1.00 0.19 O ATOM 482 CB SER A 180 4.400 -3.689 -4.499 1.00 0.22 C ATOM 483 OG SER A 180 3.616 -2.618 -4.992 1.00 1.34 O ATOM 0 H SER A 180 3.094 -4.163 -6.453 1.00 0.17 H new ATOM 0 HA SER A 180 4.394 -5.830 -4.587 1.00 0.18 H new ATOM 0 HB2 SER A 180 4.640 -3.515 -3.450 1.00 0.22 H new ATOM 0 HB3 SER A 180 5.346 -3.730 -5.040 1.00 0.22 H new ATOM 0 HG SER A 180 2.690 -2.917 -5.107 1.00 1.34 H new ATOM 489 N LEU A 181 1.610 -4.474 -3.500 1.00 0.17 N ATOM 490 CA LEU A 181 0.677 -4.611 -2.430 1.00 0.18 C ATOM 491 C LEU A 181 -0.444 -5.617 -2.736 1.00 0.18 C ATOM 492 O LEU A 181 -1.269 -5.888 -1.865 1.00 0.20 O ATOM 493 CB LEU A 181 0.174 -3.235 -1.965 1.00 0.24 C ATOM 494 CG LEU A 181 -1.117 -2.659 -2.553 1.00 0.35 C ATOM 495 CD1 LEU A 181 -1.359 -3.086 -3.978 1.00 1.08 C ATOM 496 CD2 LEU A 181 -2.292 -3.001 -1.661 1.00 0.96 C ATOM 0 H LEU A 181 1.384 -3.765 -4.197 1.00 0.17 H new ATOM 0 HA LEU A 181 1.204 -5.052 -1.584 1.00 0.18 H new ATOM 0 HB2 LEU A 181 0.045 -3.284 -0.884 1.00 0.24 H new ATOM 0 HB3 LEU A 181 0.969 -2.515 -2.159 1.00 0.24 H new ATOM 0 HG LEU A 181 -1.003 -1.576 -2.587 1.00 0.35 H new ATOM 0 HD11 LEU A 181 -2.289 -2.645 -4.337 1.00 1.08 H new ATOM 0 HD12 LEU A 181 -0.532 -2.750 -4.604 1.00 1.08 H new ATOM 0 HD13 LEU A 181 -1.431 -4.173 -4.025 1.00 1.08 H new ATOM 0 HD21 LEU A 181 -3.205 -2.587 -2.088 1.00 0.96 H new ATOM 0 HD22 LEU A 181 -2.386 -4.084 -1.583 1.00 0.96 H new ATOM 0 HD23 LEU A 181 -2.131 -2.579 -0.669 1.00 0.96 H new ATOM 508 N LYS A 182 -0.497 -6.197 -3.951 1.00 0.18 N ATOM 509 CA LYS A 182 -1.435 -7.303 -4.149 1.00 0.22 C ATOM 510 C LYS A 182 -0.969 -8.464 -3.291 1.00 0.22 C ATOM 511 O LYS A 182 -1.773 -9.219 -2.747 1.00 0.25 O ATOM 512 CB LYS A 182 -1.594 -7.754 -5.610 1.00 0.32 C ATOM 513 CG LYS A 182 -0.415 -8.532 -6.159 1.00 0.75 C ATOM 514 CD LYS A 182 -0.742 -9.215 -7.483 1.00 0.76 C ATOM 515 CE LYS A 182 -1.155 -8.222 -8.563 1.00 0.80 C ATOM 516 NZ LYS A 182 -1.434 -8.899 -9.856 1.00 1.15 N ATOM 0 H LYS A 182 0.064 -5.935 -4.761 1.00 0.18 H new ATOM 0 HA LYS A 182 -2.423 -6.948 -3.857 1.00 0.22 H new ATOM 0 HB2 LYS A 182 -2.489 -8.370 -5.691 1.00 0.32 H new ATOM 0 HB3 LYS A 182 -1.755 -6.874 -6.233 1.00 0.32 H new ATOM 0 HG2 LYS A 182 0.430 -7.858 -6.299 1.00 0.75 H new ATOM 0 HG3 LYS A 182 -0.107 -9.283 -5.431 1.00 0.75 H new ATOM 0 HD2 LYS A 182 0.128 -9.777 -7.823 1.00 0.76 H new ATOM 0 HD3 LYS A 182 -1.546 -9.935 -7.329 1.00 0.76 H new ATOM 0 HE2 LYS A 182 -2.043 -7.679 -8.238 1.00 0.80 H new ATOM 0 HE3 LYS A 182 -0.364 -7.485 -8.702 1.00 0.80 H new ATOM 0 HZ1 LYS A 182 -1.712 -8.191 -10.566 1.00 1.15 H new ATOM 0 HZ2 LYS A 182 -0.580 -9.396 -10.179 1.00 1.15 H new ATOM 0 HZ3 LYS A 182 -2.206 -9.584 -9.730 1.00 1.15 H new ATOM 530 N LYS A 183 0.350 -8.577 -3.151 1.00 0.22 N ATOM 531 CA LYS A 183 0.927 -9.534 -2.224 1.00 0.25 C ATOM 532 C LYS A 183 0.667 -9.076 -0.792 1.00 0.23 C ATOM 533 O LYS A 183 0.362 -9.892 0.077 1.00 0.26 O ATOM 534 CB LYS A 183 2.426 -9.705 -2.483 1.00 0.33 C ATOM 535 CG LYS A 183 3.117 -10.685 -1.541 1.00 0.40 C ATOM 536 CD LYS A 183 3.829 -9.969 -0.406 1.00 1.18 C ATOM 537 CE LYS A 183 5.100 -10.694 0.018 1.00 1.31 C ATOM 538 NZ LYS A 183 6.059 -10.863 -1.109 1.00 1.80 N ATOM 0 H LYS A 183 1.031 -8.020 -3.666 1.00 0.22 H new ATOM 0 HA LYS A 183 0.456 -10.505 -2.374 1.00 0.25 H new ATOM 0 HB2 LYS A 183 2.569 -10.043 -3.509 1.00 0.33 H new ATOM 0 HB3 LYS A 183 2.911 -8.733 -2.397 1.00 0.33 H new ATOM 0 HG2 LYS A 183 2.380 -11.375 -1.130 1.00 0.40 H new ATOM 0 HG3 LYS A 183 3.836 -11.283 -2.102 1.00 0.40 H new ATOM 0 HD2 LYS A 183 4.077 -8.954 -0.717 1.00 1.18 H new ATOM 0 HD3 LYS A 183 3.157 -9.886 0.448 1.00 1.18 H new ATOM 0 HE2 LYS A 183 5.582 -10.137 0.821 1.00 1.31 H new ATOM 0 HE3 LYS A 183 4.840 -11.673 0.420 1.00 1.31 H new ATOM 0 HZ1 LYS A 183 7.024 -10.955 -0.733 1.00 1.80 H new ATOM 0 HZ2 LYS A 183 5.814 -11.718 -1.648 1.00 1.80 H new ATOM 0 HZ3 LYS A 183 6.009 -10.034 -1.735 1.00 1.80 H new ATOM 552 N ALA A 184 0.776 -7.766 -0.557 1.00 0.23 N ATOM 553 CA ALA A 184 0.434 -7.188 0.745 1.00 0.26 C ATOM 554 C ALA A 184 -0.950 -7.647 1.205 1.00 0.25 C ATOM 555 O ALA A 184 -1.113 -8.155 2.316 1.00 0.29 O ATOM 556 CB ALA A 184 0.464 -5.675 0.657 1.00 0.30 C ATOM 0 H ALA A 184 1.097 -7.088 -1.248 1.00 0.23 H new ATOM 0 HA ALA A 184 1.169 -7.530 1.473 1.00 0.26 H new ATOM 0 HB1 ALA A 184 0.209 -5.249 1.627 1.00 0.30 H new ATOM 0 HB2 ALA A 184 1.462 -5.347 0.368 1.00 0.30 H new ATOM 0 HB3 ALA A 184 -0.258 -5.339 -0.088 1.00 0.30 H new ATOM 562 N LEU A 185 -1.936 -7.464 0.337 1.00 0.23 N ATOM 563 CA LEU A 185 -3.306 -7.873 0.616 1.00 0.26 C ATOM 564 C LEU A 185 -3.401 -9.380 0.827 1.00 0.24 C ATOM 565 O LEU A 185 -3.942 -9.841 1.832 1.00 0.27 O ATOM 566 CB LEU A 185 -4.214 -7.460 -0.543 1.00 0.31 C ATOM 567 CG LEU A 185 -4.466 -5.960 -0.678 1.00 0.50 C ATOM 568 CD1 LEU A 185 -4.556 -5.573 -2.140 1.00 1.46 C ATOM 569 CD2 LEU A 185 -5.745 -5.567 0.040 1.00 1.11 C ATOM 0 H LEU A 185 -1.810 -7.029 -0.577 1.00 0.23 H new ATOM 0 HA LEU A 185 -3.627 -7.378 1.533 1.00 0.26 H new ATOM 0 HB2 LEU A 185 -3.775 -7.822 -1.473 1.00 0.31 H new ATOM 0 HB3 LEU A 185 -5.174 -7.963 -0.427 1.00 0.31 H new ATOM 0 HG LEU A 185 -3.631 -5.429 -0.220 1.00 0.50 H new ATOM 0 HD11 LEU A 185 -4.736 -4.501 -2.222 1.00 1.46 H new ATOM 0 HD12 LEU A 185 -3.621 -5.824 -2.641 1.00 1.46 H new ATOM 0 HD13 LEU A 185 -5.376 -6.116 -2.610 1.00 1.46 H new ATOM 0 HD21 LEU A 185 -5.908 -4.495 -0.067 1.00 1.11 H new ATOM 0 HD22 LEU A 185 -6.587 -6.107 -0.394 1.00 1.11 H new ATOM 0 HD23 LEU A 185 -5.660 -5.817 1.098 1.00 1.11 H new ATOM 581 N MET A 186 -2.849 -10.138 -0.113 1.00 0.22 N ATOM 582 CA MET A 186 -2.958 -11.595 -0.100 1.00 0.26 C ATOM 583 C MET A 186 -2.333 -12.214 1.145 1.00 0.29 C ATOM 584 O MET A 186 -2.748 -13.286 1.582 1.00 0.34 O ATOM 585 CB MET A 186 -2.318 -12.188 -1.353 1.00 0.30 C ATOM 586 CG MET A 186 -3.145 -11.995 -2.616 1.00 0.35 C ATOM 587 SD MET A 186 -4.235 -13.391 -2.980 1.00 0.98 S ATOM 588 CE MET A 186 -5.292 -13.423 -1.532 1.00 1.45 C ATOM 0 H MET A 186 -2.317 -9.766 -0.900 1.00 0.22 H new ATOM 0 HA MET A 186 -4.021 -11.834 -0.085 1.00 0.26 H