USER MOD reduce.3.24.130724 H: found=0, std=0, add=735, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 738 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 162 TYR OH : rot 60:sc= 0.734 USER MOD Set 1.2: A 212 MET CE :methyl -162:sc= -10.6! (180deg=-10.9!) USER MOD Set 1.3: A 216 GLN : amide:sc= -2.59! C(o=-14!,f=-27!) USER MOD Set 1.4: A 219 GLN : amide:sc= -1.77 K(o=-14,f=-21!) USER MOD Set 2.1: A 159 GLN : amide:sc= -1.55! K(o=-2.3!,f=-0.98) USER MOD Set 2.2: A 186 HIS : no HD1:sc= -0.736 X(o=-2.3,f=-2.3) USER MOD Set 3.1: A 185 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Set 3.2: A 189 THR OG1 : rot -170:sc= 0 USER MOD Set 4.1: A 133 MET CE :methyl 139:sc= -7.2! (180deg=-9.99!) USER MOD Set 4.2: A 158 ASN : amide:sc= -17.4! C(o=-25!,f=-26!) USER MOD Single : A 127 TYR OH : rot 180:sc= 0.0358 USER MOD Single : A 128 MET CE :methyl -149:sc= -1.61! (180deg=-3.13!) USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD Single : A 134 SER OG : rot -43:sc= 0.402 USER MOD Single : A 139 HIS : no HE2:sc= -1.28 K(o=-1.3,f=-5!) USER MOD Single : A 142 ASN : amide:sc= 0.977 K(o=0.98,f=-1.3!) USER MOD Single : A 144 TYR OH : rot 180:sc= 0 USER MOD Single : A 148 TYR OH : rot 180:sc= 1.26 USER MOD Single : A 149 TYR OH : rot 30:sc= -1.07 USER MOD Single : A 152 ASN : amide:sc= -13.7! C(o=-14!,f=-11!) USER MOD Single : A 153 MET CE :methyl -165:sc= -9.95! (180deg=-11.5!) USER MOD Single : A 154 TYR OH : rot 180:sc= 0 USER MOD Single : A 156 TYR OH : rot 57:sc= 1.06 USER MOD Single : A 161 TYR OH : rot 180:sc= 0 USER MOD Single : A 170 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 171 GLN : amide:sc= -10.7! C(o=-11!,f=-24!) USER MOD Single : A 172 ASN : amide:sc= -3.52! K(o=-3.5!,f=-0.65) USER MOD Single : A 173 ASN : amide:sc=-0.00143 K(o=-0.0014,f=-1.2) USER MOD Single : A 176 HIS : no HE2:sc= 1.17 K(o=1.2,f=-3.7!) USER MOD Single : A 180 ASN : amide:sc= -0.129 K(o=-0.13,f=1.2) USER MOD Single : A 182 THR OG1 : rot 86:sc= 0.908 USER MOD Single : A 184 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00801) USER MOD Single : A 187 THR OG1 : rot 80:sc= 0.676 USER MOD Single : A 190 THR OG1 : rot 130:sc= 1.3 USER MOD Single : A 196 ASN : amide:sc= -0.0234 X(o=-0.023,f=-0.023) USER MOD Single : A 198 THR OG1 : rot 180:sc= -0.0937 USER MOD Single : A 200 THR OG1 : rot 180:sc= 0 USER MOD Single : A 203 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 205 MET CE :methyl -160:sc= -13.4! (180deg=-14.4!) USER MOD Single : A 211 GLN : amide:sc= -0.111 K(o=-0.11,f=-1.4) USER MOD Single : A 215 THR OG1 : rot 180:sc= 0 USER MOD Single : A 217 TYR OH : rot 180:sc= 0 USER MOD Single : A 218 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 221 SER OG : rot -30:sc= 0.167 USER MOD Single : A 222 GLN : amide:sc=-0.00563 X(o=-0.0056,f=-0.32) USER MOD Single : A 225 TYR OH : rot 180:sc= 0 USER MOD Single : A 226 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD ----------------------------------------------------------------- ATOM 34 N TYR A 127 10.189 -9.826 2.456 1.00 0.57 N ATOM 35 CA TYR A 127 9.569 -8.559 2.119 1.00 0.44 C ATOM 36 C TYR A 127 9.198 -7.862 3.387 1.00 0.40 C ATOM 37 O TYR A 127 8.193 -8.173 4.026 1.00 0.60 O ATOM 38 CB TYR A 127 8.340 -8.709 1.208 1.00 0.46 C ATOM 39 CG TYR A 127 8.679 -9.189 -0.184 1.00 0.65 C ATOM 40 CD1 TYR A 127 9.018 -8.293 -1.189 1.00 1.10 C ATOM 41 CD2 TYR A 127 8.643 -10.542 -0.495 1.00 1.09 C ATOM 42 CE1 TYR A 127 9.306 -8.732 -2.464 1.00 1.26 C ATOM 43 CE2 TYR A 127 8.936 -10.988 -1.766 1.00 1.30 C ATOM 44 CZ TYR A 127 9.342 -10.064 -2.735 1.00 1.17 C ATOM 45 OH TYR A 127 9.551 -10.520 -4.018 1.00 1.41 O ATOM 0 HA TYR A 127 10.291 -7.972 1.551 1.00 0.44 H new ATOM 0 HB2 TYR A 127 7.641 -9.409 1.666 1.00 0.46 H new ATOM 0 HB3 TYR A 127 7.829 -7.749 1.139 1.00 0.46 H new ATOM 0 HD1 TYR A 127 9.057 -7.236 -0.969 1.00 1.10 H new ATOM 0 HD2 TYR A 127 8.381 -11.256 0.271 1.00 1.09 H new ATOM 0 HE1 TYR A 127 9.503 -8.017 -3.249 1.00 1.26 H new ATOM 0 HE2 TYR A 127 8.853 -12.037 -2.011 1.00 1.30 H new ATOM 0 HH TYR A 127 9.546 -11.500 -4.022 1.00 1.41 H new ATOM 55 N MET A 128 10.072 -6.963 3.749 1.00 0.42 N ATOM 56 CA MET A 128 9.932 -6.146 4.920 1.00 0.37 C ATOM 57 C MET A 128 8.549 -5.534 4.991 1.00 0.31 C ATOM 58 O MET A 128 8.171 -4.715 4.151 1.00 0.30 O ATOM 59 CB MET A 128 10.998 -5.074 4.859 1.00 0.45 C ATOM 60 CG MET A 128 11.428 -4.577 6.206 1.00 0.90 C ATOM 61 SD MET A 128 10.341 -3.306 6.881 1.00 1.18 S ATOM 62 CE MET A 128 10.041 -2.288 5.432 1.00 0.45 C ATOM 0 H MET A 128 10.925 -6.775 3.222 1.00 0.42 H new ATOM 0 HA MET A 128 10.056 -6.749 5.819 1.00 0.37 H new ATOM 0 HB2 MET A 128 11.867 -5.467 4.332 1.00 0.45 H new ATOM 0 HB3 MET A 128 10.624 -4.234 4.274 1.00 0.45 H new ATOM 0 HG2 MET A 128 11.467 -5.417 6.900 1.00 0.90 H new ATOM 0 HG3 MET A 128 12.439 -4.178 6.132 1.00 0.90 H new ATOM 0 HE1 MET A 128 9.890 -1.253 5.739 1.00 0.45 H new ATOM 0 HE2 MET A 128 10.899 -2.346 4.762 1.00 0.45 H new ATOM 0 HE3 MET A 128 9.151 -2.646 4.914 1.00 0.45 H new ATOM 72 N LEU A 129 7.782 -5.970 5.977 1.00 0.32 N ATOM 73 CA LEU A 129 6.467 -5.420 6.198 1.00 0.28 C ATOM 74 C LEU A 129 6.592 -3.911 6.281 1.00 0.26 C ATOM 75 O LEU A 129 7.288 -3.393 7.151 1.00 0.30 O ATOM 76 CB LEU A 129 5.852 -5.994 7.482 1.00 0.33 C ATOM 77 CG LEU A 129 4.407 -5.578 7.788 1.00 0.35 C ATOM 78 CD1 LEU A 129 3.746 -6.615 8.678 1.00 0.87 C ATOM 79 CD2 LEU A 129 4.369 -4.219 8.468 1.00 0.80 C ATOM 0 H LEU A 129 8.053 -6.703 6.633 1.00 0.32 H new ATOM 0 HA LEU A 129 5.805 -5.688 5.375 1.00 0.28 H new ATOM 0 HB2 LEU A 129 5.890 -7.082 7.423 1.00 0.33 H new ATOM 0 HB3 LEU A 129 6.479 -5.698 8.323 1.00 0.33 H new ATOM 0 HG LEU A 129 3.863 -5.510 6.846 1.00 0.35 H new ATOM 0 HD11 LEU A 129 2.721 -6.312 8.890 1.00 0.87 H new ATOM 0 HD12 LEU A 129 3.742 -7.580 8.171 1.00 0.87 H new ATOM 0 HD13 LEU A 129 4.300 -6.699 9.613 1.00 0.87 H new ATOM 0 HD21 LEU A 129 3.335 -3.945 8.675 1.00 0.80 H new ATOM 0 HD22 LEU A 129 4.927 -4.264 9.403 1.00 0.80 H new ATOM 0 HD23 LEU A 129 4.818 -3.472 7.814 1.00 0.80 H new ATOM 91 N GLY A 130 5.942 -3.228 5.352 1.00 0.23 N ATOM 92 CA GLY A 130 6.027 -1.790 5.251 1.00 0.25 C ATOM 93 C GLY A 130 5.355 -1.086 6.401 1.00 0.21 C ATOM 94 O GLY A 130 4.304 -0.486 6.213 1.00 0.20 O ATOM 0 H GLY A 130 5.342 -3.660 4.649 1.00 0.23 H new ATOM 0 HA2 GLY A 130 7.075 -1.494 5.212 1.00 0.25 H new ATOM 0 HA3 GLY A 130 5.569 -1.468 4.316 1.00 0.25 H new ATOM 98 N SER A 131 5.940 -1.299 7.585 1.00 0.26 N ATOM 99 CA SER A 131 5.723 -0.546 8.844 1.00 0.31 C ATOM 100 C SER A 131 4.380 0.181 8.984 1.00 0.23 C ATOM 101 O SER A 131 4.342 1.301 9.500 1.00 0.29 O ATOM 102 CB SER A 131 6.867 0.459 9.008 1.00 0.53 C ATOM 103 OG SER A 131 7.101 1.174 7.802 1.00 1.41 O ATOM 0 H SER A 131 6.622 -2.047 7.706 1.00 0.26 H new ATOM 0 HA SER A 131 5.702 -1.299 9.631 1.00 0.31 H new ATOM 0 HB2 SER A 131 6.627 1.159 9.808 1.00 0.53 H new ATOM 0 HB3 SER A 131 7.775 -0.065 9.305 1.00 0.53 H new ATOM 0 HG SER A 131 7.835 1.810 7.936 1.00 1.41 H new ATOM 109 N ALA A 132 3.284 -0.462 8.584 1.00 0.23 N ATOM 110 CA ALA A 132 1.960 0.169 8.596 1.00 0.24 C ATOM 111 C ALA A 132 1.964 1.489 7.822 1.00 0.21 C ATOM 112 O ALA A 132 1.089 2.344 7.993 1.00 0.31 O ATOM 113 CB ALA A 132 1.464 0.371 10.017 1.00 0.33 C ATOM 0 H ALA A 132 3.285 -1.424 8.246 1.00 0.23 H new ATOM 0 HA ALA A 132 1.269 -0.507 8.092 1.00 0.24 H new ATOM 0 HB1 ALA A 132 0.481 0.840 9.996 1.00 0.33 H new ATOM 0 HB2 ALA A 132 1.395 -0.594 10.519 1.00 0.33 H new ATOM 0 HB3 ALA A 132 2.160 1.012 10.558 1.00 0.33 H new ATOM 119 N MET A 133 2.950 1.608 6.945 1.00 0.16 N ATOM 120 CA MET A 133 3.120 2.746 6.057 1.00 0.21 C ATOM 121 C MET A 133 3.156 4.076 6.823 1.00 0.29 C ATOM 122 O MET A 133 3.342 4.102 8.044 1.00 0.55 O ATOM 123 CB MET A 133 2.026 2.724 4.979 1.00 0.20 C ATOM 124 CG MET A 133 1.955 1.386 4.254 1.00 0.26 C ATOM 125 SD MET A 133 1.431 1.501 2.532 1.00 0.41 S ATOM 126 CE MET A 133 -0.050 2.492 2.643 1.00 0.22 C ATOM 0 H MET A 133 3.672 0.897 6.829 1.00 0.16 H new ATOM 0 HA MET A 133 4.090 2.663 5.566 1.00 0.21 H new ATOM 0 HB2 MET A 133 1.061 2.937 5.439 1.00 0.20 H new ATOM 0 HB3 MET A 133 2.216 3.517 4.256 1.00 0.20 H new ATOM 0 HG2 MET A 133 2.936 0.913 4.292 1.00 0.26 H new ATOM 0 HG3 MET A 133 1.265 0.733 4.788 1.00 0.26 H new ATOM 0 HE1 MET A 133 -0.071 3.208 1.822 1.00 0.22 H new ATOM 0 HE2 MET A 133 -0.926 1.846 2.583 1.00 0.22 H new ATOM 0 HE3 MET A 133 -0.059 3.028 3.592 1.00 0.22 H new ATOM 136 N SER A 134 3.015 5.183 6.109 1.00 0.47 N ATOM 137 CA SER A 134 3.110 6.499 6.726 1.00 0.56 C ATOM 138 C SER A 134 1.733 7.160 6.798 1.00 0.61 C ATOM 139 O SER A 134 1.622 8.382 6.912 1.00 0.74 O ATOM 140 CB SER A 134 4.091 7.369 5.930 1.00 0.65 C ATOM 141 OG SER A 134 4.405 8.569 6.624 1.00 1.52 O ATOM 0 H SER A 134 2.835 5.197 5.105 1.00 0.47 H new ATOM 0 HA SER A 134 3.481 6.390 7.745 1.00 0.56 H new ATOM 0 HB2 SER A 134 5.006 6.807 5.740 1.00 0.65 H new ATOM 0 HB3 SER A 134 3.659 7.611 4.959 1.00 0.65 H new ATOM 0 HG SER A 134 3.588 8.946 7.011 1.00 1.52 H new ATOM 147 N ARG A 135 0.692 6.329 6.759 1.00 0.61 N ATOM 148 CA ARG A 135 -0.694 6.797 6.741 1.00 0.76 C ATOM 149 C ARG A 135 -0.920 7.864 5.668 1.00 0.75 C ATOM 150 O ARG A 135 -1.089 9.043 5.977 1.00 1.14 O ATOM 151 CB ARG A 135 -1.115 7.345 8.091 1.00 1.01 C ATOM 152 CG ARG A 135 -2.608 7.586 8.168 1.00 0.98 C ATOM 153 CD ARG A 135 -3.356 6.316 7.809 1.00 1.57 C ATOM 154 NE ARG A 135 -3.337 5.351 8.906 1.00 2.57 N ATOM 155 CZ ARG A 135 -4.096 5.430 9.997 1.00 3.27 C ATOM 156 NH1 ARG A 135 -4.956 6.431 10.153 1.00 3.37 N ATOM 157 NH2 ARG A 135 -3.983 4.505 10.940 1.00 4.17 N ATOM 0 H ARG A 135 0.785 5.313 6.739 1.00 0.61 H new ATOM 0 HA ARG A 135 -1.308 5.928 6.504 1.00 0.76 H new ATOM 0 HB2 ARG A 135 -0.820 6.646 8.873 1.00 1.01 H new ATOM 0 HB3 ARG A 135 -0.587 8.279 8.283 1.00 1.01 H new ATOM 0 HG2 ARG A 135 -2.882 7.908 9.173 1.00 0.98 H new ATOM 0 HG3 ARG A 135 -2.891 8.389 7.488 1.00 0.98 H new ATOM 0 HD2 ARG A 135 -4.388 6.560 7.556 1.00 1.57 H new ATOM 0 HD3 ARG A 135 -2.908 5.868 6.922 1.00 1.57 H new ATOM 0 HE ARG A 135 -2.697 4.561 8.831 1.00 2.57 H new ATOM 0 HH11 ARG A 135 -5.039 7.149 9.433 1.00 3.37 H new ATOM 0 HH12 ARG A 135 -5.533 6.482 10.993 1.00 3.37 H new ATOM 0 HH21 ARG A 135 -3.318 3.740 10.827 1.00 4.17 H new ATOM 0 HH22 ARG A 135 -4.561 4.559 11.779 1.00 4.17 H new ATOM 171 N PRO A 136 -0.857 7.470 4.394 1.00 0.54 N ATOM 172 CA PRO A 136 -1.287 8.303 3.279 1.00 0.50 C ATOM 173 C PRO A 136 -2.650 8.931 3.513 1.00 0.51 C ATOM 174 O PRO A 136 -2.779 10.153 3.584 1.00 0.57 O ATOM 175 CB PRO A 136 -1.407 7.307 2.119 1.00 0.55 C ATOM 176 CG PRO A 136 -1.160 5.966 2.713 1.00 0.62 C ATOM 177 CD PRO A 136 -0.317 6.207 3.915 1.00 0.59 C ATOM 0 HA PRO A 136 -0.593 9.127 3.113 1.00 0.50 H new ATOM 0 HB2 PRO A 136 -2.395 7.356 1.661 1.00 0.55 H new ATOM 0 HB3 PRO A 136 -0.681 7.528 1.336 1.00 0.55 H new ATOM 0 HG2 PRO A 136 -2.097 5.479 2.983 1.00 0.62 H new ATOM 0 HG3 PRO A 136 -0.653 5.311 