USER MOD reduce.3.24.130724 H: found=0, std=0, add=1184, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1180 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: B 5 GLN : amide:sc= 0.445 K(o=0.97,f=-2.6!) USER MOD Set 1.2: B 9 HIS : no HE2:sc= 0.525 K(o=0.97,f=-3.8) USER MOD Set 2.1: A 140 MET CE :methyl 162:sc= -0.42 (180deg=-0.786) USER MOD Set 2.2: A 141 MET CE :methyl 176:sc= -0.75 (180deg=-0.85) USER MOD Set 3.1: A 105 MET CE :methyl 178:sc= 0 (180deg=0) USER MOD Set 3.2: A 120 MET CE :methyl 168:sc= -0.773 (180deg=-1.03) USER MOD Set 3.3: B 7 THR OG1 : rot 84:sc= 0.95 USER MOD Set 4.1: A 90 LYS NZ :NH3+ -175:sc= 1.22 (180deg=0) USER MOD Set 4.2: A 103 HIS : no HE2:sc= 0.404 K(o=0.99,f=-4.6) USER MOD Set 4.3: A 107 ASN : amide:sc= -0.634 X(o=0.99,f=0.84) USER MOD Set 5.1: A 56 ASN : amide:sc= 1.42 K(o=1.7,f=-6.9!) USER MOD Set 5.2: A 58 THR OG1 : rot 27:sc= 0.247 USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 9 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0359) USER MOD Single : A 13 SER OG : rot 169:sc= 1.28 USER MOD Single : A 17 LYS NZ :NH3+ -146:sc= 0.931 (180deg=0.285) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 THR OG1 : rot 180:sc= 0.0353 USER MOD Single : A 25 THR OG1 : rot 180:sc= 0.0356 USER MOD Single : A 26 LYS NZ :NH3+ -108:sc= 0.55 (180deg=-0.544!) USER MOD Single : A 30 THR OG1 : rot 83:sc= 1.04 USER MOD Single : A 32 MET CE :methyl 173:sc= 0 (180deg=-0.0583) USER MOD Single : A 34 SER OG : rot 91:sc= 0.649 USER MOD Single : A 37 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 38 ASN : amide:sc=-0.00562 K(o=-0.0056,f=-2.8!) USER MOD Single : A 40 THR OG1 : rot -60:sc= 0.951 USER MOD Single : A 45 GLN : amide:sc= -0.0467 X(o=-0.047,f=0) USER MOD Single : A 47 MET CE :methyl 177:sc= 0 (180deg=-0.00893) USER MOD Single : A 49 ASN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 66 THR OG1 : rot 78:sc= 1.06 USER MOD Single : A 67 MET CE :methyl -147:sc= -0.0533 (180deg=-2.23!) USER MOD Single : A 68 MET CE :methyl 175:sc= 0 (180deg=-0.0542) USER MOD Single : A 71 LYS NZ :NH3+ -148:sc= 2.57 (180deg=1.32) USER MOD Single : A 72 MET CE :methyl 177:sc= -0.13 (180deg=-0.177) USER MOD Single : A 73 LYS NZ :NH3+ -136:sc= 1.29 (180deg=-0.13) USER MOD Single : A 75 THR OG1 : rot 180:sc= -0.073 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 93 ASN : amide:sc= -0.504 K(o=-0.5,f=-5.5!) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot -56:sc= 0.986 USER MOD Single : A 106 THR OG1 : rot 77:sc= 0.588 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0.00551 USER MOD Single : A 131 GLN : amide:sc= -0.128 X(o=-0.13,f=-0.35) USER MOD Single : A 133 ASN : amide:sc= -0.165 K(o=-0.16,f=-7.4!) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 139 GLN : amide:sc=-0.000623 K(o=-0.00062,f=-1.4) USER MOD Single : A 142 THR OG1 : rot 81:sc= 0.494 USER MOD Single : B 1 ARG N :NH3+ -171:sc= 1.08 (180deg=0.747) USER MOD Single : B 3 LYS NZ :NH3+ -148:sc= 1.19 (180deg=0.8) USER MOD Single : B 6 LYS NZ :NH3+ -145:sc= 1.27 (180deg=0.969) USER MOD ----------------------------------------------------------------- ATOM 29 N GLU A 3 -0.975 0.856 16.744 1.00 0.00 N ATOM 30 CA GLU A 3 -1.787 0.367 15.673 1.00 0.00 C ATOM 31 C GLU A 3 -1.128 0.500 14.343 1.00 0.00 C ATOM 32 O GLU A 3 -0.959 -0.524 13.684 1.00 0.00 O ATOM 33 CB GLU A 3 -3.178 1.018 15.588 1.00 0.00 C ATOM 34 CG GLU A 3 -4.129 0.402 14.560 1.00 0.00 C ATOM 35 CD GLU A 3 -5.612 0.723 14.678 1.00 0.00 C ATOM 36 OE1 GLU A 3 -6.291 0.184 15.591 1.00 0.00 O ATOM 37 OE2 GLU A 3 -6.064 1.630 13.928 1.00 0.00 O ATOM 0 HA GLU A 3 -1.917 -0.687 15.918 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -3.647 0.963 16.570 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -3.052 2.075 15.354 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -3.797 0.713 13.569 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -4.017 -0.681 14.608 1.00 0.00 H new ATOM 44 N GLN A 4 -0.723 1.708 13.912 1.00 0.00 N ATOM 45 CA GLN A 4 -0.031 2.031 12.703 1.00 0.00 C ATOM 46 C GLN A 4 1.323 1.414 12.624 1.00 0.00 C ATOM 47 O GLN A 4 1.710 0.969 11.544 1.00 0.00 O ATOM 48 CB GLN A 4 0.065 3.557 12.542 1.00 0.00 C ATOM 49 CG GLN A 4 0.267 3.942 11.075 1.00 0.00 C ATOM 50 CD GLN A 4 0.418 5.441 10.859 1.00 0.00 C ATOM 51 OE1 GLN A 4 1.403 6.128 11.126 1.00 0.00 O ATOM 52 NE2 GLN A 4 -0.672 6.035 10.302 1.00 0.00 N ATOM 0 H GLN A 4 -0.900 2.543 14.470 1.00 0.00 H new ATOM 0 HA GLN A 4 -0.612 1.610 11.882 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -0.843 4.024 12.923 1.00 0.00 H new ATOM 0 HB3 GLN A 4 0.894 3.938 13.139 1.00 0.00 H new ATOM 0 HG2 GLN A 4 1.154 3.436 10.693 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -0.581 3.582 10.492 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -1.496 5.478 10.075 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -0.665 7.037 10.111 1.00 0.00 H new ATOM 61 N ILE A 5 2.050 1.287 13.748 1.00 0.00 N ATOM 62 CA ILE A 5 3.211 0.454 13.820 1.00 0.00 C ATOM 63 C ILE A 5 2.964 -0.990 13.552 1.00 0.00 C ATOM 64 O ILE A 5 3.574 -1.541 12.637 1.00 0.00 O ATOM 65 CB ILE A 5 3.917 0.640 15.131 1.00 0.00 C ATOM 66 CG1 ILE A 5 4.436 2.087 15.140 1.00 0.00 C ATOM 67 CG2 ILE A 5 5.140 -0.285 15.249 1.00 0.00 C ATOM 68 CD1 ILE A 5 