new ATOM 0 HB2 MET A 186 -1.338 -11.734 -1.499 1.00 0.30 H new ATOM 0 HB3 MET A 186 -2.155 -13.254 -1.196 1.00 0.30 H new ATOM 0 HG2 MET A 186 -3.746 -11.091 -2.514 1.00 0.35 H new ATOM 0 HG3 MET A 186 -2.474 -11.838 -3.460 1.00 0.35 H new ATOM 0 HE1 MET A 186 -6.067 -14.178 -1.664 1.00 1.45 H new ATOM 0 HE2 MET A 186 -4.696 -13.665 -0.652 1.00 1.45 H new ATOM 0 HE3 MET A 186 -5.756 -12.446 -1.399 1.00 1.45 H new ATOM 598 N MET A 187 -1.357 -11.535 1.732 1.00 0.30 N ATOM 599 CA MET A 187 -0.684 -12.051 2.919 1.00 0.37 C ATOM 600 C MET A 187 -1.565 -11.895 4.158 1.00 0.40 C ATOM 601 O MET A 187 -1.344 -12.544 5.180 1.00 0.53 O ATOM 602 CB MET A 187 0.673 -11.372 3.115 1.00 0.44 C ATOM 603 CG MET A 187 1.698 -11.777 2.065 1.00 0.49 C ATOM 604 SD MET A 187 1.894 -13.565 1.955 1.00 0.72 S ATOM 605 CE MET A 187 2.725 -13.698 0.377 1.00 0.85 C ATOM 0 H MET A 187 -1.014 -10.630 1.409 1.00 0.30 H new ATOM 0 HA MET A 187 -0.505 -13.116 2.771 1.00 0.37 H new ATOM 0 HB2 MET A 187 0.539 -10.291 3.086 1.00 0.44 H new ATOM 0 HB3 MET A 187 1.057 -11.620 4.104 1.00 0.44 H new ATOM 0 HG2 MET A 187 1.394 -11.387 1.094 1.00 0.49 H new ATOM 0 HG3 MET A 187 2.659 -11.322 2.304 1.00 0.49 H new ATOM 0 HE1 MET A 187 3.345 -14.594 0.367 1.00 0.85 H new ATOM 0 HE2 MET A 187 1.984 -13.760 -0.420 1.00 0.85 H new ATOM 0 HE3 MET A 187 3.353 -12.821 0.221 1.00 0.85 H new ATOM 615 N ARG A 188 -2.556 -11.021 4.067 1.00 0.35 N ATOM 616 CA ARG A 188 -3.584 -10.906 5.077 1.00 0.41 C ATOM 617 C ARG A 188 -4.807 -11.718 4.672 1.00 0.41 C ATOM 618 O ARG A 188 -5.720 -11.942 5.464 1.00 0.50 O ATOM 619 CB ARG A 188 -3.968 -9.446 5.223 1.00 0.47 C ATOM 620 CG ARG A 188 -2.865 -8.559 5.771 1.00 0.79 C ATOM 621 CD ARG A 188 -2.538 -8.857 7.226 1.00 0.63 C ATOM 622 NE ARG A 188 -1.813 -10.116 7.412 1.00 1.20 N ATOM 623 CZ ARG A 188 -1.338 -10.530 8.588 1.00 1.43 C ATOM 624 NH1 ARG A 188 -1.462 -9.760 9.663 1.00 1.42 N ATOM 625 NH2 ARG A 188 -0.719 -11.701 8.685 1.00 2.12 N ATOM 0 H ARG A 188 -2.666 -10.373 3.287 1.00 0.35 H new ATOM 0 HA ARG A 188 -3.207 -11.288 6.026 1.00 0.41 H new ATOM 0 HB2 ARG A 188 -4.274 -9.064 4.249 1.00 0.47 H new ATOM 0 HB3 ARG A 188 -4.835 -9.375 5.880 1.00 0.47 H new ATOM 0 HG2 ARG A 188 -1.967 -8.689 5.167 1.00 0.79 H new ATOM 0 HG3 ARG A 188 -3.164 -7.515 5.677 1.00 0.79 H new ATOM 0 HD2 ARG A 188 -1.942 -8.040 7.632 1.00 0.63 H new ATOM 0 HD3 ARG A 188 -3.464 -8.891 7.799 1.00 0.63 H new ATOM 0 HE ARG A 188 -1.663 -10.710 6.596 1.00 1.20 H new ATOM 0 HH11 ARG A 188 -1.921 -8.852 9.590 1.00 1.42 H new ATOM 0 HH12 ARG A 188 -1.099 -10.077 10.562 1.00 1.42 H new ATOM 0 HH21 ARG A 188 -0.605 -12.288 7.858 1.00 2.12 H new ATOM 0 HH22 ARG A 188 -0.357 -12.014 9.586 1.00 2.12 H new ATOM 639 N GLY A 189 -4.810 -12.144 3.421 1.00 0.37 N ATOM 640 CA GLY A 189 -5.928 -12.892 2.887 1.00 0.42 C ATOM 641 C GLY A 189 -6.945 -11.984 2.229 1.00 0.43 C ATOM 642 O GLY A 189 -8.099 -12.361 2.039 1.00 0.53 O ATOM 0 H GLY A 189 -4.051 -11.984 2.759 1.00 0.37 H new ATOM 0 HA2 GLY A 189 -5.566 -13.619 2.161 1.00 0.42 H new ATOM 0 HA3 GLY A 189 -6.407 -13.454 3.689 1.00 0.42 H new ATOM 646 N LEU A 190 -6.510 -10.780 1.890 1.00 0.37 N ATOM 647 CA LEU A 190 -7.384 -9.784 1.285 1.00 0.40 C ATOM 648 C LEU A 190 -7.127 -9.701 -0.214 1.00 0.35 C ATOM 649 O LEU A 190 -6.143 -10.253 -0.712 1.00 0.37 O ATOM 650 CB LEU A 190 -7.144 -8.418 1.931 1.00 0.45 C ATOM 651 CG LEU A 190 -7.021 -8.433 3.457 1.00 0.61 C ATOM 652 CD1 LEU A 190 -6.916 -7.022 3.998 1.00 1.05 C ATOM 653 CD2 LEU A 190 -8.193 -9.164 4.087 1.00 1.28 C ATOM 0 H LEU A 190 -5.549 -10.466 2.025 1.00 0.37 H new ATOM 0 HA LEU A 190 -8.420 -10.079 1.449 1.00 0.40 H new ATOM 0 HB2 LEU A 190 -6.232 -7.991 1.513 1.00 0.45 H new ATOM 0 HB3 LEU A 190 -7.963 -7.754 1.655 1.00 0.45 H new ATOM 0 HG LEU A 190 -6.109 -8.969 3.719 1.00 0.61 H new ATOM 0 HD11 LEU A 190 -6.829 -7.054 5.084 1.00 1.05 H new ATOM 0 HD12 LEU A 190 -6.035 -6.536 3.578 1.00 1.05 H new ATOM 0 HD13 LEU A 190 -7.808 -6.459 3.722 1.00 1.05 H new ATOM 0 HD21 LEU A 190 -8.083 -9.161 5.171 1.00 1.28 H new ATOM 0 HD22 LEU A 190 -9.122 -8.664 3.815 1.00 1.28 H new ATOM 0 HD23 LEU A 190 -8.216 -10.193 3.727 1.00 1.28 H new ATOM 665 N ILE A 191 -8.003 -9.012 -0.930 1.00 0.37 N ATOM 666 CA ILE A 191 -7.886 -8.907 -2.374 1.00 0.35 C ATOM 667 C ILE A 191 -7.919 -7.453 -2.841 1.00 0.36 C ATOM 668 O ILE A 191 -8.643 -6.620 -2.292 1.00 0.39 O ATOM 669 CB ILE A 191 -9.003 -9.696 -3.083 1.00 0.39 C ATOM 670 CG1 ILE A 191 -10.380 -9.149 -2.695 1.00 0.45 C ATOM 671 CG2 ILE A 191 -8.893 -11.170 -2.724 1.00 0.41 C ATOM 672 CD1 ILE A 191 -11.507 -9.709 -3.521 1.00 0.52 C ATOM 0 H ILE A 191 -8.802 -8.518 -0.533 1.00 0.37 H new ATOM 0 HA ILE A 191 -6.920 -9.336 -2.640 1.00 0.35 H new ATOM 0 HB ILE A 191 -8.888 -9.583 -4.161 1.00 0.39 H new ATOM 0 HG12 ILE A 191 -10.566 -9.370 -1.644 1.00 0.45 H new ATOM 0 HG13 ILE A 191 -10.372 -8.064 -2.796 1.00 0.45 H new ATOM 0 HG21 ILE A 191 -9.684 -11.727 -3.226 1.00 0.41 H new ATOM 0 HG22 ILE A 191 -7.923 -11.551 -3.043 1.00 0.41 H new ATOM 0 HG23 ILE A 191 -8.994 -11.290 -1.645 1.00 0.41 H new ATOM 0 HD11 ILE A 191 -12.451 -9.276 -3.190 1.00 0.52 H new ATOM 0 HD12 ILE A 191 -11.345 -9.465 -4.571 1.00 0.52 H new ATOM 0 HD13 ILE A 191 -11.542 -10.792 -3.402 1.00 0.52 H new ATOM 684 N PRO A 192 -7.125 -7.142 -3.881 1.00 0.39 N ATOM 685 CA PRO A 192 -7.022 -5.789 -4.448 1.00 0.43 C ATOM 686 C PRO A 192 -8.251 -5.391 -5.257 1.00 0.41 C ATOM 687 O PRO A 192 -8.353 -4.263 -5.737 1.00 0.46 O ATOM 688 CB PRO A 192 -5.801 -5.888 -5.365 1.00 0.52 C ATOM 689 CG PRO A 192 -5.746 -7.319 -5.765 1.00 0.48 C ATOM 690 CD PRO A 192 -6.243 -8.097 -4.579 1.00 0.43 C ATOM 0 HA PRO A 192 -6.940 -5.031 -3.669 1.00 0.43 H new ATOM 0 HB2 PRO A 192 -5.904 -5.238 -6.234 1.00 0.52 H new ATOM 0 HB3 PRO A 192 -4.891 -5.586 -4.847 1.00 0.52 H new ATOM 0 HG2 PRO A 192 -6.367 -7.504 -6.642 1.00 0.48 H new ATOM 0 HG3 PRO A 192 -4.729 -7.613 -6.027 1.00 0.48 H new ATOM 0 HD2 PRO A 192 -6.784 -8.992 -4.885 1.00 0.43 H new ATOM 0 HD3 PRO A 192 -5.422 -8.424 -3.941 1.00 0.43 H new ATOM 698 N GLU A 193 -9.174 -6.327 -5.409 1.00 0.39 N ATOM 699 CA