2.004 1.00 0.62 H new ATOM 0 HD2 PRO A 136 -0.417 5.411 4.653 1.00 0.59 H new ATOM 0 HD3 PRO A 136 0.742 6.281 3.666 1.00 0.59 H new ATOM 185 N LEU A 137 -3.653 8.061 3.666 1.00 0.50 N ATOM 186 CA LEU A 137 -5.049 8.463 3.594 1.00 0.54 C ATOM 187 C LEU A 137 -5.242 9.358 2.386 1.00 0.58 C ATOM 188 O LEU A 137 -5.281 10.577 2.492 1.00 0.99 O ATOM 189 CB LEU A 137 -5.519 9.140 4.881 1.00 0.59 C ATOM 190 CG LEU A 137 -5.614 8.206 6.087 1.00 0.64 C ATOM 191 CD1 LEU A 137 -6.149 8.948 7.303 1.00 0.97 C ATOM 192 CD2 LEU A 137 -6.490 7.003 5.760 1.00 0.90 C ATOM 0 H LEU A 137 -3.515 7.066 3.842 1.00 0.50 H new ATOM 0 HA LEU A 137 -5.667 7.572 3.483 1.00 0.54 H new ATOM 0 HB2 LEU A 137 -4.834 9.954 5.120 1.00 0.59 H new ATOM 0 HB3 LEU A 137 -6.497 9.588 4.705 1.00 0.59 H new ATOM 0 HG LEU A 137 -4.612 7.848 6.324 1.00 0.64 H new ATOM 0 HD11 LEU A 137 -6.208 8.264 8.150 1.00 0.97 H new ATOM 0 HD12 LEU A 137 -5.480 9.773 7.549 1.00 0.97 H new ATOM 0 HD13 LEU A 137 -7.142 9.339 7.083 1.00 0.97 H new ATOM 0 HD21 LEU A 137 -6.547 6.348 6.629 1.00 0.90 H new ATOM 0 HD22 LEU A 137 -7.491 7.343 5.495 1.00 0.90 H new ATOM 0 HD23 LEU A 137 -6.059 6.456 4.921 1.00 0.90 H new ATOM 204 N ILE A 138 -5.322 8.707 1.236 1.00 0.55 N ATOM 205 CA ILE A 138 -5.257 9.353 -0.070 1.00 0.64 C ATOM 206 C ILE A 138 -6.226 10.518 -0.223 1.00 0.61 C ATOM 207 O ILE A 138 -5.973 11.412 -1.029 1.00 1.10 O ATOM 208 CB ILE A 138 -5.528 8.324 -1.182 1.00 0.91 C ATOM 209 CG1 ILE A 138 -4.727 7.056 -0.917 1.00 1.07 C ATOM 210 CG2 ILE A 138 -5.154 8.894 -2.537 1.00 1.17 C ATOM 211 CD1 ILE A 138 -3.241 7.300 -0.903 1.00 0.63 C ATOM 0 H ILE A 138 -5.436 7.695 1.181 1.00 0.55 H new ATOM 0 HA ILE A 138 -4.250 9.760 -0.155 1.00 0.64 H new ATOM 0 HB ILE A 138 -6.592 8.086 -1.186 1.00 0.91 H new ATOM 0 HG12 ILE A 138 -5.031 6.633 0.040 1.00 1.07 H new ATOM 0 HG13 ILE A 138 -4.962 6.316 -1.682 1.00 1.07 H new ATOM 0 HG21 ILE A 138 -5.352 8.153 -3.311 1.00 1.17 H new ATOM 0 HG22 ILE A 138 -5.746 9.789 -2.731 1.00 1.17 H new ATOM 0 HG23 ILE A 138 -4.095 9.151 -2.544 1.00 1.17 H new ATOM 0 HD11 ILE A 138 -2.720 6.362 -0.710 1.00 0.63 H new ATOM 0 HD12 ILE A 138 -2.928 7.696 -1.869 1.00 0.63 H new ATOM 0 HD13 ILE A 138 -2.998 8.018 -0.120 1.00 0.63 H new ATOM 223 N HIS A 139 -7.318 10.498 0.554 1.00 0.40 N ATOM 224 CA HIS A 139 -8.411 11.490 0.512 1.00 0.41 C ATOM 225 C HIS A 139 -9.080 11.608 -0.856 1.00 0.46 C ATOM 226 O HIS A 139 -10.255 11.944 -0.927 1.00 0.82 O ATOM 227 CB HIS A 139 -8.043 12.880 1.108 1.00 0.53 C ATOM 228 CG HIS A 139 -6.667 13.395 0.817 1.00 0.65 C ATOM 229 ND1 HIS A 139 -5.567 13.049 1.568 1.00 0.86 N ATOM 230 CD2 HIS A 139 -6.211 14.209 -0.159 1.00 1.13 C ATOM 231 CE1 HIS A 139 -4.496 13.624 1.067 1.00 1.07 C ATOM 232 NE2 HIS A 139 -4.853 14.335 0.012 1.00 1.28 N ATOM 0 H HIS A 139 -7.473 9.770 1.252 1.00 0.40 H new ATOM 0 HA HIS A 139 -9.160 11.075 1.186 1.00 0.41 H new ATOM 0 HB2 HIS A 139 -8.764 13.610 0.740 1.00 0.53 H new ATOM 0 HB3 HIS A 139 -8.165 12.829 2.190 1.00 0.53 H new ATOM 0 HD1 HIS A 139 -5.580 12.441 2.387 1.00 0.86 H new ATOM 0 HD2 HIS A 139 -6.804 14.675 -0.932 1.00 1.13 H new ATOM 0 HE1 HIS A 139 -3.492 13.531 1.453 1.00 1.07 H new ATOM 241 N PHE A 140 -8.340 11.343 -1.926 1.00 0.45 N ATOM 242 CA PHE A 140 -8.895 11.190 -3.272 1.00 0.41 C ATOM 243 C PHE A 140 -9.371 12.514 -3.871 1.00 0.46 C ATOM 244 O PHE A 140 -9.439 12.667 -5.092 1.00 0.64 O ATOM 245 CB PHE A 140 -10.054 10.179 -3.249 1.00 0.38 C ATOM 246 CG PHE A 140 -10.672 9.957 -4.596 1.00 0.70 C ATOM 247 CD1 PHE A 140 -10.069 9.137 -5.535 1.00 0.74 C ATOM 248 CD2 PHE A 140 -11.872 10.561 -4.911 1.00 1.23 C ATOM 249 CE1 PHE A 140 -10.655 8.929 -6.768 1.00 1.19 C ATOM 250 CE2 PHE A 140 -12.464 10.361 -6.142 1.00 1.74 C ATOM 251 CZ PHE A 140 -11.782 9.550 -7.107 1.00 1.70 C ATOM 0 H PHE A 140 -7.327 11.227 -1.887 1.00 0.45 H new ATOM 0 HA PHE A 140 -8.090 10.823 -3.909 1.00 0.41 H new ATOM 0 HB2 PHE A 140 -9.689 9.227 -2.863 1.00 0.38 H new ATOM 0 HB3 PHE A 140 -10.821 10.531 -2.558 1.00 0.38 H new ATOM 0 HD1 PHE A 140 -9.131 8.655 -5.301 1.00 0.74 H new ATOM 0 HD2 PHE A 140 -12.354 11.199 -4.185 1.00 1.23 H new ATOM 0 HE1 PHE A 140 -10.191 8.251 -7.469 1.00 1.19 H new ATOM 0 HE2 PHE A 140 -13.421 10.806 -6.373 1.00 1.74 H new ATOM 0 HZ PHE A 140 -12.181 9.443 -8.105 1.00 1.70 H new ATOM 261 N GLY A 141 -9.669 13.468 -3.019 1.00 0.47 N ATOM 262 CA GLY A 141 -10.383 14.638 -3.444 1.00 0.53 C ATOM 263 C GLY A 141 -11.827 14.527 -3.027 1.00 0.48 C ATOM 264 O GLY A 141 -12.641 15.405 -3.304 1.00 0.54 O ATOM 0 H GLY A 141 -9.426 13.452 -2.029 1.00 0.47 H new ATOM 0 HA2 GLY A 141 -9.935 15.530 -3.005 1.00 0.53 H new ATOM 0 HA3 GLY A 141 -10.314 14.746 -4.526 1.00 0.53 H new ATOM 268 N ASN A 142 -12.143 13.416 -2.363 1.00 0.41 N ATOM 269 CA ASN A 142 -13.454 13.191 -1.807 1.00 0.45 C ATOM 270 C ASN A 142 -13.297 12.608 -0.431 1.00 0.47 C ATOM 271 O ASN A 142 -12.862 11.477 -0.306 1.00 0.46 O ATOM 272 CB ASN A 142 -14.255 12.199 -2.647 1.00 0.48 C ATOM 273 CG ASN A 142 -14.810 12.796 -3.924 1.00 1.22 C ATOM 274 OD1 ASN A 142 -15.065 13.998 -4.008 1.00 1.71 O ATOM 275 ND2 ASN A 142 -15.026 11.951 -4.917 1.00 1.88 N ATOM 0 H ASN A 142 -11.487 12.652 -2.201 1.00 0.41 H new ATOM 0 HA ASN A 142 -13.983 14.144 -1.785 1.00 0.45 H new ATOM 0 HB2 ASN A 142 -13.618 11.351 -2.899 1.00 0.48 H new ATOM 0 HB3 ASN A 142 -15.079 11.811 -2.049 1.00 0.48 H new ATOM 0 HD21 ASN A 142 -15.419 12.287 -5.796 1.00 1.88 H new ATOM 0 HD22 ASN A 142 -14.800 10.963 -4.804 1.00 1.88 H new ATOM 282 N ASP A 143 -13.618 13.371 0.594 1.00 0.54 N ATOM 283 CA ASP A 143 -13.667 12.842 1.948 1.00 0.57 C ATOM 284 C ASP A 143 -14.569 11.614 2.016 1.00 0.52 C ATOM 285 O ASP A 143 -14.506 10.853 2.967 1.00 0.52 O ATOM 286 CB ASP A 143 -14.161 13.884 2.943 1.00 0.72 C ATOM 287 CG ASP A 143 -15.671 14.031 2.948 1.00 1.04 C ATOM 288 OD1 ASP A 143 -16.219 14.612 1.990 1.00 1.14 O ATOM 289 OD2 ASP A 143 -16.320 13.561 3.905 1.00 1.39 O ATOM 0 H ASP A 143 -13.850 14.361 0.518 1.00 0.54 H new ATOM 0 HA ASP A 143 -12.649 12.562 2.217 1.00 0.57 H new ATOM 0 HB2 ASP A 143 -13.825 13.611 3.943 1.00 0.72 H new ATOM 0 HB3 ASP A 143 -13.709 14.847 2.707 1.00 0.72 H new ATOM 294 N TYR A 144 -15.409 11.443 1.005 1.00 0.53 N ATOM 295 CA TYR A 144 -16.225 10.255 0.865 1.00 0.55 C ATOM 296 C TYR A 144 -15.311 9.052 0.663 1.00 0.45 C ATOM 297 O TYR A 144 -15.422 8.041 1.345 1.00 0.47 O ATOM 298 CB TYR A 144 -17.163 10.422 -0.328 1.00 0.63 C ATOM 299 CG TYR A 144 -18.425 9.599 -0.242 1.00 0.82 C ATOM 300 CD1 TYR A 144 -18.377 8.221 -0.397 1.00 0.90 C ATOM 301 CD2 TYR A 144 -19.658 10.192 -0.003 1.00 1.15 C ATOM 302 CE1 TYR A 144 -19.521 7.456 -0.316 1.00 1.19 C ATOM 303 CE2 TYR A 144 -20.807 9.431 0.080 1.00 1.41 C ATOM 304 CZ TYR A 144 -20.762 8.107 -0.088 1.00 1.40 C ATOM 305 OH TYR A 144 -21.871 7.297 0.008 1.00 1.70 O ATOM 0 H TYR A 144 -15.541 12.127 0.260 1.00 0.53 H new ATOM 0 HA TYR A 144 -16.827 10.101 1.761 1.00 0.55 H new ATOM 0 HB2 TYR A 144 -17.434 11.474 -0.418 1.00 0.63 H new ATOM 0 HB3 TYR A 144 -16.627 10.151 -1.238 1.00 0.63 H new ATOM 0 HD1 TYR A 144 -17.428 7.740 -0.584 1.00 0.90 H new ATOM 0 HD2 TYR A 144 -19.719 11.263 0.120 1.00 1.15 H new ATOM 0 HE1 TYR A 144 -19.474 6.382 -0.424 1.00 1.19 H new ATOM 0 HE2 TYR A 144 -21.753 9.912 0.283 1.00 1.41 H new ATOM 0 HH TYR A 144 -22.666 7.848 0.166 1.00 1.70 H new ATOM 315 N GLU A 145 -14.381 9.181 -0.263 1.00 0.39 N ATOM 316 CA GLU A 145 -13.371 8.161 -0.465 1.00 0.34 C ATOM 317 C GLU A 145 -12.293 8.265 0.572 1.00 0.33 C ATOM 318 O GLU A 145 -11.657 7.268 0.910 1.00 0.34 O ATOM 319 CB GLU A 145 -12.730 8.270 -1.810 1.00 0.34 C ATOM 320 CG GLU A 145 -13.535 7.641 -2.924 1.00 0.43 C ATOM 321 CD GLU A 145 -14.793 8.412 -3.274 1.00 1.12 C ATOM 322 OE1 GLU A 145 -15.835 8.186 -2.632 1.00 1.23 O ATOM 323 OE2 GLU A 145 -14.745 9.241 -4.210 1.00 2.20 O ATOM 0 H GLU A 145 -14.304 9.983 -0.888 1.00 0.39 H new ATOM 0 HA GLU A 145 -13.883 7.202 -0.386 1.00 0.34 H new ATOM 0 HB2 GLU A 145 -12.569 9.323 -2.041 1.00 0.34 H new ATOM 0 HB3 GLU A 145 -11.748 7.798 -1.773 1.00 0.34 H new ATOM 0 HG2 GLU A 145 -12.909 7.561 -3.813 1.00 0.43 H new ATOM 0 HG3 GLU A 145 -13.809 6.627 -2.635 1.00 0.43 H new ATOM 330 N ASP A 146 -12.061 9.464 1.066 1.00 0.37 N ATOM 331 CA ASP A 146 -11.076 9.642 2.097 1.00 0.45 C ATOM 332 C ASP A 146 -11.485 8.829 3.290 1.00 0.45 C ATOM 333 O ASP A 146 -10.697 8.114 3.904 1.00 0.49 O ATOM 334 CB ASP A 146 -10.918 11.091 2.518 1.00 0.56 C ATOM 335 CG ASP A 146 -9.910 11.244 3.639 1.00 1.11 C ATOM 336 OD1 ASP A 146 -8.727 10.898 3.432 1.00 1.44 O ATOM 337 OD2 ASP A 146 -10.292 11.709 4.728 1.00 1.40 O ATOM 0 H ASP A 146 -12.538 10.316 0.771 1.00 0.37 H new ATOM 0 HA ASP A 146 -10.115 9.316 1.698 1.00 0.45 H new ATOM 0 HB2 ASP A 146 -10.602 11.686 1.661 1.00 0.56 H new ATOM 0 HB3 ASP A 146 -11.883 11.483 2.840 1.00 0.56 H new ATOM 342 N ARG A 147 -12.759 8.940 3.570 1.00 0.47 N ATOM 343 CA ARG A 147 -13.409 8.159 4.588 1.00 0.52 C ATOM 344 C ARG A 147 -13.301 6.695 4.242 1.00 0.50 C ATOM 345 O ARG A 147 -13.139 5.843 5.112 1.00 0.54 O ATOM 346 CB ARG A 147 -14.878 8.581 4.680 1.00 0.57 C ATOM 347 CG ARG A 147 -15.848 7.439 4.975 1.00 0.66 C ATOM 348 CD ARG A 147 -16.381 6.838 3.689 1.00 0.69 C ATOM 349 NE ARG A 147 -17.323 5.747 3.927 1.00 1.11 N ATOM 350 CZ ARG A 147 -16.961 4.507 4.233 1.00 1.15 C ATOM 351 NH1 ARG A 147 -15.685 4.203 4.389 1.00 1.34 N ATOM 352 NH2 ARG A 147 -17.872 3.565 4.400 1.00 1.94 N ATOM 0 H ARG A 147 -13.383 9.587 3.088 1.00 0.47 H new ATOM 0 HA ARG A 147 -12.930 8.326 5.553 1.00 0.52 H new ATOM 0 HB2 ARG A 147 -14.978 9.336 5.460 1.00 0.57 H new ATOM 0 HB3 ARG A 147 -15.167 9.053 3.741 1.00 0.57 H new ATOM 0 HG2 ARG A 147 -15.344 6.669 5.559 1.00 0.66 H new ATOM 0 HG3 ARG A 147 -16.676 7.807 5.580 1.00 0.66 H new ATOM 0 HD2 ARG A 147 -16.872 7.616 3.105 1.00 0.69 H new ATOM 0 HD3 ARG A 147 -15.547 6.469 3.092 1.00 0.69 H new ATOM 0 HE ARG A 147 -18.320 5.950 3.854 1.00 1.11 H new ATOM 0 HH11 ARG A 147 -14.972 4.923 4.274 1.00 1.34 H new ATOM 0 HH12 ARG A 147 -15.413 3.248 4.624 1.00 1.34 H new ATOM 0 HH21 ARG A 147 -18.862 3.788 4.294 1.00 1.94 H new ATOM 0 HH22 ARG A 147 -17.586 2.615 4.635 1.00 1.94 H new ATOM 366 N TYR A 148 -13.402 6.411 2.956 1.00 0.45 N ATOM 367 CA TYR A 148 -13.396 5.056 2.496 1.00 0.46 C ATOM 368 C TYR A 148 -12.083 4.409 2.832 1.00 0.44 C ATOM 369 O TYR A 148 -12.053 3.397 3.501 1.00 0.57 O ATOM 370 CB TYR A 148 -13.701 4.986 1.003 1.00 0.47 C ATOM 371 CG TYR A 148 -14.156 3.625 0.542 1.00 0.49 C ATOM 372 CD1 TYR A 148 -14.921 2.820 1.367 1.00 0.71 C ATOM 373 CD2 TYR A 148 -13.810 3.143 -0.714 1.00 0.38 C ATOM 374 CE1 TYR A 148 -15.333 1.571 0.956 1.00 0.77 C ATOM 375 CE2 TYR A 148 -14.216 1.893 -1.134 1.00 0.43 C ATOM 376 CZ TYR A 148 -15.008 1.126 -0.313 1.00 0.60 C ATOM 377 OH TYR A 148 -15.385 -0.138 -0.707 1.00 0.68 O ATOM 0 H TYR A 148 -13.489 7.111 2.219 1.00 0.45 H new ATOM 0 HA TYR A 148 -14.185 4.503 3.006 1.00 0.46 H new ATOM 0 HB2 TYR A 148 -14.473 