USER MOD reduce.3.24.130724 H: found=0, std=0, add=740, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 744 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 Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 143:sc= 1.08 (180deg=0.301) USER MOD Single : A 18 GLN : amide:sc= -0.237 K(o=-0.24,f=-8.2!) USER MOD Single : A 20 TYR OH : rot 180:sc= -0.0884 USER MOD Single : A 67 THR OG1 : rot 180:sc= -0.16 USER MOD Single : A 73 LYS NZ :NH3+ 166:sc= -0.853! (180deg=-1.69!) USER MOD Single : A 79 SER OG : rot 162:sc= 1.22 USER MOD Single : A 87 ASN : amide:sc= -0.384 K(o=-0.38,f=-7.8!) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot 108:sc= 1.09 USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 124 MET CE :methyl 125:sc= -0.725 (180deg=-1.29) USER MOD Single : A 138 MET CE :methyl -146:sc= -2.82! (180deg=-5.25!) USER MOD Single : A 141 LYS NZ :NH3+ -172:sc= 1.16 (180deg=1.11) USER MOD Single : A 144 GLN : amide:sc= -8.72! C(o=-8.7!,f=-7.9!) USER MOD ----------------------------------------------------------------- ATOM 56 N VAL A 5 2.614 6.680 9.974 1.00 1.32 N ATOM 57 CA VAL A 5 2.362 5.361 9.439 1.00 21.21 C ATOM 58 C VAL A 5 1.372 5.488 8.291 1.00 33.00 C ATOM 59 O VAL A 5 0.205 5.820 8.502 1.00 23.03 O ATOM 60 CB VAL A 5 1.802 4.412 10.519 1.00 45.23 C ATOM 61 CG1 VAL A 5 1.386 3.075 9.919 1.00 44.14 C ATOM 62 CG2 VAL A 5 2.825 4.201 11.625 1.00 5.23 C ATOM 0 HA VAL A 5 3.301 4.935 9.086 1.00 21.21 H new ATOM 0 HB VAL A 5 0.915 4.879 10.946 1.00 45.23 H new ATOM 0 HG11 VAL A 5 0.996 2.429 10.705 1.00 44.14 H new ATOM 0 HG12 VAL A 5 0.614 3.238 9.167 1.00 44.14 H new ATOM 0 HG13 VAL A 5 2.250 2.600 9.455 1.00 44.14 H new ATOM 0 HG21 VAL A 5 2.413 3.529 12.378 1.00 5.23 H new ATOM 0 HG22 VAL A 5 3.730 3.763 11.204 1.00 5.23 H new ATOM 0 HG23 VAL A 5 3.065 5.159 12.086 1.00 5.23 H new ATOM 72 N VAL A 6 1.844 5.250 7.079 1.00 73.03 N ATOM 73 CA VAL A 6 1.026 5.465 5.901 1.00 62.55 C ATOM 74 C VAL A 6 0.039 4.320 5.723 1.00 70.33 C ATOM 75 O VAL A 6 0.413 3.144 5.705 1.00 71.31 O ATOM 76 CB VAL A 6 1.884 5.656 4.621 1.00 5.14 C ATOM 77 CG1 VAL A 6 2.755 4.441 4.346 1.00 11.12 C ATOM 78 CG2 VAL A 6 1.000 5.965 3.422 1.00 14.41 C ATOM 0 H VAL A 6 2.786 4.909 6.887 1.00 73.03 H new ATOM 0 HA VAL A 6 0.469 6.389 6.054 1.00 62.55 H new ATOM 0 HB VAL A 6 2.546 6.505 4.792 1.00 5.14 H new ATOM 0 HG11 VAL A 6 3.341 4.611 3.443 1.00 11.12 H new ATOM 0 HG12 VAL A 6 3.426 4.276 5.189 1.00 11.12 H new ATOM 0 HG13 VAL A 6 2.123 3.564 4.209 1.00 11.12 H new ATOM 0 HG21 VAL A 6 1.621 6.095 2.536 1.00 14.41 H new ATOM 0 HG22 VAL A 6 0.305 5.141 3.260 1.00 14.41 H new ATOM 0 HG23 VAL A 6 0.439 6.881 3.610 1.00 14.41 H new ATOM 88 N ARG A 7 -1.232 4.675 5.649 1.00 63.53 N ATOM 89 CA ARG A 7 -2.291 3.701 5.482 1.00 4.30 C ATOM 90 C ARG A 7 -3.367 4.234 4.546 1.00 4.44 C ATOM 91 O ARG A 7 -4.075 5.185 4.862 1.00 71.34 O ATOM 92 CB ARG A 7 -2.869 3.297 6.852 1.00 43.52 C ATOM 93 CG ARG A 7 -3.070 4.460 7.814 1.00 52.33 C ATOM 94 CD ARG A 7 -4.462 5.057 7.715 1.00 42.25 C ATOM 95 NE ARG A 7 -5.452 4.269 8.447 1.00 71.40 N ATOM 96 CZ ARG A 7 -6.510 4.796 9.060 1.00 71.23 C ATOM 97 NH1 ARG A 7 -6.721 6.107 9.018 1.00 61.05 N ATOM 98 NH2 ARG A 7 -7.360 4.014 9.715 1.00 40.25 N ATOM 0 H ARG A 7 -1.555 5.641 5.703 1.00 63.53 H new ATOM 0 HA ARG A 7 -1.877 2.804 5.022 1.00 4.30 H new ATOM 0 HB2 ARG A 7 -3.826 2.799 6.697 1.00 43.52 H new ATOM 0 HB3 ARG A 7 -2.202 2.569 7.314 1.00 43.52 H new ATOM 0 HG2 ARG A 7 -2.895 4.119 8.834 1.00 52.33 H new ATOM 0 HG3 ARG A 7 -2.330 5.233 7.605 1.00 52.33 H new ATOM 0 HD2 ARG A 7 -4.448 6.074 8.106 1.00 42.25 H new ATOM 0 HD3 ARG A 7 -4.754 5.122 6.667 1.00 42.25 H new ATOM 0 HE ARG A 7 -5.325 3.258 8.491 1.00 71.40 H new ATOM 0 HH11 ARG A 7 -6.072 6.712 8.515 1.00 61.05 H new ATOM 0 HH12 ARG A 7 -7.532 6.508 9.488 1.00 61.05 H new ATOM 0 HH21 ARG A 7 -7.203 3.007 9.750 1.00 40.25 H new ATOM 0 HH22 ARG A 7 -8.170 4.421 10.184 1.00 40.25 H new ATOM 112 N ASP A 8 -3.448 3.643 3.370 1.00 45.44 N ATOM 113 CA ASP A 8 -4.483 3.987 2.412 1.00 32.20 C ATOM 114 C ASP A 8 -4.873 2.739 1.633 1.00 53.02 C ATOM 115 O ASP A 8 -4.215 1.700 1.756 1.00 64.11 O ATOM 116 CB ASP A 8 -4.007 5.096 1.465 1.00 2.54 C ATOM 117 CG ASP A 8 -5.140 5.722 0.675 1.00 31.51 C ATOM 118 OD1 ASP A 8 -5.799 6.637 1.206 1.00 60.54 O ATOM 119 OD2 ASP A 8 -5.386 5.289 -0.471 1.00 33.12 O ATOM 0 H ASP A 8 -2.805 2.917 3.053 1.00 45.44 H new ATOM 0 HA ASP A 8 -5.355 4.367 2.945 1.00 32.20 H new ATOM 0 HB2 ASP A 8 -3.503 5.870 2.044 1.00 2.54 H new ATOM 0 HB3 ASP A 8 -3.271 4.686 0.773 1.00 2.54 H new ATOM 124 N ALA A 9 -5.925 2.835 0.841 1.00 23.42 N ATOM 125 CA ALA A 9 -6.462 1.681 0.148 1.00 33.00 C ATOM 126 C ALA A 9 -6.877 2.040 -1.266 1.00 34.22 C ATOM 127 O ALA A 9 -7.723 2.910 -1.476 1.00 73.13 O ATOM 128 CB ALA A 9 -7.643 1.117 0.918 1.00 23.13 C ATOM 0 H ALA A 9 -6.426 3.705 0.662 1.00 23.42 H new ATOM 0 HA ALA A 9 -5.681 0.923 0.087 1.00 33.00 H new ATOM 0 HB1 ALA A 9 -8.041 0.250 0.390 1.00 23.13 H new ATOM 0 HB2 ALA A 9 -7.318 0.818 1.915 1.00 23.13 H new ATOM 0 HB3 ALA A 9 -8.419 1.878 1.002 1.00 23.13 H new ATOM 134 N VAL A 10 -6.277 1.371 -2.232 1.00 74.44 N ATOM 135 CA VAL A 10 -6.633 1.572 -3.623 1.00 45.31 C ATOM 136 C VAL A 10 -7.239 0.301 -4.198 1.00 45.52 C ATOM 137 O VAL A 10 -6.837 -0.810 -3.849 1.00 61.25 O ATOM 138 CB VAL A 10 -5.425 2.007 -4.481 1.00 51.55 C ATOM 139 CG1 VAL A 10 -4.982 3.417 -4.133 1.00 54.55 C ATOM 140 CG2 VAL A 10 -4.272 1.023 -4.339 1.00 31.11 C ATOM 0 H VAL A 10 -5.540 0.683 -2.078 1.00 74.44 H new ATOM 0 HA VAL A 10 -7.366 2.378 -3.653 1.00 45.31 H new ATOM 0 HB VAL A 10 -5.742 2.006 -5.524 1.00 51.55 H new ATOM 0 HG11 VAL A 10 -4.130 3.694 -4.754 1.00 54.55 H new ATOM 0 HG12 VAL A 10 -5.803 4.111 -4.313 1.00 54.55 H new ATOM 0 HG13 VAL A 10 -4.694 3.459 -3.082 1.00 54.55 H new ATOM 0 HG21 VAL A 10 -3.434 1.353 -4.953 1.00 31.11 H new ATOM 0 HG22 VAL A 10 -3.960 0.976 -3.296 1.00 31.11 H new ATOM 0 HG23 VAL A 10 -4.595 0.035 -4.666 1.00 31.11 H new ATOM 150 N THR A 11 -8.221 0.469 -5.061 1.00 61.34 N ATOM 151 CA THR A 11 -8.877 -0.657 -5.691 1.00 31.43 C ATOM 152 C THR A 11 -8.400 -0.810 -7.130 1.00 35.54 C ATOM 153 O THR A 11 -8.676 0.042 -7.978 1.00 23.44 O ATOM 154 CB THR A 11 -10.405 -0.483 -5.666 1.00 24.24 C ATOM 155 OG1 THR A 11 -10.845 -0.260 -4.320 1.00 71.40 O ATOM 156 CG2 THR A 11 -11.095 -1.709 -6.235 1.00 45.31 C ATOM 0 H THR A 11 -8.583 1.380 -5.343 1.00 61.34 H new ATOM 0 HA THR A 11 -8.619 -1.556 -5.131 1.00 31.43 H new ATOM 0 HB THR A 11 -10.666 0.378 -6.282 1.00 24.24 H new ATOM 0 HG1 THR A 11 -11.819 -0.148 -4.308 1.00 71.40 H new ATOM 0 HG21 THR A 11 -12.175 -1.564 -6.208 1.00 45.31 H new ATOM 0 HG22 THR A 11 -10.775 -1.861 -7.266 1.00 45.31 H new ATOM 0 HG23 THR A 11 -10.831 -2.584 -5.641 1.00 45.31 H new ATOM 164 N ILE A 12 -7.669 -1.883 -7.395 1.00 50.30 N ATOM 165 CA ILE A 12 -7.151 -2.138 -8.733 1.00 74.23 C ATOM 166 C ILE A 12 -8.021 -3.169 -9.439 1.00 31.13 C ATOM 167 O ILE A 12 -8.547 -4.085 -8.801 1.00 22.23 O ATOM 168 CB ILE A 12 -5.700 -2.678 -8.711 1.00 23.11 C ATOM 169 CG1 ILE A 12 -4.841 -1.973 -7.657 1.00 41.05 C ATOM 170 CG2 ILE A 12 -5.062 -2.518 -10.083 1.00 71.43 C ATOM 171 CD1 ILE A 12 -4.722 -0.482 -7.853 1.00 2.13 C ATOM 0 H ILE A 12 -7.421 -2.590 -6.703 1.00 50.30 H new ATOM 0 HA ILE A 12 -7.163 -1.183 -9.259 1.00 74.23 H new ATOM 0 HB ILE A 12 -5.750 -3.735 -8.448 1.00 23.11 H new ATOM 0 HG12 ILE A 12 -5.264 -2.166 -6.671 1.00 41.05 H new ATOM 0 HG13 ILE A 12 -3.843 -2.410 -7.666 1.00 41.05 H new ATOM 0 HG21 ILE A 12 -4.042 -2.901 -10.057 1.00 71.43 H new ATOM 0 HG22 ILE A 12 -5.640 -3.075 -10.820 1.00 71.43 H new ATOM 0 HG23 ILE A 12 -5.047 -1.463 -10.356 1.00 71.43 H new ATOM 0 HD11 ILE A 12 -4.098 -0.060 -7.065 1.00 2.13 H new ATOM 0 HD12 ILE A 12 -4.269 -0.278 -8.823 1.00 2.13 H new ATOM 0 HD13 ILE A 12 -5.713 -0.029 -7.813 1.00 2.13 H new ATOM 183 N GLY A 13 -8.166 -3.026 -10.750 1.00 21.53 N ATOM 184 CA GLY A 13 -8.883 -4.018 -11.528 1.00 0.21 C ATOM 185 C GLY A 13 -8.018 -5.225 -11.837 1.00 42.23 C ATOM 186 O GLY A 13 -7.750 -5.529 -13.001 1.00 52.54 O ATOM 0 H GLY A 13 -7.800 -2.241 -11.289 1.00 21.53 H new ATOM 0 HA2 GLY A 13 -9.770 -4.337 -10.981 1.00 0.21 H new ATOM 0 HA3 GLY A 13 -9.227 -3.570 -12.460 1.00 0.21 H new ATOM 190 N LYS A 14 -7.553 -5.894 -10.787 1.00 14.34 N ATOM 191 CA LYS A 14 -6.717 -7.080 -10.919 1.00 3.34 C ATOM 192 C LYS A 14 -7.102 -8.102 -9.858 1.00 60.34 C ATOM 193 O LYS A 14 -7.482 -7.727 -8.747 1.00 62.10 O ATOM 194 CB LYS A 14 -5.234 -6.705 -10.796 1.00 32.43 C ATOM 195 CG LYS A 14 -4.693 -5.970 -12.012 1.00 1.45 C ATOM 196 CD LYS A 14 -4.392 -6.929 -13.152 1.00 4.33 C ATOM 197 CE LYS A 14 -4.355 -6.214 -14.493 1.00 61.01 C ATOM 198 NZ LYS A 14 -5.721 -5.849 -14.961 1.00 43.24 N ATOM 0 H LYS A 14 -7.746 -5.629 -9.821 1.00 14.34 H new ATOM 0 HA LYS A 14 -6.876 -7.519 -11.904 1.00 3.34 H new ATOM 0 HB2 LYS A 14 -5.097 -6.081 -9.913 1.00 32.43 H new ATOM 0 HB3 LYS A 14 -4.650 -7.612 -10.639 1.00 32.43 H new ATOM 0 HG2 LYS A 14 -5.419 -5.227 -12.342 1.00 1.45 H new ATOM 0 HG3 LYS A 14 -3.786 -5.431 -11.739 1.00 1.45 H new ATOM 0 HD2 LYS A 14 -3.434 -7.417 -12.973 1.00 4.33 H new ATOM 0 HD3 LYS A 14 -5.149 -7.713 -13.178 1.00 4.33 H new ATOM 0 HE2 LYS A 14 -3.747 -5.314 -14.409 1.00 61.01 H new ATOM 0 HE3 LYS A 14 -3.876 -6.854 -15.234 1.00 61.01 H new ATOM 0 HZ1 LYS A 14 -5.689 -4.925 -15.438 1.00 43.24 H new ATOM 0 HZ2 LYS A 14 -6.064 -6.571 -15.627 1.00 43.24 H new ATOM 0 HZ3 LYS A 14 -6.365 -5.796 -14.146 1.00 43.24 H new ATOM 212 N PRO A 15 -7.025 -9.402 -10.195 1.00 42.35 N ATOM 213 CA PRO A 15 -7.465 -10.492 -9.307 1.00 64.41 C ATOM 214 C PRO A 15 -6.857 -10.422 -7.904 1.00 52.42 C ATOM 215 O PRO A 15 -7.594 -10.353 -6.922 1.00 21.33 O ATOM 216 CB PRO A 15 -6.984 -11.750 -10.031 1.00 32.32 C ATOM 217 CG PRO A 15 -6.927 -11.362 -11.466 1.00 21.01 C ATOM 218 CD PRO A 15 -6.524 -9.915 -11.485 1.00 52.53 C ATOM 0 HA PRO A 15 -8.541 -10.453 -9.137 1.00 64.41 H new ATOM 0 HB2 PRO A 15 -6.006 -12.067 -9.667 1.00 32.32 H new ATOM 0 HB3 PRO A 15 -7.668 -12.584 -9.873 1.00 32.32 H new ATOM 0 HG2 PRO A 15 -6.207 -11.975 -12.008 1.00 21.01 H new ATOM 0 HG3 PRO A 15 -7.894 -11.505 -11.948 1.00 21.01 H new ATOM 0 HD2 PRO A 15 -5.443 -9.800 -11.570 1.00 52.53 H new ATOM 0 HD3 PRO A 15 -6.968 -9.385 -12.328 1.00 52.53 H new ATOM 226 N ALA A 16 -5.521 -10.431 -7.817 1.00 54.21 N ATOM 227 CA ALA A 16 -4.818 -10.335 -6.529 1.00 62.04 C ATOM 228 C ALA A 16 -3.317 -10.503 -6.709 1.00 63.40 C ATOM 229 O ALA A 16 -2.525 -9.734 -6.166 1.00 60.22 O ATOM 230 CB ALA A 16 -5.323 -11.376 -5.536 1.00 43.44 C ATOM 0 H ALA A 16 -4.903 -10.504 -8.625 1.00 54.21 H new ATOM 0 HA ALA A 16 -5.024 -9.341 -6.132 1.00 62.04 H new ATOM 0 HB1 ALA A 16 -4.781 -11.275 -4.596 1.00 43.44 H new ATOM 0 HB2 ALA A 16 -6.388 -11.224 -5.359 1.00 43.44 H new ATOM 0 HB3 ALA A 16 -5.162 -12.375 -5.942 1.00 43.44 H new ATOM 236 N GLU A 17 -2.931 -11.516 -7.475 1.00 4.21 N ATOM 237 CA GLU A 17 -1.520 -11.840 -7.677 1.00 74.54 C ATOM 238 C GLU A 17 -0.773 -10.658 -8.289 1.00 74.11 C ATOM 239 O GLU A 17 0.302 -10.282 -7.826 1.00 22.44 O ATOM 240 CB GLU A 17 -1.391 -13.064 -8.581 1.00 31.23 C ATOM 241 CG GLU A 17 0.014 -13.636 -8.644 1.00 31.34 C ATOM 242 CD GLU A 17 0.106 -14.836 -9.559 1.00 33.23 C ATOM 243 OE1 GLU A 17 -0.532 -15.868 -9.257 1.00 31.41 O ATOM 244 OE2 GLU A 17 0.806 -14.747 -10.590 1.00 73.24 O ATOM 0 H GLU A 17 -3.577 -12.131 -7.970 1.00 4.21 H new ATOM 0 HA GLU A 17 -1.076 -12.061 -6.707 1.00 74.54 H new ATOM 0 HB2 GLU A 17 -2.072 -13.838 -8.228 1.00 31.23 H new ATOM 0 HB3 GLU A 17 -1.709 -12.795 -9.588 1.00 31.23 H new ATOM 0 HG2 GLU A 17 0.702 -12.865 -8.990 1.00 31.34 H new ATOM 0 HG3 GLU A 17 0.333 -13.921 -7.641 1.00 31.34 H new ATOM 251 N GLN A 18 -1.376 -10.055 -9.303 1.00 2.41 N ATOM 252 CA GLN A 18 -0.768 -8.935 -10.013 1.00 10.11 C ATOM 253 C GLN A 18 -0.655 -7.713 -9.107 1.00 62.54 C ATOM 254 O GLN A 18 0.091 -6.778 -9.398 1.00 50.32 O ATOM 255 CB GLN A 18 -1.575 -8.566 -11.264 1.00 72.10 C ATOM 256 CG GLN A 18 -1.754 -9.702 -12.261 1.00 13.02 C ATOM 257 CD GLN A 18 -2.986 -10.547 -11.986 1.00 53.14 C ATOM 258 OE1 GLN A 18 -3.419 -10.698 -10.843 1.00 53.41 O ATOM 259 NE2 GLN A 18 -3.569 -11.087 -13.039 1.00 65.51 N ATOM 0 H GLN A 18 -2.294 -10.324 -9.656 1.00 2.41 H new ATOM 0 HA GLN A 18 0.230 -9.250 -10.317 1.00 10.11 H new ATOM 0 HB2 GLN A 18 -2.559 -8.213 -10.955 1.00 72.10 H new ATOM 0 HB3 GLN A 18 -1.082 -7.734 -11.766 1.00 72.10 H new ATOM 0 HG2 GLN A 18 -1.822 -9.287 -13.267 1.00 13.02 H new ATOM 0 HG3 GLN A 18 -0.871 -10.340 -12.238 1.00 13.02 H new ATOM 0 HE21 GLN A 18 -3.179 -10.938 -13.970 1.00 65.51 H new ATOM 0 HE22 GLN A 18 -4.409 -11.653 -12.922 1.00 65.51 H new ATOM 268 N LEU A 19 -1.395 -7.725 -8.008 1.00 45.32 N ATOM 269 CA LEU A 19 -1.369 -6.622 -7.066 1.00 2.12 C ATOM 270 C LEU A 19 -0.075 -6.638 -6.274 1.00 13.31 C ATOM 271 O LEU A 19 0.560 -5.605 -6.101 1.00 45.32 O ATOM 272 CB LEU A 19 -2.582 -6.674 -6.136 1.00 64.44 C ATOM 273 CG LEU A 19 -3.932 -6.624 -6.847 1.00 74.14 C ATOM 274 CD1 LEU A 19 -5.065 -6.606 -5.842 1.00 52.22 C ATOM 275 CD2 LEU A 19 -4.009 -5.410 -7.752 1.00 11.52 C ATOM 0 H LEU A 19 -2.020 -8.488 -7.749 1.00 45.32 H new ATOM 0 HA LEU A 19 -1.418 -5.687 -7.624 1.00 2.12 H new ATOM 0 HB2 LEU A 19 -2.531 -7.589 -5.545 1.00 64.44 H new ATOM 0 HB3 LEU A 19 -2.523 -5.840 -5.437 1.00 64.44 H new ATOM 0 HG LEU A 19 -4.030 -7.521 -7.459 1.00 74.14 H new ATOM 0 HD11 LEU A 19 -6.018 -6.570 -6.369 1.00 52.22 H new ATOM 0 HD12 LEU A 19 -5.022 -7.507 -5.230 1.00 52.22 H new ATOM 0 HD13 LEU A 19 -4.971 -5.728 -5.203 1.00 52.22 H new ATOM 0 HD21 LEU A 19 -4.978 -5.389 -8.251 1.00 11.52 H new ATOM 0 HD22 LEU A 19 -3.888 -4.505 -7.157 1.00 11.52 H new ATOM 0 HD23 LEU A 19 -3.217 -5.462 -8.499 1.00 11.52 H new ATOM 287 N TYR A 20 0.320 -7.808 -5.791 1.00 51.34 N ATOM 288 CA TYR A 20 1.613 -7.937 -5.129 1.00 70.01 C ATOM 289 C TYR A 20 2.733 -7.906 -6.166 1.00 11.52 C ATOM 290 O TYR A 20 3.840 -7.443 -5.899 1.00 25.00 O ATOM 291 CB TYR A 20 1.695 -9.217 -4.294 1.00 34.34 C ATOM 292 CG TYR A 20 2.852 -9.206 -3.321 1.00 62.12 C ATOM 293 CD1 TYR A 20 2.885 -8.292 -2.275 1.00 51.12 C ATOM 294 CD2 TYR A 20 3.910 -10.096 -3.448 1.00 23.35 C ATOM 295 CE1 TYR A 20 3.937 -8.265 -1.384 1.00 73.34 C ATOM 296 CE2 TYR A 20 4.969 -10.077 -2.557 1.00 31.11 C ATOM 297 CZ TYR A 20 4.975 -9.157 -1.526 1.00 55.34 C ATOM 298 OH TYR A 20 6.022 -9.129 -0.634 1.00 52.21 O ATOM 0 H TYR A 20 -0.225 -8.669 -5.843 1.00 51.34 H new ATOM 0 HA TYR A 20 1.728 -7.094 -4.448 1.00 70.01 H new ATOM 0 HB2 TYR A 20 0.764 -9.347 -3.743 1.00 34.34 H new ATOM 0 HB3 TYR A 20 1.794 -10.074 -4.960 1.00 34.34 H new ATOM 0 HD1 TYR A 20 2.072 -7.590 -2.158 1.00 51.12 H new ATOM 0 HD2 TYR A 20 3.907 -10.814 -4.255 1.00 23.35 H new ATOM 0 HE1 TYR A 20 3.946 -7.546 -0.578 1.00 73.34 H new ATOM 0 HE2 TYR A 20 5.785 -10.776 -2.667 1.00 31.11 H new ATOM 0 HH TYR A 20 6.672 -9.823 -0.871 1.00 52.21 H new ATOM 308 N ALA A 21 2.411 -8.385 -7.364 1.00 12.23 N ATOM 309 CA ALA A 21 3.364 -8.447 -8.468 1.00 11.14 C ATOM 310 C ALA A 21 3.701 -7.061 -9.008 1.00 54.31 C ATOM 311 O ALA A 21 4.528 -6.931 -9.910 1.00 43.54 O ATOM 312 CB ALA A 21 2.816 -9.321 -9.583 1.00 60.30 C ATOM 0 H ALA A 21 1.484 -8.741 -7.597 1.00 12.23 H new ATOM 0 HA ALA A 21 4.285 -8.884 -8.082 1.00 11.14 H new ATOM 0 HB1 ALA A 21 3.535 -9.360 -10.401 1.00 60.30 H new ATOM 0 HB2 ALA A 21 2.642 -10.328 -9.204 1.00 60.30 H new ATOM 0 HB3 ALA A 21 1.877 -8.903 -9.945 1.00 60.30 H new ATOM 318 N VAL A 22 3.049 -6.039 -8.454 1.00 62.11 N ATOM 319 CA VAL A 22 3.255 -4.644 -8.858 1.00 31.14 C ATOM 320 C VAL A 22 4.738 -4.245 -8.813 1.00 60.03 C ATOM 321 O VAL A 22 5.147 -3.277 -9.451 1.00 32.45 O ATOM 322 CB VAL A 22 2.426 -3.675 -7.976 1.00 20.44 C ATOM 323 CG1 VAL A 22 2.931 -3.662 -6.542 1.00 11.23 C ATOM 324 CG2 VAL A 22 2.430 -2.270 -8.562 1.00 42.33 C ATOM 0 H VAL A 22 2.361 -6.153 -7.710 1.00 62.11 H new ATOM 0 HA VAL A 22 2.912 -4.566 -9.890 1.00 31.14 H new ATOM 0 HB VAL A 22 1.398 -4.037 -7.963 1.00 20.44 H new ATOM 0 HG11 VAL A 22 2.328 -2.973 -5.950 1.00 11.23 H new ATOM 0 HG12 VAL A 22 2.855 -4.664 -6.120 1.00 11.23 H new ATOM 0 HG13 VAL A 22 3.972 -3.340 -6.526 1.00 11.23 H new ATOM 0 HG21 VAL A 22 1.842 -1.609 -7.926 1.00 42.33 H new ATOM 0 HG22 VAL A 22 3.455 -1.902 -8.619 1.00 42.33 H new ATOM 0 HG23 VAL A 22 1.996 -2.292 -9.562 1.00 42.33 H new ATOM 334 N TRP A 23 5.538 -4.985 -8.043 1.00 14.31 N ATOM 335 CA TRP A 23 6.977 -4.745 -7.980 1.00 4.31 C ATOM 336 C TRP A 23 7.616 -4.887 -9.364 1.00 55.15 C ATOM 337 O TRP A 23 8.663 -4.298 -9.639 1.00 42.14 O ATOM 338 CB TRP A 23 7.662 -5.728 -7.022 1.00 30.40 C ATOM 339 CG TRP A 23 7.100 -5.761 -5.629 1.00 74.21 C ATOM 340 CD1 TRP A 23 7.005 -6.861 -4.827 1.00 0.24 C ATOM 341 CD2 TRP A 23 6.555 -4.668 -4.875 1.00 70.42 C ATOM 342 NE1 TRP A 23 6.453 -6.520 -3.619 1.00 2.33 N ATOM 343 CE2 TRP A 23 6.163 -5.181 -3.622 1.00 23.01 C ATOM 344 CE3 TRP A 23 6.366 -3.306 -5.131 1.00 5.02 C ATOM 345 CZ2 TRP A 23 5.591 -4.380 -2.633 1.00 34.12 C ATOM 346 CZ3 TRP A 23 5.795 -2.515 -4.150 1.00 64.20 C ATOM 347 CH2 TRP A 23 5.414 -3.054 -2.916 1.00 13.04 C ATOM 0 H TRP A 23 5.213 -5.753 -7.456 1.00 14.31 H new ATOM 0 HA TRP A 23 7.115 -3.727 -7.614 1.00 4.31 H new ATOM 0 HB2 TRP A 23 7.596 -6.730 -7.447 1.00 30.40 H new ATOM 0 HB3 TRP A 23 8.721 -5.475 -6.964 1.00 30.40 H new ATOM 0 HD1 TRP A 23 7.319 -7.857 -5.104 1.00 0.24 H new ATOM 0 HE1 TRP A 23 6.285 -7.160 -2.843 1.00 2.33 H new ATOM 0 HE3 TRP A 23 6.661 -2.879 -6.078 1.00 5.02 H new ATOM 0 HZ2 TRP A 23 5.299 -4.792 -1.679 1.00 34.12 H new ATOM 0 HZ3 TRP A 23 5.641 -1.463 -4.340 1.00 64.20 H new ATOM 0 HH2 TRP A 23 4.971 -2.409 -2.172 1.00 13.04 H new ATOM 358 N ARG A 24 6.984 -5.679 -10.224 1.00 74.15 N ATOM 359 CA ARG A 24 7.508 -5.953 -11.554 1.00 71.01 C ATOM 360 C ARG A 24 6.385 -5.894 -12.584 1.00 64.43 C ATOM 361 O ARG A 24 5.295 -5.406 -12.298 1.00 32.14 O ATOM 362 CB ARG A 24 8.180 -7.330 -11.590 1.00 34.20 C ATOM 363 CG ARG A 24 9.328 -7.478 -10.607 1.00 63.32 C ATOM 364 CD ARG A 24 9.988 -8.843 -10.716 1.00 74.21 C ATOM 365 NE ARG A 24 10.696 -9.019 -11.981 1.00 1.11 N ATOM 366 CZ ARG A 24 11.573 -9.999 -12.210 1.00 40.13 C ATOM 367 NH1 ARG A 24 11.829 -10.897 -11.265 1.00 61.42 N ATOM 368 NH2 ARG A 24 12.179 -10.087 -13.387 1.00 0.30 N ATOM 0 H ARG A 24 6.100 -6.145 -10.019 1.00 74.15 H new ATOM 0 HA ARG A 24 8.252 -5.194 -11.797 1.00 71.01 H new ATOM 0 HB2 ARG A 24 7.432 -8.094 -11.379 1.00 34.20 H new ATOM 0 HB3 ARG A 24 8.551 -7.517 -12.598 1.00 34.20 H new ATOM 0 HG2 ARG A 24 10.068 -6.700 -10.792 1.00 63.32 H new ATOM 0 HG3 ARG A 24 8.959 -7.332 -9.592 1.00 63.32 H new ATOM 0 HD2 ARG A 24 10.687 -8.972 -9.890 1.00 74.21 H new ATOM 0 HD3 ARG A 24 9.230 -9.619 -10.616 1.00 74.21 H new ATOM 0 HE ARG A 24 10.510 -8.355 -12.733 1.00 1.11 H new ATOM 0 HH11 ARG A 24 11.355 -10.838 -10.364 1.00 61.42 H new ATOM 0 HH12 ARG A 24 12.499 -11.645 -11.441 1.00 61.42 H new ATOM 0 HH21 ARG A 24 11.975 -9.405 -14.118 1.00 0.30 H new ATOM 0 HH22 ARG A 24 12.849 -10.836 -13.561 1.00 0.30 H new ATOM 382 N ASP A 25 6.648 -6.424 -13.770 1.00 41.33 N ATOM 383 CA ASP A 25 5.696 -6.367 -14.877 1.00 2.21 C ATOM 384 C ASP A 25 4.745 -7.568 -14.820 1.00 65.33 C ATOM 385 O ASP A 25 4.514 -8.228 -15.832 1.00 70.21 O ATOM 386 CB ASP A 25 6.470 -6.370 -16.200 1.00 52.15 C ATOM 387 CG ASP A 25 5.710 -5.743 -17.356 1.00 24.02 C ATOM 388 OD1 ASP A 25 4.705 -6.324 -17.817 1.00 20.21 O ATOM 389 OD2 ASP A 25 6.146 -4.672 -17.839 1.00 12.43 O ATOM 0 H ASP A 25 7.520 -6.903 -13.994 1.00 41.33 H new ATOM 0 HA ASP A 25 5.103 -5.455 -14.801 1.00 2.21 H new ATOM 0 HB2 ASP A 25 7.409 -5.835 -16.062 1.00 52.15 H new ATOM 0 HB3 ASP A 25 6.724 -7.398 -16.459 1.00 52.15 H new ATOM 394 N LEU A 26 4.212 -7.840 -13.619 1.00 20.53 N ATOM 395 CA LEU A 26 3.314 -8.984 -13.366 1.00 40.42 C ATOM 396 C LEU A 26 3.811 -10.267 -14.050 1.00 3.14 C ATOM 397 O LEU A 26 3.389 -10.600 -15.157 1.00 51.25 O ATOM 398 CB LEU A 26 1.844 -8.683 -13.739 1.00 71.11 C ATOM 399 CG LEU A 26 1.584 -8.116 -15.141 1.00 55.30 C ATOM 400 CD1 LEU A 26 0.295 -8.686 -15.707 1.00 31.50 C ATOM 401 CD2 LEU A 26 1.497 -6.596 -15.091 1.00 71.04 C ATOM 0 H LEU A 26 4.391 -7.272 -12.791 1.00 20.53 H new ATOM 0 HA LEU A 26 3.338 -9.153 -12.289 1.00 40.42 H new ATOM 0 HB2 LEU A 26 1.272 -9.605 -13.635 1.00 71.11 H new ATOM 0 HB3 LEU A 26 1.447 -7.978 -13.009 1.00 71.11 H new ATOM 0 HG LEU A 26 2.414 -8.401 -15.788 1.00 55.30 H new ATOM 0 HD11 LEU A 26 0.122 -8.276 -16.702 1.00 31.50 H new ATOM 0 HD12 LEU A 26 0.374 -9.771 -15.771 1.00 31.50 H new ATOM 0 HD13 LEU A 26 -0.537 -8.420 -15.055 1.00 31.50 H new ATOM 0 HD21 LEU A 26 1.312 -6.209 -16.093 1.00 71.04 H new ATOM 0 HD22 LEU A 26 0.681 -6.300 -14.432 1.00 71.04 H new ATOM 0 HD23 LEU A 26 2.435 -6.190 -14.713 1.00 71.04 H new ATOM 413 N PRO A 27 4.720 -10.997 -13.382 1.00 22.40 N ATOM 414 CA PRO A 27 5.393 -12.167 -13.966 1.00 44.32 