GLU A 193 -10.376 -6.095 -6.192 1.00 0.43 C ATOM 700 C GLU A 193 -11.359 -5.220 -5.422 1.00 0.36 C ATOM 701 O GLU A 193 -12.065 -4.399 -6.005 1.00 0.45 O ATOM 702 CB GLU A 193 -11.040 -7.426 -6.547 1.00 0.57 C ATOM 703 CG GLU A 193 -10.074 -8.469 -7.087 1.00 0.99 C ATOM 704 CD GLU A 193 -10.774 -9.732 -7.537 1.00 1.20 C ATOM 705 OE1 GLU A 193 -10.998 -9.891 -8.755 1.00 1.73 O ATOM 706 OE2 GLU A 193 -11.108 -10.572 -6.677 1.00 1.74 O ATOM 0 H GLU A 193 -9.113 -7.259 -4.998 1.00 0.39 H new ATOM 0 HA GLU A 193 -10.091 -5.579 -7.109 1.00 0.43 H new ATOM 0 HB2 GLU A 193 -11.531 -7.824 -5.659 1.00 0.57 H new ATOM 0 HB3 GLU A 193 -11.818 -7.247 -7.289 1.00 0.57 H new ATOM 0 HG2 GLU A 193 -9.520 -8.046 -7.925 1.00 0.99 H new ATOM 0 HG3 GLU A 193 -9.345 -8.717 -6.316 1.00 0.99 H new ATOM 713 N CYS A 194 -11.390 -5.395 -4.109 1.00 0.33 N ATOM 714 CA CYS A 194 -12.349 -4.692 -3.267 1.00 0.36 C ATOM 715 C CYS A 194 -11.680 -3.594 -2.443 1.00 0.33 C ATOM 716 O CYS A 194 -12.317 -2.980 -1.585 1.00 0.49 O ATOM 717 CB CYS A 194 -13.039 -5.690 -2.339 1.00 0.48 C ATOM 718 SG CYS A 194 -13.841 -7.061 -3.205 1.00 1.69 S ATOM 0 H CYS A 194 -10.762 -6.018 -3.602 1.00 0.33 H new ATOM 0 HA CYS A 194 -13.084 -4.217 -3.916 1.00 0.36 H new ATOM 0 HB2 CYS A 194 -12.303 -6.093 -1.643 1.00 0.48 H new ATOM 0 HB3 CYS A 194 -13.785 -5.163 -1.744 1.00 0.48 H new ATOM 0 HG CYS A 194 -14.396 -7.856 -2.339 1.00 1.69 H new ATOM 724 N CYS A 195 -10.409 -3.333 -2.710 1.00 0.27 N ATOM 725 CA CYS A 195 -9.659 -2.369 -1.914 1.00 0.25 C ATOM 726 C CYS A 195 -8.992 -1.325 -2.797 1.00 0.23 C ATOM 727 O CYS A 195 -8.615 -1.613 -3.927 1.00 0.29 O ATOM 728 CB CYS A 195 -8.591 -3.086 -1.084 1.00 0.28 C ATOM 729 SG CYS A 195 -9.247 -4.314 0.069 1.00 0.52 S ATOM 0 H CYS A 195 -9.878 -3.770 -3.464 1.00 0.27 H new ATOM 0 HA CYS A 195 -10.364 -1.866 -1.252 1.00 0.25 H new ATOM 0 HB2 CYS A 195 -7.891 -3.577 -1.760 1.00 0.28 H new ATOM 0 HB3 CYS A 195 -8.024 -2.343 -0.522 1.00 0.28 H new ATOM 0 HG CYS A 195 -9.226 -5.488 -0.489 1.00 0.52 H new ATOM 735 N ALA A 196 -8.913 -0.100 -2.289 1.00 0.26 N ATOM 736 CA ALA A 196 -8.175 0.966 -2.943 1.00 0.26 C ATOM 737 C ALA A 196 -6.953 1.324 -2.122 1.00 0.25 C ATOM 738 O ALA A 196 -6.890 1.021 -0.932 1.00 0.39 O ATOM 739 CB ALA A 196 -9.031 2.207 -3.123 1.00 0.37 C ATOM 0 H ALA A 196 -9.359 0.178 -1.415 1.00 0.26 H new ATOM 0 HA ALA A 196 -7.876 0.606 -3.927 1.00 0.26 H new ATOM 0 HB1 ALA A 196 -8.446 2.984 -3.616 1.00 0.37 H new ATOM 0 HB2 ALA A 196 -9.900 1.964 -3.735 1.00 0.37 H new ATOM 0 HB3 ALA A 196 -9.362 2.565 -2.148 1.00 0.37 H new ATOM 745 N VAL A 197 -5.995 1.973 -2.750 1.00 0.23 N ATOM 746 CA VAL A 197 -4.815 2.438 -2.042 1.00 0.23 C ATOM 747 C VAL A 197 -4.738 3.952 -2.094 1.00 0.24 C ATOM 748 O VAL A 197 -4.767 4.552 -3.169 1.00 0.36 O ATOM 749 CB VAL A 197 -3.507 1.875 -2.624 1.00 0.29 C ATOM 750 CG1 VAL A 197 -2.335 2.156 -1.699 1.00 0.94 C ATOM 751 CG2 VAL A 197 -3.629 0.396 -2.911 1.00 1.06 C ATOM 0 H VAL A 197 -6.007 2.191 -3.746 1.00 0.23 H new ATOM 0 HA VAL A 197 -4.916 2.083 -1.017 1.00 0.23 H new ATOM 0 HB VAL A 197 -3.318 2.382 -3.570 1.00 0.29 H new ATOM 0 HG11 VAL A 197 -1.423 1.748 -2.134 1.00 0.94 H new ATOM 0 HG12 VAL A 197 -2.225 3.232 -1.568 1.00 0.94 H new ATOM 0 HG13 VAL A 197 -2.516 1.690 -0.731 1.00 0.94 H new ATOM 0 HG21 VAL A 197 -2.689 0.026 -3.321 1.00 1.06 H new ATOM 0 HG22 VAL A 197 -3.856 -0.136 -1.987 1.00 1.06 H new ATOM 0 HG23 VAL A 197 -4.430 0.230 -3.632 1.00 1.06 H new ATOM 761 N TYR A 198 -4.647 4.559 -0.934 1.00 0.29 N ATOM 762 CA TYR A 198 -4.472 5.993 -0.838 1.00 0.37 C ATOM 763 C TYR A 198 -3.752 6.355 0.456 1.00 0.45 C ATOM 764 O TYR A 198 -3.845 5.639 1.447 1.00 0.88 O ATOM 765 CB TYR A 198 -5.801 6.727 -1.008 1.00 0.93 C ATOM 766 CG TYR A 198 -6.828 6.487 0.041 1.00 0.33 C ATOM 767 CD1 TYR A 198 -6.819 7.284 1.138 1.00 0.69 C ATOM 768 CD2 TYR A 198 -7.809 5.516 -0.082 1.00 0.53 C ATOM 769 CE1 TYR A 198 -7.761 7.150 2.132 1.00 1.46 C ATOM 770 CE2 TYR A 198 -8.764 5.357 0.900 1.00 1.18 C ATOM 771 CZ TYR A 198 -8.737 6.181 2.012 1.00 1.70 C ATOM 772 OH TYR A 198 -9.694 6.054 2.994 1.00 2.49 O ATOM 0 H TYR A 198 -4.692 4.079 -0.035 1.00 0.29 H new ATOM 0 HA TYR A 198 -3.838 6.326 -1.659 1.00 0.37 H new ATOM 0 HB2 TYR A 198 -5.598 7.797 -1.048 1.00 0.93 H new ATOM 0 HB3 TYR A 198 -6.225 6.447 -1.972 1.00 0.93 H new ATOM 0 HD1 TYR A 198 -6.055 8.041 1.234 1.00 0.69 H new ATOM 0 HD2 TYR A 198 -7.826 4.879 -0.954 1.00 0.53 H new ATOM 0 HE1 TYR A 198 -7.737 7.796 2.997 1.00 1.46 H new ATOM 0 HE2 TYR A 198 -9.525 4.597 0.802 1.00 1.18 H new ATOM 0 HH TYR A 198 -10.435 5.506 2.660 1.00 2.49 H new ATOM 782 N ARG A 199 -3.005 7.445 0.434 1.00 0.34 N ATOM 783 CA ARG A 199 -2.139 7.787 1.554 1.00 0.45 C ATOM 784 C ARG A 199 -2.733 8.943 2.337 1.00 0.51 C ATOM 785 O ARG A 199 -3.360 9.818 1.762 1.00 0.60 O ATOM 786 CB ARG A 199 -0.737 8.155 1.066 1.00 0.58 C ATOM 787 CG ARG A 199 -0.691 9.408 0.209 1.00 0.81 C ATOM 788 CD ARG A 199 0.698 9.643 -0.354 1.00 0.80 C ATOM 789 NE ARG A 199 1.637 10.049 0.685 1.00 1.01 N ATOM 790 CZ ARG A 199 2.954 9.894 0.608 1.00 1.23 C ATOM 791 NH1 ARG A 199 3.508 9.337 -0.465 1.00 1.49 N ATOM 792 NH2 ARG A 199 3.717 10.299 1.611 1.00 1.57 N ATOM 0 H ARG A 199 -2.979 8.107 -0.342 1.00 0.34 H new ATOM 0 HA ARG A 199 -2.060 6.915 2.204 1.00 0.45 H new ATOM 0 HB2 ARG A 199 -0.087 8.294 1.930 1.00 0.58 H new ATOM 0 HB3 ARG A 199 -0.332 7.321 0.494 1.00 0.58 H new ATOM 0 HG2 ARG A 199 -1.406 9.318 -0.609 1.00 0.81 H new ATOM 0 HG3 ARG A 199 -0.994 10.269 0.804 1.00 0.81 H new ATOM 0 HD2 ARG A 199 1.056 8.732 -0.833 1.00 0.80 H new ATOM 0 HD3 ARG A 199 0.653 10.412 -1.125 1.00 0.80 H new ATOM 0 HE ARG A 199 1.257 10.481 1.527 1.00 1.01 H new ATOM 0 HH11 ARG A 199 2.921 9.025 -1.238 1.00 1.49 H new ATOM 0 HH12 ARG A 199 4.520 9.222 -0.515 1.00 1.49 H new ATOM 0 HH21 ARG A 199 3.293 10.726 2.434 1.00 1.57 H new ATOM 0 HH22 ARG A 199 4.729 10.184 1.560 1.00 1.57 H new ATOM 806 N ILE A 200 -2.558 8.950 3.643 1.00 0.61 N ATOM 807 CA ILE A 200 -3.056 10.052 4.438 1.00 0.66 C ATOM 808 C ILE A 200 -2.000 11.125 4.596 1.00 0.75 C ATOM 809 O ILE A 200 -0.884 