5.718 0.764 1.00 0.47 H new ATOM 0 HB3 TYR A 148 -12.809 5.270 0.445 1.00 0.47 H new ATOM 0 HD1 TYR A 148 -15.199 3.176 2.348 1.00 0.71 H new ATOM 0 HD2 TYR A 148 -13.213 3.757 -1.373 1.00 0.38 H new ATOM 0 HE1 TYR A 148 -15.907 0.943 1.621 1.00 0.77 H new ATOM 0 HE2 TYR A 148 -13.914 1.520 -2.101 1.00 0.43 H new ATOM 0 HH TYR A 148 -15.082 -0.298 -1.625 1.00 0.68 H new ATOM 387 N TYR A 149 -11.003 5.039 2.437 1.00 0.41 N ATOM 388 CA TYR A 149 -9.679 4.517 2.713 1.00 0.43 C ATOM 389 C TYR A 149 -9.397 4.592 4.203 1.00 0.41 C ATOM 390 O TYR A 149 -8.742 3.731 4.754 1.00 0.40 O ATOM 391 CB TYR A 149 -8.604 5.336 2.044 1.00 0.54 C ATOM 392 CG TYR A 149 -8.934 5.795 0.645 1.00 0.67 C ATOM 393 CD1 TYR A 149 -9.511 4.929 -0.270 1.00 1.40 C ATOM 394 CD2 TYR A 149 -8.668 7.098 0.239 1.00 0.97 C ATOM 395 CE1 TYR A 149 -9.817 5.344 -1.547 1.00 2.09 C ATOM 396 CE2 TYR A 149 -8.971 7.519 -1.041 1.00 1.54 C ATOM 397 CZ TYR A 149 -9.545 6.634 -1.928 1.00 2.08 C ATOM 398 OH TYR A 149 -9.845 7.041 -3.202 1.00 2.82 O ATOM 0 H TYR A 149 -11.012 5.919 1.921 1.00 0.41 H new ATOM 0 HA TYR A 149 -9.663 3.493 2.340 1.00 0.43 H new ATOM 0 HB2 TYR A 149 -8.399 6.212 2.659 1.00 0.54 H new ATOM 0 HB3 TYR A 149 -7.687 4.748 2.011 1.00 0.54 H new ATOM 0 HD1 TYR A 149 -9.724 3.912 0.023 1.00 1.40 H new ATOM 0 HD2 TYR A 149 -8.218 7.791 0.935 1.00 0.97 H new ATOM 0 HE1 TYR A 149 -10.270 4.657 -2.246 1.00 2.09 H new ATOM 0 HE2 TYR A 149 -8.760 8.534 -1.344 1.00 1.54 H new ATOM 0 HH TYR A 149 -10.618 6.538 -3.533 1.00 2.82 H new ATOM 408 N ARG A 150 -9.891 5.636 4.869 1.00 0.45 N ATOM 409 CA ARG A 150 -9.617 5.792 6.291 1.00 0.48 C ATOM 410 C ARG A 150 -10.230 4.631 7.050 1.00 0.50 C ATOM 411 O ARG A 150 -9.848 4.308 8.175 1.00 0.60 O ATOM 412 CB ARG A 150 -10.127 7.139 6.836 1.00 0.56 C ATOM 413 CG ARG A 150 -11.534 7.099 7.410 1.00 0.59 C ATOM 414 CD ARG A 150 -11.931 8.436 8.021 1.00 1.15 C ATOM 415 NE ARG A 150 -11.819 9.544 7.071 1.00 1.83 N ATOM 416 CZ ARG A 150 -12.789 10.437 6.849 1.00 2.65 C ATOM 417 NH1 ARG A 150 -13.946 10.348 7.490 1.00 2.97 N ATOM 418 NH2 ARG A 150 -12.599 11.424 5.988 1.00 3.59 N ATOM 0 H ARG A 150 -10.469 6.368 4.456 1.00 0.45 H new ATOM 0 HA ARG A 150 -8.536 5.790 6.434 1.00 0.48 H new ATOM 0 HB2 ARG A 150 -9.443 7.485 7.611 1.00 0.56 H new ATOM 0 HB3 ARG A 150 -10.097 7.875 6.033 1.00 0.56 H new ATOM 0 HG2 ARG A 150 -12.241 6.834 6.623 1.00 0.59 H new ATOM 0 HG3 ARG A 150 -11.595 6.319 8.169 1.00 0.59 H new ATOM 0 HD2 ARG A 150 -12.957 8.375 8.383 1.00 1.15 H new ATOM 0 HD3 ARG A 150 -11.299 8.638 8.886 1.00 1.15 H new ATOM 0 HE ARG A 150 -10.949 9.641 6.547 1.00 1.83 H new ATOM 0 HH11 ARG A 150 -14.102 9.594 8.159 1.00 2.97 H new ATOM 0 HH12 ARG A 150 -14.680 11.034 7.314 1.00 2.97 H new ATOM 0 HH21 ARG A 150 -11.711 11.504 5.492 1.00 3.59 H new ATOM 0 HH22 ARG A 150 -13.340 12.104 5.820 1.00 3.59 H new ATOM 432 N GLU A 151 -11.171 4.009 6.383 1.00 0.44 N ATOM 433 CA GLU A 151 -11.848 2.845 6.864 1.00 0.48 C ATOM 434 C GLU A 151 -11.213 1.631 6.215 1.00 0.44 C ATOM 435 O GLU A 151 -11.273 0.509 6.715 1.00 0.50 O ATOM 436 CB GLU A 151 -13.320 2.990 6.504 1.00 0.54 C ATOM 437 CG GLU A 151 -13.845 1.925 5.561 1.00 0.49 C ATOM 438 CD GLU A 151 -15.241 1.457 5.914 1.00 0.60 C ATOM 439 OE1 GLU A 151 -15.428 0.941 7.034 1.00 0.83 O ATOM 440 OE2 GLU A 151 -16.149 1.592 5.074 1.00 0.73 O ATOM 0 H GLU A 151 -11.491 4.313 5.464 1.00 0.44 H new ATOM 0 HA GLU A 151 -11.767 2.728 7.945 1.00 0.48 H new ATOM 0 HB2 GLU A 151 -13.909 2.968 7.421 1.00 0.54 H new ATOM 0 HB3 GLU A 151 -13.475 3.968 6.049 1.00 0.54 H new ATOM 0 HG2 GLU A 151 -13.846 2.317 4.544 1.00 0.49 H new ATOM 0 HG3 GLU A 151 -13.168 1.071 5.573 1.00 0.49 H new ATOM 447 N ASN A 152 -10.551 1.903 5.099 1.00 0.40 N ATOM 448 CA ASN A 152 -9.965 0.874 4.287 1.00 0.43 C ATOM 449 C ASN A 152 -8.660 0.447 4.835 1.00 0.37 C ATOM 450 O ASN A 152 -8.123 -0.574 4.436 1.00 0.36 O ATOM 451 CB ASN A 152 -9.699 1.301 2.857 1.00 0.62 C ATOM 452 CG ASN A 152 -10.916 1.348 1.986 1.00 0.67 C ATOM 453 OD1 ASN A 152 -11.932 0.710 2.251 1.00 1.69 O ATOM 454 ND2 ASN A 152 -10.779 2.072 0.904 1.00 0.48 N ATOM 0 H ASN A 152 -10.411 2.848 4.741 1.00 0.40 H new ATOM 0 HA ASN A 152 -10.701 0.070 4.295 1.00 0.43 H new ATOM 0 HB2 ASN A 152 -9.236 2.288 2.866 1.00 0.62 H new ATOM 0 HB3 ASN A 152 -8.977 0.614 2.414 1.00 0.62 H new ATOM 0 HD21 ASN A 152 -11.540 2.127 0.228 1.00 0.48 H new ATOM 0 HD22 ASN A 152 -9.911 2.581 0.737 1.00 0.48 H new ATOM 461 N MET A 153 -8.128 1.231 5.729 1.00 0.35 N ATOM 462 CA MET A 153 -6.761 1.043 6.117 1.00 0.34 C ATOM 463 C MET A 153 -6.538 -0.257 6.867 1.00 0.33 C ATOM 464 O MET A 153 -5.424 -0.553 7.291 1.00 0.36 O ATOM 465 CB MET A 153 -6.177 2.223 6.881 1.00 0.36 C ATOM 466 CG MET A 153 -5.156 3.013 6.099 1.00 0.69 C ATOM 467 SD MET A 153 -5.829 3.959 4.716 1.00 0.61 S ATOM 468 CE MET A 153 -6.358 2.663 3.599 1.00 0.34 C ATOM 0 H MET A 153 -8.613 1.997 6.197 1.00 0.35 H new ATOM 0 HA MET A 153 -6.213 0.979 5.177 1.00 0.34 H new ATOM 0 HB2 MET A 153 -6.988 2.889 7.177 1.00 0.36 H new ATOM 0 HB3 MET A 153 -5.714 1.857 7.797 1.00 0.36 H new ATOM 0 HG2 MET A 153 -4.650 3.699 6.778 1.00 0.69 H new ATOM 0 HG3 MET A 153 -4.400 2.326 5.718 1.00 0.69 H new ATOM 0 HE1 MET A 153 -6.541 3.086 2.611 1.00 0.34 H new ATOM 0 HE2 MET A 153 -5.580 1.903 3.529 1.00 0.34 H new ATOM 0 HE3 MET A 153 -7.275 2.210 3.976 1.00 0.34 H new ATOM 478 N TYR A 154 -7.598 -1.019 7.044 1.00 0.33 N ATOM 479 CA TYR A 154 -7.501 -2.320 7.663 1.00 0.36 C ATOM 480 C TYR A 154 -7.821 -3.419 6.660 1.00 0.34 C ATOM 481 O TYR A 154 -8.043 -4.571 7.032 1.00 0.39 O ATOM 482 CB TYR A 154 -8.434 -2.390 8.872 1.00 0.47 C ATOM 483 CG TYR A 154 -8.066 -1.420 9.972 1.00 0.60 C ATOM 484 CD1 TYR A 154 -8.411 -0.078 9.885 1.00 0.68 C ATOM 485 CD2 TYR A 154 -7.386 -1.851 11.106 1.00 0.76 C ATOM 486 CE1 TYR A 154 -8.089 0.806 10.895 1.00 0.83 C ATOM 487 CE2 TYR A 154 -7.061 -0.974 12.118 1.00 0.92 C ATOM 488 CZ TYR A 154 -7.364 0.372 11.975 1.00 0.95 C ATOM 489 OH TYR A 154 -7.101 1.234 13.016 1.00 1.10 O ATOM 0 H TYR A 154 -8.543 -0.755 6.765 1.00 0.33 H new ATOM 0 HA TYR A 154 -6.478 -2.473 8.005 1.00 0.36 H new ATOM 0 HB2 TYR A 154 -9.454 -2.188 8.546 1.00 0.47 H new ATOM 0 HB3 TYR A 154 -8.422 -3.404 9.273 1.00 0.47 H new ATOM 0 HD1 TYR A 154 -8.939 0.280 9.014 1.00 0.68 H new ATOM 0 HD2 TYR A 154 -7.108 -2.891 11.195 1.00 0.76 H new ATOM 0 HE1 TYR A 154 -8.407 1.836 10.835 1.00 0.83 H new ATOM 0 HE2 TYR A 154 -6.575 -1.331 13.014 1.00 0.92 H new ATOM 0 HH TYR A 154 -6.578 0.769 13.702 1.00 1.10 H new ATOM 499 N ARG A 155 -7.810 -3.068 5.381 1.00 0.30 N ATOM 500 CA ARG A 155 -8.109 -4.029 4.336 1.00 0.31 C ATOM 501 C ARG A 155 -7.458 -3.615 3.001 1.00 0.25 C ATOM 502 O ARG A 155 -6.771 -4.414 2.378 1.00 0.26 O ATOM 503 CB ARG A 155 -9.624 -4.199 4.226 1.00 0.41 C ATOM 504 CG ARG A 155 -10.263 -3.256 3.258 1.00 0.60 C ATOM 505 CD ARG A 155 -10.806 -2.018 3.935 1.00 0.43 C ATOM 506 NE ARG A 155 -11.997 -2.277 4.734 1.00 0.95 N ATOM 507 CZ ARG A 155 -13.232 -2.339 4.225 1.00 1.23 C ATOM 508 NH1 ARG A 155 -13.425 -2.212 2.914 1.00 1.36 N ATOM 509 NH2 ARG A 155 -14.269 -2.524 5.028 1.00 1.92 N ATOM 0 H ARG A 155 -7.598 -2.128 5.046 1.00 0.30 H new ATOM 0 HA ARG A 155 -7.680 -4.998 4.593 1.00 0.31 H new ATOM 0 HB2 ARG A 155 -9.845 -5.222 3.923 1.00 0.41 H new ATOM 0 HB3 ARG A 155 -10.070 -4.054 5.210 1.00 0.41 H new ATOM 0 HG2 ARG A 155 -9.533 -2.964 2.503 1.00 0.60 H new ATOM 0 HG3 ARG A 155 -11.073 -3.767 2.737 1.00 0.60 H new ATOM 0 HD2 ARG A 155 -10.033 -1.593 4.575 1.00 0.43 H new ATOM 0 HD3 ARG A 155 -11.040 -1.270 3.177 1.00 0.43 H new ATOM 0 HE ARG A 155 -11.882 -2.419 5.738 1.00 0.95 H new ATOM 0 HH11 ARG A 155 -12.629 -2.067 2.293 1.00 1.36 H new ATOM 0 HH12 ARG A 155 -14.369 -2.260 2.530 1.00 1.36 H new ATOM 0 HH21 ARG A 155 -14.125 -2.619 6.033 1.00 1.92 H new ATOM 0 HH22 ARG A 155 -15.212 -2.571 4.641 1.00 1.92 H new ATOM 523 N TYR A 156 -7.640 -2.358 2.588 1.00 0.26 N ATOM 524 CA TYR A 156 -6.941 -1.797 1.438 1.00 0.24 C ATOM 525 C TYR A 156 -5.978 -0.812 2.024 1.00 0.24 C ATOM 526 O TYR A 156 -6.044 0.387 1.764 1.00 0.29 O ATOM 527 CB TYR A 156 -7.919 -1.083 0.516 1.00 0.28 C ATOM 528 CG TYR A 156 -9.203 -1.839 0.296 1.00 0.33 C ATOM 529 CD1 TYR A 156 -9.187 -3.203 0.089 1.00 0.53 C ATOM 530 CD2 TYR A 156 -10.418 -1.184 0.283 1.00 0.43 C ATOM 531 CE1 TYR A 156 -10.353 -3.905 -0.126 1.00 0.62 C ATOM 532 CE2 TYR A 156 -11.593 -1.873 0.073 1.00 0.49 C ATOM 533 CZ TYR A 156 -11.571 -3.223 -0.086 1.00 0.56 C ATOM 534 OH TYR A 156 -12.721 -3.924 -0.358 1.00 0.65 O ATOM 0 H TYR A 156 -8.276 -1.704 3.044 1.00 0.26 H new ATOM 0 HA TYR A 156 -6.446 -2.565 0.844 1.00 0.24 H new ATOM 0 HB2 TYR A 156 -8.151 -0.104 0.935 1.00 0.28 H new ATOM 0 HB3 TYR A 156 -7.438 -0.912 -0.447 1.00 0.28 H new ATOM 0 HD1 TYR A 156 -8.244 -3.730 0.096 1.00 0.53 H new ATOM 0 HD2 TYR A 156 -10.448 -0.116 0.440 1.00 0.43 H new ATOM 0 HE1 TYR A 156 -10.325 -4.967 -0.322 1.00 0.62 H new ATOM 0 HE2 TYR A 156 -12.532 -1.340 0.035 1.00 0.49 H new ATOM 0 HH TYR A 156 -12.797 -4.681 0.260 1.00 0.65 H new ATOM 544 N PRO A 157 -5.067 -1.328 2.831 1.00 0.21 N ATOM 545 CA PRO A 157 -4.756 -0.730 4.085 1.00 0.22 C ATOM 546 C PRO A 157 -3.487 0.084 4.112 1.00 0.23 C ATOM 547 O PRO A 157 -2.898 0.407 3.084 1.00 0.25 O ATOM 548 CB PRO A 157 -4.610 -2.016 4.870 1.00 0.21 C ATOM 549 CG PRO A 157 -3.711 -2.813 3.998 1.00 0.21 C ATOM 550 CD PRO A 157 -4.177 -2.499 2.598 1.00 0.22 C ATOM 0 HA PRO A 157 -5.481 0.006 4.432 1.00 0.22 H new ATOM 0 HB2 PRO A 157 -4.176 -1.845 5.855 1.00 0.21 H new ATOM 0 HB3 PRO A 157 -5.569 -2.509 5.026 1.00 0.21 H new ATOM 0 HG2 PRO A 157 -2.667 -2.534 4.142 1.00 0.21 H new ATOM 0 HG3 PRO A 157 -3.789 -3.879 4.214 1.00 0.21 H new ATOM 0 HD2 PRO A 157 -3.347 -2.256 1.935 1.00 0.22 H new ATOM 0 HD3 PRO A 157 -4.711 -3.336 2.147 1.00 0.22 H new ATOM 558 N ASN A 158 -3.085 0.429 5.313 1.00 0.24 N ATOM 559 CA ASN A 158 -1.822 1.075 5.519 1.00 0.27 C ATOM 560 C ASN A 158 -0.891 0.115 6.180 1.00 0.32 C ATOM 561 O ASN A 158 -0.589 0.202 7.358 1.00 0.57 O ATOM 562 CB ASN A 158 -1.960 2.366 6.297 1.00 0.29 C ATOM 563 CG ASN A 158 -2.244 3.527 5.371 1.00 1.07 C ATOM 564 OD1 ASN A 158 -2.015 4.664 5.713 1.00 1.56 O ATOM 565 ND2 ASN A 158 -2.729 3.239 4.171 1.00 1.86 N ATOM 0 H ASN A 158 -3.623 0.269 6.164 1.00 0.24 H new ATOM 0 HA ASN A 158 -1.408 1.362 4.552 1.00 0.27 H new ATOM 0 HB2 ASN A 158 -2.765 2.272 7.026 1.00 0.29 H new ATOM 0 HB3 ASN A 158 -1.044 2.558 6.857 1.00 0.29 H new ATOM 0 HD21 ASN A 158 -2.920 3.988 3.505 1.00 1.86 H new ATOM 0 HD22 ASN A 158 -2.911 2.269 3.914 1.00 1.86 H new ATOM 572 N GLN A 159 -0.588 -0.886 5.408 1.00 0.22 N ATOM 573 CA GLN A 159 0.517 -1.775 5.649 1.00 0.23 C ATOM 574 C GLN A 159 0.818 -2.507 4.380 1.00 0.21 C ATOM 575 O GLN A 159 -0.098 -2.922 3.668 1.00 0.24 O ATOM 576 CB GLN A 159 0.267 -2.781 6.764 1.00 0.25 C ATOM 577 CG GLN A 159 -1.046 -3.537 6.645 1.00 0.25 C ATOM 578 CD GLN A 159 -1.142 -4.693 7.622 1.00 0.42 C ATOM 579 