C ATOM 415 C PRO A 27 4.437 -13.277 -14.401 1.00 40.24 C ATOM 416 O PRO A 27 4.443 -13.691 -15.561 1.00 12.05 O ATOM 417 CB PRO A 27 6.292 -12.666 -12.830 1.00 15.44 C ATOM 418 CG PRO A 27 6.460 -11.495 -11.928 1.00 13.12 C ATOM 419 CD PRO A 27 5.168 -10.739 -12.006 1.00 54.44 C ATOM 0 HA PRO A 27 5.923 -11.893 -14.878 1.00 44.32 H new ATOM 0 HB2 PRO A 27 5.836 -13.506 -12.306 1.00 15.44 H new ATOM 0 HB3 PRO A 27 7.253 -13.012 -13.210 1.00 15.44 H new ATOM 0 HG2 PRO A 27 6.667 -11.813 -10.906 1.00 13.12 H new ATOM 0 HG3 PRO A 27 7.298 -10.873 -12.244 1.00 13.12 H new ATOM 0 HD2 PRO A 27 4.446 -11.096 -11.272 1.00 54.44 H new ATOM 0 HD3 PRO A 27 5.311 -9.674 -11.820 1.00 54.44 H new ATOM 998 N ALA A 64 15.301 -11.696 3.665 1.00 23.24 N ATOM 999 CA ALA A 64 14.097 -11.040 4.124 1.00 41.14 C ATOM 1000 C ALA A 64 12.942 -12.024 4.082 1.00 32.10 C ATOM 1001 O ALA A 64 12.559 -12.487 3.013 1.00 40.12 O ATOM 1002 CB ALA A 64 13.797 -9.827 3.257 1.00 61.31 C ATOM 0 HA ALA A 64 14.238 -10.699 5.150 1.00 41.14 H new ATOM 0 HB1 ALA A 64 12.888 -9.341 3.612 1.00 61.31 H new ATOM 0 HB2 ALA A 64 14.629 -9.125 3.313 1.00 61.31 H new ATOM 0 HB3 ALA A 64 13.659 -10.144 2.223 1.00 61.31 H new ATOM 1008 N GLU A 65 12.406 -12.361 5.246 1.00 2.53 N ATOM 1009 CA GLU A 65 11.276 -13.273 5.313 1.00 23.21 C ATOM 1010 C GLU A 65 10.013 -12.528 5.707 1.00 21.03 C ATOM 1011 O GLU A 65 10.021 -11.749 6.656 1.00 35.24 O ATOM 1012 CB GLU A 65 11.526 -14.364 6.349 1.00 30.32 C ATOM 1013 CG GLU A 65 10.744 -15.641 6.068 1.00 52.35 C ATOM 1014 CD GLU A 65 10.596 -16.527 7.286 1.00 22.13 C ATOM 1015 OE1 GLU A 65 9.833 -16.155 8.201 1.00 34.53 O ATOM 1016 OE2 GLU A 65 11.209 -17.615 7.326 1.00 5.12 O ATOM 0 H GLU A 65 12.733 -12.019 6.150 1.00 2.53 H new ATOM 0 HA GLU A 65 11.155 -13.718 4.326 1.00 23.21 H new ATOM 0 HB2 GLU A 65 12.591 -14.595 6.376 1.00 30.32 H new ATOM 0 HB3 GLU A 65 11.256 -13.989 7.336 1.00 30.32 H new ATOM 0 HG2 GLU A 65 9.754 -15.379 5.694 1.00 52.35 H new ATOM 0 HG3 GLU A 65 11.245 -16.200 5.278 1.00 52.35 H new ATOM 1023 N LEU A 66 8.924 -12.798 5.011 1.00 34.04 N ATOM 1024 CA LEU A 66 7.639 -12.233 5.382 1.00 70.35 C ATOM 1025 C LEU A 66 7.005 -13.091 6.460 1.00 65.44 C ATOM 1026 O LEU A 66 7.053 -14.319 6.386 1.00 65.05 O ATOM 1027 CB LEU A 66 6.705 -12.114 4.171 1.00 43.35 C ATOM 1028 CG LEU A 66 7.163 -11.136 3.081 1.00 4.05 C ATOM 1029 CD1 LEU A 66 7.754 -9.880 3.701 1.00 33.32 C ATOM 1030 CD2 LEU A 66 8.159 -11.788 2.138 1.00 54.31 C ATOM 0 H LEU A 66 8.903 -13.402 4.189 1.00 34.04 H new ATOM 0 HA LEU A 66 7.802 -11.226 5.766 1.00 70.35 H new ATOM 0 HB2 LEU A 66 6.589 -13.101 3.724 1.00 43.35 H new ATOM 0 HB3 LEU A 66 5.720 -11.806 4.522 1.00 43.35 H new ATOM 0 HG LEU A 66 6.287 -10.854 2.497 1.00 4.05 H new ATOM 0 HD11 LEU A 66 8.073 -9.200 2.911 1.00 33.32 H new ATOM 0 HD12 LEU A 66 7.002 -9.391 4.320 1.00 33.32 H new ATOM 0 HD13 LEU A 66 8.612 -10.148 4.317 1.00 33.32 H new ATOM 0 HD21 LEU A 66 8.464 -11.069 1.377 1.00 54.31 H new ATOM 0 HD22 LEU A 66 9.034 -12.114 2.701 1.00 54.31 H new ATOM 0 HD23 LEU A 66 7.695 -12.650 1.658 1.00 54.31 H new ATOM 1042 N THR A 67 6.428 -12.449 7.462 1.00 42.31 N ATOM 1043 CA THR A 67 5.853 -13.172 8.591 1.00 13.44 C ATOM 1044 C THR A 67 4.639 -13.962 8.153 1.00 60.32 C ATOM 1045 O THR A 67 4.365 -15.054 8.656 1.00 24.42 O ATOM 1046 CB THR A 67 5.454 -12.218 9.723 1.00 25.22 C ATOM 1047 OG1 THR A 67 4.694 -11.124 9.202 1.00 71.11 O ATOM 1048 CG2 THR A 67 6.683 -11.693 10.420 1.00 72.33 C ATOM 0 H THR A 67 6.344 -11.434 7.520 1.00 42.31 H new ATOM 0 HA THR A 67 6.618 -13.854 8.963 1.00 13.44 H new ATOM 0 HB THR A 67 4.844 -12.768 10.440 1.00 25.22 H new ATOM 0 HG1 THR A 67 4.443 -10.522 9.934 1.00 71.11 H new ATOM 0 HG21 THR A 67 6.386 -11.017 11.222 1.00 72.33 H new ATOM 0 HG22 THR A 67 7.248 -12.526 10.839 1.00 72.33 H new ATOM 0 HG23 THR A 67 7.306 -11.156 9.704 1.00 72.33 H new ATOM 1056 N ALA A 68 3.919 -13.396 7.211 1.00 61.54 N ATOM 1057 CA ALA A 68 2.755 -14.052 6.642 1.00 72.10 C ATOM 1058 C ALA A 68 2.747 -13.916 5.134 1.00 42.03 C ATOM 1059 O ALA A 68 2.809 -12.807 4.599 1.00 53.10 O ATOM 1060 CB ALA A 68 1.473 -13.488 7.225 1.00 10.33 C ATOM 0 H ALA A 68 4.118 -12.476 6.818 1.00 61.54 H new ATOM 0 HA ALA A 68 2.812 -15.110 6.897 1.00 72.10 H new ATOM 0 HB1 ALA A 68 0.617 -13.997 6.782 1.00 10.33 H new ATOM 0 HB2 ALA A 68 1.466 -13.640 8.304 1.00 10.33 H new ATOM 0 HB3 ALA A 68 1.413 -12.421 7.008 1.00 10.33 H new ATOM 1066 N ASP A 69 2.669 -15.050 4.463 1.00 14.14 N ATOM 1067 CA ASP A 69 2.632 -15.086 3.009 1.00 45.23 C ATOM 1068 C ASP A 69 1.315 -15.686 2.548 1.00 5.13 C ATOM 1069 O ASP A 69 1.174 -16.906 2.430 1.00 71.40 O ATOM 1070 CB ASP A 69 3.814 -15.887 2.450 1.00 40.52 C ATOM 1071 CG ASP A 69 3.782 -16.018 0.936 1.00 3.45 C ATOM 1072 OD1 ASP A 69 3.384 -15.054 0.253 1.00 41.43 O ATOM 1073 OD2 ASP A 69 4.166 -17.089 0.417 1.00 11.11 O ATOM 0 H ASP A 69 2.630 -15.968 4.905 1.00 14.14 H new ATOM 0 HA ASP A 69 2.713 -14.067 2.631 1.00 45.23 H new ATOM 0 HB2 ASP A 69 4.745 -15.405 2.747 1.00 40.52 H new ATOM 0 HB3 ASP A 69 3.814 -16.882 2.895 1.00 40.52 H new ATOM 1078 N GLU A 70 0.338 -14.823 2.346 1.00 22.13 N ATOM 1079 CA GLU A 70 -0.983 -15.241 1.918 1.00 53.33 C ATOM 1080 C GLU A 70 -1.339 -14.597 0.580 1.00 64.03 C ATOM 1081 O GLU A 70 -1.933 -13.515 0.543 1.00 72.03 O ATOM 1082 CB GLU A 70 -2.031 -14.866 2.966 1.00 11.23 C ATOM 1083 CG GLU A 70 -1.920 -15.625 4.277 1.00 24.54 C ATOM 1084 CD GLU A 70 -2.921 -15.133 5.304 1.00 33.51 C ATOM 1085 OE1 GLU A 70 -4.143 -15.267 5.069 1.00 73.12 O ATOM 1086 OE2 GLU A 70 -2.494 -14.607 6.351 1.00 42.41 O ATOM 0 H GLU A 70 0.437 -13.816 2.473 1.00 22.13 H new ATOM 0 HA GLU A 70 -0.974 -16.325 1.800 1.00 53.33 H new ATOM 0 HB2 GLU A 70 -1.952 -13.799 3.172 1.00 11.23 H new ATOM 0 HB3 GLU A 70 -3.022 -15.037 2.546 1.00 11.23 H new ATOM 0 HG2 GLU A 70 -2.080 -16.688 4.095 1.00 24.54 H new ATOM 0 HG3 GLU A 70 -0.911 -15.517 4.674 1.00 24.54 H new ATOM 1093 N PRO A 71 -0.942 -15.226 -0.536 1.00 54.15 N ATOM 1094 CA PRO A 71 -1.236 -14.714 -1.879 1.00 11.50 C ATOM 1095 C PRO A 71 -2.737 -14.615 -2.132 1.00 11.12 C ATOM 1096 O PRO A 71 -3.419 -15.628 -2.288 1.00 72.31 O ATOM 1097 CB PRO A 71 -0.594 -15.748 -2.815 1.00 1.03 C ATOM 1098 CG PRO A 71 0.401 -16.467 -1.968 1.00 11.41 C ATOM 1099 CD PRO A 71 -0.176 -16.480 -0.583 1.00 21.42 C ATOM 0 HA PRO A 71 -0.851 -13.705 -2.026 1.00 11.50 H new ATOM 0 HB2 PRO A 71 -1.340 -16.434 -3.217 1.00 1.03 H new ATOM 0 HB3 PRO A 71 -0.113 -15.266 -3.666 1.00 1.03 H new ATOM 0 HG2 PRO A 71 0.565 -17.481 -2.333 1.00 11.41 H new ATOM 0 HG3 PRO A 71 1.367 -15.962 -1.985 1.00 11.41 H new ATOM 0 HD2 PRO A 71 -0.813 -17.349 -0.419 1.00 21.42 H new ATOM 0 HD3 PRO A 71 0.603 -16.507 0.179 1.00 21.42 H new ATOM 1107 N GLY A 72 -3.246 -13.389 -2.144 1.00 0.12 N ATOM 1108 CA GLY A 72 -4.668 -13.175 -2.330 1.00 44.55 C ATOM 1109 C GLY A 72 -5.378 -12.938 -1.015 1.00 41.24 C ATOM 1110 O GLY A 72 -6.603 -12.860 -0.962 1.00 53.35 O ATOM 0 H GLY A 72 -2.697 -12.537 -2.028 1.00 0.12 H new ATOM 0 HA2 GLY A 72 -4.824 -12.319 -2.986 1.00 44.55 H new ATOM 0 HA3 GLY A 72 -5.104 -14.042 -2.827 1.00 44.55 H new ATOM 1114 N LYS A 73 -4.597 -12.836 0.052 1.00 13.44 N ATOM 1115 CA LYS A 73 -5.138 -12.598 1.380 1.00 51.34 C ATOM 1116 C LYS A 73 -4.431 -11.420 2.041 1.00 34.34 C ATOM 1117 O LYS A 73 -5.039 -10.375 2.274 1.00 70.24 O ATOM 1118 CB LYS A 73 -4.987 -13.853 2.242 1.00 53.14 C ATOM 1119 CG LYS A 73 -5.852 -15.019 1.798 1.00 34.30 C ATOM 1120 CD LYS A 73 -7.303 -14.834 2.208 1.00 33.12 C ATOM 1121 CE LYS A 73 -7.553 -15.271 3.652 1.00 61.13 C ATOM 1122 NZ LYS A 73 -6.741 -14.510 4.643 1.00 55.43 N ATOM 0 H LYS A 73 -3.581 -12.915 0.021 1.00 13.44 H new ATOM 0 HA LYS A 73 -6.197 -12.358 1.286 1.00 51.34 H new ATOM 0 HB2 LYS A 73 -3.943 -14.165 2.231 1.00 53.14 H new ATOM 0 HB3 LYS A 73 -5.234 -13.604 3.274 1.00 53.14 H new ATOM 0 HG2 LYS A 73 -5.791 -15.125 0.715 1.00 34.30 H new ATOM 0 HG3 LYS A 73 -5.467 -15.942 2.231 1.00 34.30 H new ATOM 0 HD2 LYS A 73 -7.581 -13.786 2.094 1.00 33.12 H new ATOM 0 HD3 LYS A 73 -7.944 -15.409 1.540 1.00 33.12 H new ATOM 0 HE2 LYS A 73 -8.610 -15.146 3.885 1.00 61.13 H new ATOM 0 HE3 LYS A 73 -7.329 -16.334 3.747 1.00 61.13 H new ATOM 0 HZ1 LYS A 73 -7.116 -14.675 5.599 1.00 55.43 H new ATOM 0 HZ2 LYS A 73 -5.752 -14.828 4.599 1.00 55.43 H new ATOM 0 HZ3 LYS A 73 -6.788 -13.495 4.424 1.00 55.43 H new ATOM 1136 N ARG A 74 -3.145 -11.592 2.332 1.00 42.11 N ATOM 1137 CA ARG A 74 -2.348 -10.542 2.956 1.00 13.03 C ATOM 1138 C ARG A 74 -0.864 -10.895 2.912 1.00 64.34 C ATOM 1139 O ARG A 74 -0.496 -12.069 2.916 1.00 55.13 O ATOM 1140 CB ARG A 74 -2.768 -10.324 4.416 1.00 53.33 C ATOM 1141 CG ARG A 74 -2.411 -11.484 5.327 1.00 75.31 C ATOM 1142 CD ARG A 74 -2.624 -11.145 6.791 1.00 12.11 C ATOM 1143 NE ARG A 74 -2.170 -12.228 7.658 1.00 31.41 N ATOM 1144 CZ ARG A 74 -1.726 -12.057 8.906 1.00 63.32 C ATOM 1145 NH1 ARG A 74 -1.740 -10.851 9.465 1.00 53.31 N ATOM 1146 NH2 ARG A 74 -1.282 -13.098 9.596 1.00 74.24 N ATOM 0 H ARG A 74 -2.631 -12.453 2.144 1.00 42.11 H new ATOM 0 HA ARG A 74 -2.521 -9.624 2.395 1.00 13.03 H new ATOM 0 HB2 ARG A 74 -2.293 -9.418 4.791 1.00 53.33 H new ATOM 0 HB3 ARG A 74 -3.845 -10.159 4.456 1.00 53.33 H new ATOM 0 HG2 ARG A 74 -3.017 -12.351 5.064 1.00 75.31 H new ATOM 0 HG3 ARG A 74 -1.369 -11.763 5.167 1.00 75.31 H new ATOM 0 HD2 ARG A 74 -2.085 -10.230 7.037 1.00 12.11 H new ATOM 0 HD3 ARG A 74 -3.681 -10.951 6.971 1.00 12.11 H new ATOM 0 HE ARG A 74 -2.193 -13.178 7.286 1.00 31.41 H new ATOM 0 HH11 ARG A 74 -2.091 -10.050 8.940 1.00 53.31 H new ATOM 0 HH12 ARG A 74 -1.400 -10.727 10.418 1.00 53.31 H new ATOM 0 HH21 ARG A 74 -1.280 -14.026 9.174 1.00 74.24 H new ATOM 0 HH22 ARG A 74 -0.942 -12.971 10.549 1.00 74.24 H new ATOM 1160 N ILE A 75 -0.023 -9.876 2.854 1.00 71.15 N ATOM 1161 CA ILE A 75 1.418 -10.060 2.956 1.00 5.35 C ATOM 1162 C ILE A 75 1.971 -9.192 4.081 1.00 72.43 C ATOM 1163 O ILE A 75 1.914 -7.964 4.018 1.00 52.31 O ATOM 1164 CB ILE A 75 2.173 -9.739 1.635 1.00 54.40 C ATOM 1165 CG1 ILE A 75 1.831 -10.750 0.530 1.00 21.14 C ATOM 1166 CG2 ILE A 75 3.679 -9.727 1.875 1.00 74.04 C ATOM 1167 CD1 ILE A 75 0.491 -10.522 -0.137 1.00 14.21 C ATOM 0 H ILE A 75 -0.315 -8.906 2.736 1.00 71.15 H new ATOM 0 HA ILE A 75 1.583 -11.116 3.169 1.00 5.35 H new ATOM 0 HB ILE A 75 1.851 -8.752 1.304 1.00 54.40 H new ATOM 0 HG12 ILE A 75 2.611 -10.716 -0.230 1.00 21.14 H new ATOM 0 HG13 ILE A 75 1.845 -11.753 0.956 