5.127 2.544 16.425 1.00 0.00 C ATOM 0 H ILE A 5 1.830 1.769 14.620 1.00 0.00 H new ATOM 0 HA ILE A 5 3.853 0.788 13.005 1.00 0.00 H new ATOM 0 HB ILE A 5 3.232 0.417 15.949 1.00 0.00 H new ATOM 0 HG12 ILE A 5 5.136 2.206 14.313 1.00 0.00 H new ATOM 0 HG13 ILE A 5 3.596 2.754 14.946 1.00 0.00 H new ATOM 0 HG21 ILE A 5 5.627 -0.123 16.211 1.00 0.00 H new ATOM 0 HG22 ILE A 5 4.819 -1.324 15.175 1.00 0.00 H new ATOM 0 HG23 ILE A 5 5.842 -0.064 14.445 1.00 0.00 H new ATOM 0 HD11 ILE A 5 5.451 3.579 16.316 1.00 0.00 H new ATOM 0 HD12 ILE A 5 4.430 2.468 17.260 1.00 0.00 H new ATOM 0 HD13 ILE A 5 5.994 1.911 16.617 1.00 0.00 H new ATOM 80 N ALA A 6 1.965 -1.677 14.136 1.00 0.00 N ATOM 81 CA ALA A 6 1.585 -3.030 13.875 1.00 0.00 C ATOM 82 C ALA A 6 1.092 -3.289 12.493 1.00 0.00 C ATOM 83 O ALA A 6 1.444 -4.322 11.926 1.00 0.00 O ATOM 84 CB ALA A 6 0.643 -3.548 14.974 1.00 0.00 C ATOM 0 H ALA A 6 1.376 -1.248 14.850 1.00 0.00 H new ATOM 0 HA ALA A 6 2.501 -3.619 13.916 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.365 -4.579 14.758 1.00 0.00 H new ATOM 0 HB2 ALA A 6 1.149 -3.503 15.938 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -0.254 -2.929 15.006 1.00 0.00 H new ATOM 90 N GLU A 7 0.375 -2.321 11.894 1.00 0.00 N ATOM 91 CA GLU A 7 -0.138 -2.452 10.566 1.00 0.00 C ATOM 92 C GLU A 7 0.915 -2.396 9.512 1.00 0.00 C ATOM 93 O GLU A 7 0.775 -3.050 8.480 1.00 0.00 O ATOM 94 CB GLU A 7 -1.100 -1.300 10.232 1.00 0.00 C ATOM 95 CG GLU A 7 -2.516 -1.545 10.759 1.00 0.00 C ATOM 96 CD GLU A 7 -3.381 -0.293 10.794 1.00 0.00 C ATOM 97 OE1 GLU A 7 -2.876 0.753 10.306 1.00 0.00 O ATOM 98 OE2 GLU A 7 -4.562 -0.300 11.231 1.00 0.00 O ATOM 0 H GLU A 7 0.148 -1.432 12.340 1.00 0.00 H new ATOM 0 HA GLU A 7 -0.626 -3.427 10.561 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -0.713 -0.374 10.657 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -1.137 -1.164 9.151 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -3.002 -2.294 10.134 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -2.453 -1.961 11.765 1.00 0.00 H new ATOM 105 N PHE A 8 2.068 -1.745 9.745 1.00 0.00 N ATOM 106 CA PHE A 8 3.211 -1.684 8.887 1.00 0.00 C ATOM 107 C PHE A 8 4.097 -2.841 9.199 1.00 0.00 C ATOM 108 O PHE A 8 4.544 -3.588 8.330 1.00 0.00 O ATOM 109 CB PHE A 8 3.878 -0.332 9.192 1.00 0.00 C ATOM 110 CG PHE A 8 4.839 0.037 8.114 1.00 0.00 C ATOM 111 CD1 PHE A 8 6.152 -0.368 8.175 1.00 0.00 C ATOM 112 CD2 PHE A 8 4.474 0.815 7.041 1.00 0.00 C ATOM 113 CE1 PHE A 8 7.036 0.014 7.193 1.00 0.00 C ATOM 114 CE2 PHE A 8 5.340 1.219 6.053 1.00 0.00 C ATOM 115 CZ PHE A 8 6.621 0.721 6.089 1.00 0.00 C ATOM 0 H PHE A 8 2.211 -1.217 10.606 1.00 0.00 H new ATOM 0 HA PHE A 8 2.970 -1.747 7.826 1.00 0.00 H new ATOM 0 HB2 PHE A 8 3.116 0.442 9.287 1.00 0.00 H new ATOM 0 HB3 PHE A 8 4.399 -0.385 10.148 1.00 0.00 H new ATOM 0 HD1 PHE A 8 6.489 -0.986 8.994 1.00 0.00 H new ATOM 0 HD2 PHE A 8 3.443 1.128 6.970 1.00 0.00 H new ATOM 0 HE1 PHE A 8 8.079 -0.247 7.291 1.00 0.00 H new ATOM 0 HE2 PHE A 8 5.026 1.902 5.278 1.00 0.00 H new ATOM 0 HZ PHE A 8 7.294 0.883 5.260 1.00 0.00 H new ATOM 125 N LYS A 9 4.282 -3.254 10.465 1.00 0.00 N ATOM 126 CA LYS A 9 5.046 -4.374 10.919 1.00 0.00 C ATOM 127 C LYS A 9 4.495 -5.668 10.428 1.00 0.00 C ATOM 128 O LYS A 9 5.275 -6.558 10.092 1.00 0.00 O ATOM 129 CB LYS A 9 5.021 -4.444 12.455 1.00 0.00 C ATOM 130 CG LYS A 9 6.133 -5.386 12.922 1.00 0.00 C ATOM 131 CD LYS A 9 6.239 -5.345 14.448 1.00 0.00 C ATOM 132 CE LYS A 9 7.286 -6.339 14.953 1.00 0.00 C ATOM 133 NZ LYS A 9 8.648 -5.877 14.601 1.00 0.00 N ATOM 0 H LYS A 9 3.854 -2.754 11.244 1.00 0.00 H new ATOM 0 HA LYS A 9 6.055 -4.231 10.533 1.00 0.00 H new ATOM 0 HB2 LYS A 9 5.164 -3.451 12.881 1.00 0.00 H new ATOM 0 HB3 LYS A 9 4.052 -4.803 12.801 1.00 0.00 H new ATOM 0 HG2 LYS A 9 5.924 -6.403 12.590 1.00 0.00 H new ATOM 0 HG3 LYS A 9 7.083 -5.093 12.474 1.00 0.00 H new ATOM 0 HD2 LYS A 9 6.503 -4.338 14.771 1.00 0.00 H new ATOM 0 HD3 LYS A 9 5.270 -5.577 14.890 1.00 0.00 H new ATOM 0 HE2 LYS A 9 7.200 -6.449 16.034 1.00 0.00 H new ATOM 0 HE3 LYS A 9 7.104 -7.321 14.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 9.352 -6.486 15.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 8.775 -5.924 13.570 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 8.775 -4.896 14.921 1.00 0.00 H new ATOM 147 N GLU A 10 3.170 -5.802 10.243 1.00 0.00 N ATOM 148 CA GLU A 10 2.520 -6.936 9.665 1.00 0.00 C ATOM 149 C GLU A 10 2.873 -7.289 8.261 1.00 0.00 C ATOM 150 O GLU A 10 2.581 -8.394 7.808 1.00 0.00 O ATOM 151 CB GLU A 10 0.992 -6.767 9.728 1.00 0.00 C ATOM 152 CG GLU A 10 0.563 -7.072 11.165 1.00 0.00 C ATOM 153 CD GLU A 10 0.467 -8.578 11.363 1.00 0.00 C ATOM 154 OE1 GLU A 10 1.500 -9.209 11.711 1.00 0.00 O ATOM 155 OE2 GLU A 10 -0.692 -9.071 11.314 1.00 0.00 O ATOM 0 H GLU A 10 2.512 -5.072 10.515 1.00 0.00 H new ATOM 0 HA GLU A 10 2.892 -7.758 10.277 1.00 0.00 H new ATOM 0 HB2 GLU A 10 0.705 -5.754 9.447 1.00 0.00 H new ATOM 0 HB3 GLU A 10 0.501 -7.443 9.028 1.00 0.00 H new ATOM 0 HG2 GLU A 10 1.281 -6.648 11.867 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -0.400 -6.606 11.374 1.00 0.00 H new ATOM 162 N ALA A 11 3.556 -6.433 7.480 1.00 0.00 N ATOM 163 CA ALA A 11 4.076 -6.752 6.186 1.00 0.00 C ATOM 