OE1 GLN A 159 -2.226 -5.044 8.082 1.00 0.87 O ATOM 580 NE2 GLN A 159 -0.010 -5.305 7.934 1.00 0.63 N ATOM 0 H GLN A 159 -1.117 -1.116 4.567 1.00 0.22 H new ATOM 0 HA GLN A 159 1.358 -1.163 5.975 1.00 0.23 H new ATOM 0 HB2 GLN A 159 1.086 -3.500 6.778 1.00 0.25 H new ATOM 0 HB3 GLN A 159 0.285 -2.258 7.720 1.00 0.25 H new ATOM 0 HG2 GLN A 159 -1.874 -2.850 6.818 1.00 0.25 H new ATOM 0 HG3 GLN A 159 -1.153 -3.915 5.628 1.00 0.25 H new ATOM 0 HE21 GLN A 159 0.871 -4.984 7.532 1.00 0.63 H new ATOM 0 HE22 GLN A 159 -0.019 -6.097 8.577 1.00 0.63 H new ATOM 589 N VAL A 160 2.085 -2.674 4.088 1.00 0.20 N ATOM 590 CA VAL A 160 2.463 -3.265 2.845 1.00 0.18 C ATOM 591 C VAL A 160 3.541 -4.295 3.051 1.00 0.20 C ATOM 592 O VAL A 160 4.079 -4.425 4.140 1.00 0.26 O ATOM 593 CB VAL A 160 2.902 -2.227 1.797 1.00 0.20 C ATOM 594 CG1 VAL A 160 1.684 -1.634 1.131 1.00 0.22 C ATOM 595 CG2 VAL A 160 3.740 -1.112 2.391 1.00 0.23 C ATOM 0 H VAL A 160 2.861 -2.408 4.695 1.00 0.20 H new ATOM 0 HA VAL A 160 1.572 -3.754 2.450 1.00 0.18 H new ATOM 0 HB VAL A 160 3.523 -2.750 1.070 1.00 0.20 H new ATOM 0 HG11 VAL A 160 1.997 -0.899 0.389 1.00 0.22 H new ATOM 0 HG12 VAL A 160 1.116 -2.425 0.641 1.00 0.22 H new ATOM 0 HG13 VAL A 160 1.059 -1.149 1.881 1.00 0.22 H new ATOM 0 HG21 VAL A 160 4.021 -0.410 1.606 1.00 0.23 H new ATOM 0 HG22 VAL A 160 3.163 -0.591 3.155 1.00 0.23 H new ATOM 0 HG23 VAL A 160 4.640 -1.533 2.840 1.00 0.23 H new ATOM 605 N TYR A 161 3.787 -5.076 2.035 1.00 0.20 N ATOM 606 CA TYR A 161 4.873 -6.020 2.054 1.00 0.24 C ATOM 607 C TYR A 161 5.765 -5.766 0.868 1.00 0.31 C ATOM 608 O TYR A 161 5.421 -6.078 -0.264 1.00 0.62 O ATOM 609 CB TYR A 161 4.338 -7.434 2.029 1.00 0.26 C ATOM 610 CG TYR A 161 3.600 -7.827 3.287 1.00 0.60 C ATOM 611 CD1 TYR A 161 4.288 -8.322 4.385 1.00 0.71 C ATOM 612 CD2 TYR A 161 2.218 -7.710 3.375 1.00 1.05 C ATOM 613 CE1 TYR A 161 3.622 -8.692 5.535 1.00 1.25 C ATOM 614 CE2 TYR A 161 1.544 -8.074 4.522 1.00 1.60 C ATOM 615 CZ TYR A 161 2.251 -8.568 5.599 1.00 1.70 C ATOM 616 OH TYR A 161 1.585 -8.940 6.745 1.00 2.25 O ATOM 0 H TYR A 161 3.243 -5.077 1.172 1.00 0.20 H new ATOM 0 HA TYR A 161 5.451 -5.896 2.970 1.00 0.24 H new ATOM 0 HB2 TYR A 161 3.668 -7.544 1.176 1.00 0.26 H new ATOM 0 HB3 TYR A 161 5.167 -8.124 1.874 1.00 0.26 H new ATOM 0 HD1 TYR A 161 5.363 -8.419 4.339 1.00 0.71 H new ATOM 0 HD2 TYR A 161 1.663 -7.328 2.531 1.00 1.05 H new ATOM 0 HE1 TYR A 161 4.172 -9.077 6.381 1.00 1.25 H new ATOM 0 HE2 TYR A 161 0.470 -7.973 4.577 1.00 1.60 H new ATOM 0 HH TYR A 161 0.624 -8.789 6.628 1.00 2.25 H new ATOM 626 N TYR A 162 6.891 -5.164 1.130 1.00 0.27 N ATOM 627 CA TYR A 162 7.842 -4.843 0.096 1.00 0.35 C ATOM 628 C TYR A 162 9.205 -5.013 0.675 1.00 0.41 C ATOM 629 O TYR A 162 9.357 -5.167 1.871 1.00 0.46 O ATOM 630 CB TYR A 162 7.636 -3.414 -0.443 1.00 0.41 C ATOM 631 CG TYR A 162 8.298 -2.327 0.380 1.00 0.47 C ATOM 632 CD1 TYR A 162 8.115 -2.258 1.754 1.00 0.62 C ATOM 633 CD2 TYR A 162 9.122 -1.378 -0.221 1.00 0.79 C ATOM 634 CE1 TYR A 162 8.735 -1.285 2.507 1.00 0.78 C ATOM 635 CE2 TYR A 162 9.740 -0.401 0.528 1.00 0.92 C ATOM 636 CZ TYR A 162 9.548 -0.361 1.889 1.00 0.83 C ATOM 637 OH TYR A 162 10.169 0.609 2.634 1.00 1.03 O ATOM 0 H TYR A 162 7.178 -4.880 2.067 1.00 0.27 H new ATOM 0 HA TYR A 162 7.706 -5.509 -0.756 1.00 0.35 H new ATOM 0 HB2 TYR A 162 8.021 -3.365 -1.462 1.00 0.41 H new ATOM 0 HB3 TYR A 162 6.566 -3.211 -0.496 1.00 0.41 H new ATOM 0 HD1 TYR A 162 7.476 -2.979 2.241 1.00 0.62 H new ATOM 0 HD2 TYR A 162 9.278 -1.409 -1.289 1.00 0.79 H new ATOM 0 HE1 TYR A 162 8.584 -1.247 3.576 1.00 0.78 H new ATOM 0 HE2 TYR A 162 10.373 0.331 0.048 1.00 0.92 H new ATOM 0 HH TYR A 162 10.751 0.187 3.300 1.00 1.03 H new ATOM 647 N ARG A 163 10.187 -4.991 -0.149 1.00 0.49 N ATOM 648 CA ARG A 163 11.507 -5.252 0.324 1.00 0.56 C ATOM 649 C ARG A 163 12.187 -3.912 0.500 1.00 0.60 C ATOM 650 O ARG A 163 11.759 -2.944 -0.127 1.00 0.68 O ATOM 651 CB ARG A 163 12.228 -6.146 -0.672 1.00 0.71 C ATOM 652 CG ARG A 163 13.156 -7.094 0.018 1.00 0.89 C ATOM 653 CD ARG A 163 13.949 -7.949 -0.951 1.00 1.18 C ATOM 654 NE ARG A 163 13.091 -8.678 -1.888 1.00 1.82 N ATOM 655 CZ ARG A 163 13.305 -9.944 -2.258 1.00 2.23 C ATOM 656 NH1 ARG A 163 14.305 -10.629 -1.721 1.00 2.21 N ATOM 657 NH2 ARG A 163 12.506 -10.528 -3.146 1.00 3.01 N ATOM 0 H ARG A 163 10.110 -4.797 -1.147 1.00 0.49 H new ATOM 0 HA ARG A 163 11.509 -5.779 1.278 1.00 0.56 H new ATOM 0 HB2 ARG A 163 11.498 -6.708 -1.254 1.00 0.71 H new ATOM 0 HB3 ARG A 163 12.790 -5.531 -1.375 1.00 0.71 H new ATOM 0 HG2 ARG A 163 13.846 -6.529 0.645 1.00 0.89 H new ATOM 0 HG3 ARG A 163 12.581 -7.741 0.680 1.00 0.89 H new ATOM 0 HD2 ARG A 163 14.637 -7.315 -1.511 1.00 1.18 H new ATOM 0 HD3 ARG A 163 14.556 -8.660 -0.390 1.00 1.18 H new ATOM 0 HE ARG A 163 12.285 -8.192 -2.280 1.00 1.82 H new ATOM 0 HH11 ARG A 163 14.909 -10.190 -1.027 1.00 2.21 H new ATOM 0 HH12 ARG A 163 14.470 -11.596 -2.002 1.00 2.21 H new ATOM 0 HH21 ARG A 163 11.725 -10.009 -3.548 1.00 3.01 H new ATOM 0 HH22 ARG A 163 12.674 -11.495 -3.425 1.00 3.01 H new ATOM 671 N PRO A 164 13.252 -3.790 1.310 1.00 0.61 N ATOM 672 CA PRO A 164 13.764 -2.498 1.648 1.00 0.66 C ATOM 673 C PRO A 164 14.805 -2.102 0.648 1.00 0.65 C ATOM 674 O PRO A 164 15.836 -2.753 0.458 1.00 0.73 O ATOM 675 CB PRO A 164 14.390 -2.697 3.037 1.00 0.72 C ATOM 676 CG PRO A 164 14.209 -4.151 3.350 1.00 0.71 C ATOM 677 CD PRO A 164 14.003 -4.816 2.025 1.00 0.62 C ATOM 0 HA PRO A 164 13.005 -1.715 1.648 1.00 0.66 H new ATOM 0 HB2 PRO A 164 15.445 -2.424 3.035 1.00 0.72 H new ATOM 0 HB3 PRO A 164 13.900 -2.071 3.782 1.00 0.72 H new ATOM 0 HG2 PRO A 164 15.082 -4.555 3.862 1.00 0.71 H new ATOM 0 HG3 PRO A 164 13.354 -4.309 4.007 1.00 0.71 H new ATOM 0 HD2 PRO A 164 14.946 -5.055 1.533 1.00 0.62 H new ATOM 0 HD3 PRO A 164 13.445 -5.748 2.114 1.00 0.62 H new ATOM 685 N VAL A 165 14.484 -1.021 0.007 1.00 0.60 N ATOM 686 CA VAL A 165 15.150 -0.586 -1.180 1.00 0.63 C ATOM 687 C VAL A 165 16.135 0.489 -0.824 1.00 0.59 C ATOM 688 O VAL A 165 15.765 1.595 -0.442 1.00 0.62 O ATOM 689 CB VAL A 165 14.113 -0.051 -2.195 1.00 0.72 C ATOM 690 CG1 VAL A 165 12.998 0.660 -1.462 1.00 0.63 C ATOM 691 CG2 VAL A 165 14.757 0.891 -3.187 1.00 0.82 C ATOM 0 H VAL A 165 13.731 -0.400 0.304 1.00 0.60 H new ATOM 0 HA VAL A 165 15.680 -1.423 -1.635 1.00 0.63 H new ATOM 0 HB VAL A 165 13.706 -0.899 -2.745 1.00 0.72 H new ATOM 0 HG11 VAL A 165 12.270 1.035 -2.182 1.00 0.63 H new ATOM 0 HG12 VAL A 165 12.509 -0.036 -0.781 1.00 0.63 H new ATOM 0 HG13 VAL A 165 13.410 1.494 -0.894 1.00 0.63 H new ATOM 0 HG21 VAL A 165 14.004 1.251 -3.888 1.00 0.82 H new ATOM 0 HG22 VAL A 165 15.192 1.737 -2.655 1.00 0.82 H new ATOM 0 HG23 VAL A 165 15.539 0.365 -3.734 1.00 0.82 H new ATOM 701 N ASP A 166 17.397 0.145 -0.909 1.00 0.68 N ATOM 702 CA ASP A 166 18.461 1.098 -0.690 1.00 0.72 C ATOM 703 C ASP A 166 18.510 2.067 -1.857 1.00 0.94 C ATOM 704 O ASP A 166 19.494 2.160 -2.596 1.00 1.54 O ATOM 705 CB ASP A 166 19.756 0.352 -0.504 1.00 1.14 C ATOM 706 CG ASP A 166 20.921 1.249 -0.112 1.00 1.67 C ATOM 707 OD1 ASP A 166 20.687 2.418 0.253 1.00 2.37 O ATOM 708 OD2 ASP A 166 22.081 0.786 -0.171 1.00 2.09 O ATOM 0 H ASP A 166 17.716 -0.798 -1.131 1.00 0.68 H new ATOM 0 HA ASP A 166 18.284 1.683 0.213 1.00 0.72 H new ATOM 0 HB2 ASP A 166 19.620 -0.410 0.263 1.00 1.14 H new ATOM 0 HB3 ASP A 166 20.003 -0.168 -1.430 1.00 1.14 H new ATOM 762 N ASN A 170 14.289 2.703 -7.843 1.00 0.82 N ATOM 763 CA ASN A 170 13.210 1.863 -8.326 1.00 0.65 C ATOM 764 C ASN A 170 12.462 1.253 -7.156 1.00 0.56 C ATOM 765 O ASN A 170 12.502 0.044 -6.940 1.00 0.77 O ATOM 766 CB ASN A 170 13.720 0.743 -9.248 1.00 0.84 C ATOM 767 CG ASN A 170 14.144 1.235 -10.622 1.00 1.23 C ATOM 768 OD1 ASN A 170 15.312 1.549 -10.850 1.00 1.94 O ATOM 769 ND2 ASN A 170 13.198 1.304 -11.548 1.00 1.70 N ATOM 0 HA ASN A 170 12.540 2.497 -8.907 1.00 0.65 H new ATOM 0 HB2 ASN A 170 14.566 0.248 -8.771 1.00 0.84 H new ATOM 0 HB3 ASN A 170 12.937 -0.006 -9.365 1.00 0.84 H new ATOM 0 HD21 ASN A 170 13.427 1.626 -12.488 1.00 1.70 H new ATOM 0 HD22 ASN A 170 12.241 1.035 -11.320 1.00 1.70 H new ATOM 776 N GLN A 171 11.808 2.103 -6.382 1.00 0.41 N ATOM 777 CA GLN A 171 10.927 1.640 -5.327 1.00 0.37 C ATOM 778 C GLN A 171 9.737 0.990 -5.985 1.00 0.29 C ATOM 779 O GLN A 171 9.288 -0.074 -5.600 1.00 0.34 O ATOM 780 CB GLN A 171 10.457 2.812 -4.449 1.00 0.57 C ATOM 781 CG GLN A 171 9.189 3.551 -4.935 1.00 1.32 C ATOM 782 CD GLN A 171 9.344 4.324 -6.264 1.00 2.56 C ATOM 783 OE1 GLN A 171 10.218 4.042 -7.080 1.00 3.22 O ATOM 784 NE2 GLN A 171 8.478 5.295 -6.494 1.00 3.29 N ATOM 0 H GLN A 171 11.872 3.118 -6.466 1.00 0.41 H new ATOM 0 HA GLN A 171 11.455 0.936 -4.684 1.00 0.37 H new ATOM 0 HB2 GLN A 171 10.272 2.436 -3.443 1.00 0.57 H new ATOM 0 HB3 GLN A 171 11.270 3.535 -4.375 1.00 0.57 H new ATOM 0 HG2 GLN A 171 8.385 2.823 -5.049 1.00 1.32 H new ATOM 0 HG3 GLN A 171 8.877 4.252 -4.160 1.00 1.32 H new ATOM 0 HE21 GLN A 171 7.760 5.513 -5.803 1.00 3.29 H new ATOM 0 HE22 GLN A 171 8.527 5.827 -7.363 1.00 3.29 H new ATOM 793 N ASN A 172 9.309 1.672 -7.034 1.00 0.35 N ATOM 794 CA ASN A 172 8.151 1.378 -7.844 1.00 0.42 C ATOM 795 C ASN A 172 8.225 -0.018 -8.400 1.00 0.42 C ATOM 796 O ASN A 172 7.222 -0.617 -8.793 1.00 0.48 O ATOM 797 CB ASN A 172 8.125 2.442 -8.941 1.00 0.47 C ATOM 798 CG ASN A 172 7.259 2.084 -10.139 1.00 0.54 C ATOM 799 OD1 ASN A 172 7.721 1.446 -11.085 1.00 1.24 O ATOM 800 ND2 ASN A 172 6.005 2.510 -10.111 1.00 1.02 N ATOM 0 H ASN A 172 9.801 2.504 -7.361 1.00 0.35 H new ATOM 0 HA ASN A 172 7.229 1.409 -7.263 1.00 0.42 H new ATOM 0 HB2 ASN A 172 7.766 3.378 -8.514 1.00 0.47 H new ATOM 0 HB3 ASN A 172 9.144 2.619 -9.284 1.00 0.47 H new ATOM 0 HD21 ASN A 172 5.382 2.312 -10.894 1.00 1.02 H new ATOM 0 HD22 ASN A 172 5.663 3.036 -9.307 1.00 1.02 H new ATOM 807 N ASN A 173 9.421 -0.545 -8.366 1.00 0.40 N ATOM 808 CA ASN A 173 9.651 -1.914 -8.778 1.00 0.50 C ATOM 809 C ASN A 173 9.132 -2.820 -7.675 1.00 0.44 C ATOM 810 O ASN A 173 8.231 -3.659 -7.871 1.00 0.46 O ATOM 811 CB ASN A 173 11.143 -2.134 -8.995 1.00 0.63 C ATOM 812 CG ASN A 173 11.438 -3.350 -9.858 1.00 0.77 C ATOM 813 OD1 ASN A 173 10.701 -4.336 -9.846 1.00 1.33 O ATOM 814 ND2 ASN A 173 12.521 -3.290 -10.620 1.00 1.44 N ATOM 0 H ASN A 173 10.257 -0.049 -8.057 1.00 0.40 H new ATOM 0 HA ASN A 173 9.136 -2.134 -9.713 1.00 0.50 H new ATOM 0 HB2 ASN A 173 11.572 -1.248 -9.464 1.00 0.63 H new ATOM 0 HB3 ASN A 173 11.633 -2.252 -8.028 1.00 0.63 H new ATOM 0 HD21 ASN A 173 12.766 -4.077 -11.221 1.00 1.44 H new ATOM 0 HD22 ASN A 173 13.110 -2.457 -10.605 1.00 1.44 H new ATOM 821 N PHE A 174 9.654 -2.556 -6.484 1.00 0.42 N ATOM 822 CA PHE A 174 9.254 -3.272 -5.288 1.00 0.42 C ATOM 823 C PHE A 174 7.809 -2.968 -4.947 1.00 0.33 C ATOM 824 O PHE A 174 7.182 -3.690 -4.184 1.00 0.34 O ATOM 825 CB PHE A 174 10.141 -2.864 -4.118 1.00 0.49 C ATOM 826 CG PHE A 174 11.545 -3.379 -4.224 1.00 0.60 C ATOM 827 CD1 PHE A 174 11.870 -4.642 -3.754 1.00 