10.879 5.053 1.00 0.88 O ATOM 810 CB ILE A 200 -3.558 9.605 5.818 1.00 0.81 C ATOM 811 CG1 ILE A 200 -4.732 8.655 5.646 1.00 0.82 C ATOM 812 CG2 ILE A 200 -3.978 10.805 6.652 1.00 0.88 C ATOM 813 CD1 ILE A 200 -6.014 9.311 5.169 1.00 0.80 C ATOM 0 H ILE A 200 -2.082 8.217 4.169 1.00 0.61 H new ATOM 0 HA ILE A 200 -3.908 10.462 3.896 1.00 0.66 H new ATOM 0 HB ILE A 200 -2.748 9.094 6.338 1.00 0.81 H new ATOM 0 HG12 ILE A 200 -4.452 7.878 4.935 1.00 0.82 H new ATOM 0 HG13 ILE A 200 -4.925 8.162 6.599 1.00 0.82 H new ATOM 0 HG21 ILE A 200 -4.330 10.466 7.626 1.00 0.88 H new ATOM 0 HG22 ILE A 200 -3.126 11.471 6.786 1.00 0.88 H new ATOM 0 HG23 ILE A 200 -4.779 11.340 6.142 1.00 0.88 H new ATOM 0 HD11 ILE A 200 -6.796 8.557 5.075 1.00 0.80 H new ATOM 0 HD12 ILE A 200 -6.325 10.068 5.889 1.00 0.80 H new ATOM 0 HD13 ILE A 200 -5.844 9.780 4.200 1.00 0.80 H new ATOM 825 N GLN A 201 -2.381 12.308 4.191 1.00 0.75 N ATOM 826 CA GLN A 201 -1.535 13.476 4.294 1.00 0.91 C ATOM 827 C GLN A 201 -2.006 14.328 5.465 1.00 0.98 C ATOM 828 O GLN A 201 -2.434 13.774 6.469 1.00 0.99 O ATOM 829 CB GLN A 201 -1.563 14.250 2.996 1.00 0.98 C ATOM 830 CG GLN A 201 -0.206 14.819 2.642 1.00 1.22 C ATOM 831 CD GLN A 201 0.900 13.777 2.671 1.00 1.76 C ATOM 832 OE1 GLN A 201 1.157 13.103 1.674 1.00 2.41 O ATOM 833 NE2 GLN A 201 1.570 13.645 3.806 1.00 2.39 N ATOM 0 H GLN A 201 -3.294 12.493 3.776 1.00 0.75 H new ATOM 0 HA GLN A 201 -0.503 13.178 4.476 1.00 0.91 H new ATOM 0 HB2 GLN A 201 -1.902 13.597 2.192 1.00 0.98 H new ATOM 0 HB3 GLN A 201 -2.287 15.061 3.074 1.00 0.98 H new ATOM 0 HG2 GLN A 201 -0.253 15.264 1.648 1.00 1.22 H new ATOM 0 HG3 GLN A 201 0.039 15.621 3.339 1.00 1.22 H new ATOM 0 HE21 GLN A 201 1.328 14.222 4.611 1.00 2.39 H new ATOM 0 HE22 GLN A 201 2.328 12.966 3.875 1.00 2.39 H new ATOM 842 N ASP A 202 -1.953 15.652 5.326 1.00 1.08 N ATOM 843 CA ASP A 202 -2.329 16.584 6.403 1.00 1.18 C ATOM 844 C ASP A 202 -3.770 16.358 6.884 1.00 1.09 C ATOM 845 O ASP A 202 -4.680 17.105 6.524 1.00 1.07 O ATOM 846 CB ASP A 202 -2.196 18.014 5.892 1.00 1.30 C ATOM 847 CG ASP A 202 -2.264 19.050 6.998 1.00 1.45 C ATOM 848 OD1 ASP A 202 -1.195 19.525 7.441 1.00 1.84 O ATOM 849 OD2 ASP A 202 -3.380 19.402 7.430 1.00 1.91 O ATOM 0 H ASP A 202 -1.650 16.114 4.468 1.00 1.08 H new ATOM 0 HA ASP A 202 -1.662 16.407 7.247 1.00 1.18 H new ATOM 0 HB2 ASP A 202 -1.249 18.118 5.363 1.00 1.30 H new ATOM 0 HB3 ASP A 202 -2.988 18.210 5.169 1.00 1.30 H new ATOM 854 N GLY A 203 -3.968 15.323 7.690 1.00 1.11 N ATOM 855 CA GLY A 203 -5.297 14.951 8.135 1.00 1.12 C ATOM 856 C GLY A 203 -6.211 14.588 6.978 1.00 0.99 C ATOM 857 O GLY A 203 -7.413 14.409 7.164 1.00 1.07 O ATOM 0 H GLY A 203 -3.221 14.727 8.047 1.00 1.11 H new ATOM 0 HA2 GLY A 203 -5.225 14.105 8.818 1.00 1.12 H new ATOM 0 HA3 GLY A 203 -5.735 15.777 8.696 1.00 1.12 H new ATOM 861 N GLU A 204 -5.639 14.462 5.787 1.00 0.86 N ATOM 862 CA GLU A 204 -6.431 14.282 4.583 1.00 0.79 C ATOM 863 C GLU A 204 -5.959 13.069 3.810 1.00 0.68 C ATOM 864 O GLU A 204 -5.077 12.351 4.252 1.00 0.67 O ATOM 865 CB GLU A 204 -6.331 15.529 3.712 1.00 0.83 C ATOM 866 CG GLU A 204 -4.968 15.715 3.079 1.00 0.82 C ATOM 867 CD GLU A 204 -4.905 16.934 2.188 1.00 0.98 C ATOM 868 OE1 GLU A 204 -5.472 16.897 1.078 1.00 1.54 O ATOM 869 OE2 GLU A 204 -4.280 17.933 2.590 1.00 1.51 O ATOM 0 H GLU A 204 -4.631 14.481 5.632 1.00 0.86 H new ATOM 0 HA GLU A 204 -7.471 14.123 4.868 1.00 0.79 H new ATOM 0 HB2 GLU A 204 -7.084 15.475 2.926 1.00 0.83 H new ATOM 0 HB3 GLU A 204 -6.565 16.405 4.317 1.00 0.83 H new ATOM 0 HG2 GLU A 204 -4.216 15.803 3.863 1.00 0.82 H new ATOM 0 HG3 GLU A 204 -4.718 14.829 2.495 1.00 0.82 H new ATOM 876 N LYS A 205 -6.549 12.848 2.659 1.00 0.69 N ATOM 877 CA LYS A 205 -6.227 11.683 1.854 1.00 0.62 C ATOM 878 C LYS A 205 -5.721 12.089 0.473 1.00 0.61 C ATOM 879 O LYS A 205 -6.351 12.881 -0.226 1.00 0.71 O ATOM 880 CB LYS A 205 -7.467 10.810 1.698 1.00 0.73 C ATOM 881 CG LYS A 205 -8.279 10.698 2.970 1.00 0.90 C ATOM 882 CD LYS A 205 -9.742 10.371 2.710 1.00 1.16 C ATOM 883 CE LYS A 205 -9.944 9.410 1.547 1.00 1.29 C ATOM 884 NZ LYS A 205 -11.364 8.989 1.406 1.00 1.69 N ATOM 0 H LYS A 205 -7.258 13.459 2.254 1.00 0.69 H new ATOM 0 HA LYS A 205 -5.439 11.127 2.362 1.00 0.62 H new ATOM 0 HB2 LYS A 205 -8.096 11.220 0.908 1.00 0.73 H new ATOM 0 HB3 LYS A 205 -7.164 9.813 1.379 1.00 0.73 H new ATOM 0 HG2 LYS A 205 -7.846 9.925 3.605 1.00 0.90 H new ATOM 0 HG3 LYS A 205 -8.214 11.636 3.521 1.00 0.90 H new ATOM 0 HD2 LYS A 205 -10.176 9.937 3.611 1.00 1.16 H new ATOM 0 HD3 LYS A 205 -10.284 11.295 2.508 1.00 1.16 H new ATOM 0 HE2 LYS A 205 -9.614 9.886 0.623 1.00 1.29 H new ATOM 0 HE3 LYS A 205 -9.318 8.529 1.693 1.00 1.29 H new ATOM 0 HZ1 LYS A 205 -11.454 8.335 0.602 1.00 1.69 H new ATOM 0 HZ2 LYS A 205 -11.673 8.511 2.277 1.00 1.69 H new ATOM 0 HZ3 LYS A 205 -11.959 9.826 1.241 1.00 1.69 H new ATOM 898 N LYS A 206 -4.587 11.535 0.095 1.00 0.57 N ATOM 899 CA LYS A 206 -4.030 11.699 -1.240 1.00 0.61 C ATOM 900 C LYS A 206 -4.043 10.340 -1.930 1.00 0.57 C ATOM 901 O LYS A 206 -3.176 9.503 -1.677 1.00 0.60 O ATOM 902 CB LYS A 206 -2.590 12.226 -1.178 1.00 0.65 C ATOM 903 CG LYS A 206 -2.423 13.529 -0.411 1.00 0.84 C ATOM 904 CD LYS A 206 -3.100 14.699 -1.109 1.00 1.09 C ATOM 905 CE LYS A 206 -2.796 16.014 -0.403 1.00 1.23 C ATOM 906 NZ LYS A 206 -1.387 16.450 -0.599 1.00 1.66 N ATOM 0 H LYS A 206 -4.018 10.952 0.709 1.00 0.57 H new ATOM 0 HA LYS A 206 -4.629 12.423 -1.793 1.00 0.61 H new ATOM 0 HB2 LYS A 206 -1.959 11.466 -0.718 1.00 0.65 H new ATOM 0 HB3 LYS A 206 -2.226 12.370 -2.195 1.00 0.65 H new ATOM 0 HG2 LYS A 206 -2.840 13.415 0.590 1.00 0.84 H new ATOM 0 HG3 LYS A 206 -1.361 13.745 -0.292 1.00 0.84 H new ATOM 0 HD2 LYS A 206 -2.763 14.753 -2.144 1.00 1.09 H new ATOM 0 HD3 LYS A 206 -4.178 14.537 -1.133 1.00 1.09 H new ATOM 0 HE2 LYS A 206 -3.468 16.787 -0.776 1.00 1.23 H new ATOM 0 HE3 LYS A 206 -2.995 15.905 0.663 1.00 1.23 H new ATOM 0 HZ1 LYS A 206 -0.987 16.750 0.313 1.00 1.66 H new ATOM 0 HZ2 LYS A 206 -0.828 15.659 -0.979 1.00 1.66 H new ATOM 0 HZ3 LYS A 206 -1.360 17.246 -1.268 1.00 1.66 H new