164 C ALA A 11 5.190 -7.736 6.284 1.00 0.00 C ATOM 165 O ALA A 11 5.222 -8.755 5.596 1.00 0.00 O ATOM 166 CB ALA A 11 4.753 -5.522 5.558 1.00 0.00 C ATOM 0 H ALA A 11 3.755 -5.474 7.764 1.00 0.00 H new ATOM 0 HA ALA A 11 3.229 -7.124 5.609 1.00 0.00 H new ATOM 0 HB1 ALA A 11 5.142 -5.784 4.574 1.00 0.00 H new ATOM 0 HB2 ALA A 11 4.025 -4.717 5.458 1.00 0.00 H new ATOM 0 HB3 ALA A 11 5.572 -5.192 6.197 1.00 0.00 H new ATOM 172 N PHE A 12 6.194 -7.435 7.127 1.00 0.00 N ATOM 173 CA PHE A 12 7.260 -8.304 7.520 1.00 0.00 C ATOM 174 C PHE A 12 6.826 -9.639 8.019 1.00 0.00 C ATOM 175 O PHE A 12 7.546 -10.626 7.885 1.00 0.00 O ATOM 176 CB PHE A 12 8.053 -7.695 8.689 1.00 0.00 C ATOM 177 CG PHE A 12 8.717 -6.503 8.092 1.00 0.00 C ATOM 178 CD1 PHE A 12 9.949 -6.607 7.490 1.00 0.00 C ATOM 179 CD2 PHE A 12 8.205 -5.243 8.294 1.00 0.00 C ATOM 180 CE1 PHE A 12 10.621 -5.486 7.061 1.00 0.00 C ATOM 181 CE2 PHE A 12 8.834 -4.092 7.882 1.00 0.00 C ATOM 182 CZ PHE A 12 10.010 -4.261 7.191 1.00 0.00 C ATOM 0 H PHE A 12 6.265 -6.517 7.565 1.00 0.00 H new ATOM 0 HA PHE A 12 7.841 -8.424 6.606 1.00 0.00 H new ATOM 0 HB2 PHE A 12 7.397 -7.415 9.513 1.00 0.00 H new ATOM 0 HB3 PHE A 12 8.782 -8.401 9.087 1.00 0.00 H new ATOM 0 HD1 PHE A 12 10.395 -7.581 7.352 1.00 0.00 H new ATOM 0 HD2 PHE A 12 7.257 -5.153 8.804 1.00 0.00 H new ATOM 0 HE1 PHE A 12 11.608 -5.566 6.631 1.00 0.00 H new ATOM 0 HE2 PHE A 12 8.428 -3.113 8.089 1.00 0.00 H new ATOM 0 HZ PHE A 12 10.472 -3.399 6.733 1.00 0.00 H new ATOM 192 N SER A 13 5.616 -9.831 8.574 1.00 0.00 N ATOM 193 CA SER A 13 5.122 -11.133 8.899 1.00 0.00 C ATOM 194 C SER A 13 4.858 -11.904 7.652 1.00 0.00 C ATOM 195 O SER A 13 5.145 -13.098 7.569 1.00 0.00 O ATOM 196 CB SER A 13 3.839 -11.022 9.740 1.00 0.00 C ATOM 197 OG SER A 13 3.884 -10.107 10.825 1.00 0.00 O ATOM 0 H SER A 13 4.972 -9.073 8.800 1.00 0.00 H new ATOM 0 HA SER A 13 5.876 -11.659 9.485 1.00 0.00 H new ATOM 0 HB2 SER A 13 3.020 -10.734 9.081 1.00 0.00 H new ATOM 0 HB3 SER A 13 3.599 -12.010 10.133 1.00 0.00 H new ATOM 0 HG SER A 13 2.980 -9.978 11.182 1.00 0.00 H new ATOM 203 N LEU A 14 4.275 -11.279 6.613 1.00 0.00 N ATOM 204 CA LEU A 14 3.851 -11.803 5.352 1.00 0.00 C ATOM 205 C LEU A 14 4.985 -12.011 4.409 1.00 0.00 C ATOM 206 O LEU A 14 5.163 -13.079 3.826 1.00 0.00 O ATOM 207 CB LEU A 14 2.790 -10.911 4.686 1.00 0.00 C ATOM 208 CG LEU A 14 2.196 -11.314 3.326 1.00 0.00 C ATOM 209 CD1 LEU A 14 1.557 -12.713 3.355 1.00 0.00 C ATOM 210 CD2 LEU A 14 1.355 -10.157 2.760 1.00 0.00 C ATOM 0 H LEU A 14 4.078 -10.280 6.669 1.00 0.00 H new ATOM 0 HA LEU A 14 3.408 -12.774 5.574 1.00 0.00 H new ATOM 0 HB2 LEU A 14 1.961 -10.814 5.387 1.00 0.00 H new ATOM 0 HB3 LEU A 14 3.226 -9.919 4.569 1.00 0.00 H new ATOM 0 HG LEU A 14 2.987 -11.458 2.590 1.00 0.00 H new ATOM 0 HD11 LEU A 14 1.153 -12.949 2.371 1.00 0.00 H new ATOM 0 HD12 LEU A 14 2.312 -13.452 3.624 1.00 0.00 H new ATOM 0 HD13 LEU A 14 0.753 -12.731 4.091 1.00 0.00 H new ATOM 0 HD21 LEU A 14 0.937 -10.449 1.797 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.545 -9.924 3.451 1.00 0.00 H new ATOM 0 HD23 LEU A 14 1.986 -9.278 2.631 1.00 0.00 H new ATOM 222 N PHE A 15 5.875 -11.009 4.286 1.00 0.00 N ATOM 223 CA PHE A 15 6.965 -11.157 3.373 1.00 0.00 C ATOM 224 C PHE A 15 8.021 -12.105 3.824 1.00 0.00 C ATOM 225 O PHE A 15 8.473 -12.954 3.056 1.00 0.00 O ATOM 226 CB PHE A 15 7.555 -9.747 3.198 1.00 0.00 C ATOM 227 CG PHE A 15 6.827 -8.833 2.273 1.00 0.00 C ATOM 228 CD1 PHE A 15 6.154 -9.292 1.165 1.00 0.00 C ATOM 229 CD2 PHE A 15 6.877 -7.476 2.489 1.00 0.00 C ATOM 230 CE1 PHE A 15 5.454 -8.441 0.342 1.00 0.00 C ATOM 231 CE2 PHE A 15 6.293 -6.584 1.621 1.00 0.00 C ATOM 232 CZ PHE A 15 5.659 -7.092 0.512 1.00 0.00 C ATOM 0 H PHE A 15 5.844 -10.127 4.798 1.00 0.00 H new ATOM 0 HA PHE A 15 6.594 -11.588 2.443 1.00 0.00 H new ATOM 0 HB2 PHE A 15 7.603 -9.273 4.178 1.00 0.00 H new ATOM 0 HB3 PHE A 15 8.580 -9.848 2.842 1.00 0.00 H new ATOM 0 HD1 PHE A 15 6.176 -10.347 0.935 1.00 0.00 H new ATOM 0 HD2 PHE A 15 7.388 -7.101 3.363 1.00 0.00 H new ATOM 0 HE1 PHE A 15 4.772 -8.817 -0.406 1.00 0.00 H new ATOM 0 HE2 PHE A 15 6.331 -5.520 1.804 1.00 0.00 H new ATOM 0 HZ PHE A 15 5.311 -6.410 -0.250 1.00 0.00 H new ATOM 242 N ASP A 16 8.463 -12.197 5.091 1.00 0.00 N ATOM 243 CA ASP A 16 9.551 -13.034 5.493 1.00 0.00 C ATOM 244 C ASP A 16 9.153 -14.454 5.708 1.00 0.00 C ATOM 245 O ASP A 16 8.172 -14.770 6.379 1.00 0.00 O ATOM 246 CB ASP A 16 9.999 -12.408 6.825 1.00 0.00 C ATOM 247 CG ASP A 16 11.447 -12.790 7.098 1.00 0.00 C ATOM 248 OD1 ASP A 16 11.854 -13.982 7.067 1.00 0.00 O ATOM 249 OD2 ASP A 16 12.282 -11.901 7.411 1.00 0.00 O ATOM 0 H ASP A 16 8.050 -11.672 5.861 1.00 0.00 H new ATOM 0 HA ASP A 16 10.325 -13.075 4.727 1.00 0.00 H new ATOM 0 HB2 ASP A 16 9.899 -11.323 6.782 1.00 0.00 H new ATOM 0 HB3 ASP A 16 9.360 -12.756 7.637 1.00 0.00 H new ATOM 254 N LYS A 17 9.967 -15.381 5.172 1.00 0.00 N ATOM 255 CA LYS A 17 9.738 -16.790 5.260 1.00 0.00 C ATOM 256 C LYS A 17 10.619 -17.530 6.207 1.00 0.00 C ATOM 257 O LYS A 17 10.522 -18.710 6.540 1.00 0.00 O ATOM 258 CB LYS A 17 9.717 -17.489 3.890 1.00 0.00 C ATOM 259 CG LYS A 17 8.873 -16.717 2.874 1.00 0.00 C ATOM 260 CD LYS A 17 7.409 -16.592 3.302 1.00 0.00 C ATOM 261 CE LYS A 17 6.478 -15.963 2.263 1.00 0.00 C ATOM 262 NZ LYS A 17 5.123 -15.798 2.835 1.00 0.00 N ATOM 0 H LYS A 17 10.815 -15.141 4.659 1.00 0.00 H new ATOM 0 HA LYS A 17 8.737 -16.836 5.690 1.00 0.00 H new ATOM 0 HB2 LYS A 17 10.736 -17.588 3.516 1.00 0.00 H new ATOM 0 HB3 LYS A 17 9.319 -18.498 4.002 1.00 0.00 H new ATOM 0 HG2 LYS A 17 9.295 -15.721 2.738 1.00 0.00 H new ATOM 0 HG3 LYS A 17 8.924 -17.219 1.908 1.00 0.00 H new ATOM 0 HD2 LYS A 17 7.033 -17.585 3.549 1.00 0.00 H new ATOM 0 HD3 LYS A 17 7.363 -15.998 4.215 1.00 0.00 H new ATOM 0 HE2 LYS A 17 6.870 -14.996 1.949 1.00 0.00 H new ATOM 0 HE3 LYS A 17 6.433 -16.592 1.