1.00 21.14 H new ATOM 0 HG21 ILE A 75 4.194 -9.501 0.942 1.00 74.04 H new ATOM 0 HG22 ILE A 75 3.923 -8.967 2.617 1.00 74.04 H new ATOM 0 HG23 ILE A 75 3.997 -10.704 2.238 1.00 74.04 H new ATOM 0 HD11 ILE A 75 0.332 -11.281 -0.903 1.00 14.21 H new ATOM 0 HD12 ILE A 75 -0.302 -10.587 0.608 1.00 14.21 H new ATOM 0 HD13 ILE A 75 0.477 -9.534 -0.597 1.00 14.21 H new ATOM 1179 N ALA A 76 2.479 -9.838 5.118 1.00 74.21 N ATOM 1180 CA ALA A 76 3.029 -9.132 6.264 1.00 34.34 C ATOM 1181 C ALA A 76 4.551 -9.116 6.199 1.00 52.41 C ATOM 1182 O ALA A 76 5.190 -10.169 6.171 1.00 64.13 O ATOM 1183 CB ALA A 76 2.545 -9.770 7.554 1.00 11.12 C ATOM 0 H ALA A 76 2.522 -10.855 5.190 1.00 74.21 H new ATOM 0 HA ALA A 76 2.681 -8.099 6.242 1.00 34.34 H new ATOM 0 HB1 ALA A 76 2.964 -9.233 8.405 1.00 11.12 H new ATOM 0 HB2 ALA A 76 1.457 -9.725 7.596 1.00 11.12 H new ATOM 0 HB3 ALA A 76 2.867 -10.811 7.588 1.00 11.12 H new ATOM 1189 N TRP A 77 5.122 -7.920 6.176 1.00 35.52 N ATOM 1190 CA TRP A 77 6.554 -7.759 5.963 1.00 22.44 C ATOM 1191 C TRP A 77 7.374 -7.998 7.225 1.00 12.44 C ATOM 1192 O TRP A 77 6.884 -7.858 8.348 1.00 20.20 O ATOM 1193 CB TRP A 77 6.862 -6.370 5.395 1.00 53.31 C ATOM 1194 CG TRP A 77 6.587 -6.241 3.925 1.00 1.52 C ATOM 1195 CD1 TRP A 77 5.787 -7.042 3.163 1.00 65.22 C ATOM 1196 CD2 TRP A 77 7.118 -5.246 3.039 1.00 34.34 C ATOM 1197 NE1 TRP A 77 5.798 -6.617 1.858 1.00 14.01 N ATOM 1198 CE2 TRP A 77 6.603 -5.512 1.756 1.00 72.22 C ATOM 1199 CE3 TRP A 77 7.979 -4.157 3.208 1.00 52.41 C ATOM 1200 CZ2 TRP A 77 6.923 -4.728 0.650 1.00 13.44 C ATOM 1201 CZ3 TRP A 77 8.294 -3.379 2.110 1.00 11.11 C ATOM 1202 CH2 TRP A 77 7.767 -3.667 0.845 1.00 64.11 C ATOM 0 H TRP A 77 4.614 -7.044 6.303 1.00 35.52 H new ATOM 0 HA TRP A 77 6.845 -8.523 5.242 1.00 22.44 H new ATOM 0 HB2 TRP A 77 6.270 -5.629 5.932 1.00 53.31 H new ATOM 0 HB3 TRP A 77 7.910 -6.136 5.581 1.00 53.31 H new ATOM 0 HD1 TRP A 77 5.226 -7.888 3.533 1.00 65.22 H new ATOM 0 HE1 TRP A 77 5.290 -7.053 1.089 1.00 14.01 H new ATOM 0 HE3 TRP A 77 8.391 -3.928 4.180 1.00 52.41 H new ATOM 0 HZ2 TRP A 77 6.520 -4.949 -0.327 1.00 13.44 H new ATOM 0 HZ3 TRP A 77 8.957 -2.535 2.230 1.00 11.11 H new ATOM 0 HH2 TRP A 77 8.031 -3.040 0.006 1.00 64.11 H new ATOM 1213 N ARG A 78 8.632 -8.367 7.001 1.00 30.11 N ATOM 1214 CA ARG A 78 9.588 -8.659 8.057 1.00 54.45 C ATOM 1215 C ARG A 78 10.943 -8.963 7.407 1.00 2.42 C ATOM 1216 O ARG A 78 11.041 -9.025 6.181 1.00 34.51 O ATOM 1217 CB ARG A 78 9.109 -9.852 8.904 1.00 42.02 C ATOM 1218 CG ARG A 78 9.992 -10.179 10.102 1.00 32.21 C ATOM 1219 CD ARG A 78 9.932 -9.095 11.172 1.00 41.24 C ATOM 1220 NE ARG A 78 8.665 -9.105 11.902 1.00 11.31 N ATOM 1221 CZ ARG A 78 8.284 -8.155 12.758 1.00 41.32 C ATOM 1222 NH1 ARG A 78 9.081 -7.124 13.023 1.00 24.51 N ATOM 1223 NH2 ARG A 78 7.115 -8.254 13.374 1.00 15.21 N ATOM 0 H ARG A 78 9.019 -8.472 6.063 1.00 30.11 H new ATOM 0 HA ARG A 78 9.682 -7.801 8.723 1.00 54.45 H new ATOM 0 HB2 ARG A 78 8.100 -9.645 9.260 1.00 42.02 H new ATOM 0 HB3 ARG A 78 9.047 -10.732 8.264 1.00 42.02 H new ATOM 0 HG2 ARG A 78 9.680 -11.130 10.533 1.00 32.21 H new ATOM 0 HG3 ARG A 78 11.023 -10.302 9.769 1.00 32.21 H new ATOM 0 HD2 ARG A 78 10.754 -9.235 11.874 1.00 41.24 H new ATOM 0 HD3 ARG A 78 10.073 -8.120 10.706 1.00 41.24 H new ATOM 0 HE ARG A 78 8.031 -9.889 11.747 1.00 11.31 H new ATOM 0 HH11 ARG A 78 9.992 -7.054 12.570 1.00 24.51 H new ATOM 0 HH12 ARG A 78 8.781 -6.403 13.679 1.00 24.51 H new ATOM 0 HH21 ARG A 78 6.509 -9.055 13.193 1.00 15.21 H new ATOM 0 HH22 ARG A 78 6.821 -7.530 14.029 1.00 15.21 H new ATOM 1237 N SER A 79 11.968 -9.146 8.220 1.00 51.04 N ATOM 1238 CA SER A 79 13.304 -9.447 7.751 1.00 54.51 C ATOM 1239 C SER A 79 13.984 -10.314 8.796 1.00 2.41 C ATOM 1240 O SER A 79 13.720 -10.153 9.990 1.00 70.42 O ATOM 1241 CB SER A 79 14.105 -8.159 7.537 1.00 31.12 C ATOM 1242 OG SER A 79 13.436 -7.267 6.658 1.00 63.41 O ATOM 0 H SER A 79 11.893 -9.089 9.236 1.00 51.04 H new ATOM 0 HA SER A 79 13.252 -9.970 6.796 1.00 54.51 H new ATOM 0 HB2 SER A 79 14.270 -7.669 8.497 1.00 31.12 H new ATOM 0 HB3 SER A 79 15.086 -8.404 7.130 1.00 31.12 H new ATOM 0 HG SER A 79 13.811 -6.367 6.757 1.00 63.41 H new ATOM 1248 N LEU A 80 14.830 -11.235 8.367 1.00 25.13 N ATOM 1249 CA LEU A 80 15.531 -12.097 9.305 1.00 14.04 C ATOM 1250 C LEU A 80 16.592 -11.297 10.052 1.00 22.14 C ATOM 1251 O LEU A 80 17.104 -10.307 9.528 1.00 75.44 O ATOM 1252 CB LEU A 80 16.148 -13.291 8.570 1.00 62.32 C ATOM 1253 CG LEU A 80 15.134 -14.205 7.876 1.00 11.31 C ATOM 1254 CD1 LEU A 80 15.837 -15.348 7.177 1.00 1.21 C ATOM 1255 CD2 LEU A 80 14.121 -14.744 8.870 1.00 23.24 C ATOM 0 H LEU A 80 15.047 -11.405 7.385 1.00 25.13 H new ATOM 0 HA LEU A 80 14.822 -12.486 10.035 1.00 14.04 H new ATOM 0 HB2 LEU A 80 16.851 -12.919 7.825 1.00 62.32 H new ATOM 0 HB3 LEU A 80 16.722 -13.883 9.283 1.00 62.32 H new ATOM 0 HG LEU A 80 14.604 -13.612 7.131 1.00 11.31 H new ATOM 0 HD11 LEU A 80 15.099 -15.986 6.690 1.00 1.21 H new ATOM 0 HD12 LEU A 80 16.523 -14.950 6.429 1.00 1.21 H new ATOM 0 HD13 LEU A 80 16.396 -15.933 7.908 1.00 1.21 H new ATOM 0 HD21 LEU A 80 13.412 -15.390 8.353 1.00 23.24 H new ATOM 0 HD22 LEU A 80 14.637 -15.316 9.641 1.00 23.24 H new ATOM 0 HD23 LEU A 80 13.586 -13.914 9.331 1.00 23.24 H new ATOM 1267 N PRO A 81 16.926 -11.709 11.288 1.00 72.44 N ATOM 1268 CA PRO A 81 17.857 -10.972 12.164 1.00 33.42 C ATOM 1269 C PRO A 81 19.196 -10.642 11.507 1.00 21.41 C ATOM 1270 O PRO A 81 19.874 -9.700 11.911 1.00 10.43 O ATOM 1271 CB PRO A 81 18.065 -11.929 13.337 1.00 55.31 C ATOM 1272 CG PRO A 81 16.819 -12.739 13.381 1.00 52.12 C ATOM 1273 CD PRO A 81 16.401 -12.919 11.950 1.00 44.51 C ATOM 0 HA PRO A 81 17.449 -9.999 12.438 1.00 33.42 H new ATOM 0 HB2 PRO A 81 18.942 -12.558 13.186 1.00 55.31 H new ATOM 0 HB3 PRO A 81 18.219 -11.386 14.270 1.00 55.31 H new ATOM 0 HG2 PRO A 81 16.994 -13.701 13.862 1.00 52.12 H new ATOM 0 HG3 PRO A 81 16.043 -12.233 13.955 1.00 52.12 H new ATOM 0 HD2 PRO A 81 16.822 -13.828 11.519 1.00 44.51 H new ATOM 0 HD3 PRO A 81 15.318 -12.992 11.854 1.00 44.51 H new ATOM 1281 N GLY A 82 19.568 -11.409 10.490 1.00 3.30 N ATOM 1282 CA GLY A 82 20.832 -11.184 9.812 1.00 62.33 C ATOM 1283 C GLY A 82 20.782 -10.022 8.832 1.00 44.14 C ATOM 1284 O GLY A 82 21.797 -9.664 8.236 1.00 33.13 O ATOM 0 H GLY A 82 19.017 -12.184 10.121 1.00 3.30 H new ATOM 0 HA2 GLY A 82 21.607 -10.993 10.554 1.00 62.33 H new ATOM 0 HA3 GLY A 82 21.118 -12.090 9.278 1.00 62.33 H new ATOM 1288 N ALA A 83 19.603 -9.433 8.660 1.00 45.51 N ATOM 1289 CA ALA A 83 19.442 -8.300 7.759 1.00 4.04 C ATOM 1290 C ALA A 83 19.615 -6.982 8.505 1.00 60.23 C ATOM 1291 O ALA A 83 20.012 -6.962 9.670 1.00 22.12 O ATOM 1292 CB ALA A 83 18.086 -8.343 7.072 1.00 52.51 C ATOM 0 H ALA A 83 18.747 -9.722 9.133 1.00 45.51 H new ATOM 0 HA ALA A 83 20.218 -8.368 6.996 1.00 4.04 H new ATOM 0 HB1 ALA A 83 17.989 -7.487 6.404 1.00 52.51 H new ATOM 0 HB2 ALA A 83 17.999 -9.264 6.496 1.00 52.51 H new ATOM 0 HB3 ALA A 83 17.297 -8.309 7.823 1.00 52.51 H new ATOM 1298 N ARG A 84 19.303 -5.885 7.829 1.00 20.23 N ATOM 1299 CA ARG A 84 19.570 -4.557 8.367 1.00 51.43 C ATOM 1300 C ARG A 84 18.291 -3.751 8.566 1.00 4.10 C ATOM 1301 O ARG A 84 18.162 -3.013 9.541 1.00 32.54 O ATOM 1302 CB ARG A 84 20.517 -3.820 7.428 1.00 15.44 C ATOM 1303 CG ARG A 84 21.850 -4.522 7.268 1.00 63.13 C ATOM 1304 CD ARG A 84 22.629 -3.990 6.082 1.00 31.34 C ATOM 1305 NE ARG A 84 23.994 -4.506 6.071 1.00 70.01 N ATOM 1306 CZ ARG A 84 24.763 -4.585 4.987 1.00 51.34 C ATOM 1307 NH1 ARG A 84 24.311 -4.187 3.802 1.00 24.20 N ATOM 1308 NH2 ARG A 84 25.991 -5.073 5.096 1.00 2.51 N ATOM 0 H ARG A 84 18.865 -5.888 6.908 1.00 20.23 H new ATOM 0 HA ARG A 84 20.030 -4.673 9.348 1.00 51.43 H new ATOM 0 HB2 ARG A 84 20.046 -3.718 6.450 1.00 15.44 H new ATOM 0 HB3 ARG A 84 20.686 -2.812 7.807 1.00 15.44 H new ATOM 0 HG2 ARG A 84 22.439 -4.394 8.176 1.00 63.13 H new ATOM 0 HG3 ARG A 84 21.684 -5.592 7.143 1.00 63.13 H new ATOM 0 HD2 ARG A 84 22.124 -4.270 5.157 1.00 31.34 H new ATOM 0 HD3 ARG A 84 22.650 -2.901 6.117 1.00 31.34 H new ATOM 0 HE ARG A 84 24.386 -4.829 6.956 1.00 70.01 H new ATOM 0 HH11 ARG A 84 23.365 -3.816 3.715 1.00 24.20 H new ATOM 0 HH12 ARG A 84 24.910 -4.253 2.979 1.00 24.20 H new ATOM 0 HH21 ARG A 84 26.338 -5.383 6.004 1.00 2.51 H new ATOM 0 HH22 ARG A 84 26.589 -5.138 4.272 1.00 2.51 H new ATOM 1322 N ILE A 85 17.350 -3.882 7.641 1.00 5.13 N ATOM 1323 CA ILE A 85 16.109 -3.122 7.722 1.00 63.53 C ATOM 1324 C ILE A 85 14.907 -4.056 7.765 1.00 2.31 C ATOM 1325 O ILE A 85 14.730 -4.893 6.879 1.00 61.42 O ATOM 1326 CB ILE A 85 15.934 -2.140 6.531 1.00 32.21 C ATOM 1327 CG1 ILE A 85 17.055 -1.088 6.498 1.00 11.15 C ATOM 1328 CG2 ILE A 85 14.575 -1.451 6.595 1.00 24.43 C ATOM 1329 CD1 ILE A 85 18.320 -1.550 5.804 1.00 12.44 C ATOM 0 H ILE A 85 17.420 -4.501 6.833 1.00 5.13 H new ATOM 0 HA ILE A 85 16.167 -2.540 8.642 1.00 63.53 H new ATOM 0 HB ILE A 85 15.992 -2.727 5.614 1.00 32.21 H new ATOM 0 HG12 ILE A 85 16.684 -0.194 5.996 1.00 11.15 H new ATOM 0 HG13 ILE A 85 17.299 -0.801 7.521 1.00 11.15 H new ATOM 0 HG21 ILE A 85 14.473 -0.768 5.752 1.00 24.43 H new ATOM 0 HG22 ILE A 85 13.785 -2.200 6.552 1.00 24.43 H new ATOM 0 HG23 ILE A 85 14.494 -0.892 7.527 1.00 24.43 H new ATOM 0 HD11 ILE A 85 19.059 -0.749 5.825 1.00 12.44 H new ATOM 0 HD12 ILE A 85 18.718 -2.425 6.318 1.00 12.44 H new ATOM 0 HD13 ILE A 85 18.094 -1.808 4.769 1.00 12.44 H new ATOM 1341 N GLU A 86 14.104 -3.927 8.809 1.00 74.22 N ATOM 1342 CA GLU A 86 12.840 -4.633 8.892 1.00 72.11 C ATOM 1343 C GLU A 86 11.714 -3.635 9.150 1.00 70.43 C ATOM 1344 O GLU A 86 11.756 -2.866 10.113 1.00 73.55 O ATOM 1345 CB GLU A 86 12.869 -5.706 9.989 1.00 1.04 C ATOM 1346 CG GLU A 86 13.110 -5.162 11.388 1.00 62.14 C ATOM 1347 CD GLU A 86 12.918 -6.209 12.463 1.00 2.01 C ATOM 1348 OE1 GLU A 86 11.755 -6.578 12.738 1.00 74.23 O ATOM 1349 OE2 GLU A 86 13.921 -6.656 13.052 1.00 24.54 O ATOM 0 H GLU A 86 14.309 -3.336 9.614 1.00 74.22 H new ATOM 0 HA GLU A 86 12.664 -5.140 7.943 1.00 72.11 H new ATOM 0 HB2 GLU A 86 11.922 -6.245 9.979 1.00 1.04 H new ATOM 0 HB3 GLU A 86 13.650 -6.429 9.753 1.00 1.04 H new ATOM 0 HG2 GLU A 86 14.124 -4.766 11.450 1.00 62.14 H new ATOM 0 HG3 GLU A 86 12.431 -4.330 11.572 1.00 62.14 H new ATOM 1356 N ASN A 87 10.726 -3.624 8.276 1.00 24.34 N ATOM 1357 CA ASN A 87 9.584 -2.735 8.441 1.00 21.42 C ATOM 1358 C ASN A 87 8.350 -3.566 8.754 1.00 20.11 C ATOM 1359 O ASN A 87 8.150 -4.630 8.171 