ATOM 920 N PRO A 207 -5.049 10.077 -2.769 1.00 0.52 N ATOM 921 CA PRO A 207 -5.208 8.775 -3.418 1.00 0.47 C ATOM 922 C PRO A 207 -4.054 8.424 -4.354 1.00 0.44 C ATOM 923 O PRO A 207 -3.722 9.182 -5.270 1.00 0.53 O ATOM 924 CB PRO A 207 -6.516 8.912 -4.201 1.00 0.54 C ATOM 925 CG PRO A 207 -7.213 10.074 -3.585 1.00 0.58 C ATOM 926 CD PRO A 207 -6.125 11.006 -3.141 1.00 0.56 C ATOM 0 HA PRO A 207 -5.219 7.968 -2.685 1.00 0.47 H new ATOM 0 HB2 PRO A 207 -6.326 9.082 -5.261 1.00 0.54 H new ATOM 0 HB3 PRO A 207 -7.117 8.006 -4.127 1.00 0.54 H new ATOM 0 HG2 PRO A 207 -7.876 10.558 -4.302 1.00 0.58 H new ATOM 0 HG3 PRO A 207 -7.829 9.760 -2.742 1.00 0.58 H new ATOM 0 HD2 PRO A 207 -5.820 11.684 -3.938 1.00 0.56 H new ATOM 0 HD3 PRO A 207 -6.437 11.624 -2.299 1.00 0.56 H new ATOM 934 N ILE A 208 -3.445 7.270 -4.112 1.00 0.36 N ATOM 935 CA ILE A 208 -2.366 6.778 -4.951 1.00 0.36 C ATOM 936 C ILE A 208 -2.953 6.083 -6.164 1.00 0.32 C ATOM 937 O ILE A 208 -4.124 5.702 -6.169 1.00 0.44 O ATOM 938 CB ILE A 208 -1.463 5.755 -4.215 1.00 0.42 C ATOM 939 CG1 ILE A 208 -1.230 6.154 -2.763 1.00 0.56 C ATOM 940 CG2 ILE A 208 -0.128 5.603 -4.928 1.00 0.52 C ATOM 941 CD1 ILE A 208 -0.654 7.536 -2.584 1.00 0.90 C ATOM 0 H ILE A 208 -3.684 6.655 -3.334 1.00 0.36 H new ATOM 0 HA ILE A 208 -1.760 7.640 -5.230 1.00 0.36 H new ATOM 0 HB ILE A 208 -1.985 4.798 -4.226 1.00 0.42 H new ATOM 0 HG12 ILE A 208 -2.177 6.095 -2.226 1.00 0.56 H new ATOM 0 HG13 ILE A 208 -0.557 5.430 -2.303 1.00 0.56 H new ATOM 0 HG21 ILE A 208 0.489 4.881 -4.394 1.00 0.52 H new ATOM 0 HG22 ILE A 208 -0.297 5.253 -5.946 1.00 0.52 H new ATOM 0 HG23 ILE A 208 0.382 6.566 -4.955 1.00 0.52 H new ATOM 0 HD11 ILE A 208 -0.520 7.739 -1.522 1.00 0.90 H new ATOM 0 HD12 ILE A 208 0.310 7.597 -3.090 1.00 0.90 H new ATOM 0 HD13 ILE A 208 -1.335 8.272 -3.011 1.00 0.90 H new ATOM 953 N GLY A 209 -2.139 5.917 -7.180 1.00 0.34 N ATOM 954 CA GLY A 209 -2.552 5.163 -8.329 1.00 0.37 C ATOM 955 C GLY A 209 -2.038 3.751 -8.242 1.00 0.31 C ATOM 956 O GLY A 209 -0.913 3.524 -7.803 1.00 0.33 O ATOM 0 H GLY A 209 -1.192 6.294 -7.230 1.00 0.34 H new ATOM 0 HA2 GLY A 209 -3.640 5.157 -8.396 1.00 0.37 H new ATOM 0 HA3 GLY A 209 -2.179 5.637 -9.237 1.00 0.37 H new ATOM 960 N TRP A 210 -2.846 2.793 -8.647 1.00 0.29 N ATOM 961 CA TRP A 210 -2.435 1.399 -8.608 1.00 0.27 C ATOM 962 C TRP A 210 -1.335 1.138 -9.635 1.00 0.27 C ATOM 963 O TRP A 210 -0.657 0.111 -9.593 1.00 0.30 O ATOM 964 CB TRP A 210 -3.643 0.490 -8.836 1.00 0.31 C ATOM 965 CG TRP A 210 -4.563 0.425 -7.649 1.00 0.28 C ATOM 966 CD1 TRP A 210 -5.476 1.360 -7.245 1.00 0.31 C ATOM 967 CD2 TRP A 210 -4.647 -0.646 -6.709 1.00 0.26 C ATOM 968 NE1 TRP A 210 -6.124 0.928 -6.106 1.00 0.30 N ATOM 969 CE2 TRP A 210 -5.630 -0.305 -5.763 1.00 0.26 C ATOM 970 CE3 TRP A 210 -3.985 -1.864 -6.581 1.00 0.29 C ATOM 971 CZ2 TRP A 210 -5.959 -1.149 -4.704 1.00 0.26 C ATOM 972 CZ3 TRP A 210 -4.313 -2.697 -5.532 1.00 0.31 C ATOM 973 CH2 TRP A 210 -5.293 -2.337 -4.605 1.00 0.29 C ATOM 0 H TRP A 210 -3.788 2.950 -9.006 1.00 0.29 H new ATOM 0 HA TRP A 210 -2.026 1.174 -7.623 1.00 0.27 H new ATOM 0 HB2 TRP A 210 -4.201 0.847 -9.702 1.00 0.31 H new ATOM 0 HB3 TRP A 210 -3.294 -0.515 -9.074 1.00 0.31 H new ATOM 0 HD1 TRP A 210 -5.662 2.299 -7.745 1.00 0.31 H new ATOM 0 HE1 TRP A 210 -6.849 1.440 -5.603 1.00 0.30 H new ATOM 0 HE3 TRP A 210 -3.226 -2.152 -7.293 1.00 0.29 H new ATOM 0 HZ2 TRP A 210 -6.716 -0.873 -3.985 1.00 0.26 H new ATOM 0 HZ3 TRP A 210 -3.803 -3.643 -5.426 1.00 0.31 H new ATOM 0 HH2 TRP A 210 -5.529 -3.011 -3.794 1.00 0.29 H new ATOM 984 N ASP A 211 -1.149 2.098 -10.534 1.00 0.27 N ATOM 985 CA ASP A 211 -0.100 2.030 -11.543 1.00 0.29 C ATOM 986 C ASP A 211 1.092 2.893 -11.129 1.00 0.25 C ATOM 987 O ASP A 211 2.049 3.057 -11.886 1.00 0.32 O ATOM 988 CB ASP A 211 -0.634 2.489 -12.904 1.00 0.39 C ATOM 989 CG ASP A 211 -1.086 3.936 -12.900 1.00 1.49 C ATOM 990 OD1 ASP A 211 -0.455 4.767 -13.584 1.00 2.30 O ATOM 991 OD2 ASP A 211 -2.080 4.251 -12.208 1.00 2.30 O ATOM 0 H ASP A 211 -1.719 2.942 -10.584 1.00 0.27 H new ATOM 0 HA ASP A 211 0.228 0.994 -11.628 1.00 0.29 H new ATOM 0 HB2 ASP A 211 0.143 2.358 -13.657 1.00 0.39 H new ATOM 0 HB3 ASP A 211 -1.470 1.853 -13.195 1.00 0.39 H new ATOM 996 N THR A 212 1.025 3.440 -9.920 1.00 0.23 N ATOM 997 CA THR A 212 2.118 4.221 -9.362 1.00 0.23 C ATOM 998 C THR A 212 3.279 3.304 -8.989 1.00 0.21 C ATOM 999 O THR A 212 3.069 2.214 -8.458 1.00 0.26 O ATOM 1000 CB THR A 212 1.640 5.011 -8.123 1.00 0.25 C ATOM 1001 OG1 THR A 212 0.679 6.001 -8.515 1.00 0.30 O ATOM 1002 CG2 THR A 212 2.793 5.685 -7.386 1.00 0.31 C ATOM 0 H THR A 212 0.216 3.354 -9.304 1.00 0.23 H new ATOM 0 HA THR A 212 2.458 4.932 -10.114 1.00 0.23 H new ATOM 0 HB THR A 212 1.184 4.295 -7.440 1.00 0.25 H new ATOM 0 HG1 THR A 212 0.730 6.766 -7.905 1.00 0.30 H new ATOM 0 HG21 THR A 212 2.406 6.227 -6.523 1.00 0.31 H new ATOM 0 HG22 THR A 212 3.502 4.928 -7.051 1.00 0.31 H new ATOM 0 HG23 THR A 212 3.296 6.382 -8.057 1.00 0.31 H new ATOM 1010 N ASP A 213 4.492 3.739 -9.293 1.00 0.23 N ATOM 1011 CA ASP A 213 5.688 2.964 -8.986 1.00 0.25 C ATOM 1012 C ASP A 213 5.978 3.023 -7.489 1.00 0.23 C ATOM 1013 O ASP A 213 6.318 4.077 -6.958 1.00 0.29 O ATOM 1014 CB ASP A 213 6.884 3.497 -9.778 1.00 0.32 C ATOM 1015 CG ASP A 213 8.120 2.631 -9.626 1.00 0.93 C ATOM 1016 OD1 ASP A 213 8.796 2.727 -8.584 1.00 1.73 O ATOM 1017 OD2 ASP A 213 8.436 1.867 -10.563 1.00 1.66 O ATOM 0 H ASP A 213 4.676 4.630 -9.755 1.00 0.23 H new ATOM 0 HA ASP A 213 5.517 1.926 -9.272 1.00 0.25 H new ATOM 0 HB2 ASP A 213 6.617 3.560 -10.833 1.00 0.32 H new ATOM 0 HB3 ASP A 213 7.112 4.510 -9.446 1.00 0.32 H new ATOM 1022 N ILE A 214 5.843 1.884 -6.821 1.00 0.23 N ATOM 1023 CA ILE A 214 5.985 1.805 -5.364 1.00 0.21 C ATOM 1024 C ILE A 214 7.392 2.206 -4.897 1.00 0.19 C ATOM 1025 O ILE A 214 7.570 2.697 -3.783 1.00 0.21 O ATOM 1026 CB ILE A 214 5.631 0.385 -4.847 1.00 0.22 C ATOM 1027 CG1 ILE A 214 5.965 0.240 -3.359 1.00 0.24 C ATOM 1028 CG2 ILE A 214 6.337 -0.681 -5.663 1.00 0.26 C ATOM 1029 CD1 ILE A 214 5.695 -1.138 -2.806 1.00 0.29 C ATOM 0 H ILE A 214 5.633 0.991 -7.267 