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 4.412 -15.936 2.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 4.976 -16.500 3.588 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 5.027 -14.841 3.231 1.00 0.00 H new ATOM 276 N ASP A 18 11.553 -16.819 6.864 1.00 0.00 N ATOM 277 CA ASP A 18 12.240 -17.239 8.046 1.00 0.00 C ATOM 278 C ASP A 18 11.398 -16.825 9.203 1.00 0.00 C ATOM 279 O ASP A 18 11.369 -17.536 10.206 1.00 0.00 O ATOM 280 CB ASP A 18 13.642 -16.624 8.196 1.00 0.00 C ATOM 281 CG ASP A 18 14.402 -16.690 6.880 1.00 0.00 C ATOM 282 OD1 ASP A 18 14.511 -17.815 6.324 1.00 0.00 O ATOM 283 OD2 ASP A 18 14.870 -15.616 6.415 1.00 0.00 O ATOM 0 H ASP A 18 11.846 -15.894 6.550 1.00 0.00 H new ATOM 0 HA ASP A 18 12.389 -18.317 7.993 1.00 0.00 H new ATOM 0 HB2 ASP A 18 13.557 -15.587 8.521 1.00 0.00 H new ATOM 0 HB3 ASP A 18 14.197 -17.156 8.969 1.00 0.00 H new ATOM 288 N GLY A 19 10.770 -15.637 9.128 1.00 0.00 N ATOM 289 CA GLY A 19 10.214 -14.861 10.192 1.00 0.00 C ATOM 290 C GLY A 19 11.229 -14.130 11.002 1.00 0.00 C ATOM 291 O GLY A 19 11.144 -13.993 12.221 1.00 0.00 O ATOM 0 H GLY A 19 10.640 -15.176 8.228 1.00 0.00 H new ATOM 0 HA2 GLY A 19 9.510 -14.141 9.774 1.00 0.00 H new ATOM 0 HA3 GLY A 19 9.645 -15.519 10.849 1.00 0.00 H new ATOM 295 N ASP A 20 12.275 -13.624 10.326 1.00 0.00 N ATOM 296 CA ASP A 20 13.233 -12.801 10.998 1.00 0.00 C ATOM 297 C ASP A 20 13.025 -11.326 10.989 1.00 0.00 C ATOM 298 O ASP A 20 13.355 -10.671 11.977 1.00 0.00 O ATOM 299 CB ASP A 20 14.645 -13.322 10.683 1.00 0.00 C ATOM 300 CG ASP A 20 15.210 -12.707 9.410 1.00 0.00 C ATOM 301 OD1 ASP A 20 14.720 -13.061 8.304 1.00 0.00 O ATOM 302 OD2 ASP A 20 16.167 -11.904 9.575 1.00 0.00 O ATOM 0 H ASP A 20 12.457 -13.780 9.334 1.00 0.00 H new ATOM 0 HA ASP A 20 13.062 -12.921 12.068 1.00 0.00 H new ATOM 0 HB2 ASP A 20 15.308 -13.099 11.519 1.00 0.00 H new ATOM 0 HB3 ASP A 20 14.616 -14.407 10.580 1.00 0.00 H new ATOM 307 N GLY A 21 12.649 -10.712 9.853 1.00 0.00 N ATOM 308 CA GLY A 21 12.396 -9.308 9.762 1.00 0.00 C ATOM 309 C GLY A 21 13.375 -8.606 8.885 1.00 0.00 C ATOM 310 O GLY A 21 13.612 -7.405 9.004 1.00 0.00 O ATOM 0 H GLY A 21 12.517 -11.208 8.971 1.00 0.00 H new ATOM 0 HA2 GLY A 21 11.389 -9.148 9.377 1.00 0.00 H new ATOM 0 HA3 GLY A 21 12.429 -8.871 10.760 1.00 0.00 H new ATOM 314 N THR A 22 14.106 -9.391 8.073 1.00 0.00 N ATOM 315 CA THR A 22 14.988 -8.973 7.029 1.00 0.00 C ATOM 316 C THR A 22 14.437 -9.622 5.806 1.00 0.00 C ATOM 317 O THR A 22 14.399 -10.842 5.655 1.00 0.00 O ATOM 318 CB THR A 22 16.430 -9.310 7.268 1.00 0.00 C ATOM 319 OG1 THR A 22 16.794 -8.848 8.561 1.00 0.00 O ATOM 320 CG2 THR A 22 17.300 -8.489 6.301 1.00 0.00 C ATOM 0 H THR A 22 14.075 -10.407 8.157 1.00 0.00 H new ATOM 0 HA THR A 22 15.017 -7.886 6.950 1.00 0.00 H new ATOM 0 HB THR A 22 16.568 -10.384 7.147 1.00 0.00 H new ATOM 0 HG1 THR A 22 17.735 -9.063 8.732 1.00 0.00 H new ATOM 0 HG21 THR A 22 18.351 -8.726 6.466 1.00 0.00 H new ATOM 0 HG22 THR A 22 17.030 -8.732 5.273 1.00 0.00 H new ATOM 0 HG23 THR A 22 17.136 -7.426 6.477 1.00 0.00 H new ATOM 328 N ILE A 23 13.985 -8.795 4.846 1.00 0.00 N ATOM 329 CA ILE A 23 13.375 -9.377 3.690 1.00 0.00 C ATOM 330 C ILE A 23 14.332 -9.420 2.548 1.00 0.00 C ATOM 331 O ILE A 23 15.009 -8.429 2.284 1.00 0.00 O ATOM 332 CB ILE A 23 12.161 -8.637 3.213 1.00 0.00 C ATOM 333 CG1 ILE A 23 11.243 -8.148 4.346 1.00 0.00 C ATOM 334 CG2 ILE A 23 11.416 -9.446 2.138 1.00 0.00 C ATOM 335 CD1 ILE A 23 10.240 -7.141 3.785 1.00 0.00 C ATOM 0 H ILE A 23 14.036 -7.776 4.863 1.00 0.00 H new ATOM 0 HA ILE A 23 13.078 -10.377 4.007 1.00 0.00 H new ATOM 0 HB ILE A 23 12.517 -7.718 2.747 1.00 0.00 H new ATOM 0 HG12 ILE A 23 10.717 -8.992 4.793 1.00 0.00 H new ATOM 0 HG13 ILE A 23 11.836 -7.687 5.136 1.00 0.00 H new ATOM 0 HG21 ILE A 23 10.539 -8.890 1.807 1.00 0.00 H new ATOM 0 HG22 ILE A 23 12.078 -9.619 1.289 1.00 0.00 H new ATOM 0 HG23 ILE A 23 11.103 -10.403 2.555 1.00 0.00 H new ATOM 0 HD11 ILE A 23 9.588 -6.792 4.586 1.00 0.00 H new ATOM 0 HD12 ILE A 23 10.776 -6.293 3.358 1.00 0.00 H new ATOM 0 HD13 ILE A 23 9.640 -7.618 3.010 1.00 0.00 H new ATOM 347 N THR A 24 14.493 -10.552 1.839 1.00 0.00 N ATOM 348 CA THR A 24 15.325 -10.761 0.695 1.00 0.00 C ATOM 349 C THR A 24 14.680 -10.704 -0.647 1.00 0.00 C ATOM 350 O THR A 24 13.476 -10.511 -0.813 1.00 0.00 O ATOM 351 CB THR A 24 16.150 -11.999 0.891 1.00 0.00 C ATOM 352 OG1 THR A 24 15.384 -13.139 0.530 1.00 0.00 O ATOM 353 CG2 THR A 24 16.506 -12.136 2.380 1.00 0.00 C ATOM 0 H THR A 24 13.990 -11.402 2.094 1.00 0.00 H new ATOM 0 HA THR A 24 15.965 -9.879 0.654 1.00 0.00 H new ATOM 0 HB THR A 24 