1.00 12.24 O ATOM 1360 CB ASN A 87 9.361 -1.895 7.173 1.00 74.14 C ATOM 1361 CG ASN A 87 8.445 -0.694 7.397 1.00 72.21 C ATOM 1362 OD1 ASN A 87 7.554 -0.714 8.242 1.00 50.21 O ATOM 1363 ND2 ASN A 87 8.662 0.365 6.630 1.00 65.34 N ATOM 0 H ASN A 87 10.687 -4.217 7.447 1.00 24.34 H new ATOM 0 HA ASN A 87 9.778 -2.048 9.265 1.00 21.42 H new ATOM 0 HB2 ASN A 87 10.325 -1.544 6.804 1.00 74.14 H new ATOM 0 HB3 ASN A 87 8.934 -2.529 6.396 1.00 74.14 H new ATOM 0 HD21 ASN A 87 8.080 1.197 6.732 1.00 65.34 H new ATOM 0 HD22 ASN A 87 9.411 0.348 5.938 1.00 65.34 H new ATOM 1370 N SER A 88 7.537 -3.093 9.681 1.00 34.45 N ATOM 1371 CA SER A 88 6.341 -3.814 10.060 1.00 4.31 C ATOM 1372 C SER A 88 5.146 -3.265 9.292 1.00 34.50 C ATOM 1373 O SER A 88 4.902 -2.055 9.279 1.00 4.44 O ATOM 1374 CB SER A 88 6.103 -3.702 11.569 1.00 2.13 C ATOM 1375 OG SER A 88 7.201 -4.227 12.303 1.00 14.55 O ATOM 0 H SER A 88 7.684 -2.217 10.182 1.00 34.45 H new ATOM 0 HA SER A 88 6.469 -4.868 9.812 1.00 4.31 H new ATOM 0 HB2 SER A 88 5.948 -2.657 11.839 1.00 2.13 H new ATOM 0 HB3 SER A 88 5.193 -4.239 11.837 1.00 2.13 H new ATOM 0 HG SER A 88 7.024 -4.141 13.263 1.00 14.55 H new ATOM 1381 N GLY A 89 4.412 -4.157 8.655 1.00 0.34 N ATOM 1382 CA GLY A 89 3.278 -3.749 7.865 1.00 30.11 C ATOM 1383 C GLY A 89 2.743 -4.880 7.023 1.00 13.14 C ATOM 1384 O GLY A 89 3.479 -5.491 6.249 1.00 60.01 O ATOM 0 H GLY A 89 4.583 -5.162 8.672 1.00 0.34 H new ATOM 0 HA2 GLY A 89 2.490 -3.382 8.523 1.00 30.11 H new ATOM 0 HA3 GLY A 89 3.565 -2.920 7.219 1.00 30.11 H new ATOM 1388 N GLU A 90 1.470 -5.177 7.190 1.00 14.30 N ATOM 1389 CA GLU A 90 0.825 -6.218 6.420 1.00 74.30 C ATOM 1390 C GLU A 90 -0.146 -5.608 5.415 1.00 50.13 C ATOM 1391 O GLU A 90 -1.007 -4.804 5.775 1.00 3.25 O ATOM 1392 CB GLU A 90 0.098 -7.217 7.340 1.00 54.30 C ATOM 1393 CG GLU A 90 -0.937 -6.598 8.276 1.00 53.52 C ATOM 1394 CD GLU A 90 -0.323 -5.815 9.422 1.00 75.12 C ATOM 1395 OE1 GLU A 90 -0.044 -6.421 10.476 1.00 0.34 O ATOM 1396 OE2 GLU A 90 -0.128 -4.587 9.281 1.00 22.02 O ATOM 0 H GLU A 90 0.859 -4.707 7.858 1.00 14.30 H new ATOM 0 HA GLU A 90 1.594 -6.765 5.874 1.00 74.30 H new ATOM 0 HB2 GLU A 90 -0.396 -7.965 6.720 1.00 54.30 H new ATOM 0 HB3 GLU A 90 0.841 -7.741 7.941 1.00 54.30 H new ATOM 0 HG2 GLU A 90 -1.586 -5.937 7.701 1.00 53.52 H new ATOM 0 HG3 GLU A 90 -1.567 -7.389 8.683 1.00 53.52 H new ATOM 1403 N VAL A 91 0.012 -5.967 4.151 1.00 33.41 N ATOM 1404 CA VAL A 91 -0.900 -5.501 3.120 1.00 51.22 C ATOM 1405 C VAL A 91 -1.945 -6.573 2.845 1.00 1.44 C ATOM 1406 O VAL A 91 -1.615 -7.734 2.621 1.00 3.33 O ATOM 1407 CB VAL A 91 -0.166 -5.114 1.810 1.00 52.32 C ATOM 1408 CG1 VAL A 91 1.016 -4.221 2.115 1.00 21.50 C ATOM 1409 CG2 VAL A 91 0.290 -6.331 1.023 1.00 2.21 C ATOM 0 H VAL A 91 0.759 -6.576 3.816 1.00 33.41 H new ATOM 0 HA VAL A 91 -1.383 -4.596 3.489 1.00 51.22 H new ATOM 0 HB VAL A 91 -0.881 -4.573 1.189 1.00 52.32 H new ATOM 0 HG11 VAL A 91 1.522 -3.957 1.186 1.00 21.50 H new ATOM 0 HG12 VAL A 91 0.669 -3.314 2.609 1.00 21.50 H new ATOM 0 HG13 VAL A 91 1.711 -4.748 2.770 1.00 21.50 H new ATOM 0 HG21 VAL A 91 0.798 -6.007 0.115 1.00 2.21 H new ATOM 0 HG22 VAL A 91 0.975 -6.922 1.631 1.00 2.21 H new ATOM 0 HG23 VAL A 91 -0.576 -6.938 0.758 1.00 2.21 H new ATOM 1419 N LEU A 92 -3.201 -6.197 2.918 1.00 0.22 N ATOM 1420 CA LEU A 92 -4.283 -7.145 2.723 1.00 52.55 C ATOM 1421 C LEU A 92 -4.932 -6.953 1.366 1.00 14.20 C ATOM 1422 O LEU A 92 -5.132 -5.821 0.918 1.00 65.24 O ATOM 1423 CB LEU A 92 -5.342 -6.994 3.821 1.00 43.31 C ATOM 1424 CG LEU A 92 -5.009 -7.614 5.185 1.00 10.23 C ATOM 1425 CD1 LEU A 92 -3.739 -7.025 5.784 1.00 53.30 C ATOM 1426 CD2 LEU A 92 -6.171 -7.407 6.135 1.00 32.10 C ATOM 0 H LEU A 92 -3.503 -5.242 3.111 1.00 0.22 H new ATOM 0 HA LEU A 92 -3.857 -8.147 2.774 1.00 52.55 H new ATOM 0 HB2 LEU A 92 -5.532 -5.931 3.967 1.00 43.31 H new ATOM 0 HB3 LEU A 92 -6.271 -7.438 3.462 1.00 43.31 H new ATOM 0 HG LEU A 92 -4.837 -8.680 5.034 1.00 10.23 H new ATOM 0 HD11 LEU A 92 -3.541 -7.492 6.749 1.00 53.30 H new ATOM 0 HD12 LEU A 92 -2.900 -7.210 5.113 1.00 53.30 H new ATOM 0 HD13 LEU A 92 -3.865 -5.951 5.920 1.00 53.30 H new ATOM 0 HD21 LEU A 92 -5.933 -7.848 7.103 1.00 32.10 H new ATOM 0 HD22 LEU A 92 -6.355 -6.340 6.258 1.00 32.10 H new ATOM 0 HD23 LEU A 92 -7.063 -7.884 5.729 1.00 32.10 H new ATOM 1438 N PHE A 93 -5.247 -8.059 0.716 1.00 12.33 N ATOM 1439 CA PHE A 93 -6.021 -8.024 -0.509 1.00 22.11 C ATOM 1440 C PHE A 93 -7.464 -8.353 -0.175 1.00 3.14 C ATOM 1441 O PHE A 93 -7.808 -9.496 0.120 1.00 55.21 O ATOM 1442 CB PHE A 93 -5.457 -8.999 -1.544 1.00 40.14 C ATOM 1443 CG PHE A 93 -4.061 -8.656 -1.977 1.00 62.54 C ATOM 1444 CD1 PHE A 93 -3.729 -7.353 -2.320 1.00 41.31 C ATOM 1445 CD2 PHE A 93 -3.081 -9.630 -2.038 1.00 21.23 C ATOM 1446 CE1 PHE A 93 -2.445 -7.032 -2.713 1.00 34.14 C ATOM 1447 CE2 PHE A 93 -1.795 -9.315 -2.433 1.00 15.41 C ATOM 1448 CZ PHE A 93 -1.476 -8.013 -2.769 1.00 35.45 C ATOM 0 H PHE A 93 -4.977 -8.995 1.018 1.00 12.33 H new ATOM 0 HA PHE A 93 -5.966 -7.028 -0.950 1.00 22.11 H new ATOM 0 HB2 PHE A 93 -5.465 -10.006 -1.127 1.00 40.14 H new ATOM 0 HB3 PHE A 93 -6.109 -9.010 -2.417 1.00 40.14 H new ATOM 0 HD1 PHE A 93 -4.484 -6.581 -2.279 1.00 41.31 H new ATOM 0 HD2 PHE A 93 -3.324 -10.649 -1.774 1.00 21.23 H new ATOM 0 HE1 PHE A 93 -2.199 -6.014 -2.976 1.00 34.14 H new ATOM 0 HE2 PHE A 93 -1.040 -10.086 -2.479 1.00 15.41 H new ATOM 0 HZ PHE A 93 -0.471 -7.764 -3.075 1.00 35.45 H new ATOM 1458 N ARG A 94 -8.292 -7.331 -0.193 1.00 61.25 N ATOM 1459 CA ARG A 94 -9.661 -7.442 0.275 1.00 62.34 C ATOM 1460 C ARG A 94 -10.645 -7.290 -0.872 1.00 62.15 C ATOM 1461 O ARG A 94 -10.351 -6.619 -1.862 1.00 1.05 O ATOM 1462 CB ARG A 94 -9.919 -6.364 1.328 1.00 64.25 C ATOM 1463 CG ARG A 94 -9.254 -6.636 2.667 1.00 11.31 C ATOM 1464 CD ARG A 94 -9.137 -5.371 3.504 1.00 10.41 C ATOM 1465 NE ARG A 94 -10.238 -4.445 3.256 1.00 5.33 N ATOM 1466 CZ ARG A 94 -11.199 -4.162 4.129 1.00 22.10 C ATOM 1467 NH1 ARG A 94 -11.198 -4.716 5.337 1.00 40.14 N ATOM 1468 NH2 ARG A 94 -12.154 -3.312 3.787 1.00 64.42 N ATOM 0 H ARG A 94 -8.039 -6.402 -0.531 1.00 61.25 H new ATOM 0 HA ARG A 94 -9.803 -8.431 0.711 1.00 62.34 H new ATOM 0 HB2 ARG A 94 -9.566 -5.406 0.946 1.00 64.25 H new ATOM 0 HB3 ARG A 94 -10.994 -6.269 1.480 1.00 64.25 H new ATOM 0 HG2 ARG A 94 -9.830 -7.383 3.214 1.00 11.31 H new ATOM 0 HG3 ARG A 94 -8.262 -7.056 2.502 1.00 11.31 H new ATOM 0 HD2 ARG A 94 -9.118 -5.637 4.561 1.00 10.41 H new ATOM 0 HD3 ARG A 94 -8.191 -4.877 3.283 1.00 10.41 H new ATOM 0 HE ARG A 94 -10.272 -3.982 2.348 1.00 5.33 H new ATOM 0 HH11 ARG A 94 -10.456 -5.364 5.600 1.00 40.14 H new ATOM 0 HH12 ARG A 94 -11.940 -4.493 6.001 1.00 40.14 H new ATOM 0 HH21 ARG A 94 -12.147 -2.882 2.862 1.00 64.42 H new ATOM 0 HH22 ARG A 94 -12.897 -3.087 4.448 1.00 64.42 H new ATOM 1482 N PRO A 95 -11.816 -7.941 -0.763 1.00 41.42 N ATOM 1483 CA PRO A 95 -12.911 -7.751 -1.715 1.00 71.22 C ATOM 1484 C PRO A 95 -13.203 -6.271 -1.931 1.00 43.32 C ATOM 1485 O PRO A 95 -13.408 -5.519 -0.973 1.00 62.01 O ATOM 1486 CB PRO A 95 -14.090 -8.452 -1.041 1.00 64.22 C ATOM 1487 CG PRO A 95 -13.463 -9.505 -0.194 1.00 63.02 C ATOM 1488 CD PRO A 95 -12.157 -8.928 0.281 1.00 10.02 C ATOM 0 HA PRO A 95 -12.687 -8.150 -2.705 1.00 71.22 H new ATOM 0 HB2 PRO A 95 -14.675 -7.756 -0.440 1.00 64.22 H new ATOM 0 HB3 PRO A 95 -14.767 -8.886 -1.777 1.00 64.22 H new ATOM 0 HG2 PRO A 95 -14.105 -9.763 0.648 1.00 63.02 H new ATOM 0 HG3 PRO A 95 -13.302 -10.420 -0.764 1.00 63.02 H new ATOM 0 HD2 PRO A 95 -12.258 -8.459 1.260 1.00 10.02 H new ATOM 0 HD3 PRO A 95 -11.389 -9.696 0.374 1.00 10.02 H new ATOM 1496 N ALA A 96 -13.216 -5.863 -3.188 1.00 13.41 N ATOM 1497 CA ALA A 96 -13.318 -4.458 -3.542 1.00 51.23 C ATOM 1498 C ALA A 96 -14.732 -3.930 -3.353 1.00 14.11 C ATOM 1499 O ALA A 96 -15.701 -4.684 -3.462 1.00 45.31 O ATOM 1500 CB ALA A 96 -12.874 -4.250 -4.974 1.00 20.34 C ATOM 0 H ALA A 96 -13.156 -6.493 -3.988 1.00 13.41 H new ATOM 0 HA ALA A 96 -12.663 -3.899 -2.873 1.00 51.23 H new ATOM 0 HB1 ALA A 96 -12.954 -3.194 -5.230 1.00 20.34 H new ATOM 0 HB2 ALA A 96 -11.839 -4.573 -5.084 1.00 20.34 H new ATOM 0 HB3 ALA A 96 -13.509 -4.834 -5.640 1.00 20.34 H new ATOM 1506 N PRO A 97 -14.861 -2.626 -3.054 1.00 12.54 N ATOM 1507 CA PRO A 97 -16.158 -1.965 -2.938 1.00 43.24 C ATOM 1508 C PRO A 97 -16.969 -2.064 -4.225 1.00 33.14 C ATOM 1509 O PRO A 97 -16.622 -1.475 -5.253 1.00 43.54 O ATOM 1510 CB PRO A 97 -15.812 -0.504 -2.630 1.00 71.44 C ATOM 1511 CG PRO A 97 -14.373 -0.353 -2.994 1.00 60.34 C ATOM 1512 CD PRO A 97 -13.748 -1.700 -2.785 1.00 14.34 C ATOM 0 HA PRO A 97 -16.777 -2.428 -2.169 1.00 43.24 H new ATOM 0 HB2 PRO A 97 -16.437 0.178 -3.207 1.00 71.44 H new ATOM 0 HB3 PRO A 97 -15.977 -0.275 -1.577 1.00 71.44 H new ATOM 0 HG2 PRO A 97 -14.265 -0.029 -4.029 1.00 60.34 H new ATOM 0 HG3 PRO A 97 -13.891 0.401 -2.372 1.00 60.34 H new ATOM 0 HD2 PRO A 97 -12.911 -1.867 -3.463 1.00 14.34 H new ATOM 0 HD3 PRO A 97 -13.364 -1.814 -1.771 1.00 14.34 H new ATOM 1520 N GLY A 98 -18.020 -2.858 -4.166 1.00 51.24 N ATOM 1521 CA GLY A 98 -18.921 -3.007 -5.279 1.00 44.42 C ATOM 1522 C GLY A 98 -18.530 -4.168 -6.153 1.00 61.45 C ATOM 1523 O GLY A 98 -19.158 -5.228 -6.107 1.00 63.24 O ATOM 0 H GLY A 98 -18.268 -3.413 -3.347 1.00 51.24 H new ATOM 0 HA2 GLY A 98 -19.936 -3.154 -4.910 1.00 44.42 H new ATOM 0 HA3 GLY A 98 -18.926 -2.091 -5.870 1.00 44.42 H new ATOM 1527 N ALA A 99 -17.462 -3.966 -6.910 1.00 61.34 N ATOM 1528 CA ALA A 99 -16.984 -4.946 -7.889 1.00 43.22 C ATOM 1529 C ALA A 99 -15.824 -4.388 -8.710 1.00 31.23 C ATOM 1530 O ALA A 99 -15.561 -4.850 -9.818 1.00 72.22 O ATOM 1531 CB ALA A 99 -18.115 -5.344 -8.828 1.00 13.12 C ATOM 0 H ALA A 99 -16.897 -3.118 -6.867 1.00 61.34 H new ATOM 0 HA ALA A 99 -16.635 -5.820 -7.339 1.00 43.22 H new ATOM 0 HB1 ALA A 99 -17.748 -6.072 -9.551 1.00 13.12 H new ATOM 0 HB2 ALA A 99 -18.929 -5.783 -8.251 1.00 13.12 H new ATOM 0 HB3 ALA A 99 -18.478 -4.461 -9.355 1.00 13.12 H new ATOM 1537 N ARG A 100 -15.109 -3.421 -8.157 1.00 35.01 N ATOM 1538 CA ARG A 100 -14.105 -2.691 -8.928 1.00 40.32 C ATOM 1539 C ARG A 100 -12.771 -3.433 -9.004 1.00 5.15 C ATOM 1540 O ARG A 100 -11.784 -2.894 -9.502 1.00 53.24 O ATOM 1541 CB ARG A 100 -13.894 -1.304 -8.331 1.00 2.22 C ATOM 1542 CG ARG A 100 -15.125 -0.422 -8.400 1.00 43.11 C ATOM 1543 CD ARG A 100 -14.840 0.970 -7.867 1.00 52.44 C ATOM 1544 NE ARG A 100 -13.795 1.651 -8.628 1.00 15.24 N ATOM 1545 CZ ARG A 100 -13.901 2.897 -9.076 