1.00 0.23 H new ATOM 0 HA ILE A 214 5.280 2.520 -4.939 1.00 0.21 H new ATOM 0 HB ILE A 214 4.556 0.247 -4.965 1.00 0.22 H new ATOM 0 HG12 ILE A 214 7.017 0.483 -3.207 1.00 0.24 H new ATOM 0 HG13 ILE A 214 5.385 0.969 -2.793 1.00 0.24 H new ATOM 0 HG21 ILE A 214 6.072 -1.667 -5.281 1.00 0.26 H new ATOM 0 HG22 ILE A 214 6.031 -0.602 -6.706 1.00 0.26 H new ATOM 0 HG23 ILE A 214 7.415 -0.541 -5.589 1.00 0.26 H new ATOM 0 HD11 ILE A 214 5.956 -1.163 -1.748 1.00 0.29 H new ATOM 0 HD12 ILE A 214 4.638 -1.377 -2.925 1.00 0.29 H new ATOM 0 HD13 ILE A 214 6.296 -1.871 -3.345 1.00 0.29 H new ATOM 1041 N SER A 215 8.380 2.043 -5.767 1.00 0.21 N ATOM 1042 CA SER A 215 9.757 2.389 -5.435 1.00 0.23 C ATOM 1043 C SER A 215 9.936 3.912 -5.328 1.00 0.25 C ATOM 1044 O SER A 215 10.986 4.394 -4.896 1.00 0.31 O ATOM 1045 CB SER A 215 10.713 1.780 -6.478 1.00 0.31 C ATOM 1046 OG SER A 215 11.929 2.506 -6.577 1.00 1.07 O ATOM 0 H SER A 215 8.254 1.673 -6.709 1.00 0.21 H new ATOM 0 HA SER A 215 9.999 1.970 -4.458 1.00 0.23 H new ATOM 0 HB2 SER A 215 10.930 0.746 -6.210 1.00 0.31 H new ATOM 0 HB3 SER A 215 10.222 1.761 -7.451 1.00 0.31 H new ATOM 0 HG SER A 215 11.959 3.191 -5.877 1.00 1.07 H new ATOM 1052 N TRP A 216 8.913 4.666 -5.714 1.00 0.25 N ATOM 1053 CA TRP A 216 8.934 6.119 -5.570 1.00 0.33 C ATOM 1054 C TRP A 216 8.422 6.497 -4.176 1.00 0.33 C ATOM 1055 O TRP A 216 8.697 7.580 -3.656 1.00 0.45 O ATOM 1056 CB TRP A 216 8.048 6.754 -6.649 1.00 0.40 C ATOM 1057 CG TRP A 216 8.446 8.144 -7.047 1.00 1.13 C ATOM 1058 CD1 TRP A 216 8.751 9.190 -6.224 1.00 1.75 C ATOM 1059 CD2 TRP A 216 8.556 8.639 -8.384 1.00 1.92 C ATOM 1060 NE1 TRP A 216 9.057 10.300 -6.970 1.00 2.60 N ATOM 1061 CE2 TRP A 216 8.941 9.989 -8.299 1.00 2.73 C ATOM 1062 CE3 TRP A 216 8.367 8.070 -9.648 1.00 2.29 C ATOM 1063 CZ2 TRP A 216 9.141 10.778 -9.429 1.00 3.66 C ATOM 1064 CZ3 TRP A 216 8.568 8.854 -10.767 1.00 3.27 C ATOM 1065 CH2 TRP A 216 8.951 10.195 -10.652 1.00 3.87 C ATOM 0 H TRP A 216 8.058 4.296 -6.129 1.00 0.25 H new ATOM 0 HA TRP A 216 9.953 6.487 -5.688 1.00 0.33 H new ATOM 0 HB2 TRP A 216 8.065 6.118 -7.534 1.00 0.40 H new ATOM 0 HB3 TRP A 216 7.019 6.774 -6.290 1.00 0.40 H new ATOM 0 HD1 TRP A 216 8.751 9.150 -5.145 1.00 1.75 H new ATOM 0 HE1 TRP A 216 9.327 11.210 -6.596 1.00 2.60 H new ATOM 0 HE3 TRP A 216 8.069 7.037 -9.747 1.00 2.29 H new ATOM 0 HZ2 TRP A 216 9.436 11.813 -9.343 1.00 3.66 H new ATOM 0 HZ3 TRP A 216 8.427 8.425 -11.748 1.00 3.27 H new ATOM 0 HH2 TRP A 216 9.100 10.781 -11.547 1.00 3.87 H new ATOM 1076 N LEU A 217 7.688 5.569 -3.580 1.00 0.25 N ATOM 1077 CA LEU A 217 7.028 5.773 -2.294 1.00 0.26 C ATOM 1078 C LEU A 217 7.827 5.145 -1.180 1.00 0.24 C ATOM 1079 O LEU A 217 7.345 4.956 -0.067 1.00 0.25 O ATOM 1080 CB LEU A 217 5.633 5.174 -2.361 1.00 0.26 C ATOM 1081 CG LEU A 217 4.692 5.957 -3.261 1.00 0.47 C ATOM 1082 CD1 LEU A 217 5.002 5.740 -4.725 1.00 1.21 C ATOM 1083 CD2 LEU A 217 3.252 5.599 -2.989 1.00 0.92 C ATOM 0 H LEU A 217 7.531 4.643 -3.978 1.00 0.25 H new ATOM 0 HA LEU A 217 6.956 6.840 -2.085 1.00 0.26 H new ATOM 0 HB2 LEU A 217 5.701 4.148 -2.722 1.00 0.26 H new ATOM 0 HB3 LEU A 217 5.214 5.131 -1.356 1.00 0.26 H new ATOM 0 HG LEU A 217 4.845 7.011 -3.031 1.00 0.47 H new ATOM 0 HD11 LEU A 217 4.306 6.318 -5.334 1.00 1.21 H new ATOM 0 HD12 LEU A 217 6.022 6.064 -4.933 1.00 1.21 H new ATOM 0 HD13 LEU A 217 4.902 4.682 -4.965 1.00 1.21 H new ATOM 0 HD21 LEU A 217 2.603 6.175 -3.648 1.00 0.92 H new ATOM 0 HD22 LEU A 217 3.101 4.535 -3.171 1.00 0.92 H new ATOM 0 HD23 LEU A 217 3.010 5.828 -1.951 1.00 0.92 H new ATOM 1095 N THR A 218 9.038 4.795 -1.532 1.00 0.25 N ATOM 1096 CA THR A 218 10.024 4.254 -0.607 1.00 0.26 C ATOM 1097 C THR A 218 9.998 4.934 0.760 1.00 0.28 C ATOM 1098 O THR A 218 10.035 6.160 0.860 1.00 0.32 O ATOM 1099 CB THR A 218 11.439 4.406 -1.166 1.00 0.31 C ATOM 1100 OG1 THR A 218 11.570 3.725 -2.419 1.00 0.32 O ATOM 1101 CG2 THR A 218 12.421 3.861 -0.169 1.00 0.39 C ATOM 0 H THR A 218 9.382 4.877 -2.489 1.00 0.25 H new ATOM 0 HA THR A 218 9.759 3.204 -0.486 1.00 0.26 H new ATOM 0 HB THR A 218 11.642 5.463 -1.340 1.00 0.31 H new ATOM 0 HG1 THR A 218 11.439 4.361 -3.153 1.00 0.32 H new ATOM 0 HG21 THR A 218 13.433 3.966 -0.560 1.00 0.39 H new ATOM 0 HG22 THR A 218 12.335 4.414 0.766 1.00 0.39 H new ATOM 0 HG23 THR A 218 12.209 2.807 0.012 1.00 0.39 H new ATOM 1109 N GLY A 219 9.941 4.119 1.808 1.00 0.30 N ATOM 1110 CA GLY A 219 10.036 4.625 3.159 1.00 0.37 C ATOM 1111 C GLY A 219 8.734 5.207 3.646 1.00 0.38 C ATOM 1112 O GLY A 219 8.589 5.533 4.824 1.00 0.53 O ATOM 0 H GLY A 219 9.830 3.107 1.741 1.00 0.30 H new ATOM 0 HA2 GLY A 219 10.343 3.819 3.826 1.00 0.37 H new ATOM 0 HA3 GLY A 219 10.812 5.389 3.205 1.00 0.37 H new ATOM 1116 N GLU A 220 7.777 5.319 2.750 1.00 0.29 N ATOM 1117 CA GLU A 220 6.508 5.949 3.077 1.00 0.29 C ATOM 1118 C GLU A 220 5.461 4.905 3.444 1.00 0.28 C ATOM 1119 O GLU A 220 5.647 3.709 3.201 1.00 0.40 O ATOM 1120 CB GLU A 220 6.042 6.829 1.913 1.00 0.36 C ATOM 1121 CG GLU A 220 7.081 7.864 1.521 1.00 1.26 C ATOM 1122 CD GLU A 220 6.500 9.018 0.743 1.00 1.53 C ATOM 1123 OE1 GLU A 220 6.239 8.864 -0.464 1.00 2.02 O ATOM 1124 OE2 GLU A 220 6.303 10.096 1.339 1.00 2.16 O ATOM 0 H GLU A 220 7.850 4.984 1.789 1.00 0.29 H new ATOM 0 HA GLU A 220 6.647 6.587 3.950 1.00 0.29 H new ATOM 0 HB2 GLU A 220 5.817 6.200 1.052 1.00 0.36 H new ATOM 0 HB3 GLU A 220 5.116 7.334 2.190 1.00 0.36 H new ATOM 0 HG2 GLU A 220 7.563 8.246 2.421 1.00 1.26 H new ATOM 0 HG3 GLU A 220 7.856 7.384 0.924 1.00 1.26 H new ATOM 1131 N GLU A 221 4.379 5.353 4.068 1.00 0.30 N ATOM 1132 CA GLU A 221 3.321 4.451 4.492 1.00 0.30 C ATOM 1133 C GLU A 221 2.044 4.718 3.723 1.00 0.31 C ATOM 1134 O GLU A 221 1.520 5.831 3.720 1.00 0.38 O ATOM 1135 CB GLU A 221 3.048 4.573 5.990 1.00 0.38 C ATOM 1136 CG GLU A 221 4.264 4.307 6.856 1.00 0.46 C ATOM 1137 CD GLU A 221 3.929 4.199 8.330 1.00 1.26 C ATOM 1138 OE1 GLU A 221 3.825 3.063 8.838 1.00 2.01 O ATOM 1139 OE2 GLU A 221 3.790 5.252 8.992 1.00 2.03 O ATOM 0 H GLU A 221 4.213 6.334 4.291 1.00 0.30 H new ATOM 0 HA GLU A 221 3.661 3.437 4.282 1.00 0.30 H new ATOM 0 