17.049 -11.929 0.279 1.00 0.00 H new ATOM 0 HG1 THR A 24 15.922 -13.948 0.656 1.00 0.00 H new ATOM 0 HG21 THR A 24 17.106 -13.034 2.530 1.00 0.00 H new ATOM 0 HG22 THR A 24 17.074 -11.263 2.700 1.00 0.00 H new ATOM 0 HG23 THR A 24 15.591 -12.209 2.968 1.00 0.00 H new ATOM 361 N THR A 25 15.469 -11.012 -1.692 1.00 0.00 N ATOM 362 CA THR A 25 15.191 -11.281 -3.069 1.00 0.00 C ATOM 363 C THR A 25 14.229 -12.393 -3.309 1.00 0.00 C ATOM 364 O THR A 25 13.126 -12.321 -3.848 1.00 0.00 O ATOM 365 CB THR A 25 16.416 -11.484 -3.910 1.00 0.00 C ATOM 366 OG1 THR A 25 17.533 -10.725 -3.472 1.00 0.00 O ATOM 367 CG2 THR A 25 16.120 -11.136 -5.379 1.00 0.00 C ATOM 0 H THR A 25 16.474 -11.082 -1.534 1.00 0.00 H new ATOM 0 HA THR A 25 14.705 -10.359 -3.389 1.00 0.00 H new ATOM 0 HB THR A 25 16.677 -12.537 -3.809 1.00 0.00 H new ATOM 0 HG1 THR A 25 18.298 -10.902 -4.058 1.00 0.00 H new ATOM 0 HG21 THR A 25 17.018 -11.288 -5.977 1.00 0.00 H new ATOM 0 HG22 THR A 25 15.323 -11.779 -5.752 1.00 0.00 H new ATOM 0 HG23 THR A 25 15.809 -10.094 -5.450 1.00 0.00 H new ATOM 375 N LYS A 26 14.659 -13.574 -2.830 1.00 0.00 N ATOM 376 CA LYS A 26 13.925 -14.799 -2.747 1.00 0.00 C ATOM 377 C LYS A 26 12.601 -14.676 -2.076 1.00 0.00 C ATOM 378 O LYS A 26 11.605 -15.160 -2.613 1.00 0.00 O ATOM 379 CB LYS A 26 14.675 -15.968 -2.086 1.00 0.00 C ATOM 380 CG LYS A 26 15.991 -16.451 -2.698 1.00 0.00 C ATOM 381 CD LYS A 26 15.808 -17.193 -4.024 1.00 0.00 C ATOM 382 CE LYS A 26 17.002 -18.077 -4.388 1.00 0.00 C ATOM 383 NZ LYS A 26 16.788 -18.590 -5.760 1.00 0.00 N ATOM 0 H LYS A 26 15.607 -13.679 -2.468 1.00 0.00 H new ATOM 0 HA LYS A 26 13.781 -15.029 -3.803 1.00 0.00 H new ATOM 0 HB2 LYS A 26 14.878 -15.686 -1.053 1.00 0.00 H new ATOM 0 HB3 LYS A 26 13.995 -16.819 -2.056 1.00 0.00 H new ATOM 0 HG2 LYS A 26 16.645 -15.594 -2.857 1.00 0.00 H new ATOM 0 HG3 LYS A 26 16.493 -17.108 -1.989 1.00 0.00 H new ATOM 0 HD2 LYS A 26 14.911 -17.810 -3.967 1.00 0.00 H new ATOM 0 HD3 LYS A 26 15.645 -16.467 -4.820 1.00 0.00 H new ATOM 0 HE2 LYS A 26 17.929 -17.506 -4.334 1.00 0.00 H new ATOM 0 HE3 LYS A 26 17.095 -18.903 -3.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 16.556 -19.603 -5.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 16.003 -18.073 -6.206 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 17.654 -18.455 -6.320 1.00 0.00 H new ATOM 397 N GLU A 27 12.571 -14.265 -0.796 1.00 0.00 N ATOM 398 CA GLU A 27 11.348 -14.261 -0.054 1.00 0.00 C ATOM 399 C GLU A 27 10.231 -13.423 -0.574 1.00 0.00 C ATOM 400 O GLU A 27 9.066 -13.814 -0.618 1.00 0.00 O ATOM 401 CB GLU A 27 11.708 -13.807 1.371 1.00 0.00 C ATOM 402 CG GLU A 27 12.694 -14.624 2.208 1.00 0.00 C ATOM 403 CD GLU A 27 12.921 -14.080 3.612 1.00 0.00 C ATOM 404 OE1 GLU A 27 13.213 -12.864 3.765 1.00 0.00 O ATOM 405 OE2 GLU A 27 12.796 -14.889 4.569 1.00 0.00 O ATOM 0 H GLU A 27 13.386 -13.938 -0.278 1.00 0.00 H new ATOM 0 HA GLU A 27 10.947 -15.272 -0.123 1.00 0.00 H new ATOM 0 HB2 GLU A 27 12.106 -12.795 1.298 1.00 0.00 H new ATOM 0 HB3 GLU A 27 10.778 -13.744 1.936 1.00 0.00 H new ATOM 0 HG2 GLU A 27 12.329 -15.648 2.282 1.00 0.00 H new ATOM 0 HG3 GLU A 27 13.650 -14.663 1.687 1.00 0.00 H new ATOM 412 N LEU A 28 10.572 -12.262 -1.160 1.00 0.00 N ATOM 413 CA LEU A 28 9.787 -11.276 -1.836 1.00 0.00 C ATOM 414 C LEU A 28 9.226 -11.877 -3.079 1.00 0.00 C ATOM 415 O LEU A 28 8.025 -11.951 -3.336 1.00 0.00 O ATOM 416 CB LEU A 28 10.555 -9.960 -2.051 1.00 0.00 C ATOM 417 CG LEU A 28 9.773 -8.854 -2.779 1.00 0.00 C ATOM 418 CD1 LEU A 28 8.542 -8.462 -1.944 1.00 0.00 C ATOM 419 CD2 LEU A 28 10.678 -7.618 -2.908 1.00 0.00 C ATOM 0 H LEU A 28 11.551 -11.977 -1.155 1.00 0.00 H new ATOM 0 HA LEU A 28 8.947 -10.979 -1.209 1.00 0.00 H new ATOM 0 HB2 LEU A 28 10.870 -9.580 -1.079 1.00 0.00 H new ATOM 0 HB3 LEU A 28 11.460 -10.175 -2.618 1.00 0.00 H new ATOM 0 HG LEU A 28 9.460 -9.211 -3.760 1.00 0.00 H new ATOM 0 HD11 LEU A 28 7.987 -7.678 -2.460 1.00 0.00 H new ATOM 0 HD12 LEU A 28 7.900 -9.333 -1.811 1.00 0.00 H new ATOM 0 HD13 LEU A 28 8.865 -8.097 -0.969 1.00 0.00 H new ATOM 0 HD21 LEU A 28 10.138 -6.824 -3.423 1.00 0.00 H new ATOM 0 HD22 LEU A 28 10.969 -7.275 -1.915 1.00 0.00 H new ATOM 0 HD23 LEU A 28 11.570 -7.878 -3.478 1.00 0.00 H new ATOM 431 N GLY A 29 10.196 -12.284 -3.916 1.00 0.00 N ATOM 432 CA GLY A 29 9.992 -13.061 -5.099 1.00 0.00 C ATOM 433 C GLY A 29 8.982 -14.154 -5.023 1.00 0.00 C ATOM 434 O GLY A 29 8.091 -14.259 -5.864 1.00 0.00 O ATOM 0 H GLY A 29 11.178 -12.058 -3.758 1.00 0.00 H new ATOM 0 HA2 GLY A 29 9.700 -12.385 -5.903 1.00 0.00 H new ATOM 0 HA3 GLY A 29 10.947 -13.501 -5.384 1.00 0.00 H new ATOM 438 N THR A 30 9.014 -15.001 -3.979 1.00 0.00 N ATOM 439 CA THR A 30 8.095 -16.021 -3.578 1.00 0.00 C ATOM 440 C THR A 30 6.687 -15.534 -3.571 1.00 0.00 C ATOM 441 O THR A 30 5.777 -16.156 -4.116 1.00 0.00 O ATOM 442 CB THR A 30 8.501 -16.548 -2.233 1.00 0.00 C ATOM 443 OG1 THR A 30 9.728 -17.235 -2.433 1.00 0.00 O ATOM 444 CG2 THR A 30 7.465 -17.523 -1.650 1.00 0.00 C ATOM 0 H THR A 30 9.798 -14.960 -3.327 1.00 0.00 H new ATOM 0 HA THR A 30 8.133 -16.830 -4.307 1.00 0.00 H new ATOM 0 HB THR A 30 8.588 -15.723 -1.525 1.00 0.00 H new ATOM 0 HG1 THR A 30 10.467 -16.592 -2.431 1.00 0.00 H new ATOM 0 HG21 THR A 30 7.805 -17.876 -0.676 1.00 0.00 H new ATOM 0 HG22 THR A 30 6.508 -17.013 -1.537 1.00 0.00 H new ATOM 0 HG23 THR A 30 7.346 -18.372 -2.323 1.00 0.00 H new ATOM 452 N VAL A 31 6.448 -14.355 -2.968 1.00 0.00 N ATOM 453 CA VAL A 31 5.194 -13.694 -2.777 1.00 0.00 C ATOM 454 C VAL A 31 4.769 -13.160 -4.101 1.00 0.00 C ATOM 455 O VAL A 31 3.647 -13.456 -4.507 1.00 0.00 O ATOM 456 CB VAL A 31 5.244 -12.694 -1.660 1.00 0.00 C ATOM 457 CG1 VAL A 31 3.932 -11.895 -1.587 1.00 0.00 C ATOM 458 CG2 VAL A 31 5.451 -13.425 -0.323 1.00 0.00 C ATOM 0 H VAL A 31 7.215 -13.811 -2.574 1.00 0.00 H new ATOM 0 HA VAL A 31 4.425 -14.387 -2.435 1.00 0.00 H new ATOM 0 HB VAL A 31 6.071 -12.009 -1.849 1.00 0.00 H new ATOM 0 HG11 VAL A 31 3.989 -11.175 -0.770 1.00 0.00 H new ATOM 0 HG12 VAL A 31 3.776 -11.366 -2.527 1.00 0.00 H new ATOM 0 HG13 VAL A 31 3.100 -12.577 -1.412 1.00 0.00 H new ATOM 0 HG21 VAL A 31 5.487 -12.697 0.488 1.00 0.00 H new ATOM 0 HG22 VAL A 31 4.625 -14.116 -0.154 1.00 0.00 H new ATOM 0 HG23 VAL A 31 6.388 -13.981 -0.354 1.00 0.00 H new ATOM 468 N MET A 32 5.574 -12.382 -4.847 1.00 0.00 N ATOM 469 CA MET A 32 5.254 -11.893 -6.152 1.00 0.00 C ATOM 470 C MET A 32 4.935 -12.980 -7.119 1.00 0.00 C ATOM 471 O MET A 32 3.966 -12.884 -7.871 1.00 0.00 O ATOM 472 CB MET A 32 6.426 -11.085 -6.736 1.00 0.00 C ATOM 473 CG MET A 32 6.919 -9.952 -5.834 1.00 0.00 C ATOM 474 SD MET A 32 8.183 -9.053 -6.782 1.00 0.00 S ATOM 475 CE MET A 32 8.223 -7.393 -6.046 1.00 0.00 C ATOM 0 H MET A 32 6.493 -12.079 -4.524 1.00 0.00 H new ATOM 0 HA MET A 32 4.371 -11.267 -6.019 1.00 0.00 H new ATOM 0 HB2 MET A 32 7.256 -11.763 -6.935 1.00 0.00 H new ATOM 0 HB3 MET A 32 6.121 -10.665 -7.694 1.00 0.00 H new ATOM 0 HG2 MET A 32 6.098 -9.291 -5.557 1.00 0.00 H new ATOM 0 HG3 MET A 32 7.336 -10.347 -4.908 1.00 0.00 H new ATOM 0 HE1 MET A 32 9.046 -6.824 -6.477 1.00 0.00 H new ATOM 0 HE2 MET A 32 7.282 -6.882 -6.250 1.00 0.00 H new ATOM 0 HE3 MET A 32 8.365 -7.476 -4.968 1.00 0.00 H new ATOM 485 N ARG A 33 5.648 -14.121 -7.108 1.00 0.00 N ATOM 486 CA ARG A 33 5.409 -15.325 -7.841 1.00 0.00 C ATOM 487 C ARG A 33 4.121 -16.012 -7.543 1.00 0.00 C ATOM 488 O ARG A 33 3.345 -16.424 -8.403 1.00 0.00 O ATOM 489 CB ARG A 33 6.579 -16.272 -7.527 1.00 0.00 C ATOM 490 CG ARG A 33 6.548 -17.649 -8.193 1.00 0.00 C ATOM 491 CD ARG A 33 7.686 -18.604 -7.827 1.00 0.00 C ATOM 492 NE ARG A 33 7.443 -19.058 -6.429 1.00 0.00 N ATOM 493 CZ ARG A 33 8.397 -19.270 -5.476 1.00 0.00 C ATOM 494 NH1 ARG A 33 9.707 -18.934 -5.659 1.00 0.00 N ATOM 495 NH2 ARG A 33 8.081 -19.994 -4.363 1.00 0.00 N ATOM 0 H ARG A 33 6.479 -14.205 -6.523 1.00 0.00 H new ATOM 0 HA ARG A 33 5.336 -15.055 -8.895 1.00 0.00 H new ATOM 0 HB2 ARG A 33 7.505 -15.775 -7.816 1.00 0.00 H new ATOM 0 HB3 ARG A 33 6.619 -16.417 -6.447 1.00 0.00 H new ATOM 0 HG2 ARG A 33 5.603 -18.130 -7.941 1.00 0.00 H new ATOM 0 HG3 ARG A 33 6.555 -17.507 -9.274 1.00 0.00 H new ATOM 0 HD2 ARG A 33 7.711 -19.454 -8.509 1.00 0.00 H new ATOM 0 HD3 ARG A 33 8.651 -18.103 -7.907 1.00 0.00 H new ATOM 0 HE ARG A 33 6.474 -19.226 -6.159 1.00 0.00 H new ATOM 0 HH11 ARG A 33 10.006 -18.506 -6.535 1.00 0.00 H new ATOM 0 HH12 ARG A 33 10.387 -19.110 -4.919 1.00 0.00 H new ATOM 0 HH21 ARG A 33 7.140 -20.371 -4.250 1.00 0.00 H new ATOM 0 HH22 ARG A 33 8.786 -20.159 -3.645 1.00 0.00 H new ATOM 509 N SER A 34 3.785 -16.135 -6.246 1.00 0.00 N ATOM 510 CA SER A 34 2.526 -16.674 -5.834 1.00 0.00 C ATOM 511 C SER A 34 1.403 -15.753 -6.165 1.00 0.00 C ATOM 512 O SER A 34 0.440 -16.140 -6.825 1.00 0.00 O ATOM 513 CB SER A 34 2.659 -16.818 -4.309 1.00 0.00 C ATOM 514 OG SER A 34 3.531 -17.922 -4.115 1.00 0.00 O ATOM 0 H SER A 34 4.393 -15.858 -5.475 1.00 0.00 H new ATOM 0 HA SER A 34 2.304 -17.615 -6.337 1.00 0.00 H new ATOM 0 HB2 SER A 34 3.066 -15.911 -3.862 1.00 0.00 H new ATOM 0 HB3 SER A 34 1.689 -16.995 -3.844 1.00 0.00 H new ATOM 0 HG SER A 34 4.457 -17.604 -4.073 1.00 0.00 H new ATOM 520 N LEU A 35 1.553 -14.474 -5.778 1.00 0.00 N ATOM 521 CA LEU A 35 0.614 -13.407 -5.939 1.00 0.00 C ATOM 522 C LEU A 35 0.259 -13.271 -7.380 1.00 0.00 C ATOM 523 O LEU A 35 -0.929 -13.308 -7.696 1.00 0.00 O ATOM 524 CB LEU A 35 1.103 -12.058 -5.385 1.00 0.00 C ATOM 525 CG LEU A 35 0.150 -10.874 -5.618 1.00 0.00 C ATOM 526 CD1 LEU A 35 -1.177 -11.103 -4.875 1.00 0.00 C ATOM 527 CD2 LEU A 35 0.837 -9.574 -5.166 1.00 0.00 C ATOM 0 H LEU A 35 2.405 -14.161 -5.313 1.00 0.00 H new ATOM 0 HA LEU A 35 -0.264 -13.672 -5.350 1.00 0.00 H new ATOM 0 HB2 LEU A 35 1.272 -12.163 -4.313 1.00 0.00 H new ATOM 0 HB3 LEU A 35 2.066 -11.824 -5.839 1.00 0.00 H new ATOM 0 HG LEU A 35 -0.083 -10.790 -6.680 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -1.842 -10.257 -5.049 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -1.647 -12.015 -5.242 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -0.984 -11.199 -3.807 1.00 0.00 H new ATOM 0 HD21 LEU A 35 0.165 -8.732 -5.329 1.00 0.00 H new ATOM 0 HD22 LEU A 35 1.083 -9.642 -4.106 1.00 0.00 H new ATOM 0 HD23 LEU A 35 1.751 -9.426 -5.742 1.00 0.00 H new ATOM 539 N GLY A 36 1.261 -13.164 -8.271 1.00 0.00 N ATOM 540 CA GLY A 36 1.033 -12.980 -9.671 1.00 0.00 C ATOM 541 C GLY A 36 2.239 -13.188 -10.521 1.00 0.00 C ATOM 542 O GLY A 36 2.525 -14.352 -10.798 1.00 0.00 O ATOM 0 H GLY A 36 