1.00 24.14 C ATOM 1546 NH1 ARG A 100 -15.024 3.577 -8.883 1.00 11.42 N ATOM 1547 NH2 ARG A 100 -12.896 3.457 -9.735 1.00 53.30 N ATOM 0 H ARG A 100 -15.201 -3.122 -7.186 1.00 35.01 H new ATOM 0 HA ARG A 100 -14.485 -2.603 -9.946 1.00 40.32 H new ATOM 0 HB2 ARG A 100 -13.589 -1.408 -7.290 1.00 2.22 H new ATOM 0 HB3 ARG A 100 -13.075 -0.812 -8.855 1.00 2.22 H new ATOM 0 HG2 ARG A 100 -15.469 -0.355 -9.432 1.00 43.11 H new ATOM 0 HG3 ARG A 100 -15.932 -0.875 -7.824 1.00 43.11 H new ATOM 0 HD2 ARG A 100 -15.754 1.563 -7.898 1.00 52.44 H new ATOM 0 HD3 ARG A 100 -14.539 0.902 -6.821 1.00 52.44 H new ATOM 0 HE ARG A 100 -12.935 1.140 -8.827 1.00 15.24 H new ATOM 0 HH11 ARG A 100 -15.805 3.143 -8.391 1.00 11.42 H new ATOM 0 HH12 ARG A 100 -15.106 4.534 -9.227 1.00 11.42 H new ATOM 0 HH21 ARG A 100 -12.038 2.931 -9.899 1.00 53.30 H new ATOM 0 HH22 ARG A 100 -12.981 4.414 -10.078 1.00 53.30 H new ATOM 1561 N GLY A 101 -12.739 -4.661 -8.509 1.00 41.01 N ATOM 1562 CA GLY A 101 -11.528 -5.453 -8.585 1.00 0.23 C ATOM 1563 C GLY A 101 -11.119 -5.981 -7.233 1.00 44.32 C ATOM 1564 O GLY A 101 -11.824 -6.798 -6.644 1.00 25.32 O ATOM 0 H GLY A 101 -13.528 -5.123 -8.057 1.00 41.01 H new ATOM 0 HA2 GLY A 101 -11.681 -6.287 -9.270 1.00 0.23 H new ATOM 0 HA3 GLY A 101 -10.722 -4.846 -8.997 1.00 0.23 H new ATOM 1568 N THR A 102 -9.994 -5.500 -6.729 1.00 12.03 N ATOM 1569 CA THR A 102 -9.512 -5.907 -5.421 1.00 21.53 C ATOM 1570 C THR A 102 -8.909 -4.715 -4.686 1.00 14.24 C ATOM 1571 O THR A 102 -8.243 -3.869 -5.291 1.00 62.44 O ATOM 1572 CB THR A 102 -8.468 -7.033 -5.546 1.00 2.33 C ATOM 1573 OG1 THR A 102 -8.964 -8.051 -6.421 1.00 20.22 O ATOM 1574 CG2 THR A 102 -8.149 -7.650 -4.191 1.00 72.10 C ATOM 0 H THR A 102 -9.397 -4.826 -7.208 1.00 12.03 H new ATOM 0 HA THR A 102 -10.359 -6.286 -4.850 1.00 21.53 H new ATOM 0 HB THR A 102 -7.553 -6.600 -5.950 1.00 2.33 H new ATOM 0 HG1 THR A 102 -8.478 -8.016 -7.272 1.00 20.22 H new ATOM 0 HG21 THR A 102 -7.409 -8.441 -4.316 1.00 72.10 H new ATOM 0 HG22 THR A 102 -7.751 -6.883 -3.527 1.00 72.10 H new ATOM 0 HG23 THR A 102 -9.058 -8.069 -3.759 1.00 72.10 H new ATOM 1582 N GLU A 103 -9.162 -4.640 -3.388 1.00 11.33 N ATOM 1583 CA GLU A 103 -8.681 -3.538 -2.571 1.00 41.14 C ATOM 1584 C GLU A 103 -7.382 -3.917 -1.861 1.00 54.23 C ATOM 1585 O GLU A 103 -7.347 -4.869 -1.081 1.00 54.21 O ATOM 1586 CB GLU A 103 -9.754 -3.154 -1.546 1.00 4.31 C ATOM 1587 CG GLU A 103 -9.320 -2.070 -0.573 1.00 34.55 C ATOM 1588 CD GLU A 103 -10.371 -1.773 0.476 1.00 63.12 C ATOM 1589 OE1 GLU A 103 -10.624 -2.644 1.337 1.00 60.22 O ATOM 1590 OE2 GLU A 103 -10.934 -0.657 0.463 1.00 43.44 O ATOM 0 H GLU A 103 -9.703 -5.336 -2.875 1.00 11.33 H new ATOM 0 HA GLU A 103 -8.477 -2.684 -3.217 1.00 41.14 H new ATOM 0 HB2 GLU A 103 -10.644 -2.816 -2.077 1.00 4.31 H new ATOM 0 HB3 GLU A 103 -10.037 -4.042 -0.981 1.00 4.31 H new ATOM 0 HG2 GLU A 103 -8.397 -2.377 -0.081 1.00 34.55 H new ATOM 0 HG3 GLU A 103 -9.097 -1.158 -1.127 1.00 34.55 H new ATOM 1597 N VAL A 104 -6.316 -3.182 -2.149 1.00 62.12 N ATOM 1598 CA VAL A 104 -5.046 -3.372 -1.456 1.00 21.10 C ATOM 1599 C VAL A 104 -4.866 -2.304 -0.380 1.00 12.52 C ATOM 1600 O VAL A 104 -4.655 -1.124 -0.672 1.00 40.43 O ATOM 1601 CB VAL A 104 -3.835 -3.389 -2.430 1.00 13.21 C ATOM 1602 CG1 VAL A 104 -3.899 -2.259 -3.441 1.00 32.44 C ATOM 1603 CG2 VAL A 104 -2.522 -3.337 -1.663 1.00 54.20 C ATOM 0 H VAL A 104 -6.304 -2.448 -2.858 1.00 62.12 H new ATOM 0 HA VAL A 104 -5.078 -4.352 -0.981 1.00 21.10 H new ATOM 0 HB VAL A 104 -3.884 -4.327 -2.982 1.00 13.21 H new ATOM 0 HG11 VAL A 104 -3.033 -2.311 -4.100 1.00 32.44 H new ATOM 0 HG12 VAL A 104 -4.810 -2.350 -4.032 1.00 32.44 H new ATOM 0 HG13 VAL A 104 -3.900 -1.303 -2.918 1.00 32.44 H new ATOM 0 HG21 VAL A 104 -1.689 -3.350 -2.366 1.00 54.20 H new ATOM 0 HG22 VAL A 104 -2.483 -2.423 -1.071 1.00 54.20 H new ATOM 0 HG23 VAL A 104 -2.452 -4.201 -1.002 1.00 54.20 H new ATOM 1613 N VAL A 105 -4.997 -2.728 0.868 1.00 74.22 N ATOM 1614 CA VAL A 105 -4.814 -1.847 1.999 1.00 14.30 C ATOM 1615 C VAL A 105 -3.390 -1.962 2.525 1.00 14.42 C ATOM 1616 O VAL A 105 -2.941 -3.037 2.930 1.00 15.23 O ATOM 1617 CB VAL A 105 -5.826 -2.145 3.133 1.00 12.21 C ATOM 1618 CG1 VAL A 105 -7.237 -1.785 2.706 1.00 11.52 C ATOM 1619 CG2 VAL A 105 -5.772 -3.602 3.561 1.00 61.20 C ATOM 0 H VAL A 105 -5.232 -3.688 1.119 1.00 74.22 H new ATOM 0 HA VAL A 105 -4.994 -0.828 1.656 1.00 14.30 H new ATOM 0 HB VAL A 105 -5.545 -1.528 3.986 1.00 12.21 H new ATOM 0 HG11 VAL A 105 -7.930 -2.003 3.519 1.00 11.52 H new ATOM 0 HG12 VAL A 105 -7.284 -0.723 2.464 1.00 11.52 H new ATOM 0 HG13 VAL A 105 -7.512 -2.370 1.828 1.00 11.52 H new ATOM 0 HG21 VAL A 105 -6.495 -3.774 4.358 1.00 61.20 H new ATOM 0 HG22 VAL A 105 -6.011 -4.240 2.710 1.00 61.20 H new ATOM 0 HG23 VAL A 105 -4.771 -3.838 3.922 1.00 61.20 H new ATOM 1629 N VAL A 106 -2.673 -0.860 2.484 1.00 22.42 N ATOM 1630 CA VAL A 106 -1.294 -0.837 2.934 1.00 41.41 C ATOM 1631 C VAL A 106 -1.157 0.002 4.196 1.00 61.20 C ATOM 1632 O VAL A 106 -1.624 1.139 4.251 1.00 4.24 O ATOM 1633 CB VAL A 106 -0.339 -0.305 1.839 1.00 12.03 C ATOM 1634 CG1 VAL A 106 -0.254 -1.285 0.678 1.00 72.02 C ATOM 1635 CG2 VAL A 106 -0.787 1.059 1.338 1.00 15.53 C ATOM 0 H VAL A 106 -3.022 0.036 2.143 1.00 22.42 H new ATOM 0 HA VAL A 106 -1.009 -1.866 3.155 1.00 41.41 H new ATOM 0 HB VAL A 106 0.651 -0.200 2.284 1.00 12.03 H new ATOM 0 HG11 VAL A 106 0.422 -0.892 -0.081 1.00 72.02 H new ATOM 0 HG12 VAL A 106 0.121 -2.243 1.037 1.00 72.02 H new ATOM 0 HG13 VAL A 106 -1.245 -1.423 0.245 1.00 72.02 H new ATOM 0 HG21 VAL A 106 -0.098 1.409 0.569 1.00 15.53 H new ATOM 0 HG22 VAL A 106 -1.790 0.981 0.918 1.00 15.53 H new ATOM 0 HG23 VAL A 106 -0.795 1.767 2.167 1.00 15.53 H new ATOM 1645 N ARG A 107 -0.547 -0.577 5.214 1.00 74.24 N ATOM 1646 CA ARG A 107 -0.320 0.120 6.470 1.00 72.03 C ATOM 1647 C ARG A 107 1.085 -0.178 6.981 1.00 21.35 C ATOM 1648 O ARG A 107 1.340 -1.243 7.543 1.00 5.12 O ATOM 1649 CB ARG A 107 -1.362 -0.302 7.508 1.00 55.22 C ATOM 1650 CG ARG A 107 -1.260 0.448 8.828 1.00 62.22 C ATOM 1651 CD ARG A 107 -2.115 -0.201 9.906 1.00 0.24 C ATOM 1652 NE ARG A 107 -1.703 -1.581 10.159 1.00 51.34 N ATOM 1653 CZ ARG A 107 -1.456 -2.085 11.370 1.00 22.32 C ATOM 1654 NH1 ARG A 107 -1.666 -1.355 12.458 1.00 11.14 N ATOM 1655 NH2 ARG A 107 -1.016 -3.333 11.489 1.00 32.25 N ATOM 0 H ARG A 107 -0.197 -1.535 5.196 1.00 74.24 H new ATOM 0 HA ARG A 107 -0.415 1.193 6.301 1.00 72.03 H new ATOM 0 HB2 ARG A 107 -2.358 -0.149 7.091 1.00 55.22 H new ATOM 0 HB3 ARG A 107 -1.257 -1.370 7.700 1.00 55.22 H new ATOM 0 HG2 ARG A 107 -0.220 0.474 9.154 1.00 62.22 H new ATOM 0 HG3 ARG A 107 -1.575 1.482 8.686 1.00 62.22 H new ATOM 0 HD2 ARG A 107 -2.041 0.377 10.827 1.00 0.24 H new ATOM 0 HD3 ARG A 107 -3.162 -0.183 9.602 1.00 0.24 H new ATOM 0 HE ARG A 107 -1.597 -2.200 9.356 1.00 51.34 H new ATOM 0 HH11 ARG A 107 -2.019 -0.402 12.372 1.00 11.14 H new ATOM 0 HH12 ARG A 107 -1.475 -1.747 13.380 1.00 11.14 H new ATOM 0 HH21 ARG A 107 -0.868 -3.903 10.656 1.00 32.25 H new ATOM 0 HH22 ARG A 107 -0.826 -3.721 12.413 1.00 32.25 H new ATOM 1669 N LEU A 108 1.992 0.757 6.759 1.00 52.12 N ATOM 1670 CA LEU A 108 3.386 0.598 7.148 1.00 40.50 C ATOM 1671 C LEU A 108 3.950 1.941 7.572 1.00 31.13 C ATOM 1672 O LEU A 108 3.441 2.982 7.161 1.00 14.03 O ATOM 1673 CB LEU A 108 4.211 -0.016 6.002 1.00 62.11 C ATOM 1674 CG LEU A 108 4.143 0.711 4.655 1.00 4.20 C ATOM 1675 CD1 LEU A 108 5.192 1.810 4.572 1.00 25.01 C ATOM 1676 CD2 LEU A 108 4.320 -0.279 3.514 1.00 74.24 C ATOM 0 H LEU A 108 1.786 1.647 6.305 1.00 52.12 H new ATOM 0 HA LEU A 108 3.444 -0.089 7.992 1.00 40.50 H new ATOM 0 HB2 LEU A 108 5.254 -0.059 6.316 1.00 62.11 H new ATOM 0 HB3 LEU A 108 3.880 -1.044 5.854 1.00 62.11 H new ATOM 0 HG LEU A 108 3.161 1.177 4.569 1.00 4.20 H new ATOM 0 HD11 LEU A 108 5.121 2.309 3.606 1.00 25.01 H new ATOM 0 HD12 LEU A 108 5.023 2.535 5.368 1.00 25.01 H new ATOM 0 HD13 LEU A 108 6.185 1.374 4.683 1.00 25.01 H new ATOM 0 HD21 LEU A 108 4.270 0.250 2.562 1.00 74.24 H new ATOM 0 HD22 LEU A 108 5.289 -0.770 3.605 1.00 74.24 H new ATOM 0 HD23 LEU A 108 3.529 -1.027 3.555 1.00 74.24 H new ATOM 1688 N THR A 109 4.979 1.935 8.402 1.00 32.22 N ATOM 1689 CA THR A 109 5.523 3.186 8.898 1.00 64.04 C ATOM 1690 C THR A 109 6.450 3.799 7.853 1.00 54.32 C ATOM 1691 O THR A 109 7.230 3.100 7.198 1.00 31.45 O ATOM 1692 CB THR A 109 6.267 3.007 10.248 1.00 4.00 C ATOM 1693 OG1 THR A 109 6.692 4.281 10.759 1.00 63.20 O ATOM 1694 CG2 THR A 109 7.474 2.088 10.105 1.00 4.22 C ATOM 0 H THR A 109 5.447 1.095 8.741 1.00 32.22 H new ATOM 0 HA THR A 109 4.687 3.861 9.082 1.00 64.04 H new ATOM 0 HB THR A 109 5.568 2.549 10.947 1.00 4.00 H new ATOM 0 HG1 THR A 109 7.158 4.153 11.611 1.00 63.20 H new ATOM 0 HG21 THR A 109 7.970 1.986 11.070 1.00 4.22 H new ATOM 0 HG22 THR A 109 7.146 1.107 9.760 1.00 4.22 H new ATOM 0 HG23 THR A 109 8.171 2.512 9.382 1.00 4.22 H new ATOM 1702 N TYR A 110 6.325 5.107 7.690 1.00 70.21 N ATOM 1703 CA TYR A 110 6.996 5.831 6.630 1.00 73.40 C ATOM 1704 C TYR A 110 7.043 7.301 7.019 1.00 20.43 C ATOM 1705 O TYR A 110 6.012 7.966 7.071 1.00 21.23 O ATOM 1706 CB TYR A 110 6.219 5.642 5.320 1.00 53.10 C ATOM 1707 CG TYR A 110 6.979 5.996 4.062 1.00 62.22 C ATOM 1708 CD1 TYR A 110 7.805 5.062 3.448 1.00 73.30 C ATOM 1709 CD2 TYR A 110 6.854 7.249 3.475 1.00 62.52 C ATOM 1710 CE1 TYR A 110 8.483 5.366 2.284 1.00 51.22 C ATOM 1711 CE2 TYR A 110 7.532 7.562 2.313 1.00 24.01 C ATOM 1712 CZ TYR A 110 8.347 6.619 1.721 1.00 2.10 C ATOM 1713 OH TYR A 110 9.019 6.925 0.558 1.00 53.31 O ATOM 0 H TYR A 110 5.752 5.696 8.294 1.00 70.21 H new ATOM 0 HA TYR A 110 8.011 5.460 6.485 1.00 73.40 H new ATOM 0 HB2 TYR A 110 5.901 4.602 5.252 1.00 53.10 H new ATOM 0 HB3 TYR A 110 5.315 6.250 5.362 1.00 53.10 H new ATOM 0 HD1 TYR A 110 7.918 4.082 3.888 1.00 73.30 H new ATOM 0 HD2 TYR A 110 6.217 7.990 3.934 1.00 62.52 H new ATOM 0 HE1 TYR A 110 9.117 4.627 1.816 1.00 51.22 H new ATOM 0 HE2 TYR A 110 7.425 8.541 1.870 1.00 24.01 H new ATOM 0 HH TYR A 110 8.814 7.846 0.294 1.00 53.31 H new ATOM 1782 N GLY A 115 6.982 18.463 8.169 1.00 12.32 N ATOM 1783 CA GLY A 115 5.550 18.465 8.395 1.00 33.22 C ATOM 1784 C GLY A 115 5.148 19.368 9.540 1.00 31.13 C ATOM 1785 O GLY A 115 3.973 19.702 9.698 1.00 52.32 O ATOM 0 HA2 GLY A 115 5.042 18.787 7.486 1.00 33.22 H new ATOM 0 HA3 GLY A 115 5.216 17.448 8.603 1.00 33.22 H new ATOM 1789 N SER A 116 6.121 19.760 10.346 1.00 71.31 N ATOM 1790 CA SER A 