1.03 C ATOM 828 CD2 PHE A 174 12.544 -2.600 -4.783 1.00 1.56 C ATOM 829 CE1 PHE A 174 13.164 -5.116 -3.840 1.00 1.38 C ATOM 830 CE2 PHE A 174 13.840 -3.070 -4.874 1.00 1.90 C ATOM 831 CZ PHE A 174 14.144 -4.336 -4.437 1.00 1.53 C ATOM 0 H PHE A 174 10.364 -1.841 -6.324 1.00 0.42 H new ATOM 0 HA PHE A 174 9.360 -4.341 -5.475 1.00 0.42 H new ATOM 0 HB2 PHE A 174 10.165 -1.776 -4.053 1.00 0.49 H new ATOM 0 HB3 PHE A 174 9.698 -3.229 -3.192 1.00 0.49 H new ATOM 0 HD1 PHE A 174 11.102 -5.262 -3.316 1.00 1.03 H new ATOM 0 HD2 PHE A 174 12.307 -1.613 -5.152 1.00 1.56 H new ATOM 0 HE1 PHE A 174 13.412 -6.090 -3.444 1.00 1.38 H new ATOM 0 HE2 PHE A 174 14.614 -2.442 -5.289 1.00 1.90 H new ATOM 0 HZ PHE A 174 15.145 -4.724 -4.558 1.00 1.53 H new ATOM 841 N VAL A 175 7.294 -1.886 -5.513 1.00 0.29 N ATOM 842 CA VAL A 175 5.949 -1.440 -5.219 1.00 0.25 C ATOM 843 C VAL A 175 4.914 -2.257 -5.921 1.00 0.25 C ATOM 844 O VAL A 175 4.123 -2.903 -5.278 1.00 0.28 O ATOM 845 CB VAL A 175 5.701 -0.008 -5.628 1.00 0.26 C ATOM 846 CG1 VAL A 175 4.263 0.375 -5.292 1.00 0.26 C ATOM 847 CG2 VAL A 175 6.694 0.897 -4.963 1.00 0.33 C ATOM 0 H VAL A 175 7.795 -1.301 -6.182 1.00 0.29 H new ATOM 0 HA VAL A 175 5.866 -1.547 -4.137 1.00 0.25 H new ATOM 0 HB VAL A 175 5.834 0.100 -6.704 1.00 0.26 H new ATOM 0 HG11 VAL A 175 4.083 1.409 -5.587 1.00 0.26 H new ATOM 0 HG12 VAL A 175 3.577 -0.280 -5.829 1.00 0.26 H new ATOM 0 HG13 VAL A 175 4.100 0.270 -4.219 1.00 0.26 H new ATOM 0 HG21 VAL A 175 6.506 1.927 -5.265 1.00 0.33 H new ATOM 0 HG22 VAL A 175 6.596 0.812 -3.881 1.00 0.33 H new ATOM 0 HG23 VAL A 175 7.703 0.610 -5.259 1.00 0.33 H new ATOM 857 N HIS A 176 4.884 -2.192 -7.247 1.00 0.27 N ATOM 858 CA HIS A 176 3.873 -2.921 -7.993 1.00 0.33 C ATOM 859 C HIS A 176 3.908 -4.383 -7.574 1.00 0.28 C ATOM 860 O HIS A 176 2.891 -5.066 -7.592 1.00 0.29 O ATOM 861 CB HIS A 176 4.059 -2.767 -9.503 1.00 0.41 C ATOM 862 CG HIS A 176 2.801 -3.031 -10.281 1.00 1.16 C ATOM 863 ND1 HIS A 176 1.732 -2.157 -10.319 1.00 2.23 N ATOM 864 CD2 HIS A 176 2.442 -4.082 -11.053 1.00 1.62 C ATOM 865 CE1 HIS A 176 0.780 -2.661 -11.079 1.00 2.89 C ATOM 866 NE2 HIS A 176 1.183 -3.829 -11.540 1.00 2.52 N ATOM 0 H HIS A 176 5.536 -1.652 -7.816 1.00 0.27 H new ATOM 0 HA HIS A 176 2.893 -2.503 -7.762 1.00 0.33 H new ATOM 0 HB2 HIS A 176 4.408 -1.757 -9.719 1.00 0.41 H new ATOM 0 HB3 HIS A 176 4.838 -3.452 -9.839 1.00 0.41 H new ATOM 0 HD1 HIS A 176 1.686 -1.261 -9.834 1.00 2.23 H new ATOM 0 HD2 HIS A 176 3.038 -4.961 -11.251 1.00 1.62 H new ATOM 0 HE1 HIS A 176 -0.171 -2.195 -11.289 1.00 2.89 H new ATOM 875 N ASP A 177 5.082 -4.830 -7.143 1.00 0.26 N ATOM 876 CA ASP A 177 5.210 -6.130 -6.517 1.00 0.27 C ATOM 877 C ASP A 177 4.585 -6.122 -5.114 1.00 0.24 C ATOM 878 O ASP A 177 3.790 -6.989 -4.792 1.00 0.31 O ATOM 879 CB ASP A 177 6.679 -6.536 -6.448 1.00 0.36 C ATOM 880 CG ASP A 177 6.858 -7.994 -6.091 1.00 0.49 C ATOM 881 OD1 ASP A 177 6.642 -8.856 -6.965 1.00 0.66 O ATOM 882 OD2 ASP A 177 7.174 -8.283 -4.917 1.00 0.64 O ATOM 0 H ASP A 177 5.955 -4.308 -7.218 1.00 0.26 H new ATOM 0 HA ASP A 177 4.673 -6.861 -7.122 1.00 0.27 H new ATOM 0 HB2 ASP A 177 7.153 -6.339 -7.410 1.00 0.36 H new ATOM 0 HB3 ASP A 177 7.189 -5.918 -5.709 1.00 0.36 H new ATOM 887 N CYS A 178 4.950 -5.136 -4.293 1.00 0.26 N ATOM 888 CA CYS A 178 4.352 -4.933 -2.963 1.00 0.29 C ATOM 889 C CYS A 178 2.836 -4.918 -3.038 1.00 0.27 C ATOM 890 O CYS A 178 2.190 -5.621 -2.284 1.00 0.32 O ATOM 891 CB CYS A 178 4.855 -3.648 -2.270 1.00 0.41 C ATOM 892 SG CYS A 178 3.726 -2.211 -2.365 1.00 0.64 S ATOM 0 H CYS A 178 5.669 -4.452 -4.528 1.00 0.26 H new ATOM 0 HA CYS A 178 4.673 -5.780 -2.357 1.00 0.29 H new ATOM 0 HB2 CYS A 178 5.043 -3.872 -1.220 1.00 0.41 H new ATOM 0 HB3 CYS A 178 5.811 -3.367 -2.712 1.00 0.41 H new ATOM 897 N VAL A 179 2.260 -4.142 -3.955 1.00 0.23 N ATOM 898 CA VAL A 179 0.813 -4.118 -4.106 1.00 0.20 C ATOM 899 C VAL A 179 0.357 -5.531 -4.489 1.00 0.21 C ATOM 900 O VAL A 179 -0.663 -6.020 -4.036 1.00 0.28 O ATOM 901 CB VAL A 179 0.317 -3.080 -5.172 1.00 0.19 C ATOM 902 CG1 VAL A 179 -0.795 -2.202 -4.635 1.00 0.67 C ATOM 903 CG2 VAL A 179 1.425 -2.177 -5.645 1.00 0.57 C ATOM 0 H VAL A 179 2.768 -3.531 -4.595 1.00 0.23 H new ATOM 0 HA VAL A 179 0.376 -3.801 -3.159 1.00 0.20 H new ATOM 0 HB VAL A 179 -0.051 -3.679 -6.005 1.00 0.19 H new ATOM 0 HG11 VAL A 179 -1.108 -1.498 -5.406 1.00 0.67 H new ATOM 0 HG12 VAL A 179 -1.642 -2.824 -4.346 1.00 0.67 H new ATOM 0 HG13 VAL A 179 -0.436 -1.651 -3.766 1.00 0.67 H new ATOM 0 HG21 VAL A 179 1.033 -1.476 -6.382 1.00 0.57 H new ATOM 0 HG22 VAL A 179 1.831 -1.624 -4.798 1.00 0.57 H new ATOM 0 HG23 VAL A 179 2.214 -2.776 -6.098 1.00 0.57 H new ATOM 913 N ASN A 180 1.173 -6.219 -5.263 1.00 0.23 N ATOM 914 CA ASN A 180 0.870 -7.585 -5.674 1.00 0.24 C ATOM 915 C ASN A 180 0.764 -8.541 -4.495 1.00 0.25 C ATOM 916 O ASN A 180 0.084 -9.544 -4.593 1.00 0.26 O ATOM 917 CB ASN A 180 1.944 -8.109 -6.616 1.00 0.25 C ATOM 918 CG ASN A 180 1.511 -8.118 -8.073 1.00 0.48 C ATOM 919 OD1 ASN A 180 1.723 -7.159 -8.812 1.00 1.17 O ATOM 920 ND2 ASN A 180 0.884 -9.206 -8.496 1.00 1.33 N ATOM 0 H ASN A 180 2.056 -5.857 -5.624 1.00 0.23 H new ATOM 0 HA ASN A 180 -0.097 -7.544 -6.175 1.00 0.24 H new ATOM 0 HB2 ASN A 180 2.839 -7.495 -6.514 1.00 0.25 H new ATOM 0 HB3 ASN A 180 2.216 -9.122 -6.318 1.00 0.25 H new ATOM 0 HD21 ASN A 180 0.561 -9.266 -9.462 1.00 1.33 H new ATOM 0 HD22 ASN A 180 0.724 -9.984 -7.856 1.00 1.33 H new ATOM 927 N ILE A 181 1.486 -8.295 -3.418 1.00 0.28 N ATOM 928 CA ILE A 181 1.309 -9.113 -2.229 1.00 0.29 C ATOM 929 C ILE A 181 0.416 -8.432 -1.209 1.00 0.27 C ATOM 930 O ILE A 181 -0.546 -9.009 -0.750 1.00 0.36 O ATOM 931 CB ILE A 181 2.613 -9.534 -1.536 1.00 0.34 C ATOM 932 CG1 ILE A 181 3.532 -8.361 -1.224 1.00 0.42 C ATOM 933 CG2 ILE A 181 3.351 -10.569 -2.357 1.00 0.52 C ATOM 934 CD1 ILE A 181 4.536 -8.118 -2.299 1.00 0.77 C ATOM 0 H ILE A 181 2.184 -7.555 -3.339 1.00 0.28 H new ATOM 0 HA ILE A 181 0.838 -10.021 -2.606 1.00 0.29 H new ATOM 0 HB ILE A 181 2.320 -9.971 -0.581 1.00 0.34 H new ATOM 0 HG12 ILE A 181 2.932 -7.462 -1.082 1.00 0.42 H new ATOM 0 HG13 ILE A 181 4.050 -8.550 -0.284 1.00 0.42 H new ATOM 0 HG21 ILE A 181 4.271 -10.851 -1.845 1.00 0.52 H new ATOM 0 HG22 ILE A 181 2.721 -11.450 -2.483 1.00 0.52 H new ATOM 0 HG23 ILE A 181 3.593 -10.153 -3.335 1.00 0.52 H new ATOM 0 HD11 ILE A 181 5.165 -7.271 -2.025 1.00 0.77 H new ATOM 0 HD12 ILE A 181 5.157 -9.005 -2.424 1.00 0.77 H new ATOM 0 HD13 ILE A 181 4.021 -7.900 -3.235 1.00 0.77 H new ATOM 946 N THR A 182 0.749 -7.198 -0.891 1.00 0.27 N ATOM 947 CA THR A 182 0.046 -6.386 0.092 1.00 0.24 C ATOM 948 C THR A 182 -1.440 -6.515 -0.017 1.00 0.26 C ATOM 949 O THR A 182 -2.140 -6.853 0.942 1.00 0.30 O ATOM 950 CB THR A 182 0.428 -4.922 -0.140 1.00 0.22 C ATOM 951 OG1 THR A 182 1.774 -4.691 0.275 1.00 0.46 O ATOM 952 CG2 THR A 182 -0.524 -3.985 0.561 1.00 0.30 C ATOM 0 H THR A 182 1.538 -6.715 -1.319 1.00 0.27 H new ATOM 0 HA THR A 182 0.334 -6.731 1.085 1.00 0.24 H new ATOM 0 HB THR A 182 0.355 -4.718 -1.208 1.00 0.22 H new ATOM 0 HG1 THR A 182 2.385 -4.914 -0.458 1.00 0.46 H new ATOM 0 HG21 THR A 182 -0.223 -2.954 0.375 1.00 0.30 H new ATOM 0 HG22 THR A 182 -1.534 -4.142 0.182 1.00 0.30 H new ATOM 0 HG23 THR A 182 -0.504 -4.181 1.633 1.00 0.30 H new ATOM 960 N VAL A 183 -1.900 -6.278 -1.200 1.00 0.26 N ATOM 961 CA VAL A 183 -3.298 -6.177 -1.453 1.00 0.28 C ATOM 962 C VAL A 183 -3.838 -7.577 -1.624 1.00 0.29 C ATOM 963 O VAL A 183 -4.988 -7.850 -1.394 1.00 0.32 O ATOM 964 CB VAL A 183 -3.500 -5.287 -2.688 1.00 0.28 C ATOM 965 CG1 VAL A 183 -2.379 -4.282 -2.724 1.00 0.26 C ATOM 966 CG2 VAL A 183 -3.568 -6.083 -3.971 1.00 0.29 C ATOM 0 H VAL A 183 -1.313 -6.148 -2.024 1.00 0.26 H new ATOM 0 HA VAL A 183 -3.844 -5.713 -0.632 1.00 0.28 H new ATOM 0 HB VAL A 183 -4.461 -4.779 -2.609 1.00 0.28 H new ATOM 0 HG11 VAL A 183 -2.498 -3.635 -3.593 1.00 0.26 H new ATOM 0 HG12 VAL A 183 -2.402 -3.678 -1.817 1.00 0.26 H new ATOM 0 HG13 VAL A 183 -1.424 -4.804 -2.788 1.00 0.26 H new ATOM 0 HG21 VAL A 183 -3.712 -5.405 -4.813 1.00 0.29 H new ATOM 0 HG22 VAL A 183 -2.639 -6.637 -4.105 1.00 0.29 H new ATOM 0 HG23 VAL A 183 -4.403 -6.782 -3.922 1.00 0.29 H new ATOM 976 N LYS A 184 -2.937 -8.481 -1.924 1.00 0.30 N ATOM 977 CA LYS A 184 -3.284 -9.865 -2.135 1.00 0.32 C ATOM 978 C LYS A 184 -3.488 -10.576 -0.825 1.00 0.32 C ATOM 979 O LYS A 184 -4.451 -11.311 -0.630 1.00 0.38 O ATOM 980 CB LYS A 184 -2.211 -10.517 -2.991 1.00 0.34 C ATOM 981 CG LYS A 184 -2.560 -10.487 -4.467 1.00 0.37 C ATOM 982 CD LYS A 184 -3.098 -9.123 -4.855 1.00 1.01 C ATOM 983 CE LYS A 184 -2.589 -8.650 -6.205 1.00 1.37 C ATOM 984 NZ LYS A 184 -2.954 -9.569 -7.318 1.00 2.14 N ATOM 0 H LYS A 184 -1.943 -8.278 -2.029 1.00 0.30 H new ATOM 0 HA LYS A 184 -4.233 -9.933 -2.666 1.00 0.32 H new ATOM 0 HB2 LYS A 184 -1.262 -10.005 -2.833 1.00 0.34 H new ATOM 0 HB3 LYS A 184 -2.073 -11.550 -2.673 1.00 0.34 H new ATOM 0 HG2 LYS A 184 -1.676 -10.719 -5.061 1.00 0.37 H new ATOM 0 HG3 LYS A 184 -3.302 -11.254 -4.687 1.00 0.37 H new ATOM 0 HD2 LYS A 184 -4.187 -9.160 -4.875 1.00 1.01 H new ATOM 0 HD3 LYS A 184 -2.818 -8.397 -4.092 1.00 1.01 H new ATOM 0 HE2 LYS A 184 -2.992 -7.659 -6.412 1.00 1.37 H new ATOM 0 HE3 LYS A 184 -1.504 -8.551 -6.164 1.00 1.37 H new ATOM 0 HZ1 LYS A 184 -2.624 -9.170 -8.220 1.00 2.14 H new ATOM 0 HZ2 LYS A 184 -2.506 -10.495 -7.165 1.00 2.14 H new ATOM 0 HZ3 LYS A 184 -3.987 -9.685 -7.348 1.00 2.14 H new ATOM 998 N GLN A 185 -2.609 -10.304 0.081 1.00 0.31 N ATOM 999 CA GLN A 185 -2.707 -10.795 1.422 1.00 0.39 C ATOM 1000 C GLN A 185 -3.956 -10.246 2.084 1.00 0.38 C ATOM 1001 O GLN A 185 -4.537 -10.874 2.962 1.00 0.44 O ATOM 1002 CB GLN A 185 -1.456 -10.344 2.137 1.00 0.56 C ATOM 1003 CG GLN A 185 -0.223 -10.830 1.428 1.00 1.32 C ATOM 1004 CD GLN A 185 0.150 -12.246 1.814 1.00 1.75 C ATOM 1005 OE1 GLN A 185 0.859 -12.469 2.794 1.00 2.11 O ATOM 1006 NE2 GLN A 185 -0.316 -13.213 1.044 1.00 2.02 N ATOM 0 H GLN A 185 -1.787 -9.725 -0.089 1.00 0.31 H new ATOM 0 HA GLN A 185 -2.786 -11.882 1.451 1.00 0.39 H new ATOM 0 HB2 GLN A 185 -1.440 -9.256 2.197 1.00 0.56 H new ATOM 0 HB3 GLN A 185 -1.463 -10.719 3.160 1.00 0.56 H new ATOM 0 HG2 GLN A 185 -0.385 -10.781 0.351 1.00 1.32 H new ATOM 0 HG3 GLN A 185 0.609 -10.164 1.656 1.00 1.32 H new ATOM 0 HE21 GLN A 185 -0.901 -12.987 0.240 1.00 2.02 H new ATOM 0 HE22 GLN A 185 -0.091 -14.185 1.254 1.00 2.02 H new ATOM 1015 N HIS A 186 -4.356 -9.065 1.642 1.00 0.36 N ATOM 1016 CA HIS A 186 -5.483 -8.367 2.224 1.00 0.44 C ATOM 1017 C HIS A 186 -6.790 -8.512 1.444 1.00 0.51 C ATOM 1018 O HIS A 186 -7.844 -8.162 1.965 1.00 0.67 O ATOM 1019 CB HIS A 186 -5.143 -6.898 2.395 1.00 0.49 C ATOM 1020 CG HIS A 186 -4.429 -6.621 3.678 1.00 0.55 C ATOM 1021 ND1 HIS A 186 -5.036 -6.046 4.769 1.00 0.73 N ATOM 1022 CD2 HIS A 186 -3.155 -6.880 4.053 1.00 1.09 C ATOM 1023 CE1 HIS A 186 -4.172 -5.969 5.761 1.00 0.65 C ATOM 1024 NE2 HIS A 186 -3.018 -6.471 5.356 1.00 0.91 N ATOM 