2.247 -13.206 -8.015 1.00 0.00 H new ATOM 0 HA2 GLY A 36 0.252 -13.669 -9.994 1.00 0.00 H new ATOM 0 HA3 GLY A 36 0.656 -11.971 -9.836 1.00 0.00 H new ATOM 546 N GLN A 37 2.801 -12.125 -11.123 1.00 0.00 N ATOM 547 CA GLN A 37 3.962 -12.153 -11.957 1.00 0.00 C ATOM 548 C GLN A 37 5.296 -12.146 -11.293 1.00 0.00 C ATOM 549 O GLN A 37 5.565 -11.368 -10.380 1.00 0.00 O ATOM 550 CB GLN A 37 3.925 -11.115 -13.092 1.00 0.00 C ATOM 551 CG GLN A 37 3.850 -9.652 -12.651 1.00 0.00 C ATOM 552 CD GLN A 37 3.172 -8.818 -13.728 1.00 0.00 C ATOM 553 OE1 GLN A 37 2.020 -8.411 -13.583 1.00 0.00 O ATOM 554 NE2 GLN A 37 3.864 -8.646 -14.886 1.00 0.00 N ATOM 0 H GLN A 37 2.419 -11.185 -11.020 1.00 0.00 H new ATOM 0 HA GLN A 37 3.877 -13.156 -12.375 1.00 0.00 H new ATOM 0 HB2 GLN A 37 4.815 -11.245 -13.707 1.00 0.00 H new ATOM 0 HB3 GLN A 37 3.065 -11.328 -13.727 1.00 0.00 H new ATOM 0 HG2 GLN A 37 3.296 -9.573 -11.716 1.00 0.00 H new ATOM 0 HG3 GLN A 37 4.853 -9.269 -12.460 1.00 0.00 H new ATOM 0 HE21 GLN A 37 4.818 -8.998 -14.967 1.00 0.00 H new ATOM 0 HE22 GLN A 37 3.429 -8.165 -15.673 1.00 0.00 H new ATOM 563 N ASN A 38 6.206 -13.044 -11.713 1.00 0.00 N ATOM 564 CA ASN A 38 7.472 -13.256 -11.084 1.00 0.00 C ATOM 565 C ASN A 38 8.467 -12.444 -11.841 1.00 0.00 C ATOM 566 O ASN A 38 8.607 -12.618 -13.050 1.00 0.00 O ATOM 567 CB ASN A 38 7.786 -14.760 -11.161 1.00 0.00 C ATOM 568 CG ASN A 38 8.958 -15.174 -10.283 1.00 0.00 C ATOM 569 OD1 ASN A 38 9.410 -14.424 -9.419 1.00 0.00 O ATOM 570 ND2 ASN A 38 9.427 -16.438 -10.458 1.00 0.00 N ATOM 0 H ASN A 38 6.053 -13.646 -12.522 1.00 0.00 H new ATOM 0 HA ASN A 38 7.487 -12.957 -10.036 1.00 0.00 H new ATOM 0 HB2 ASN A 38 6.902 -15.325 -10.865 1.00 0.00 H new ATOM 0 HB3 ASN A 38 8.003 -15.027 -12.195 1.00 0.00 H new ATOM 0 HD21 ASN A 38 10.177 -16.791 -9.863 1.00 0.00 H new ATOM 0 HD22 ASN A 38 9.029 -17.034 -11.184 1.00 0.00 H new ATOM 577 N PRO A 39 9.201 -11.483 -11.364 1.00 0.00 N ATOM 578 CA PRO A 39 10.387 -11.023 -12.025 1.00 0.00 C ATOM 579 C PRO A 39 11.467 -12.045 -11.930 1.00 0.00 C ATOM 580 O PRO A 39 11.272 -13.074 -11.285 1.00 0.00 O ATOM 581 CB PRO A 39 10.640 -9.714 -11.281 1.00 0.00 C ATOM 582 CG PRO A 39 10.365 -10.099 -9.819 1.00 0.00 C ATOM 583 CD PRO A 39 9.111 -10.967 -10.007 1.00 0.00 C ATOM 0 HA PRO A 39 10.320 -10.864 -13.101 1.00 0.00 H new ATOM 0 HB2 PRO A 39 11.661 -9.359 -11.421 1.00 0.00 H new ATOM 0 HB3 PRO A 39 9.977 -8.919 -11.622 1.00 0.00 H new ATOM 0 HG2 PRO A 39 11.191 -10.651 -9.370 1.00 0.00 H new ATOM 0 HG3 PRO A 39 10.181 -9.231 -9.186 1.00 0.00 H new ATOM 0 HD2 PRO A 39 9.081 -11.778 -9.279 1.00 0.00 H new ATOM 0 HD3 PRO A 39 8.203 -10.381 -9.869 1.00 0.00 H new ATOM 591 N THR A 40 12.610 -11.813 -12.598 1.00 0.00 N ATOM 592 CA THR A 40 13.769 -12.609 -12.336 1.00 0.00 C ATOM 593 C THR A 40 14.490 -12.116 -11.129 1.00 0.00 C ATOM 594 O THR A 40 14.302 -10.979 -10.699 1.00 0.00 O ATOM 595 CB THR A 40 14.774 -12.636 -13.449 1.00 0.00 C ATOM 596 OG1 THR A 40 15.224 -11.330 -13.776 1.00 0.00 O ATOM 597 CG2 THR A 40 14.187 -13.116 -14.787 1.00 0.00 C ATOM 0 H THR A 40 12.733 -11.089 -13.306 1.00 0.00 H new ATOM 0 HA THR A 40 13.371 -13.615 -12.203 1.00 0.00 H new ATOM 0 HB THR A 40 15.552 -13.299 -13.070 1.00 0.00 H new ATOM 0 HG1 THR A 40 14.463 -10.784 -14.065 1.00 0.00 H new ATOM 0 HG21 THR A 40 14.967 -13.112 -15.549 1.00 0.00 H new ATOM 0 HG22 THR A 40 13.798 -14.128 -14.672 1.00 0.00 H new ATOM 0 HG23 THR A 40 13.380 -12.449 -15.090 1.00 0.00 H new ATOM 605 N GLU A 41 15.328 -12.952 -10.491 1.00 0.00 N ATOM 606 CA GLU A 41 16.013 -12.465 -9.334 1.00 0.00 C ATOM 607 C GLU A 41 17.013 -11.383 -9.554 1.00 0.00 C ATOM 608 O GLU A 41 17.273 -10.486 -8.753 1.00 0.00 O ATOM 609 CB GLU A 41 16.750 -13.681 -8.748 1.00 0.00 C ATOM 610 CG GLU A 41 15.874 -14.520 -7.815 1.00 0.00 C ATOM 611 CD GLU A 41 16.385 -15.911 -7.469 1.00 0.00 C ATOM 612 OE1 GLU A 41 17.537 -16.120 -7.005 1.00 0.00 O ATOM 613 OE2 GLU A 41 15.601 -16.878 -7.664 1.00 0.00 O ATOM 0 H GLU A 41 15.526 -13.917 -10.757 1.00 0.00 H new ATOM 0 HA GLU A 41 15.261 -12.011 -8.689 1.00 0.00 H new ATOM 0 HB2 GLU A 41 17.108 -14.309 -9.564 1.00 0.00 H new ATOM 0 HB3 GLU A 41 17.628 -13.338 -8.201 1.00 0.00 H new ATOM 0 HG2 GLU A 41 15.738 -13.966 -6.886 1.00 0.00 H new ATOM 0 HG3 GLU A 41 14.890 -14.622 -8.272 1.00 0.00 H new ATOM 620 N ALA A 42 17.607 -11.348 -10.760 1.00 0.00 N ATOM 621 CA ALA A 42 18.405 -10.326 -11.362 1.00 0.00 C ATOM 622 C ALA A 42 17.692 -9.019 -11.294 1.00 0.00 C ATOM 623 O ALA A 42 18.279 -8.029 -10.859 1.00 0.00 O ATOM 624 CB ALA A 42 18.784 -10.729 -12.797 1.00 0.00 C ATOM 0 H ALA A 42 17.512 -12.143 -11.392 1.00 0.00 H new ATOM 0 HA ALA A 42 19.338 -10.208 -10.811 1.00 0.00 H new ATOM 0 HB1 ALA A 42 19.392 -9.944 -13.247 1.00 0.00 H new ATOM 0 HB2 ALA A 42 19.351 -11.660 -12.776 1.00 0.00 H new ATOM 0 HB3 ALA A 42 17.878 -10.869 -13.387 1.00 0.00 H new ATOM 630 N GLU A 43 16.409 -8.984 -11.696 1.00 0.00 N ATOM 631 CA GLU A 43 15.624 -7.790 -11.758 1.00 0.00 C ATOM 632 C GLU A 43 15.266 -7.453 -10.352 1.00 0.00 C ATOM 633 O GLU A 43 15.221 -6.262 -10.049 1.00 0.00 O ATOM 634 CB GLU A 43 14.308 -7.846 -12.551 1.00 0.00 C ATOM 635 CG GLU A 43 14.529 -8.026 -14.054 1.00 0.00 C ATOM 636 CD GLU A 43 13.286 -8.671 -14.650 