HB2 GLU A 221 2.675 5.575 6.202 1.00 0.38 H new ATOM 0 HB3 GLU A 221 2.258 3.874 6.264 1.00 0.38 H new ATOM 0 HG2 GLU A 221 4.741 3.383 6.529 1.00 0.46 H new ATOM 0 HG3 GLU A 221 4.988 5.108 6.711 1.00 0.46 H new ATOM 1146 N LEU A 222 1.558 3.688 3.067 1.00 0.26 N ATOM 1147 CA LEU A 222 0.318 3.764 2.328 1.00 0.27 C ATOM 1148 C LEU A 222 -0.832 3.179 3.129 1.00 0.25 C ATOM 1149 O LEU A 222 -0.619 2.449 4.091 1.00 0.32 O ATOM 1150 CB LEU A 222 0.472 3.023 1.008 1.00 0.29 C ATOM 1151 CG LEU A 222 1.393 3.701 0.002 1.00 0.54 C ATOM 1152 CD1 LEU A 222 1.305 3.016 -1.352 1.00 1.19 C ATOM 1153 CD2 LEU A 222 1.046 5.176 -0.101 1.00 1.19 C ATOM 0 H LEU A 222 2.011 2.775 3.031 1.00 0.26 H new ATOM 0 HA LEU A 222 0.089 4.812 2.134 1.00 0.27 H new ATOM 0 HB2 LEU A 222 0.852 2.022 1.211 1.00 0.29 H new ATOM 0 HB3 LEU A 222 -0.513 2.904 0.556 1.00 0.29 H new ATOM 0 HG LEU A 222 2.423 3.614 0.347 1.00 0.54 H new ATOM 0 HD11 LEU A 222 1.970 3.515 -2.056 1.00 1.19 H new ATOM 0 HD12 LEU A 222 1.601 1.972 -1.251 1.00 1.19 H new ATOM 0 HD13 LEU A 222 0.281 3.069 -1.721 1.00 1.19 H new ATOM 0 HD21 LEU A 222 1.708 5.656 -0.822 1.00 1.19 H new ATOM 0 HD22 LEU A 222 0.012 5.285 -0.429 1.00 1.19 H new ATOM 0 HD23 LEU A 222 1.169 5.648 0.874 1.00 1.19 H new ATOM 1165 N HIS A 223 -2.050 3.523 2.742 1.00 0.24 N ATOM 1166 CA HIS A 223 -3.238 2.994 3.392 1.00 0.26 C ATOM 1167 C HIS A 223 -4.147 2.336 2.366 1.00 0.28 C ATOM 1168 O HIS A 223 -4.482 2.934 1.343 1.00 0.46 O ATOM 1169 CB HIS A 223 -4.011 4.100 4.121 1.00 0.45 C ATOM 1170 CG HIS A 223 -3.346 4.618 5.362 1.00 0.94 C ATOM 1171 ND1 HIS A 223 -3.894 4.477 6.620 1.00 1.30 N ATOM 1172 CD2 HIS A 223 -2.187 5.300 5.538 1.00 1.85 C ATOM 1173 CE1 HIS A 223 -3.105 5.046 7.511 1.00 2.26 C ATOM 1174 NE2 HIS A 223 -2.064 5.552 6.881 1.00 2.63 N ATOM 0 H HIS A 223 -2.242 4.170 1.977 1.00 0.24 H new ATOM 0 HA HIS A 223 -2.915 2.255 4.125 1.00 0.26 H new ATOM 0 HB2 HIS A 223 -4.163 4.932 3.433 1.00 0.45 H new ATOM 0 HB3 HIS A 223 -4.998 3.720 4.386 1.00 0.45 H new ATOM 0 HD2 HIS A 223 -1.491 5.591 4.765 1.00 1.85 H new ATOM 0 HE1 HIS A 223 -3.282 5.090 8.575 1.00 2.26 H new ATOM 0 HE2 HIS A 223 -1.291 6.051 7.321 1.00 2.63 H new ATOM 1183 N VAL A 224 -4.520 1.101 2.626 1.00 0.27 N ATOM 1184 CA VAL A 224 -5.468 0.402 1.786 1.00 0.34 C ATOM 1185 C VAL A 224 -6.810 0.335 2.480 1.00 0.38 C ATOM 1186 O VAL A 224 -6.906 -0.039 3.651 1.00 0.51 O ATOM 1187 CB VAL A 224 -4.998 -1.018 1.438 1.00 0.55 C ATOM 1188 CG1 VAL A 224 -6.078 -1.764 0.682 1.00 0.91 C ATOM 1189 CG2 VAL A 224 -3.757 -0.969 0.592 1.00 0.97 C ATOM 0 H VAL A 224 -4.178 0.557 3.418 1.00 0.27 H new ATOM 0 HA VAL A 224 -5.553 0.959 0.853 1.00 0.34 H new ATOM 0 HB VAL A 224 -4.782 -1.537 2.372 1.00 0.55 H new ATOM 0 HG11 VAL A 224 -5.728 -2.768 0.444 1.00 0.91 H new ATOM 0 HG12 VAL A 224 -6.975 -1.829 1.298 1.00 0.91 H new ATOM 0 HG13 VAL A 224 -6.310 -1.232 -0.241 1.00 0.91 H new ATOM 0 HG21 VAL A 224 -3.438 -1.984 0.355 1.00 0.97 H new ATOM 0 HG22 VAL A 224 -3.967 -0.430 -0.332 1.00 0.97 H new ATOM 0 HG23 VAL A 224 -2.964 -0.458 1.138 1.00 0.97 H new ATOM 1199 N GLU A 225 -7.834 0.713 1.752 1.00 0.38 N ATOM 1200 CA GLU A 225 -9.167 0.795 2.299 1.00 0.49 C ATOM 1201 C GLU A 225 -10.149 0.038 1.421 1.00 0.39 C ATOM 1202 O GLU A 225 -10.164 0.214 0.201 1.00 0.46 O ATOM 1203 CB GLU A 225 -9.567 2.262 2.401 1.00 0.68 C ATOM 1204 CG GLU A 225 -8.700 3.053 3.371 1.00 0.93 C ATOM 1205 CD GLU A 225 -9.212 2.981 4.796 1.00 1.32 C ATOM 1206 OE1 GLU A 225 -8.762 2.102 5.560 1.00 1.78 O ATOM 1207 OE2 GLU A 225 -10.068 3.814 5.161 1.00 1.94 O ATOM 0 H GLU A 225 -7.767 0.971 0.768 1.00 0.38 H new ATOM 0 HA GLU A 225 -9.183 0.341 3.290 1.00 0.49 H new ATOM 0 HB2 GLU A 225 -9.505 2.718 1.413 1.00 0.68 H new ATOM 0 HB3 GLU A 225 -10.608 2.327 2.718 1.00 0.68 H new ATOM 0 HG2 GLU A 225 -7.679 2.672 3.335 1.00 0.93 H new ATOM 0 HG3 GLU A 225 -8.663 4.095 3.054 1.00 0.93 H new ATOM 1214 N VAL A 226 -10.946 -0.822 2.041 1.00 0.50 N ATOM 1215 CA VAL A 226 -11.998 -1.530 1.333 1.00 0.48 C ATOM 1216 C VAL A 226 -13.073 -0.550 0.906 1.00 0.52 C ATOM 1217 O VAL A 226 -13.595 0.209 1.725 1.00 0.69 O ATOM 1218 CB VAL A 226 -12.631 -2.637 2.200 1.00 0.64 C ATOM 1219 CG1 VAL A 226 -13.786 -3.306 1.469 1.00 1.12 C ATOM 1220 CG2 VAL A 226 -11.585 -3.663 2.592 1.00 1.12 C ATOM 0 H VAL A 226 -10.882 -1.045 3.034 1.00 0.50 H new ATOM 0 HA VAL A 226 -11.549 -2.003 0.460 1.00 0.48 H new ATOM 0 HB VAL A 226 -13.025 -2.177 3.106 1.00 0.64 H new ATOM 0 HG11 VAL A 226 -14.216 -4.083 2.101 1.00 1.12 H new ATOM 0 HG12 VAL A 226 -14.549 -2.563 1.238 1.00 1.12 H new ATOM 0 HG13 VAL A 226 -13.421 -3.752 0.544 1.00 1.12 H new ATOM 0 HG21 VAL A 226 -12.047 -4.438 3.204 1.00 1.12 H new ATOM 0 HG22 VAL A 226 -11.163 -4.113 1.694 1.00 1.12 H new ATOM 0 HG23 VAL A 226 -10.793 -3.176 3.161 1.00 1.12 H new ATOM 1230 N LEU A 227 -13.388 -0.559 -0.372 1.00 0.49 N ATOM 1231 CA LEU A 227 -14.366 0.349 -0.917 1.00 0.65 C ATOM 1232 C LEU A 227 -15.752 -0.238 -0.745 1.00 0.83 C ATOM 1233 O LEU A 227 -16.298 -0.862 -1.657 1.00 0.94 O ATOM 1234 CB LEU A 227 -14.084 0.617 -2.392 1.00 0.71 C ATOM 1235 CG LEU A 227 -12.705 1.191 -2.721 1.00 0.58 C ATOM 1236 CD1 LEU A 227 -12.199 2.113 -1.624 1.00 1.69 C ATOM 1237 CD2 LEU A 227 -11.740 0.071 -3.003 1.00 1.23 C ATOM 0 H LEU A 227 -12.975 -1.193 -1.056 1.00 0.49 H new ATOM 0 HA LEU A 227 -14.308 1.297 -0.382 1.00 0.65 H new ATOM 0 HB2 LEU A 227 -14.206 -0.317 -2.940 1.00 0.71 H new ATOM 0 HB3 LEU A 227 -14.841 1.307 -2.766 1.00 0.71 H new ATOM 0 HG LEU A 227 -12.792 1.804 -3.618 1.00 0.58 H new ATOM 0 HD11 LEU A 227 -11.217 2.499 -1.897 1.00 1.69 H new ATOM 0 HD12 LEU A 227 -12.893 2.944 -1.498 1.00 1.69 H new ATOM 0 HD13 LEU A 227 -12.123 1.558 -0.689 1.00 1.69 H new ATOM 0 HD21 LEU A 227 -10.759 0.486 -3.237 1.00 1.23 H new ATOM 0 HD22 LEU A 227 -11.662 -0.572 -2.126 1.00 1.23 H new ATOM 0 HD23 LEU A 227 -12.098 -0.513 -3.851 1.00 1.23 H new ATOM 1249 N GLU A 228 -16.307 -0.049 0.435 1.00 0.99 N ATOM 1250 CA GLU A 228 -17.589 -0.629 0.769 1.00 1.23 C ATOM 1251 C GLU A 228 -18.707 0.269 0.273 1.00 1.51 C ATOM 1252 O GLU A 228 -19.095 1.228 0.940 