0 H HIS A 186 -3.908 -8.567 0.872 1.00 0.36 H new ATOM 0 HA HIS A 186 -5.661 -8.840 3.190 1.00 0.44 H new ATOM 0 HB2 HIS A 186 -4.522 -6.573 1.560 1.00 0.49 H new ATOM 0 HB3 HIS A 186 -6.060 -6.310 2.359 1.00 0.49 H new ATOM 0 HD2 HIS A 186 -2.387 -7.327 3.439 1.00 1.09 H new ATOM 0 HE1 HIS A 186 -4.373 -5.563 6.742 1.00 0.65 H new ATOM 0 HE2 HIS A 186 -2.169 -6.542 5.917 1.00 0.91 H new ATOM 1033 N THR A 187 -6.749 -8.999 0.211 1.00 0.48 N ATOM 1034 CA THR A 187 -7.977 -9.120 -0.564 1.00 0.59 C ATOM 1035 C THR A 187 -7.881 -10.216 -1.630 1.00 0.62 C ATOM 1036 O THR A 187 -8.493 -10.139 -2.697 1.00 0.80 O ATOM 1037 CB THR A 187 -8.401 -7.752 -1.172 1.00 0.72 C ATOM 1038 OG1 THR A 187 -9.767 -7.802 -1.589 1.00 0.89 O ATOM 1039 CG2 THR A 187 -7.523 -7.340 -2.345 1.00 0.75 C ATOM 0 H THR A 187 -5.902 -9.310 -0.265 1.00 0.48 H new ATOM 0 HA THR A 187 -8.764 -9.427 0.125 1.00 0.59 H new ATOM 0 HB THR A 187 -8.277 -7.003 -0.390 1.00 0.72 H new ATOM 0 HG1 THR A 187 -10.351 -7.679 -0.812 1.00 0.89 H new ATOM 0 HG21 THR A 187 -7.861 -6.379 -2.733 1.00 0.75 H new ATOM 0 HG22 THR A 187 -6.489 -7.254 -2.012 1.00 0.75 H new ATOM 0 HG23 THR A 187 -7.590 -8.092 -3.131 1.00 0.75 H new ATOM 1047 N VAL A 188 -7.137 -11.272 -1.313 1.00 0.55 N ATOM 1048 CA VAL A 188 -7.100 -12.469 -2.169 1.00 0.63 C ATOM 1049 C VAL A 188 -6.812 -13.699 -1.317 1.00 0.66 C ATOM 1050 O VAL A 188 -7.399 -14.762 -1.512 1.00 0.78 O ATOM 1051 CB VAL A 188 -6.095 -12.389 -3.367 1.00 0.69 C ATOM 1052 CG1 VAL A 188 -5.883 -10.959 -3.830 1.00 0.66 C ATOM 1053 CG2 VAL A 188 -4.760 -13.058 -3.064 1.00 0.84 C ATOM 0 H VAL A 188 -6.554 -11.330 -0.478 1.00 0.55 H new ATOM 0 HA VAL A 188 -8.086 -12.539 -2.629 1.00 0.63 H new ATOM 0 HB VAL A 188 -6.557 -12.947 -4.181 1.00 0.69 H new ATOM 0 HG11 VAL A 188 -5.179 -10.947 -4.662 1.00 0.66 H new ATOM 0 HG12 VAL A 188 -6.834 -10.536 -4.153 1.00 0.66 H new ATOM 0 HG13 VAL A 188 -5.483 -10.366 -3.008 1.00 0.66 H new ATOM 0 HG21 VAL A 188 -4.104 -12.971 -3.931 1.00 0.84 H new ATOM 0 HG22 VAL A 188 -4.295 -12.571 -2.207 1.00 0.84 H new ATOM 0 HG23 VAL A 188 -4.924 -14.112 -2.838 1.00 0.84 H new ATOM 1063 N THR A 189 -5.921 -13.532 -0.355 1.00 0.65 N ATOM 1064 CA THR A 189 -5.682 -14.534 0.661 1.00 0.79 C ATOM 1065 C THR A 189 -6.619 -14.238 1.819 1.00 0.83 C ATOM 1066 O THR A 189 -6.673 -14.947 2.818 1.00 1.04 O ATOM 1067 CB THR A 189 -4.214 -14.479 1.139 1.00 0.88 C ATOM 1068 OG1 THR A 189 -3.339 -14.454 0.000 1.00 0.90 O ATOM 1069 CG2 THR A 189 -3.862 -15.673 2.016 1.00 1.12 C ATOM 0 H THR A 189 -5.344 -12.696 -0.259 1.00 0.65 H new ATOM 0 HA THR A 189 -5.864 -15.532 0.261 1.00 0.79 H new ATOM 0 HB THR A 189 -4.090 -13.574 1.733 1.00 0.88 H new ATOM 0 HG1 THR A 189 -2.413 -14.578 0.296 1.00 0.90 H new ATOM 0 HG21 THR A 189 -2.822 -15.598 2.332 1.00 1.12 H new ATOM 0 HG22 THR A 189 -4.508 -15.683 2.894 1.00 1.12 H new ATOM 0 HG23 THR A 189 -4.004 -16.594 1.451 1.00 1.12 H new ATOM 1077 N THR A 190 -7.382 -13.171 1.637 1.00 0.73 N ATOM 1078 CA THR A 190 -8.206 -12.636 2.684 1.00 0.76 C ATOM 1079 C THR A 190 -9.638 -12.358 2.198 1.00 0.80 C ATOM 1080 O THR A 190 -10.544 -12.132 3.002 1.00 1.06 O ATOM 1081 CB THR A 190 -7.522 -11.377 3.271 1.00 0.90 C ATOM 1082 OG1 THR A 190 -6.602 -11.759 4.299 1.00 1.00 O ATOM 1083 CG2 THR A 190 -8.506 -10.365 3.812 1.00 0.93 C ATOM 0 H THR A 190 -7.440 -12.660 0.756 1.00 0.73 H new ATOM 0 HA THR A 190 -8.306 -13.376 3.478 1.00 0.76 H new ATOM 0 HB THR A 190 -6.992 -10.894 2.450 1.00 0.90 H new ATOM 0 HG1 THR A 190 -5.735 -11.331 4.138 1.00 1.00 H new ATOM 0 HG21 THR A 190 -7.964 -9.507 4.209 1.00 0.93 H new ATOM 0 HG22 THR A 190 -9.168 -10.037 3.011 1.00 0.93 H new ATOM 0 HG23 THR A 190 -9.096 -10.821 4.607 1.00 0.93 H new ATOM 1141 N GLY A 194 -14.249 -12.352 4.418 1.00 0.89 N ATOM 1142 CA GLY A 194 -15.322 -11.398 4.307 1.00 0.84 C ATOM 1143 C GLY A 194 -14.846 -10.126 3.657 1.00 0.70 C ATOM 1144 O GLY A 194 -15.236 -9.029 4.059 1.00 0.98 O ATOM 0 HA2 GLY A 194 -16.136 -11.827 3.723 1.00 0.84 H new ATOM 0 HA3 GLY A 194 -15.722 -11.178 5.297 1.00 0.84 H new ATOM 1148 N GLU A 195 -13.989 -10.270 2.656 1.00 0.54 N ATOM 1149 CA GLU A 195 -13.407 -9.117 1.991 1.00 0.62 C ATOM 1150 C GLU A 195 -13.598 -9.248 0.481 1.00 0.62 C ATOM 1151 O GLU A 195 -13.573 -10.354 -0.052 1.00 0.88 O ATOM 1152 CB GLU A 195 -11.916 -9.010 2.356 1.00 0.91 C ATOM 1153 CG GLU A 195 -11.436 -7.597 2.582 1.00 1.17 C ATOM 1154 CD GLU A 195 -11.695 -6.697 1.399 1.00 1.69 C ATOM 1155 OE1 GLU A 195 -10.908 -6.738 0.442 1.00 2.30 O ATOM 1156 OE2 GLU A 195 -12.710 -5.969 1.414 1.00 1.98 O ATOM 0 H GLU A 195 -13.683 -11.171 2.289 1.00 0.54 H new ATOM 0 HA GLU A 195 -13.906 -8.206 2.321 1.00 0.62 H new ATOM 0 HB2 GLU A 195 -11.731 -9.594 3.258 1.00 0.91 H new ATOM 0 HB3 GLU A 195 -11.325 -9.460 1.558 1.00 0.91 H new ATOM 0 HG2 GLU A 195 -11.932 -7.186 3.461 1.00 1.17 H new ATOM 0 HG3 GLU A 195 -10.367 -7.611 2.796 1.00 1.17 H new ATOM 1163 N ASN A 196 -13.827 -8.124 -0.187 1.00 0.61 N ATOM 1164 CA ASN A 196 -13.971 -8.088 -1.645 1.00 0.66 C ATOM 1165 C ASN A 196 -13.580 -6.728 -2.169 1.00 0.54 C ATOM 1166 O ASN A 196 -14.101 -5.720 -1.704 1.00 0.57 O ATOM 1167 CB ASN A 196 -15.399 -8.342 -2.111 1.00 0.92 C ATOM 1168 CG ASN A 196 -15.835 -9.791 -2.024 1.00 1.42 C ATOM 1169 OD1 ASN A 196 -16.439 -10.212 -1.037 1.00 2.09 O ATOM 1170 ND2 ASN A 196 -15.541 -10.561 -3.057 1.00 2.16 N ATOM 0 H ASN A 196 -13.919 -7.212 0.261 1.00 0.61 H new ATOM 0 HA ASN A 196 -13.325 -8.879 -2.026 1.00 0.66 H new ATOM 0 HB2 ASN A 196 -16.078 -7.734 -1.513 1.00 0.92 H new ATOM 0 HB3 ASN A 196 -15.497 -8.007 -3.143 1.00 0.92 H new ATOM 0 HD21 ASN A 196 -15.816 -11.543 -3.056 1.00 2.16 H new ATOM 0 HD22 ASN A 196 -15.039 -10.173 -3.856 1.00 2.16 H new ATOM 1177 N PHE A 197 -12.719 -6.694 -3.164 1.00 0.51 N ATOM 1178 CA PHE A 197 -12.263 -5.447 -3.712 1.00 0.42 C ATOM 1179 C PHE A 197 -12.745 -5.271 -5.144 1.00 0.43 C ATOM 1180 O PHE A 197 -12.831 -6.234 -5.908 1.00 0.47 O ATOM 1181 CB PHE A 197 -10.749 -5.410 -3.670 1.00 0.55 C ATOM 1182 CG PHE A 197 -10.099 -6.312 -4.675 1.00 1.16 C ATOM 1183 CD1 PHE A 197 -10.120 -7.689 -4.528 1.00 1.81 C ATOM 1184 CD2 PHE A 197 -9.478 -5.771 -5.776 1.00 2.03 C ATOM 1185 CE1 PHE A 197 -9.525 -8.509 -5.466 1.00 2.73 C ATOM 1186 CE2 PHE A 197 -8.883 -6.584 -6.722 1.00 2.99 C ATOM 1187 CZ PHE A 197 -8.907 -7.955 -6.567 1.00 3.21 C ATOM 0 H PHE A 197 -12.323 -7.523 -3.607 1.00 0.51 H new ATOM 0 HA PHE A 197 -12.672 -4.631 -3.116 1.00 0.42 H new ATOM 0 HB2 PHE A 197 -10.414 -4.387 -3.842 1.00 0.55 H new ATOM 0 HB3 PHE A 197 -10.414 -5.691 -2.672 1.00 0.55 H new ATOM 0 HD1 PHE A 197 -10.608 -8.127 -3.669 1.00 1.81 H new ATOM 0 HD2 PHE A 197 -9.455 -4.699 -5.903 1.00 2.03 H new ATOM 0 HE1 PHE A 197 -9.544 -9.581 -5.338 1.00 2.73 H new ATOM 0 HE2 PHE A 197 -8.399 -6.146 -7.583 1.00 2.99 H new ATOM 0 HZ PHE A 197 -8.443 -8.592 -7.306 1.00 3.21 H new ATOM 1197 N THR A 198 -13.084 -4.050 -5.489 1.00 0.47 N ATOM 1198 CA THR A 198 -13.353 -3.698 -6.863 1.00 0.50 C ATOM 1199 C THR A 198 -12.182 -2.903 -7.424 1.00 0.48 C ATOM 1200 O THR A 198 -11.291 -2.559 -6.683 1.00 0.45 O ATOM 1201 CB THR A 198 -14.683 -2.925 -7.012 1.00 0.54 C ATOM 1202 OG1 THR A 198 -14.969 -2.680 -8.397 1.00 0.61 O ATOM 1203 CG2 THR A 198 -14.640 -1.604 -6.265 1.00 0.49 C ATOM 0 H THR A 198 -13.180 -3.278 -4.830 1.00 0.47 H new ATOM 0 HA THR A 198 -13.465 -4.617 -7.438 1.00 0.50 H new ATOM 0 HB THR A 198 -15.471 -3.543 -6.582 1.00 0.54 H new ATOM 0 HG1 THR A 198 -15.815 -2.191 -8.475 1.00 0.61 H new ATOM 0 HG21 THR A 198 -15.590 -1.085 -6.390 1.00 0.49 H new ATOM 0 HG22 THR A 198 -14.465 -1.791 -5.206 1.00 0.49 H new ATOM 0 HG23 THR A 198 -13.834 -0.987 -6.663 1.00 0.49 H new ATOM 1211 N GLU A 199 -12.137 -2.683 -8.733 1.00 0.51 N ATOM 1212 CA GLU A 199 -11.086 -1.855 -9.331 1.00 0.50 C ATOM 1213 C GLU A 199 -10.997 -0.494 -8.659 1.00 0.44 C ATOM 1214 O GLU A 199 -9.987 0.162 -8.749 1.00 0.43 O ATOM 1215 CB GLU A 199 -11.312 -1.613 -10.810 1.00 0.53 C ATOM 1216 CG GLU A 199 -10.022 -1.364 -11.566 1.00 0.54 C ATOM 1217 CD GLU A 199 -10.264 -0.949 -13.000 1.00 0.58 C ATOM 1218 OE1 GLU A 199 -10.503 -1.837 -13.849 1.00 0.76 O ATOM 1219 OE2 GLU A 199 -10.221 0.262 -13.287 1.00 0.62 O ATOM 0 H GLU A 199 -12.809 -3.062 -9.400 1.00 0.51 H new ATOM 0 HA GLU A 199 -10.162 -2.415 -9.187 1.00 0.50 H new ATOM 0 HB2 GLU A 199 -11.821 -2.475 -11.241 1.00 0.53 H new ATOM 0 HB3 GLU A 199 -11.974 -0.756 -10.937 1.00 0.53 H new ATOM 0 HG2 GLU A 199 -9.450 -0.587 -11.058 1.00 0.54 H new ATOM 0 HG3 GLU A 199 -9.415 -2.269 -11.550 1.00 0.54 H new ATOM 1226 N THR A 200 -12.073 -0.057 -8.038 1.00 0.44 N ATOM 1227 CA THR A 200 -12.054 1.124 -7.209 1.00 0.38 C ATOM 1228 C THR A 200 -11.403 0.797 -5.887 1.00 0.33 C ATOM 1229 O THR A 200 -10.567 1.531 -5.413 1.00 0.28 O ATOM 1230 CB THR A 200 -13.462 1.660 -6.928 1.00 0.42 C ATOM 1231 OG1 THR A 200 -14.126 1.974 -8.157 1.00 0.51 O ATOM 1232 CG2 THR A 200 -13.391 2.887 -6.039 1.00 0.45 C ATOM 0 H THR A 200 -12.984 -0.512 -8.096 1.00 0.44 H new ATOM 0 HA THR A 200 -11.496 1.888 -7.750 1.00 0.38 H new ATOM 0 HB THR A 200 -14.032 0.889 -6.410 1.00 0.42 H new ATOM 0 HG1 THR A 200 -15.025 2.314 -7.966 1.00 0.51 H new ATOM 0 HG21 THR A 200 -14.398 3.257 -5.848 1.00 0.45 H new ATOM 0 HG22 THR A 200 -12.915 2.625 -5.094 1.00 0.45 H new ATOM 0 HG23 THR A 200 -12.808 3.663 -6.535 1.00 0.45 H new ATOM 1240 N ASP A 201 -11.744 -0.355 -5.343 1.00 0.37 N ATOM 1241 CA ASP A 201 -11.219 -0.776 -4.053 1.00 0.34 C ATOM 1242 C ASP A 201 -9.770 -1.102 -4.226 1.00 0.31 C ATOM 1243 O ASP A 201 -8.969 -1.105 -3.296 1.00 0.28 O ATOM 1244 CB ASP A 201 -11.958 -1.982 -3.484 1.00 0.37 C ATOM 1245 CG ASP A 201 -13.399 -1.682 -3.142 1.00 0.41 C ATOM 1246 OD1 ASP A 201 -13.667 -0.585 -2.614 1.00 0.56 O ATOM 1247 OD2 ASP A 201 -14.263 -2.542 -3.376 1.00 0.50 O ATOM 0 H ASP A 201 -12.385 -1.021 -5.774 1.00 0.37 H new ATOM 0 HA ASP A 201 -11.359 0.038 -3.342 1.00 0.34 H new ATOM 0 HB2 ASP A 201 -11.924 -2.797 -4.207 1.00 0.37 H new ATOM 0 HB3 ASP A 201 -11.442 -2.328 -2.589 1.00 0.37 H new ATOM 1252 N ILE A 202 -9.459 -1.351 -5.460 1.00 0.35 N ATOM 1253 CA ILE A 202 -8.149 -1.676 -5.882 1.00 0.36 C ATOM 1254 C ILE A 202 -7.450 -0.459 -6.321 1.00 0.33 C ATOM 1255 O ILE A 202 -6.263 -0.313 -6.100 1.00 0.34 O ATOM 1256 CB ILE A 202 -8.230 -2.649 -7.044 1.00 0.44 C ATOM 1257 CG1 ILE A 202 -7.289 -3.796 -6.864 1.00 0.50 C ATOM 1258 CG2 ILE A 202 -7.907 -1.989 -8.375 1.00 0.48 C ATOM 1259 CD1 ILE A 202 -6.605 -3.797 -5.544 1.00 0.59 C ATOM 0 H ILE A 202 -10.139 -1.331 -6.220 1.00 0.35 H new ATOM 0 HA ILE A 202 -7.603 -2.127 -5.053 1.00 0.36 H new ATOM 0 HB ILE A 202 -9.261 -3.003 -7.056 1.00 0.44 H new ATOM 0 HG12 ILE A 202 -7.839 -4.730 -6.980 1.00 0.50 H new ATOM 0 HG13 ILE A 202 -6.538 -3.768 -7.654 1.00 0.50 H new ATOM 0 HG21 ILE A 202 -7.979 -2.727 -9.174 1.00 0.48 H new ATOM 0 HG22 ILE A 202 -8.615 -1.182 -8.562 1.00 0.48 H new ATOM 0 HG23 ILE A 202 -6.895 -1.585 -8.345 1.00 0.48 H new ATOM 0 HD11 ILE A 202 -5.937 -4.656 -5.481 1.00 0.59 H new ATOM 0 HD12 ILE A 202 -6.027 -2.879 -5.433 1.00 0.59 H new ATOM 0 HD13 ILE A 202 -7.348 -3.856 -4.749 1.00 0.59 H new ATOM 1271 N LYS A 203 -8.206 0.444 -6.918 1.00 0.33 N ATOM 1272 CA LYS A 203 -7.628 1.658 -7.347 1.00 0.33 C ATOM 1273 C LYS A 203 -7.177 2.365 -6.100 1.00 0.28 C ATOM 1274 O LYS A 203 -6.357 3.268 -6.103 1.00 0.32 O ATOM 1275 CB LYS A 203 -8.583 2.498 -8.164 1.00 0.33 C ATOM 1276 CG LYS A 203 -9.562 3.310 -7.355 1.00 0.29 C ATOM 1277 CD LYS A 203 -10.554 4.032 -8.252 1.00 0.34 C ATOM 1278 CE LYS A 203 -9.893 5.143 -9.052 1.00 1.13 C ATOM 1279 NZ LYS A 203 -10.874 5.862 -9.905 1.00 1.93 N ATOM 0 H LYS A 203 -9.204 0.343 -7.105 1.00 0.33 H new ATOM 0 HA LYS A 203 -6.790 1.470 -8.018 1.00 0.33 H new ATOM 0 HB2 LYS A 203 -8.003 3.174 -8.792 1.00 0.33 H new ATOM 0 HB3 LYS A 203 -9.141 1.842 -8.832 1.00 0.33 H new ATOM 0 HG2 LYS A 203 -10.099 2.657 -6.667 1.00 0.29 H new ATOM 0 HG3 LYS A 203 -9.021 4.036 -6.748 1.00 0.29 H new ATOM 0 HD2 LYS A 203 -11.013 3.317 -8.935 1.00 0.34 H new ATOM 0 HD3 LYS A 203 -11.355 4.451 -7.643 1.00 0.34 H new ATOM 0 HE2 LYS A 203 -9.417 5.848 -8.371 1.00 1.13 H new ATOM 0 HE3 LYS A 203 -9.106 4.723 -9.678 1.00 1.13 H new ATOM 0 HZ1 LYS A 203 -10.388 6.613 -10.436 1.00 1.93 H new ATOM 0 HZ2 LYS A 203 -11.310 5.193 -10.571 1.00 1.93 H new ATOM 0 HZ3 LYS A 203 -11.612 6.284 -9.306 1.00 1.93 H new ATOM 1293 N ILE A 204 -7.760 1.857 -5.031 1.00 0.24 N ATOM 1294 CA ILE A 204 -7.432 2.176 -3.691 1.00 0.22 C ATOM 1295 C ILE A 204 -6.102 1.563 -3.355 1.00 0.22 C ATOM 1296 O ILE A 204 -5.152 2.269 -3.201 1.00 0.25 O ATOM 1297 CB ILE A 204 -8.490 1.629 -2.750 1.00 0.24 C ATOM 1298 CG1 ILE A 204 -9.804 2.353 -2.952 1.00 0.27 C ATOM 1299 CG2 ILE A 204 -8.027 1.682 -1.325 1.00 0.32 C ATOM 1300 CD1 ILE A 204 -10.862 1.975 -1.970 1.00 0.30 C ATOM 0 H ILE A 204 -8.515 1.174 -5.099 1.00 0.24 H new ATOM 0 HA ILE A 204 -7.385 3.259 -3.579 1.00 0.22 H new ATOM 0 HB ILE A 204 -8.656 0.578 -2.987 1.00 0.24 H new ATOM 0 HG12 ILE A 204 -9.629 3.427 -2.887 1.00 0.27 H new ATOM 0 HG13 ILE A 204 -10.168 2.150 -3.959 1.00 0.27 H new ATOM 0 HG21 ILE A 204 -8.806 1.284 -0.674 1.00 0.32 H new ATOM 0 HG22 ILE A 204 -7.121 1.086 -1.214 1.00 0.32 H new ATOM 0 HG23 ILE A 204 -7.817 2.715 -1.049 1.00 0.32 H new ATOM 0 HD11 ILE A 204 -11.772 2.536 -2.181 1.00 0.30 H new ATOM 0 HD12 ILE A 204 -11.068 0.908 -2.049 1.00 0.30 H new ATOM 0 HD13 ILE A 204 -10.520 2.205 -0.961 1.00 0.30 H new ATOM 1312 N MET A 205 -5.994 0.245 -3.316 1.00 0.21 N ATOM 1313 CA MET A 205 -4.737 -0.364 -2.953 1.00 0.21 C ATOM 1314 C MET A 205 -3.645 0.039 -3.904 1.00 0.22 C ATOM 1315 O MET A 205 -2.480 -0.069 -3.604 1.00 0.26 O ATOM 1316 CB MET A 205 -4.841 -1.873 -2.877 1.00 0.22 C ATOM 1317 CG MET A 205 -5.166 -2.354 -1.480 1.00 0.27 C ATOM 1318 SD MET A 205 -6.060 -3.912 -1.466 1.00 0.32 S ATOM 1319 CE MET A 205 -7.457 -3.473 -2.491 1.00 0.42 C ATOM 0 H MET A 205 -6.748 -0.408 -3.528 1.00 0.21 H new ATOM 0 HA MET A 205 -4.483 0.001 -1.958 1.00 0.21 H new ATOM 0 HB2 MET A 205 -5.612 -2.217 -3.566 1.00 0.22 H new ATOM 0 HB3 MET A 205 -3.900 -2.317 -3.203 1.00 0.22 H new ATOM 0 HG2 MET A 205 -4.240 -2.467 -0.916 1.00 0.27 H new ATOM 0 HG3 MET A 205 -5.760 -1.596 -0.969 1.00 0.27 H new ATOM 0 HE1 MET A 205 -8.275 -4.171 -2.310 1.00 0.42 H new ATOM 0 HE2 MET A 205 -7.783 -2.462 -2.248 1.00 0.42 H new ATOM 0 HE3 MET A 205 -7.167 -3.518 -3.541 1.00 0.42 H new ATOM 1329 N GLU A 206 -4.022 0.577 -5.022 1.00 0.23 N ATOM 1330 CA GLU A 206 -3.052 0.986 -5.975 1.00 0.28 C ATOM 1331 C GLU A 206 -2.697 2.429 -5.700 1.00 0.30 C ATOM 1332 O GLU A 206 -1.599 2.886 -5.964 1.00 0.38 O ATOM 1333 CB GLU A 206 -3.553 0.743 -7.383 1.00 0.32 C ATOM 1334 CG GLU A 206 -3.787 -0.737 -7.601 1.00 0.34 C ATOM 1335 CD GLU A 206 -4.063 -1.102 -9.045 1.00 0.49 C ATOM 1336 OE1 GLU A 206 -5.154 -0.778 -9.557 1.00 0.54 O ATOM 1337 OE2 GLU A 206 -3.176 -1.702 -9.691 1.00 0.90 O ATOM 0 H GLU A 206 -4.992 0.741 -5.292 1.00 0.23 H new ATOM 0 HA GLU A 206 -2.141 0.394 -5.885 1.00 0.28 H new ATOM 0 HB2 GLU A 206 -4.479 1.294 -7.549 1.00 0.32 H new ATOM 0 HB3 GLU A 206 -2.827 1.115 -8.106 1.00 0.32 H new ATOM 0 HG2 GLU A 206 -2.913 -1.289 -7.256 1.00 0.34 H new ATOM 0 HG3 GLU A 206 -4.629 -1.057 -6.987 1.00 0.34 H new ATOM 1344 N ARG A 207 -3.618 3.114 -5.062 1.00 0.26 N ATOM 1345 CA ARG A 207 -3.404 4.491 -4.691 1.00 0.30 C ATOM 1346 C ARG A 207 -2.851 4.588 -3.286 1.00 0.31 C ATOM 1347 O ARG A 207 -2.180 5.545 -2.957 1.00 0.40 O ATOM 1348 CB ARG A 207 -4.704 5.283 -4.765 1.00 0.33 C ATOM 1349 CG ARG A 207 -5.707 4.870 -3.699 1.00 0.38 C ATOM 1350 CD ARG A 207 -7.003 5.603 -3.848 1.00 0.84 C ATOM 1351 NE ARG A 207 -7.290 5.799 -5.250 1.00 1.28 N ATOM 1352 CZ ARG A 207 -7.377 6.993 -5.839 1.00 1.93 C ATOM 1353 NH1 ARG A 207 -7.278 8.096 -5.116 1.00 2.42 N ATOM 1354 NH2 ARG A 207 -7.532 7.080 -7.155 1.00 2.55 N ATOM 0 H ARG A 207 -4.526 2.737 -4.789 1.00 0.26 H new ATOM 0 HA ARG A 207 -2.685 4.910 -5.395 1.00 0.30 H new ATOM 0 HB2 ARG A 207 -4.484 6.345 -4.658 1.00 0.33 H new ATOM 0 HB3 ARG A 207 -5.151 5.148 -5.750 1.00 0.33 H new ATOM 0 HG2 ARG A 207 -5.886 3.797 -3.763 1.00 0.38 H new ATOM 0 HG3 ARG A 207 -5.290 5.065 -2.711 1.00 0.38 H new ATOM 0 HD2 ARG A 207 -7.808 5.039 -3.377 1.00 0.84 H new ATOM 0 HD3 ARG A 207 -6.949 6.566 -3.339 1.00 0.84 H new ATOM 0 HE ARG A 207 -7.436 4.971 -5.827 1.00 1.28 H new ATOM 0 HH11 ARG A 207 -7.135 8.034 -4.108 1.00 2.42 H new ATOM 0 HH12 ARG A 207 -7.345 9.009 -5.566 1.00 2.42 H new ATOM 0 HH21 ARG A 207 -7.585 6.232 -7.719 1.00 2.55 H new ATOM 0 HH22 ARG A 207 -7.598 7.995 -7.601 1.00 2.55 H new ATOM 1368 N VAL A 208 -3.155 3.621 -2.438 1.00 0.29 N ATOM 1369 CA VAL A 208 -2.612 3.652 -1.105 1.00 0.31 C ATOM 1370 C VAL A 208 -1.299 2.981 -1.066 1.00 0.34 C ATOM 1371 O VAL A 208 -0.377 3.448 -0.454 1.00 0.50 O ATOM 1372 CB VAL A 208 -3.480 3.006 -0.008 1.00 0.44 C ATOM 1373 CG1 VAL A 208 -3.865 4.041 1.004 1.00 0.30 C ATOM 1374 CG2 VAL A 208 -4.706 2.338 -0.563 1.00 0.80 C ATOM 0 H VAL A 208 -3.760 2.827 -2.647 1.00 0.29 H new ATOM 0 HA VAL A 208 -2.552 4.717 -0.882 1.00 0.31 H new ATOM 0 HB VAL A 208 -2.883 2.227 0.467 1.00 0.44 H new ATOM 0 HG11 VAL A 208 -4.479 3.582 1.779 1.00 0.30 H new ATOM 0 HG12 VAL A 208 -2.966 4.461 1.455 1.00 0.30 H new ATOM 0 HG13 VAL A 208 -4.431 4.834 0.516 1.00 0.30 H new ATOM 0 HG21 VAL A 208 -5.282 1.899 0.252 1.00 0.80 H new ATOM 0 HG22 VAL A 208 -5.318 3.075 -1.084 1.00 0.80 H new ATOM 0 HG23 VAL A 208 -4.409 1.555 -1.260 1.00 0.80 H new ATOM 1384 N VAL A 209 -1.238 1.896 -1.754 1.00 0.28 N ATOM 1385 CA VAL A 209 -0.162 0.976 -1.639 1.00 0.31 C ATOM 1386 C VAL A 209 0.844 1.192 -2.746 1.00 0.29 C ATOM 1387 O VAL A 209 2.042 1.240 -2.491 1.00 0.30 O ATOM 1388 CB VAL A 209 -0.693 -0.451 -1.665 1.00 0.38 C ATOM 1389 CG1 VAL A 209 0.428 -1.425 -1.807 1.00 0.89 C ATOM 1390 CG2 VAL A 209 -1.539 -0.744 -0.437 1.00 0.88 C ATOM 0 H VAL A 209 -1.951 1.617 -2.428 1.00 0.28 H new ATOM 0 HA VAL A 209 0.343 1.144 -0.688 1.00 0.31 H new ATOM 0 HB VAL A 209 -1.341 -0.560 -2.535 1.00 0.38 H new ATOM 0 HG11 VAL A 209 0.029 -2.439 -1.824 1.00 0.89 H new ATOM 0 HG12 VAL A 209 0.964 -1.230 -2.736 1.00 0.89 H new ATOM 0 HG13 VAL A 209 1.112 -1.318 -0.965 1.00 0.89 H new ATOM 0 HG21 VAL A 209 -1.904 -1.770 -0.483 1.00 0.88 H new ATOM 0 HG22 VAL A 209 -0.935 -0.614 0.461 1.00 0.88 H new ATOM 0 HG23 VAL A 209 -2.386 -0.058 -0.407 1.00 0.88 H new ATOM 1400 N GLU A 210 0.368 1.353 -3.981 1.00 0.28 N ATOM 1401 CA GLU A 210 1.293 1.568 -5.065 1.00 0.29 C ATOM 1402 C GLU A 210 1.866 2.956 -4.939 1.00 0.24 C ATOM 1403 O GLU A 210 3.012 3.206 -5.290 1.00 0.25 O ATOM 1404 CB GLU A 210 0.650 1.374 -6.430 1.00 0.34 C ATOM 1405 CG GLU A 210 1.660 1.403 -7.568 1.00 0.63 C ATOM 1406 CD GLU A 210 1.035 1.293 -8.941 1.00 0.87 C ATOM 1407 OE1 GLU A 210 0.692 0.162 -9.354 1.00 1.16 O ATOM 1408 OE2 GLU A 210 0.845 2.337 -9.599 1.00 1.62 O ATOM 0 H GLU A 210 -0.619 1.338 -4.239 1.00 0.28 H new ATOM 0 HA GLU A 210 2.085 0.822 -4.994 1.00 0.29 H new ATOM 0 HB2 GLU A 210 0.120 0.421 -6.445 1.00 0.34 H new ATOM 0 HB3 GLU A 210 -0.094 2.155 -6.590 1.00 0.34 H new ATOM 0 HG2 GLU A 210 2.230 2.330 -7.512 1.00 0.63 H new ATOM 0 HG3 GLU A 210 2.368 0.585 -7.434 1.00 0.63 H new ATOM 1415 N GLN A 211 1.069 3.850 -4.395 1.00 0.23 N ATOM 1416 CA GLN A 211 1.527 5.191 -4.125 1.00 0.23 C ATOM 1417 C GLN A 211 2.412 5.204 -2.900 1.00 0.22 C ATOM 1418 O GLN A 211 3.377 5.950 -2.831 1.00 0.25 O ATOM 1419 CB GLN A 211 0.353 6.104 -3.862 1.00 0.29 C ATOM 1420 CG GLN A 211 0.703 7.555 -3.566 1.00 0.34 C ATOM 1421 CD GLN A 211 1.306 8.288 -4.750 1.00 0.79 C ATOM 1422 OE1 GLN A 211 2.520 8.309 -4.932 1.00 1.49 O ATOM 1423 NE2 GLN A 211 0.457 8.907 -5.557 1.00 1.68 N ATOM 0 H GLN A 211 0.100 3.670 -4.132 1.00 0.23 H new ATOM 0 HA GLN A 211 2.083 5.537 -4.996 1.00 0.23 H new ATOM 0 HB2 GLN A 211 -0.307 6.078 -4.729 1.00 0.29 H new ATOM 0 HB3 GLN A 211 -0.212 5.706 -3.019 1.00 0.29 H new ATOM 0 HG2 GLN A 211 -0.197 8.079 -3.245 1.00 0.34 H new ATOM 0 HG3 GLN A 211 1.405 7.588 -2.733 1.00 0.34 H new ATOM 0 HE21 GLN A 211 -0.545 8.866 -5.372 1.00 1.68 H new ATOM 0 HE22 GLN A 211 0.806 9.425 -6.364 1.00 1.68 H new ATOM 1432 N MET A 212 2.074 4.396 -1.908 1.00 0.27 N ATOM 1433 CA MET A 212 2.825 4.434 -0.677 1.00 0.32 C ATOM 1434 C MET A 212 4.139 3.722 -0.820 1.00 0.25 C ATOM 1435 O MET A 212 5.174 4.237 -0.432 1.00 0.22 O ATOM 1436 CB MET A 212 2.075 3.868 0.493 1.00 0.48 C ATOM 1437 CG MET A 212 1.873 4.858 1.629 1.00 1.72 C ATOM 1438 SD MET A 212 3.376 5.180 2.557 1.00 1.89 S ATOM 1439 CE MET A 212 4.134 3.567 2.432 1.00 0.30 C ATOM 0 H MET A 212 1.306 3.726 -1.933 1.00 0.27 H new ATOM 0 HA MET A 212 3.000 5.491 -0.474 1.00 0.32 H new ATOM 0 HB2 MET A 212 1.101 3.516 0.153 1.00 0.48 H new ATOM 0 HB3 MET A 212 2.613 2.999 0.872 1.00 0.48 H new ATOM 0 HG2 MET A 212 1.496 5.796 1.223 1.00 1.72 H new ATOM 0 HG3 MET A 212 1.110 4.474 2.306 1.00 1.72 H new ATOM 0 HE1 MET A 212 4.905 3.467 3.196 1.00 0.30 H new ATOM 0 HE2 MET A 212 3.377 2.797 2.577 1.00 0.30 H new ATOM 0 HE3 MET A 212 4.584 3.452 1.446 1.00 0.30 H new ATOM 1449 N CYS A 213 4.105 2.532 -1.370 1.00 0.27 N ATOM 1450 CA CYS A 213 5.332 1.860 -1.689 1.00 0.24 C ATOM 1451 C CYS A 213 6.140 2.752 -2.647 1.00 0.23 C ATOM 1452 O CYS A 213 7.366 2.725 -2.648 1.00 0.25 O ATOM 1453 CB CYS A 213 5.060 0.485 -2.295 1.00 0.27 C ATOM 1454 SG CYS A 213 4.534 -0.809 -1.132 1.00 0.68 S ATOM 0 H CYS A 213 3.254 2.019 -1.601 1.00 0.27 H new ATOM 0 HA CYS A 213 5.911 1.692 -0.781 1.00 0.24 H new ATOM 0 HB2 CYS A 213 4.291 0.593 -3.060 1.00 0.27 H new ATOM 0 HB3 CYS A 213 5.965 0.147 -2.799 1.00 0.27 H new ATOM 1459 N ILE A 214 5.432 3.559 -3.458 1.00 0.23 N ATOM 1460 CA ILE A 214 6.079 4.574 -4.299 1.00 0.24 C ATOM 1461 C ILE A 214 6.683 5.647 -3.436 1.00 0.25 C ATOM 1462 O ILE A 214 7.759 6.149 -3.726 1.00 0.30 O ATOM 1463 CB ILE A 214 5.101 5.244 -5.296 1.00 0.24 C ATOM 1464 CG1 ILE A 214 5.396 4.803 -6.727 1.00 0.30 C ATOM 1465 CG2 ILE A 