116 5.863 20.622 11.485 1.00 11.24 C ATOM 1791 C SER A 116 5.869 22.087 11.061 1.00 34.24 C ATOM 1792 O SER A 116 4.951 22.845 11.379 1.00 43.25 O ATOM 1793 CB SER A 116 6.915 20.385 12.568 1.00 41.55 C ATOM 1794 OG SER A 116 7.042 19.002 12.861 1.00 21.35 O ATOM 0 H SER A 116 7.099 19.494 10.231 1.00 71.31 H new ATOM 0 HA SER A 116 4.878 20.382 11.886 1.00 11.24 H new ATOM 0 HB2 SER A 116 7.876 20.780 12.239 1.00 41.55 H new ATOM 0 HB3 SER A 116 6.640 20.928 13.472 1.00 41.55 H new ATOM 0 HG SER A 116 7.722 18.876 13.555 1.00 21.35 H new ATOM 1800 N ALA A 117 6.904 22.474 10.324 1.00 43.21 N ATOM 1801 CA ALA A 117 7.072 23.857 9.898 1.00 45.43 C ATOM 1802 C ALA A 117 6.074 24.229 8.807 1.00 63.11 C ATOM 1803 O ALA A 117 5.522 25.329 8.807 1.00 14.04 O ATOM 1804 CB ALA A 117 8.495 24.084 9.414 1.00 52.14 C ATOM 0 H ALA A 117 7.642 21.845 10.008 1.00 43.21 H new ATOM 0 HA ALA A 117 6.880 24.501 10.756 1.00 45.43 H new ATOM 0 HB1 ALA A 117 8.611 25.121 9.098 1.00 52.14 H new ATOM 0 HB2 ALA A 117 9.193 23.872 10.224 1.00 52.14 H new ATOM 0 HB3 ALA A 117 8.703 23.423 8.573 1.00 52.14 H new ATOM 1810 N GLY A 118 5.836 23.302 7.888 1.00 42.54 N ATOM 1811 CA GLY A 118 4.936 23.562 6.777 1.00 51.45 C ATOM 1812 C GLY A 118 3.488 23.735 7.205 1.00 62.54 C ATOM 1813 O GLY A 118 2.687 24.317 6.476 1.00 1.31 O ATOM 0 H GLY A 118 6.251 22.370 7.891 1.00 42.54 H new ATOM 0 HA2 GLY A 118 5.264 24.461 6.256 1.00 51.45 H new ATOM 0 HA3 GLY A 118 5.001 22.739 6.065 1.00 51.45 H new ATOM 1817 N ALA A 119 3.153 23.243 8.388 1.00 22.44 N ATOM 1818 CA ALA A 119 1.774 23.256 8.857 1.00 61.33 C ATOM 1819 C ALA A 119 1.312 24.659 9.258 1.00 35.14 C ATOM 1820 O ALA A 119 0.113 24.938 9.280 1.00 41.15 O ATOM 1821 CB ALA A 119 1.610 22.292 10.023 1.00 4.24 C ATOM 0 H ALA A 119 3.817 22.829 9.042 1.00 22.44 H new ATOM 0 HA ALA A 119 1.144 22.934 8.028 1.00 61.33 H new ATOM 0 HB1 ALA A 119 0.576 22.309 10.366 1.00 4.24 H new ATOM 0 HB2 ALA A 119 1.869 21.283 9.700 1.00 4.24 H new ATOM 0 HB3 ALA A 119 2.268 22.592 10.838 1.00 4.24 H new ATOM 1827 N VAL A 120 2.257 25.546 9.553 1.00 3.23 N ATOM 1828 CA VAL A 120 1.917 26.863 10.085 1.00 45.24 C ATOM 1829 C VAL A 120 1.405 27.818 9.003 1.00 54.11 C ATOM 1830 O VAL A 120 0.756 28.816 9.311 1.00 32.10 O ATOM 1831 CB VAL A 120 3.116 27.518 10.807 1.00 42.23 C ATOM 1832 CG1 VAL A 120 3.704 26.572 11.839 1.00 4.42 C ATOM 1833 CG2 VAL A 120 4.183 27.961 9.817 1.00 32.44 C ATOM 0 H VAL A 120 3.256 25.380 9.434 1.00 3.23 H new ATOM 0 HA VAL A 120 1.115 26.690 10.803 1.00 45.24 H new ATOM 0 HB VAL A 120 2.749 28.406 11.322 1.00 42.23 H new ATOM 0 HG11 VAL A 120 4.547 27.053 12.335 1.00 4.42 H new ATOM 0 HG12 VAL A 120 2.943 26.321 12.578 1.00 4.42 H new ATOM 0 HG13 VAL A 120 4.045 25.662 11.346 1.00 4.42 H new ATOM 0 HG21 VAL A 120 5.013 28.418 10.356 1.00 32.44 H new ATOM 0 HG22 VAL A 120 4.544 27.096 9.260 1.00 32.44 H new ATOM 0 HG23 VAL A 120 3.757 28.687 9.124 1.00 32.44 H new ATOM 1843 N ILE A 121 1.685 27.514 7.739 1.00 70.44 N ATOM 1844 CA ILE A 121 1.304 28.410 6.650 1.00 10.24 C ATOM 1845 C ILE A 121 -0.214 28.445 6.473 1.00 60.34 C ATOM 1846 O ILE A 121 -0.779 29.468 6.082 1.00 21.24 O ATOM 1847 CB ILE A 121 1.985 28.014 5.316 1.00 41.32 C ATOM 1848 CG1 ILE A 121 1.747 29.090 4.253 1.00 43.05 C ATOM 1849 CG2 ILE A 121 1.485 26.659 4.825 1.00 2.23 C ATOM 1850 CD1 ILE A 121 2.468 28.825 2.950 1.00 12.45 C ATOM 0 H ILE A 121 2.168 26.665 7.445 1.00 70.44 H new ATOM 0 HA ILE A 121 1.649 29.407 6.923 1.00 10.24 H new ATOM 0 HB ILE A 121 3.057 27.933 5.496 1.00 41.32 H new ATOM 0 HG12 ILE A 121 0.677 29.165 4.058 1.00 43.05 H new ATOM 0 HG13 ILE A 121 2.068 30.055 4.646 1.00 43.05 H new ATOM 0 HG21 ILE A 121 1.980 26.407 3.887 1.00 2.23 H new ATOM 0 HG22 ILE A 121 1.710 25.896 5.571 1.00 2.23 H new ATOM 0 HG23 ILE A 121 0.408 26.705 4.666 1.00 2.23 H new ATOM 0 HD11 ILE A 121 2.253 29.628 2.245 1.00 12.45 H new ATOM 0 HD12 ILE A 121 3.542 28.779 3.131 1.00 12.45 H new ATOM 0 HD13 ILE A 121 2.130 27.876 2.533 1.00 12.45 H new ATOM 1862 N ALA A 122 -0.864 27.335 6.822 1.00 72.42 N ATOM 1863 CA ALA A 122 -2.302 27.175 6.624 1.00 22.21 C ATOM 1864 C ALA A 122 -3.103 28.210 7.404 1.00 43.12 C ATOM 1865 O ALA A 122 -4.216 28.569 7.008 1.00 43.42 O ATOM 1866 CB ALA A 122 -2.734 25.771 7.022 1.00 41.33 C ATOM 0 H ALA A 122 -0.411 26.526 7.247 1.00 72.42 H new ATOM 0 HA ALA A 122 -2.506 27.331 5.565 1.00 22.21 H new ATOM 0 HB1 ALA A 122 -3.808 25.664 6.870 1.00 41.33 H new ATOM 0 HB2 ALA A 122 -2.206 25.040 6.409 1.00 41.33 H new ATOM 0 HB3 ALA A 122 -2.498 25.602 8.073 1.00 41.33 H new ATOM 1872 N ARG A 123 -2.540 28.687 8.511 1.00 22.13 N ATOM 1873 CA ARG A 123 -3.219 29.668 9.347 1.00 4.40 C ATOM 1874 C ARG A 123 -3.356 30.988 8.596 1.00 50.23 C ATOM 1875 O ARG A 123 -4.406 31.629 8.624 1.00 42.43 O ATOM 1876 CB ARG A 123 -2.455 29.886 10.655 1.00 22.54 C ATOM 1877 CG ARG A 123 -2.062 28.597 11.361 1.00 23.41 C ATOM 1878 CD ARG A 123 -1.418 28.872 12.711 1.00 71.13 C ATOM 1879 NE ARG A 123 -0.389 29.912 12.634 1.00 41.14 N ATOM 1880 CZ ARG A 123 0.737 29.907 13.346 1.00 2.21 C ATOM 1881 NH1 ARG A 123 1.069 28.847 14.076 1.00 24.35 N ATOM 1882 NH2 ARG A 123 1.548 30.956 13.306 1.00 40.15 N ATOM 0 H ARG A 123 -1.618 28.410 8.848 1.00 22.13 H new ATOM 0 HA ARG A 123 -4.212 29.288 9.587 1.00 4.40 H new ATOM 0 HB2 ARG A 123 -1.555 30.464 10.447 1.00 22.54 H new ATOM 0 HB3 ARG A 123 -3.069 30.485 11.328 1.00 22.54 H new ATOM 0 HG2 ARG A 123 -2.945 27.973 11.499 1.00 23.41 H new ATOM 0 HG3 ARG A 123 -1.369 28.035 10.735 1.00 23.41 H new ATOM 0 HD2 ARG A 123 -2.186 29.176 13.422 1.00 71.13 H new ATOM 0 HD3 ARG A 123 -0.975 27.953 13.094 1.00 71.13 H new ATOM 0 HE ARG A 123 -0.545 30.690 11.994 1.00 41.14 H new ATOM 0 HH11 ARG A 123 0.460 28.029 14.094 1.00 24.35 H new ATOM 0 HH12 ARG A 123 1.933 28.851 14.618 1.00 24.35 H new ATOM 0 HH21 ARG A 123 1.309 31.764 12.731 1.00 40.15 H new ATOM 0 HH22 ARG A 123 2.411 30.955 13.850 1.00 40.15 H new ATOM 1896 N MET A 124 -2.287 31.376 7.912 1.00 45.14 N ATOM 1897 CA MET A 124 -2.293 32.590 7.107 1.00 70.11 C ATOM 1898 C MET A 124 -3.160 32.386 5.874 1.00 44.21 C ATOM 1899 O MET A 124 -4.087 33.153 5.618 1.00 24.52 O ATOM 1900 CB MET A 124 -0.869 32.948 6.681 1.00 34.11 C ATOM 1901 CG MET A 124 -0.789 34.161 5.767 1.00 21.41 C ATOM 1902 SD MET A 124 0.826 34.327 4.984 1.00 14.01 S ATOM 1903 CE MET A 124 0.890 32.809 4.029 1.00 23.03 C ATOM 0 H MET A 124 -1.404 30.866 7.899 1.00 45.14 H new ATOM 0 HA MET A 124 -2.700 33.406 7.704 1.00 70.11 H new ATOM 0 HB2 MET A 124 -0.269 33.136 7.572 1.00 34.11 H new ATOM 0 HB3 MET A 124 -0.426 32.092 6.173 1.00 34.11 H new ATOM 0 HG2 MET A 124 -1.557 34.083 4.997 1.00 21.41 H new ATOM 0 HG3 MET A 124 -1.005 35.061 6.343 1.00 21.41 H new ATOM 0 HE1 MET A 124 1.080 33.046 2.982 1.00 23.03 H new ATOM 0 HE2 MET A 124 1.691 32.174 4.408 1.00 23.03 H new ATOM 0 HE3 MET A 124 -0.061 32.284 4.116 1.00 23.03 H new ATOM 2057 N ARG A 134 -3.219 10.101 -1.083 1.00 61.31 N ATOM 2058 CA ARG A 134 -2.929 8.897 -1.861 1.00 24.04 C ATOM 2059 C ARG A 134 -1.885 9.196 -2.933 1.00 23.34 C ATOM 2060 O ARG A 134 -2.008 8.735 -4.063 1.00 40.33 O ATOM 2061 CB ARG A 134 -4.197 8.357 -2.539 1.00 14.14 C ATOM 2062 CG ARG A 134 -5.441 8.369 -1.666 1.00 33.14 C ATOM 2063 CD ARG A 134 -6.596 7.677 -2.367 1.00 74.44 C ATOM 2064 NE ARG A 134 -7.884 7.930 -1.722 1.00 74.30 N ATOM 2065 CZ ARG A 134 -8.590 7.004 -1.074 1.00 1.20 C ATOM 2066 NH1 ARG A 134 -8.067 5.812 -0.825 1.00 30.45 N ATOM 2067 NH2 ARG A 134 -9.805 7.292 -0.635 1.00 15.35 N ATOM 0 HA ARG A 134 -2.546 8.145 -1.171 1.00 24.04 H new ATOM 0 HB2 ARG A 134 -4.393 8.947 -3.434 1.00 14.14 H new ATOM 0 HB3 ARG A 134 -4.010 7.334 -2.866 1.00 14.14 H new ATOM 0 HG2 ARG A 134 -5.232 7.870 -0.720 1.00 33.14 H new ATOM 0 HG3 ARG A 134 -5.716 9.397 -1.430 1.00 33.14 H new ATOM 0 HD2 ARG A 134 -6.641 8.014 -3.403 1.00 74.44 H new ATOM 0 HD3 ARG A 134 -6.411 6.603 -2.389 1.00 74.44 H new ATOM 0 HE ARG A 134 -8.266 8.875 -1.771 1.00 74.30 H new ATOM 0 HH11 ARG A 134 -7.117 5.598 -1.130 1.00 30.45 H new ATOM 0 HH12 ARG A 134 -8.614 5.109 -0.328 1.00 30.45 H new ATOM 0 HH21 ARG A 134 -10.198 8.220 -0.793 1.00 15.35 H new ATOM 0 HH22 ARG A 134 -10.349 6.586 -0.139 1.00 15.35 H new ATOM 2081 N ASP A 135 -0.850 9.946 -2.570 1.00 33.10 N ATOM 2082 CA ASP A 135 0.139 10.411 -3.539 1.00 50.05 C ATOM 2083 C ASP A 135 0.785 9.246 -4.295 1.00 3.15 C ATOM 2084 O ASP A 135 0.739 9.203 -5.527 1.00 72.15 O ATOM 2085 CB ASP A 135 1.210 11.277 -2.852 1.00 25.40 C ATOM 2086 CG ASP A 135 1.913 10.574 -1.705 1.00 45.15 C ATOM 2087 OD1 ASP A 135 1.244 10.258 -0.695 1.00 11.14 O ATOM 2088 OD2 ASP A 135 3.134 10.336 -1.804 1.00 41.20 O ATOM 0 H ASP A 135 -0.673 10.246 -1.611 1.00 33.10 H new ATOM 0 HA ASP A 135 -0.385 11.025 -4.272 1.00 50.05 H new ATOM 0 HB2 ASP A 135 1.951 11.579 -3.592 1.00 25.40 H new ATOM 0 HB3 ASP A 135 0.744 12.189 -2.478 1.00 25.40 H new ATOM 2093 N ASP A 136 1.379 8.302 -3.573 1.00 62.11 N ATOM 2094 CA ASP A 136 1.966 7.129 -4.212 1.00 61.01 C ATOM 2095 C ASP A 136 0.872 6.151 -4.620 1.00 51.20 C ATOM 2096 O ASP A 136 0.927 5.553 -5.697 1.00 24.34 O ATOM 2097 CB ASP A 136 2.982 6.440 -3.296 1.00 44.53 C ATOM 2098 CG ASP A 136 3.940 5.549 -4.070 1.00 13.44 C ATOM 2099 OD1 ASP A 136 3.590 4.387 -4.357 1.00 23.43 O ATOM 2100 OD2 ASP A 136 5.059 6.011 -4.392 1.00 75.33 O ATOM 0 H ASP A 136 1.467 8.324 -2.557 1.00 62.11 H new ATOM 0 HA ASP A 136 2.497 7.463 -5.103 1.00 61.01 H new ATOM 0 HB2 ASP A 136 3.550 7.195 -2.752 1.00 44.53 H new ATOM 0 HB3 ASP A 136 2.453 5.843 -2.553 1.00 44.53 H new ATOM 2105 N LEU A 137 -0.135 6.011 -3.749 1.00 55.02 N ATOM 2106 CA LEU A 137 -1.250 5.093 -3.985 1.00 3.00 C ATOM 2107 C LEU A 137 -1.912 5.348 -5.341 1.00 13.45 C ATOM 2108 O LEU A 137 -2.092 4.429 -6.136 1.00 30.35 O ATOM 2109 CB LEU A 137 -2.314 5.222 -2.882 1.00 42.31 C ATOM 2110 CG LEU A 137 -2.299 4.154 -1.773 1.00 15.34 C ATOM 2111 CD1 LEU A 137 -1.908 2.794 -2.309 1.00 23.22 C ATOM 2112 CD2 LEU A 137 -1.383 4.544 -0.623 1.00 1.41 C ATOM 0 H LEU A 137 -0.198 6.526 -2.871 1.00 55.02 H new ATOM 0 HA LEU A 137 -0.834 4.086 -3.976 1.00 3.00 H new ATOM 0 HB2 LEU A 137 -2.200 6.200 -2.413 1.00 42.31 H new ATOM 0 HB3 LEU A 137 -3.296 5.207 -3.354 1.00 42.31 H new ATOM 0 HG LEU A 137 -3.318 4.093 -1.392 1.00 15.34 H new ATOM 0 HD11 LEU A 137 -1.909 2.068 -1.496 1.00 23.22 H new ATOM 0 HD12 LEU A 137 -2.622 2.485 -3.072 1.00 23.22 H new ATOM 0 HD13 LEU A 137 -0.911 2.848 -2.746 1.00 23.22 