1.00 1.69 O ATOM 1253 CB GLU A 228 -17.691 -0.834 2.278 1.00 1.37 C ATOM 1254 CG GLU A 228 -16.510 -1.600 2.845 1.00 1.33 C ATOM 1255 CD GLU A 228 -16.552 -1.703 4.352 1.00 1.66 C ATOM 1256 OE1 GLU A 228 -16.795 -2.813 4.870 1.00 2.12 O ATOM 1257 OE2 GLU A 228 -16.345 -0.672 5.028 1.00 2.12 O ATOM 0 H GLU A 228 -15.887 0.505 1.181 1.00 0.99 H new ATOM 0 HA GLU A 228 -17.683 -1.600 0.282 1.00 1.23 H new ATOM 0 HB2 GLU A 228 -17.759 0.137 2.769 1.00 1.37 H new ATOM 0 HB3 GLU A 228 -18.611 -1.372 2.506 1.00 1.37 H new ATOM 0 HG2 GLU A 228 -16.493 -2.602 2.417 1.00 1.33 H new ATOM 0 HG3 GLU A 228 -15.585 -1.108 2.544 1.00 1.33 H new ATOM 1264 N ASN A 229 -19.218 -0.050 -0.903 1.00 1.75 N ATOM 1265 CA ASN A 229 -20.277 0.731 -1.524 1.00 2.12 C ATOM 1266 C ASN A 229 -21.353 -0.199 -2.034 1.00 2.52 C ATOM 1267 O ASN A 229 -21.652 -0.247 -3.228 1.00 3.17 O ATOM 1268 CB ASN A 229 -19.727 1.592 -2.672 1.00 2.91 C ATOM 1269 CG ASN A 229 -18.817 2.715 -2.199 1.00 3.55 C ATOM 1270 OD1 ASN A 229 -17.847 3.065 -2.871 1.00 4.42 O ATOM 1271 ND2 ASN A 229 -19.132 3.302 -1.055 1.00 3.65 N ATOM 0 H ASN A 229 -18.914 -0.853 -1.453 1.00 1.75 H new ATOM 0 HA ASN A 229 -20.701 1.403 -0.778 1.00 2.12 H new ATOM 0 HB2 ASN A 229 -19.176 0.954 -3.364 1.00 2.91 H new ATOM 0 HB3 ASN A 229 -20.561 2.020 -3.228 1.00 2.91 H new ATOM 0 HD21 ASN A 229 -18.563 4.072 -0.703 1.00 3.65 H new ATOM 0 HD22 ASN A 229 -19.944 2.984 -0.525 1.00 3.65 H new ATOM 1278 N VAL A 230 -21.913 -0.953 -1.110 1.00 2.85 N ATOM 1279 CA VAL A 230 -22.958 -1.902 -1.416 1.00 3.94 C ATOM 1280 C VAL A 230 -24.276 -1.182 -1.712 1.00 4.43 C ATOM 1281 O VAL A 230 -24.842 -0.520 -0.841 1.00 4.68 O ATOM 1282 CB VAL A 230 -23.126 -2.894 -0.261 1.00 4.70 C ATOM 1283 CG1 VAL A 230 -24.486 -3.556 -0.299 1.00 5.77 C ATOM 1284 CG2 VAL A 230 -22.020 -3.935 -0.297 1.00 4.92 C ATOM 0 H VAL A 230 -21.654 -0.923 -0.124 1.00 2.85 H new ATOM 0 HA VAL A 230 -22.672 -2.457 -2.310 1.00 3.94 H new ATOM 0 HB VAL A 230 -23.055 -2.340 0.675 1.00 4.70 H new ATOM 0 HG11 VAL A 230 -24.574 -4.254 0.533 1.00 5.77 H new ATOM 0 HG12 VAL A 230 -25.263 -2.796 -0.219 1.00 5.77 H new ATOM 0 HG13 VAL A 230 -24.602 -4.096 -1.239 1.00 5.77 H new ATOM 0 HG21 VAL A 230 -22.151 -4.634 0.529 1.00 4.92 H new ATOM 0 HG22 VAL A 230 -22.062 -4.478 -1.241 1.00 4.92 H new ATOM 0 HG23 VAL A 230 -21.053 -3.441 -0.205 1.00 4.92 H new ATOM 1294 N PRO A 231 -24.769 -1.287 -2.957 1.00 4.99 N ATOM 1295 CA PRO A 231 -25.998 -0.627 -3.385 1.00 5.82 C ATOM 1296 C PRO A 231 -27.241 -1.491 -3.174 1.00 6.50 C ATOM 1297 O PRO A 231 -28.238 -1.350 -3.887 1.00 7.15 O ATOM 1298 CB PRO A 231 -25.740 -0.410 -4.873 1.00 6.52 C ATOM 1299 CG PRO A 231 -24.910 -1.580 -5.289 1.00 6.28 C ATOM 1300 CD PRO A 231 -24.153 -2.042 -4.064 1.00 5.31 C ATOM 0 HA PRO A 231 -26.204 0.282 -2.820 1.00 5.82 H new ATOM 0 HB2 PRO A 231 -26.673 -0.367 -5.434 1.00 6.52 H new ATOM 0 HB3 PRO A 231 -25.217 0.530 -5.051 1.00 6.52 H new ATOM 0 HG2 PRO A 231 -25.539 -2.380 -5.678 1.00 6.28 H new ATOM 0 HG3 PRO A 231 -24.221 -1.300 -6.086 1.00 6.28 H new ATOM 0 HD2 PRO A 231 -24.251 -3.118 -3.917 1.00 5.31 H new ATOM 0 HD3 PRO A 231 -23.088 -1.828 -4.149 1.00 5.31 H new ATOM 1308 N LEU A 232 -27.174 -2.389 -2.199 1.00 6.68 N ATOM 1309 CA LEU A 232 -28.293 -3.262 -1.878 1.00 7.61 C ATOM 1310 C LEU A 232 -28.102 -3.885 -0.500 1.00 8.10 C ATOM 1311 O LEU A 232 -28.547 -3.273 0.494 1.00 8.45 O ATOM 1312 CB LEU A 232 -28.443 -4.358 -2.936 1.00 8.09 C ATOM 1313 CG LEU A 232 -29.673 -5.256 -2.775 1.00 8.52 C ATOM 1314 CD1 LEU A 232 -30.952 -4.435 -2.836 1.00 9.01 C ATOM 1315 CD2 LEU A 232 -29.685 -6.337 -3.841 1.00 8.89 C ATOM 1316 OXT LEU A 232 -27.498 -4.976 -0.414 1.00 8.40 O ATOM 0 H LEU A 232 -26.350 -2.531 -1.614 1.00 6.68 H new ATOM 0 HA LEU A 232 -29.203 -2.662 -1.869 1.00 7.61 H new ATOM 0 HB2 LEU A 232 -28.482 -3.889 -3.919 1.00 8.09 H new ATOM 0 HB3 LEU A 232 -27.551 -4.984 -2.917 1.00 8.09 H new ATOM 0 HG LEU A 232 -29.620 -5.734 -1.797 1.00 8.52 H new ATOM 0 HD11 LEU A 232 -31.813 -5.093 -2.719 1.00 9.01 H new ATOM 0 HD12 LEU A 232 -30.949 -3.696 -2.034 1.00 9.01 H new ATOM 0 HD13 LEU A 232 -31.012 -3.926 -3.798 1.00 9.01 H new ATOM 0 HD21 LEU A 232 -30.566 -6.966 -3.712 1.00 8.89 H new ATOM 0 HD22 LEU A 232 -29.711 -5.875 -4.828 1.00 8.89 H new ATOM 0 HD23 LEU A 232 -28.787 -6.948 -3.750 1.00 8.89 H new TER 1328 LEU A 232 HETATM 1329 C1 6FS A 301 3.514 -7.378 7.733 1.00 0.80 C HETATM 1330 C2 6FS A 301 4.898 -7.170 7.727 1.00 0.77 C HETATM 1331 C3 6FS A 301 5.693 -7.700 6.706 1.00 0.81 C HETATM 1332 C5 6FS A 301 3.695 -8.623 5.676 1.00 0.95 C HETATM 1333 C6 6FS A 301 2.910 -8.102 6.712 1.00 0.91 C HETATM 1334 C7 6FS A 301 1.068 -9.050 5.641 1.00 1.27 C HETATM 1335 C8 6FS A 301 5.176 -9.573 3.675 1.00 0.80 C HETATM 1336 C10 6FS A 301 4.600 -5.898 9.636 1.00 0.82 C HETATM 1337 C11 6FS A 301 7.928 -6.910 7.812 1.00 1.49 C HETATM 1338 C12 6FS A 301 9.859 -5.505 6.146 1.00 1.96 C HETATM 1339 C13 6FS A 301 11.760 -4.084 6.558 1.00 1.84 C HETATM 1340 C14 6FS A 301 13.104 -3.775 6.364 1.00 1.74 C HETATM 1341 C15 6FS A 301 13.899 -4.619 5.587 1.00 1.69 C HETATM 1342 C16 6FS A 301 13.354 -5.757 5.015 1.00 2.16 C HETATM 1343 C19 6FS A 301 15.687 -3.197 5.983 1.00 1.67 C HETATM 1344 C21 6FS A 301 13.404 -8.781 4.682 1.00 4.68 C HETATM 1345 O7 6FS A 301 12.532 -9.628 4.399 1.00 5.16 O HETATM 1346 S1 6FS A 301 9.644 -6.669 7.543 1.00 1.70 S HETATM 1347 C18 6FS A 301 11.212 -5.231 5.978 1.00 1.73 C HETATM 1348 O8 6FS A 301 14.025 -8.703 5.763 1.00 5.16 O HETATM 1349 O4 6FS A 301 10.298 -6.096 8.814 1.00 2.47 O HETATM 1350 O3 6FS A 301 5.525 -6.392 8.658 1.00 0.90 O HETATM 1351 O6 6FS A 301 15.229 -4.399 5.350 1.00 1.94 O HETATM 1352 C17 6FS A 301 12.011 -6.073 5.205 1.00 2.11 C HETATM 1353 C9 6FS A 301 7.088 -7.521 6.678 1.00 0.93 C HETATM 1354 O1 6FS A 301 1.549 -8.283 6.753 1.00 1.11 O HETATM 1355 C4 6FS A 301 5.079 -8.414 5.681 1.00 0.89 C HETATM 1356 C20 6FS A 301 13.739 -7.740 3.609 1.00 3.94 C HETATM 1357 O5 6FS A 301 10.311 -8.011 7.192 1.00 2.60 O HETATM 1358 N1 6FS A 301 14.175 -6.504 4.276 1.00 3.01 N HETATM 1359 O2 6FS A 301 5.906 -8.863 4.684 1.00 1.06 O