214 5.186 6.767 -5.204 1.00 0.26 C ATOM 1466 CD1 ILE A 214 5.742 3.349 -6.831 1.00 0.34 C ATOM 0 H ILE A 214 4.416 3.526 -3.546 1.00 0.23 H new ATOM 0 HA ILE A 214 6.845 4.054 -4.874 1.00 0.24 H new ATOM 0 HB ILE A 214 4.093 4.929 -5.028 1.00 0.24 H new ATOM 0 HG12 ILE A 214 4.527 5.010 -7.352 1.00 0.30 H new ATOM 0 HG13 ILE A 214 6.221 5.396 -7.122 1.00 0.30 H new ATOM 0 HG21 ILE A 214 4.490 7.214 -5.914 1.00 0.26 H new ATOM 0 HG22 ILE A 214 4.929 7.085 -4.194 1.00 0.26 H new ATOM 0 HG23 ILE A 214 6.200 7.090 -5.439 1.00 0.26 H new ATOM 0 HD11 ILE A 214 5.941 3.096 -7.872 1.00 0.34 H new ATOM 0 HD12 ILE A 214 6.628 3.142 -6.231 1.00 0.34 H new ATOM 0 HD13 ILE A 214 4.908 2.750 -6.465 1.00 0.34 H new ATOM 1478 N THR A 215 5.969 6.019 -2.400 1.00 0.25 N ATOM 1479 CA THR A 215 6.456 6.990 -1.475 1.00 0.27 C ATOM 1480 C THR A 215 7.786 6.499 -0.922 1.00 0.26 C ATOM 1481 O THR A 215 8.703 7.280 -0.735 1.00 0.33 O ATOM 1482 CB THR A 215 5.431 7.247 -0.354 1.00 0.29 C ATOM 1483 OG1 THR A 215 5.188 8.653 -0.212 1.00 0.37 O ATOM 1484 CG2 THR A 215 5.920 6.678 0.947 1.00 0.31 C ATOM 0 H THR A 215 5.041 5.654 -2.184 1.00 0.25 H new ATOM 0 HA THR A 215 6.607 7.944 -1.980 1.00 0.27 H new ATOM 0 HB THR A 215 4.498 6.753 -0.624 1.00 0.29 H new ATOM 0 HG1 THR A 215 4.534 8.801 0.502 1.00 0.37 H new ATOM 0 HG21 THR A 215 5.183 6.869 1.727 1.00 0.31 H new ATOM 0 HG22 THR A 215 6.067 5.603 0.842 1.00 0.31 H new ATOM 0 HG23 THR A 215 6.865 7.149 1.217 1.00 0.31 H new ATOM 1492 N GLN A 216 7.883 5.189 -0.687 1.00 0.23 N ATOM 1493 CA GLN A 216 9.148 4.568 -0.319 1.00 0.25 C ATOM 1494 C GLN A 216 10.277 4.930 -1.298 1.00 0.31 C ATOM 1495 O GLN A 216 11.432 4.889 -0.924 1.00 0.39 O ATOM 1496 CB GLN A 216 9.079 3.045 -0.242 1.00 0.25 C ATOM 1497 CG GLN A 216 7.863 2.466 0.462 1.00 0.28 C ATOM 1498 CD GLN A 216 7.642 3.053 1.830 1.00 0.88 C ATOM 1499 OE1 GLN A 216 6.903 4.009 1.976 1.00 1.69 O ATOM 1500 NE2 GLN A 216 8.302 2.510 2.836 1.00 1.58 N ATOM 0 H GLN A 216 7.098 4.541 -0.746 1.00 0.23 H new ATOM 0 HA GLN A 216 9.360 4.965 0.674 1.00 0.25 H new ATOM 0 HB2 GLN A 216 9.109 2.648 -1.257 1.00 0.25 H new ATOM 0 HB3 GLN A 216 9.974 2.686 0.267 1.00 0.25 H new ATOM 0 HG2 GLN A 216 6.978 2.641 -0.150 1.00 0.28 H new ATOM 0 HG3 GLN A 216 7.981 1.386 0.551 1.00 0.28 H new ATOM 0 HE21 GLN A 216 8.912 1.709 2.673 1.00 1.58 H new ATOM 0 HE22 GLN A 216 8.202 2.891 3.777 1.00 1.58 H new ATOM 1509 N TYR A 217 9.961 5.268 -2.554 1.00 0.38 N ATOM 1510 CA TYR A 217 11.005 5.710 -3.499 1.00 0.49 C ATOM 1511 C TYR A 217 11.875 6.711 -2.782 1.00 0.49 C ATOM 1512 O TYR A 217 13.099 6.634 -2.720 1.00 0.57 O ATOM 1513 CB TYR A 217 10.424 6.503 -4.666 1.00 0.73 C ATOM 1514 CG TYR A 217 11.479 7.085 -5.586 1.00 0.85 C ATOM 1515 CD1 TYR A 217 12.222 6.272 -6.432 1.00 0.97 C ATOM 1516 CD2 TYR A 217 11.742 8.451 -5.594 1.00 1.07 C ATOM 1517 CE1 TYR A 217 13.195 6.801 -7.255 1.00 1.18 C ATOM 1518 CE2 TYR A 217 12.711 8.987 -6.418 1.00 1.29 C ATOM 1519 CZ TYR A 217 13.435 8.157 -7.244 1.00 1.31 C ATOM 1520 OH TYR A 217 14.415 8.684 -8.053 1.00 1.56 O ATOM 0 H TYR A 217 9.016 5.247 -2.937 1.00 0.38 H new ATOM 0 HA TYR A 217 11.521 4.818 -3.853 1.00 0.49 H new ATOM 0 HB2 TYR A 217 9.767 5.854 -5.245 1.00 0.73 H new ATOM 0 HB3 TYR A 217 9.808 7.313 -4.274 1.00 0.73 H new ATOM 0 HD1 TYR A 217 12.035 5.208 -6.446 1.00 0.97 H new ATOM 0 HD2 TYR A 217 11.178 9.104 -4.944 1.00 1.07 H new ATOM 0 HE1 TYR A 217 13.766 6.154 -7.905 1.00 1.18 H new ATOM 0 HE2 TYR A 217 12.900 10.050 -6.415 1.00 1.29 H new ATOM 0 HH TYR A 217 14.456 9.655 -7.927 1.00 1.56 H new ATOM 1530 N GLN A 218 11.124 7.653 -2.238 1.00 0.46 N ATOM 1531 CA GLN A 218 11.630 8.841 -1.588 1.00 0.51 C ATOM 1532 C GLN A 218 11.736 8.650 -0.083 1.00 0.50 C ATOM 1533 O GLN A 218 12.552 9.290 0.563 1.00 0.61 O ATOM 1534 CB GLN A 218 10.681 10.006 -1.893 1.00 0.53 C ATOM 1535 CG GLN A 218 9.354 9.569 -2.486 1.00 0.48 C ATOM 1536 CD GLN A 218 8.433 10.731 -2.796 1.00 0.72 C ATOM 1537 OE1 GLN A 218 8.450 11.275 -3.900 1.00 1.31 O ATOM 1538 NE2 GLN A 218 7.622 11.120 -1.826 1.00 1.52 N ATOM 0 H GLN A 218 10.105 7.605 -2.239 1.00 0.46 H new ATOM 0 HA GLN A 218 12.630 9.050 -1.967 1.00 0.51 H new ATOM 0 HB2 GLN A 218 10.494 10.561 -0.974 1.00 0.53 H new ATOM 0 HB3 GLN A 218 11.171 10.691 -2.585 1.00 0.53 H new ATOM 0 HG2 GLN A 218 9.539 9.005 -3.400 1.00 0.48 H new ATOM 0 HG3 GLN A 218 8.856 8.894 -1.790 1.00 0.48 H new ATOM 0 HE21 GLN A 218 7.639 10.642 -0.925 1.00 1.52 H new ATOM 0 HE22 GLN A 218 6.980 11.897 -1.979 1.00 1.52 H new ATOM 1547 N GLN A 219 10.910 7.767 0.469 1.00 0.40 N ATOM 1548 CA GLN A 219 10.804 7.629 1.911 1.00 0.41 C ATOM 1549 C GLN A 219 11.658 6.483 2.414 1.00 0.39 C ATOM 1550 O GLN A 219 12.083 6.461 3.564 1.00 0.46 O ATOM 1551 CB GLN A 219 9.356 7.489 2.376 1.00 0.45 C ATOM 1552 CG GLN A 219 8.896 6.065 2.579 1.00 0.44 C ATOM 1553 CD GLN A 219 8.031 5.925 3.824 1.00 0.81 C ATOM 1554 OE1 GLN A 219 8.026 4.885 4.487 1.00 1.64 O ATOM 1555 NE2 GLN A 219 7.294 6.975 4.156 1.00 1.26 N ATOM 0 H GLN A 219 10.307 7.139 -0.062 1.00 0.40 H new ATOM 0 HA GLN A 219 11.186 8.552 2.348 1.00 0.41 H new ATOM 0 HB2 GLN A 219 9.235 8.033 3.313 1.00 0.45 H new ATOM 0 HB3 GLN A 219 8.705 7.966 1.643 1.00 0.45 H new ATOM 0 HG2 GLN A 219 8.333 5.737 1.706 1.00 0.44 H new ATOM 0 HG3 GLN A 219 9.764 5.411 2.663 1.00 0.44 H new ATOM 0 HE21 GLN A 219 7.323 7.819 3.585 1.00 1.26 H new ATOM 0 HE22 GLN A 219 6.698 6.939 4.983 1.00 1.26 H new ATOM 1564 N GLU A 220 11.905 5.539 1.540 1.00 0.35 N ATOM 1565 CA GLU A 220 12.809 4.456 1.823 1.00 0.39 C ATOM 1566 C GLU A 220 14.210 4.877 1.521 1.00 0.48 C ATOM 1567 O GLU A 220 15.155 4.420 2.139 1.00 0.55 O ATOM 1568 CB GLU A 220 12.491 3.270 0.987 1.00 0.50 C ATOM 1569 CG GLU A 220 13.509 2.212 1.127 1.00 1.11 C ATOM 1570 CD GLU A 220 13.179 1.242 2.245 1.00 2.32 C ATOM 1571 OE1 GLU A 220 13.390 1.596 3.416 1.00 3.07 O ATOM 1572 OE2 GLU A 220 12.722 0.115 1.956 1.00 2.80 O ATOM 0 H GLU A 220 11.484 5.501 0.612 1.00 0.35 H new ATOM 0 HA GLU A 220 12.704 4.197 2.877 1.00 0.39 H new ATOM 0 HB2 GLU A 220 11.516 2.876 1.272 1.00 0.50 H new ATOM 0 HB3 GLU A 220 12.421 3.571 -0.058 1.00 0.50 H new ATOM 0 HG2 GLU A 220 13.594 1.666 0.188 1.00 1.11 H new ATOM 0 HG3 GLU A 220 14.480 2.668 1.319 1.00 1.11 H new ATOM 1579 N SER A 221 14.368 5.767 0.574 1.00 0.52 N ATOM 1580 CA SER A 221 15.684 6.289 0.339 1.00 0.63 C ATOM 1581 C SER A 221 16.126 7.058 1.585 1.00 0.68 C ATOM 1582 O SER A 221 17.277 7.463 1.729 1.00 0.81 O ATOM 1583 CB SER A 221 15.739 7.172 -0.887 1.00 0.70 C ATOM 1584 OG SER A 221 15.036 8.389 -0.697 1.00 0.86 O ATOM 0 H SER A 221 13.629 6.133 -0.026 1.00 0.52 H new ATOM 0 HA SER A 221 16.363 5.459 0.147 1.00 0.63 H new ATOM 0 HB2 SER A 221 16.779 7.388 -1.132 1.00 0.70 H new ATOM 0 HB3 SER A 221 15.316 6.638 -1.738 1.00 0.70 H new ATOM 0 HG SER A 221 14.299 8.246 -0.067 1.00 0.86 H new ATOM 1590 N GLN A 222 15.147 7.266 2.461 1.00 0.62 N ATOM 1591 CA GLN A 222 15.340 7.807 3.787 1.00 0.66 C ATOM 1592 C GLN A 222 15.465 6.672 4.801 1.00 0.60 C ATOM 1593 O GLN A 222 16.432 6.594 5.556 1.00 0.63 O ATOM 1594 CB GLN A 222 14.127 8.644 4.147 1.00 0.71 C ATOM 1595 CG GLN A 222 13.795 9.689 3.107 1.00 0.88 C ATOM 1596 CD GLN A 222 12.702 10.646 3.542 1.00 0.95 C ATOM 1597 OE1 GLN A 222 11.811 10.292 4.315 1.00 1.36 O ATOM 1598 NE2 GLN A 222 12.763 11.866 3.033 1.00 1.60 N ATOM 0 H GLN A 222 14.171 7.054 2.254 1.00 0.62 H new ATOM 0 HA GLN A 222 16.248 8.410 3.804 1.00 0.66 H new ATOM 0 HB2 GLN A 222 13.267 7.987 4.280 1.00 0.71 H new ATOM 0 HB3 GLN A 222 14.304 9.136 5.103 1.00 0.71 H new ATOM 0 HG2 GLN A 222 14.695 10.258 2.875 1.00 0.88 H new ATOM 0 HG3 GLN A 222 13.487 9.191 2.188 1.00 0.88 H new ATOM 0 HE21 GLN A 222 13.520 12.116 2.396 1.00 1.60 H new ATOM 0 HE22 GLN A 222 12.053 12.557 3.278 1.00 1.60 H new ATOM 1607 N ALA A 223 14.459 5.797 4.817 1.00 0.56 N ATOM 1608 CA ALA A 223 14.426 4.683 5.753 1.00 0.54 C ATOM 1609 C ALA A 223 15.530 3.697 5.479 1.00 0.53 C ATOM 1610 O ALA A 223 16.319 3.406 6.358 1.00 0.60 O ATOM 1611 CB ALA A 223 13.105 3.954 5.700 1.00 0.59 C ATOM 0 H ALA A 223 13.656 5.842 4.189 1.00 0.56 H new ATOM 0 HA ALA A 223 14.563 5.113 6.745 1.00 0.54 H new ATOM 0 HB1 ALA A 223 13.116 3.129 6.412 1.00 0.59 H new ATOM 0 HB2 ALA A 223 12.299 4.642 5.955 1.00 0.59 H new ATOM 0 HB3 ALA A 223 12.945 3.564 4.695 1.00 0.59 H new ATOM 1617 N ALA A 224 15.588 3.182 4.262 1.00 0.54 N ATOM 1618 CA ALA A 224 16.617 2.224 3.891 1.00 0.64 C ATOM 1619 C ALA A 224 17.976 2.878 3.894 1.00 0.74 C ATOM 1620 O ALA A 224 18.996 2.218 3.739 1.00 0.89 O ATOM 1621 CB ALA A 224 16.367 1.605 2.540 1.00 0.77 C ATOM 0 H ALA A 224 14.934 3.411 3.513 1.00 0.54 H new ATOM 0 HA ALA A 224 16.585 1.429 4.636 1.00 0.64 H new ATOM 0 HB1 ALA A 224 17.164 0.898 2.311 1.00 0.77 H new ATOM 0 HB2 ALA A 224 15.410 1.083 2.550 1.00 0.77 H new ATOM 0 HB3 ALA A 224 16.346 2.386 1.780 1.00 0.77 H new ATOM 1627 N TYR A 225 17.986 4.182 4.067 1.00 0.72 N ATOM 1628 CA TYR A 225 19.225 4.898 4.195 1.00 0.85 C ATOM 1629 C TYR A 225 19.686 4.773 5.620 1.00 0.89 C ATOM 1630 O TYR A 225 20.873 4.685 5.933 1.00 1.06 O ATOM 1631 CB TYR A 225 19.040 6.363 3.855 1.00 0.85 C ATOM 1632 CG TYR A 225 20.328 7.131 3.885 1.00 0.97 C ATOM 1633 CD1 TYR A 225 21.198 7.123 2.802 1.00 1.21 C ATOM 1634 CD2 TYR A 225 20.670 7.869 5.003 1.00 0.95 C ATOM 1635 CE1 TYR A 225 22.383 7.836 2.842 1.00 1.36 C ATOM 1636 CE2 TYR A 225 21.848 8.581 5.054 1.00 1.11 C ATOM 1637 CZ TYR A 225 22.716 8.543 3.908 1.00 1.29 C ATOM 1638 OH TYR A 225 23.880 9.271 4.030 1.00 1.47 O ATOM 0 H TYR A 225 17.149 4.762 4.121 1.00 0.72 H new ATOM 0 HA TYR A 225 19.960 4.480 3.507 1.00 0.85 H new ATOM 0 HB2 TYR A 225 18.594 6.448 2.864 1.00 0.85 H new ATOM 0 HB3 TYR A 225 18.339 6.810 4.560 1.00 0.85 H new ATOM 0 HD1 TYR A 225 20.947 6.554 1.919 1.00 1.21 H new ATOM 0 HD2 TYR A 225 20.002 7.888 5.851 1.00 0.95 H new ATOM 0 HE1 TYR A 225 23.046 7.815 1.990 1.00 1.36 H new ATOM 0 HE2 TYR A 225 22.113 9.153 5.931 1.00 1.11 H new ATOM 0 HH TYR A 225 23.902 9.709 4.907 1.00 1.47 H new ATOM 1648 N GLN A 226 18.685 4.748 6.457 1.00 0.77 N ATOM 1649 CA GLN A 226 18.828 4.670 7.879 1.00 0.84 C ATOM 1650 C GLN A 226 19.038 3.216 8.318 1.00 0.88 C ATOM 1651 O GLN A 226 19.922 2.908 9.113 1.00 0.96 O ATOM 1652 CB GLN A 226 17.554 5.251 8.484 1.00 0.81 C ATOM 1653 CG GLN A 226 16.898 4.333 9.458 1.00 1.19 C ATOM 1654 CD GLN A 226 15.598 4.874 10.021 1.00 1.90 C ATOM 1655 OE1 GLN A 226 14.878 5.623 9.360 1.00 2.75 O ATOM 1656 NE2 GLN A 226 15.290 4.499 11.251 1.00 2.24 N ATOM 0 H GLN A 226 17.712 4.783 6.152 1.00 0.77 H new ATOM 0 HA GLN A 226 19.699 5.230 8.218 1.00 0.84 H new ATOM 0 HB2 GLN A 226 17.791 6.191 8.983 1.00 0.81 H new ATOM 0 HB3 GLN A 226 16.852 5.484 7.683 1.00 0.81 H new ATOM 0 HG2 GLN A 226 16.703 3.378 8.970 1.00 1.19 H new ATOM 0 HG3 GLN A 226 17.586 4.137 10.280 1.00 1.19 H new ATOM 0 HE21 GLN A 226 15.913 3.877 11.766 1.00 2.24 H new ATOM 0 HE22 GLN A 226 14.429 4.832 11.685 1.00 2.24 H new