H new ATOM 0 HD21 LEU A 137 -1.402 3.764 0.138 1.00 1.41 H new ATOM 0 HD22 LEU A 137 -0.365 4.665 -0.994 1.00 1.41 H new ATOM 0 HD23 LEU A 137 -1.725 5.483 -0.188 1.00 1.41 H new ATOM 2124 N MET A 138 -2.261 6.600 -5.601 1.00 3.34 N ATOM 2125 CA MET A 138 -2.978 6.964 -6.818 1.00 2.41 C ATOM 2126 C MET A 138 -2.120 6.716 -8.052 1.00 31.03 C ATOM 2127 O MET A 138 -2.622 6.266 -9.083 1.00 4.12 O ATOM 2128 CB MET A 138 -3.414 8.434 -6.773 1.00 4.12 C ATOM 2129 CG MET A 138 -4.346 8.850 -7.911 1.00 31.10 C ATOM 2130 SD MET A 138 -6.075 8.386 -7.643 1.00 35.41 S ATOM 2131 CE MET A 138 -6.007 6.601 -7.765 1.00 72.21 C ATOM 0 H MET A 138 -2.059 7.386 -4.983 1.00 3.34 H new ATOM 0 HA MET A 138 -3.866 6.335 -6.880 1.00 2.41 H new ATOM 0 HB2 MET A 138 -3.913 8.624 -5.823 1.00 4.12 H new ATOM 0 HB3 MET A 138 -2.526 9.065 -6.798 1.00 4.12 H new ATOM 0 HG2 MET A 138 -4.285 9.930 -8.042 1.00 31.10 H new ATOM 0 HG3 MET A 138 -3.997 8.396 -8.839 1.00 31.10 H new ATOM 0 HE1 MET A 138 -6.929 6.232 -8.214 1.00 72.21 H new ATOM 0 HE2 MET A 138 -5.160 6.311 -8.386 1.00 72.21 H new ATOM 0 HE3 MET A 138 -5.891 6.172 -6.770 1.00 72.21 H new ATOM 2141 N ARG A 139 -0.824 6.995 -7.940 1.00 61.34 N ATOM 2142 CA ARG A 139 0.081 6.821 -9.067 1.00 72.14 C ATOM 2143 C ARG A 139 0.215 5.358 -9.459 1.00 34.34 C ATOM 2144 O ARG A 139 0.040 5.009 -10.629 1.00 13.43 O ATOM 2145 CB ARG A 139 1.468 7.392 -8.775 1.00 31.30 C ATOM 2146 CG ARG A 139 1.534 8.908 -8.804 1.00 12.12 C ATOM 2147 CD ARG A 139 2.958 9.394 -9.028 1.00 23.44 C ATOM 2148 NE ARG A 139 3.868 8.971 -7.964 1.00 61.02 N ATOM 2149 CZ ARG A 139 4.919 8.172 -8.150 1.00 70.44 C ATOM 2150 NH1 ARG A 139 5.185 7.681 -9.355 1.00 12.31 N ATOM 2151 NH2 ARG A 139 5.706 7.863 -7.127 1.00 41.02 N ATOM 0 H ARG A 139 -0.382 7.339 -7.088 1.00 61.34 H new ATOM 0 HA ARG A 139 -0.359 7.372 -9.898 1.00 72.14 H new ATOM 0 HB2 ARG A 139 1.793 7.044 -7.795 1.00 31.30 H new ATOM 0 HB3 ARG A 139 2.174 6.995 -9.505 1.00 31.30 H new ATOM 0 HG2 ARG A 139 0.889 9.287 -9.597 1.00 12.12 H new ATOM 0 HG3 ARG A 139 1.154 9.309 -7.864 1.00 12.12 H new ATOM 0 HD2 ARG A 139 3.321 9.016 -9.984 1.00 23.44 H new ATOM 0 HD3 ARG A 139 2.961 10.482 -9.093 1.00 23.44 H new ATOM 0 HE ARG A 139 3.687 9.309 -7.019 1.00 61.02 H new ATOM 0 HH11 ARG A 139 4.584 7.915 -10.145 1.00 12.31 H new ATOM 0 HH12 ARG A 139 5.991 7.070 -9.490 1.00 12.31 H new ATOM 0 HH21 ARG A 139 5.507 8.237 -6.199 1.00 41.02 H new ATOM 0 HH22 ARG A 139 6.510 7.252 -7.269 1.00 41.02 H new ATOM 2165 N PHE A 140 0.516 4.495 -8.495 1.00 11.32 N ATOM 2166 CA PHE A 140 0.763 3.100 -8.818 1.00 12.43 C ATOM 2167 C PHE A 140 -0.554 2.407 -9.155 1.00 32.14 C ATOM 2168 O PHE A 140 -0.577 1.492 -9.965 1.00 63.50 O ATOM 2169 CB PHE A 140 1.531 2.378 -7.693 1.00 3.01 C ATOM 2170 CG PHE A 140 0.705 1.574 -6.736 1.00 1.20 C ATOM 2171 CD1 PHE A 140 -0.109 2.179 -5.803 1.00 55.32 C ATOM 2172 CD2 PHE A 140 0.767 0.191 -6.767 1.00 52.04 C ATOM 2173 CE1 PHE A 140 -0.854 1.421 -4.925 1.00 32.21 C ATOM 2174 CE2 PHE A 140 0.026 -0.571 -5.891 1.00 42.25 C ATOM 2175 CZ PHE A 140 -0.787 0.044 -4.967 1.00 14.13 C ATOM 0 H PHE A 140 0.593 4.731 -7.506 1.00 11.32 H new ATOM 0 HA PHE A 140 1.406 3.055 -9.697 1.00 12.43 H new ATOM 0 HB2 PHE A 140 2.266 1.716 -8.151 1.00 3.01 H new ATOM 0 HB3 PHE A 140 2.085 3.124 -7.124 1.00 3.01 H new ATOM 0 HD1 PHE A 140 -0.164 3.257 -5.759 1.00 55.32 H new ATOM 0 HD2 PHE A 140 1.406 -0.297 -7.488 1.00 52.04 H new ATOM 0 HE1 PHE A 140 -1.492 1.907 -4.202 1.00 32.21 H new ATOM 0 HE2 PHE A 140 0.083 -1.649 -5.929 1.00 42.25 H new ATOM 0 HZ PHE A 140 -1.370 -0.549 -4.278 1.00 14.13 H new ATOM 2185 N LYS A 141 -1.648 2.873 -8.547 1.00 25.12 N ATOM 2186 CA LYS A 141 -2.992 2.399 -8.885 1.00 62.53 C ATOM 2187 C LYS A 141 -3.228 2.583 -10.377 1.00 50.21 C ATOM 2188 O LYS A 141 -3.640 1.660 -11.080 1.00 52.35 O ATOM 2189 CB LYS A 141 -4.038 3.187 -8.070 1.00 61.31 C ATOM 2190 CG LYS A 141 -5.481 2.696 -8.196 1.00 61.03 C ATOM 2191 CD LYS A 141 -6.152 3.153 -9.484 1.00 52.40 C ATOM 2192 CE LYS A 141 -7.638 2.824 -9.481 1.00 2.41 C ATOM 2193 NZ LYS A 141 -8.274 3.117 -10.791 1.00 43.34 N ATOM 0 H LYS A 141 -1.628 3.582 -7.814 1.00 25.12 H new ATOM 0 HA LYS A 141 -3.085 1.341 -8.640 1.00 62.53 H new ATOM 0 HB2 LYS A 141 -3.753 3.154 -7.019 1.00 61.31 H new ATOM 0 HB3 LYS A 141 -4.000 4.232 -8.378 1.00 61.31 H new ATOM 0 HG2 LYS A 141 -5.494 1.607 -8.152 1.00 61.03 H new ATOM 0 HG3 LYS A 141 -6.058 3.056 -7.344 1.00 61.03 H new ATOM 0 HD2 LYS A 141 -6.016 4.228 -9.606 1.00 52.40 H new ATOM 0 HD3 LYS A 141 -5.673 2.672 -10.337 1.00 52.40 H new ATOM 0 HE2 LYS A 141 -7.776 1.770 -9.238 1.00 2.41 H new ATOM 0 HE3 LYS A 141 -8.135 3.399 -8.700 1.00 2.41 H new ATOM 0 HZ1 LYS A 141 -9.305 3.009 -10.708 1.00 43.34 H new ATOM 0 HZ2 LYS A 141 -8.050 4.092 -11.075 1.00 43.34 H new ATOM 0 HZ3 LYS A 141 -7.913 2.456 -11.508 1.00 43.34 H new ATOM 2207 N ARG A 142 -2.948 3.797 -10.833 1.00 11.33 N ATOM 2208 CA ARG A 142 -3.052 4.165 -12.243 1.00 32.51 C ATOM 2209 C ARG A 142 -2.277 3.197 -13.138 1.00 2.01 C ATOM 2210 O ARG A 142 -2.833 2.611 -14.068 1.00 14.20 O ATOM 2211 CB ARG A 142 -2.509 5.585 -12.430 1.00 73.42 C ATOM 2212 CG ARG A 142 -2.281 5.988 -13.876 1.00 50.32 C ATOM 2213 CD ARG A 142 -1.393 7.221 -13.966 1.00 20.32 C ATOM 2214 NE ARG A 142 -0.076 6.986 -13.365 1.00 64.31 N ATOM 2215 CZ ARG A 142 0.758 7.955 -12.984 1.00 11.11 C ATOM 2216 NH1 ARG A 142 0.396 9.227 -13.077 1.00 11.21 N ATOM 2217 NH2 ARG A 142 1.950 7.655 -12.483 1.00 25.40 N ATOM 0 H ARG A 142 -2.640 4.561 -10.232 1.00 11.33 H new ATOM 0 HA ARG A 142 -4.102 4.118 -12.533 1.00 32.51 H new ATOM 0 HB2 ARG A 142 -3.206 6.289 -11.976 1.00 73.42 H new ATOM 0 HB3 ARG A 142 -1.567 5.674 -11.889 1.00 73.42 H new ATOM 0 HG2 ARG A 142 -1.820 5.163 -14.419 1.00 50.32 H new ATOM 0 HG3 ARG A 142 -3.239 6.189 -14.356 1.00 50.32 H new ATOM 0 HD2 ARG A 142 -1.271 7.506 -15.011 1.00 20.32 H new ATOM 0 HD3 ARG A 142 -1.879 8.057 -13.463 1.00 20.32 H new ATOM 0 HE ARG A 142 0.221 6.020 -13.230 1.00 64.31 H new ATOM 0 HH11 ARG A 142 -0.525 9.470 -13.442 1.00 11.21 H new ATOM 0 HH12 ARG A 142 1.039 9.963 -12.784 1.00 11.21 H new ATOM 0 HH21 ARG A 142 2.232 6.679 -12.388 1.00 25.40 H new ATOM 0 HH22 ARG A 142 2.584 8.400 -12.193 1.00 25.40 H new ATOM 2231 N GLU A 143 -0.997 3.029 -12.839 1.00 1.24 N ATOM 2232 CA GLU A 143 -0.105 2.236 -13.676 1.00 2.10 C ATOM 2233 C GLU A 143 -0.385 0.738 -13.545 1.00 22.15 C ATOM 2234 O GLU A 143 -0.278 -0.007 -14.516 1.00 1.04 O ATOM 2235 CB GLU A 143 1.351 2.550 -13.310 1.00 50.33 C ATOM 2236 CG GLU A 143 1.760 3.977 -13.652 1.00 24.44 C ATOM 2237 CD GLU A 143 3.044 4.412 -12.973 1.00 62.15 C ATOM 2238 OE1 GLU A 143 4.123 3.911 -13.345 1.00 73.10 O ATOM 2239 OE2 GLU A 143 2.974 5.267 -12.065 1.00 62.44 O ATOM 0 H GLU A 143 -0.549 3.434 -12.017 1.00 1.24 H new ATOM 0 HA GLU A 143 -0.284 2.503 -14.717 1.00 2.10 H new ATOM 0 HB2 GLU A 143 1.495 2.383 -12.242 1.00 50.33 H new ATOM 0 HB3 GLU A 143 2.008 1.855 -13.832 1.00 50.33 H new ATOM 0 HG2 GLU A 143 1.881 4.064 -14.732 1.00 24.44 H new ATOM 0 HG3 GLU A 143 0.957 4.656 -13.365 1.00 24.44 H new ATOM 2246 N GLN A 144 -0.778 0.316 -12.351 1.00 23.24 N ATOM 2247 CA GLN A 144 -0.959 -1.100 -12.043 1.00 34.20 C ATOM 2248 C GLN A 144 -2.033 -1.748 -12.910 1.00 11.15 C ATOM 2249 O GLN A 144 -1.840 -2.852 -13.424 1.00 52.05 O ATOM 2250 CB GLN A 144 -1.303 -1.264 -10.564 1.00 51.40 C ATOM 2251 CG GLN A 144 -1.423 -2.704 -10.110 1.00 64.31 C ATOM 2252 CD GLN A 144 -1.332 -2.831 -8.609 1.00 12.13 C ATOM 2253 OE1 GLN A 144 -1.747 -1.946 -7.872 1.00 62.04 O ATOM 2254 NE2 GLN A 144 -0.767 -3.929 -8.148 1.00 75.43 N ATOM 0 H GLN A 144 -0.980 0.941 -11.570 1.00 23.24 H new ATOM 0 HA GLN A 144 -0.021 -1.609 -12.263 1.00 34.20 H new ATOM 0 HB2 GLN A 144 -0.537 -0.769 -9.967 1.00 51.40 H new ATOM 0 HB3 GLN A 144 -2.244 -0.752 -10.362 1.00 51.40 H new ATOM 0 HG2 GLN A 144 -2.373 -3.114 -10.452 1.00 64.31 H new ATOM 0 HG3 GLN A 144 -0.634 -3.297 -10.573 1.00 64.31 H new ATOM 0 HE21 GLN A 144 -0.434 -4.642 -8.797 1.00 75.43 H new ATOM 0 HE22 GLN A 144 -0.662 -4.065 -7.143 1.00 75.43 H new ATOM 2263 N GLU A 145 -3.163 -1.076 -13.081 1.00 73.40 N ATOM 2264 CA GLU A 145 -4.243 -1.646 -13.873 1.00 50.24 C ATOM 2265 C GLU A 145 -4.056 -1.343 -15.356 1.00 61.43 C ATOM 2266 O GLU A 145 -4.777 -1.872 -16.202 1.00 5.25 O ATOM 2267 CB GLU A 145 -5.611 -1.153 -13.400 1.00 41.11 C ATOM 2268 CG GLU A 145 -5.810 0.347 -13.505 1.00 75.42 C ATOM 2269 CD GLU A 145 -7.259 0.732 -13.314 1.00 25.01 C ATOM 2270 OE1 GLU A 145 -8.009 0.742 -14.312 1.00 71.44 O ATOM 2271 OE2 GLU A 145 -7.665 1.001 -12.167 1.00 54.21 O ATOM 0 H GLU A 145 -3.354 -0.153 -12.690 1.00 73.40 H new ATOM 0 HA GLU A 145 -4.207 -2.726 -13.732 1.00 50.24 H new ATOM 0 HB2 GLU A 145 -6.385 -1.651 -13.984 1.00 41.11 H new ATOM 0 HB3 GLU A 145 -5.752 -1.454 -12.362 1.00 41.11 H new ATOM 0 HG2 GLU A 145 -5.198 0.849 -12.756 1.00 75.42 H new ATOM 0 HG3 GLU A 145 -5.467 0.693 -14.480 1.00 75.42 H new ATOM 2278 N LEU A 146 -3.092 -0.493 -15.667 1.00 42.22 N ATOM 2279 CA LEU A 146 -2.769 -0.192 -17.051 1.00 43.52 C ATOM 2280 C LEU A 146 -1.817 -1.247 -17.602 1.00 20.21 C ATOM 2281 O LEU A 146 -2.083 -1.868 -18.634 1.00 3.15 O ATOM 2282 CB LEU A 146 -2.139 1.199 -17.168 1.00 43.30 C ATOM 2283 CG LEU A 146 -1.800 1.639 -18.594 1.00 4.34 C ATOM 2284 CD1 LEU A 146 -3.067 1.765 -19.429 1.00 1.32 C ATOM 2285 CD2 LEU A 146 -1.031 2.952 -18.584 1.00 31.41 C ATOM 0 H LEU A 146 -2.520 0.000 -14.981 1.00 42.22 H new ATOM 0 HA LEU A 146 -3.690 -0.202 -17.634 1.00 43.52 H new ATOM 0 HB2 LEU A 146 -2.822 1.928 -16.732 1.00 43.30 H new ATOM 0 HB3 LEU A 146 -1.227 1.219 -16.571 1.00 43.30 H new ATOM 0 HG LEU A 146 -1.165 0.877 -19.046 1.00 4.34 H new ATOM 0 HD11 LEU A 146 -2.807 2.079 -20.440 1.00 1.32 H new ATOM 0 HD12 LEU A 146 -3.575 0.801 -19.468 1.00 1.32 H new ATOM 0 HD13 LEU A 146 -3.728 2.505 -18.978 1.00 1.32 H new ATOM 0 HD21 LEU A 146 -0.800 3.246 -19.608 1.00 31.41 H new ATOM 0 HD22 LEU A 146 -1.637 3.725 -18.112 1.00 31.41 H new ATOM 0 HD23 LEU A 146 -0.104 2.826 -18.025 1.00 31.41 H new ATOM 2297 N GLY A 147 -0.723 -1.454 -16.888 1.00 11.14 N ATOM 2298 CA GLY A 147 0.282 -2.405 -17.307 1.00 14.24 C ATOM 2299 C GLY A 147 1.671 -1.860 -17.074 1.00 33.53 C ATOM 2300 O GLY A 147 1.812 -0.766 -16.524 1.00 43.40 O ATOM 0 H GLY A 147 -0.512 -0.973 -16.014 1.00 11.14 H new ATOM 0 HA2 GLY A 147 0.156 -3.338 -16.758 1.00 14.24 H new ATOM 0 HA3 GLY A 147 0.151 -2.637 -18.364 1.00 14.24 H new