1.00 0.00 C ATOM 637 OE1 GLU A 43 12.941 -9.817 -14.255 1.00 0.00 O ATOM 638 OE2 GLU A 43 12.701 -8.016 -15.554 1.00 0.00 O ATOM 0 H GLU A 43 15.899 -9.818 -11.989 1.00 0.00 H new ATOM 0 HA GLU A 43 16.240 -7.064 -12.289 1.00 0.00 H new ATOM 0 HB2 GLU A 43 13.698 -8.669 -12.177 1.00 0.00 H new ATOM 0 HB3 GLU A 43 13.746 -6.928 -12.378 1.00 0.00 H new ATOM 0 HG2 GLU A 43 14.720 -7.063 -14.527 1.00 0.00 H new ATOM 0 HG3 GLU A 43 15.404 -8.650 -14.236 1.00 0.00 H new ATOM 645 N LEU A 44 14.946 -8.370 -9.422 1.00 0.00 N ATOM 646 CA LEU A 44 14.437 -8.037 -8.127 1.00 0.00 C ATOM 647 C LEU A 44 15.550 -7.636 -7.221 1.00 0.00 C ATOM 648 O LEU A 44 15.374 -6.867 -6.278 1.00 0.00 O ATOM 649 CB LEU A 44 13.572 -9.167 -7.544 1.00 0.00 C ATOM 650 CG LEU A 44 12.872 -8.795 -6.226 1.00 0.00 C ATOM 651 CD1 LEU A 44 11.945 -7.596 -6.490 1.00 0.00 C ATOM 652 CD2 LEU A 44 12.106 -10.018 -5.693 1.00 0.00 C ATOM 0 H LEU A 44 15.044 -9.374 -9.575 1.00 0.00 H new ATOM 0 HA LEU A 44 13.773 -7.179 -8.228 1.00 0.00 H new ATOM 0 HB2 LEU A 44 12.818 -9.450 -8.278 1.00 0.00 H new ATOM 0 HB3 LEU A 44 14.199 -10.043 -7.377 1.00 0.00 H new ATOM 0 HG LEU A 44 13.594 -8.507 -5.462 1.00 0.00 H new ATOM 0 HD11 LEU A 44 11.439 -7.317 -5.566 1.00 0.00 H new ATOM 0 HD12 LEU A 44 12.534 -6.753 -6.850 1.00 0.00 H new ATOM 0 HD13 LEU A 44 11.204 -7.868 -7.242 1.00 0.00 H new ATOM 0 HD21 LEU A 44 11.609 -9.757 -4.759 1.00 0.00 H new ATOM 0 HD22 LEU A 44 11.361 -10.329 -6.426 1.00 0.00 H new ATOM 0 HD23 LEU A 44 12.804 -10.836 -5.516 1.00 0.00 H new ATOM 664 N GLN A 45 16.797 -8.099 -7.420 1.00 0.00 N ATOM 665 CA GLN A 45 17.912 -7.725 -6.606 1.00 0.00 C ATOM 666 C GLN A 45 18.453 -6.372 -6.914 1.00 0.00 C ATOM 667 O GLN A 45 18.913 -5.623 -6.054 1.00 0.00 O ATOM 668 CB GLN A 45 19.029 -8.777 -6.499 1.00 0.00 C ATOM 669 CG GLN A 45 20.091 -8.728 -7.599 1.00 0.00 C ATOM 670 CD GLN A 45 21.173 -9.766 -7.339 1.00 0.00 C ATOM 671 OE1 GLN A 45 21.456 -10.733 -8.045 1.00 0.00 O ATOM 672 NE2 GLN A 45 21.906 -9.477 -6.230 1.00 0.00 N ATOM 0 H GLN A 45 17.037 -8.751 -8.167 1.00 0.00 H new ATOM 0 HA GLN A 45 17.475 -7.673 -5.609 1.00 0.00 H new ATOM 0 HB2 GLN A 45 19.524 -8.658 -5.535 1.00 0.00 H new ATOM 0 HB3 GLN A 45 18.573 -9.767 -6.503 1.00 0.00 H new ATOM 0 HG2 GLN A 45 19.628 -8.911 -8.569 1.00 0.00 H new ATOM 0 HG3 GLN A 45 20.535 -7.733 -7.641 1.00 0.00 H new ATOM 0 HE21 GLN A 45 21.662 -8.673 -5.653 1.00 0.00 H new ATOM 0 HE22 GLN A 45 22.700 -10.065 -5.976 1.00 0.00 H new ATOM 681 N ASP A 46 18.399 -6.045 -8.218 1.00 0.00 N ATOM 682 CA ASP A 46 18.789 -4.751 -8.684 1.00 0.00 C ATOM 683 C ASP A 46 17.803 -3.682 -8.359 1.00 0.00 C ATOM 684 O ASP A 46 18.235 -2.546 -8.168 1.00 0.00 O ATOM 685 CB ASP A 46 19.034 -4.882 -10.197 1.00 0.00 C ATOM 686 CG ASP A 46 19.955 -3.819 -10.778 1.00 0.00 C ATOM 687 OD1 ASP A 46 20.933 -3.298 -10.179 1.00 0.00 O ATOM 688 OD2 ASP A 46 19.544 -3.541 -11.937 1.00 0.00 O ATOM 0 H ASP A 46 18.084 -6.680 -8.952 1.00 0.00 H new ATOM 0 HA ASP A 46 19.696 -4.432 -8.170 1.00 0.00 H new ATOM 0 HB2 ASP A 46 19.459 -5.865 -10.400 1.00 0.00 H new ATOM 0 HB3 ASP A 46 18.075 -4.837 -10.713 1.00 0.00 H new ATOM 693 N MET A 47 16.504 -4.008 -8.236 1.00 0.00 N ATOM 694 CA MET A 47 15.581 -3.121 -7.599 1.00 0.00 C ATOM 695 C MET A 47 15.652 -2.915 -6.125 1.00 0.00 C ATOM 696 O MET A 47 15.431 -1.835 -5.580 1.00 0.00 O ATOM 697 CB MET A 47 14.140 -3.585 -7.874 1.00 0.00 C ATOM 698 CG MET A 47 13.055 -2.582 -7.477 1.00 0.00 C ATOM 699 SD MET A 47 13.132 -1.005 -8.378 1.00 0.00 S ATOM 700 CE MET A 47 12.589 0.120 -7.060 1.00 0.00 C ATOM 0 H MET A 47 16.095 -4.879 -8.575 1.00 0.00 H new ATOM 0 HA MET A 47 15.876 -2.170 -8.042 1.00 0.00 H new ATOM 0 HB2 MET A 47 14.041 -3.804 -8.937 1.00 0.00 H new ATOM 0 HB3 MET A 47 13.966 -4.518 -7.339 1.00 0.00 H new ATOM 0 HG2 MET A 47 12.078 -3.036 -7.644 1.00 0.00 H new ATOM 0 HG3 MET A 47 13.135 -2.381 -6.409 1.00 0.00 H new ATOM 0 HE1 MET A 47 12.627 1.148 -7.421 1.00 0.00 H new ATOM 0 HE2 MET A 47 11.567 -0.126 -6.770 1.00 0.00 H new ATOM 0 HE3 MET A 47 13.247 0.014 -6.197 1.00 0.00 H new ATOM 710 N ILE A 48 16.124 -3.952 -5.410 1.00 0.00 N ATOM 711 CA ILE A 48 16.400 -3.851 -4.010 1.00 0.00 C ATOM 712 C ILE A 48 17.476 -2.855 -3.745 1.00 0.00 C ATOM 713 O ILE A 48 17.430 -2.202 -2.703 1.00 0.00 O ATOM 714 CB ILE A 48 16.646 -5.103 -3.222 1.00 0.00 C ATOM 715 CG1 ILE A 48 15.318 -5.879 -3.249 1.00 0.00 C ATOM 716 CG2 ILE A 48 17.224 -4.906 -1.810 1.00 0.00 C ATOM 717 CD1 ILE A 48 15.431 -7.396 -3.104 1.00 0.00 C ATOM 0 H ILE A 48 16.316 -4.871 -5.808 1.00 0.00 H new ATOM 0 HA ILE A 48 15.435 -3.521 -3.627 1.00 0.00 H new ATOM 0 HB ILE A 48 17.453 -5.671 -3.686 1.00 0.00 H new ATOM 0 HG12 ILE A 48 14.683 -5.503 -2.447 1.00 0.00 H new ATOM 0 HG13 ILE A 48 14.810 -5.660 -4.188 1.00 0.00 H new ATOM 0 HG21 ILE A 48 17.361 -5.877 -1.334 1.00 0.00 H new ATOM 0 HG22 ILE A 48 18.185 -4.397 -1.878 1.00 0.00 H new ATOM 0 HG23 ILE A 48 16.536 -4.304 -1.216 1.00 0.00 H new ATOM 0 HD11 ILE A 48 14.436 -7.840 -3.137 1.00 0.00 H new ATOM 0 HD12 ILE A 48 16.033 -7.796 -3.920 1.00 0.00 H new ATOM 0 HD13 ILE A 48 15.904 -7.636 -2.152 1.00 0.00 H new ATOM 729 N ASN A 49 18.478 -2.665 -4.621 1.00 0.00 N ATOM 730 CA ASN A 49 19.529 -1.745 -4.310 1.00 0.00 C ATOM 731 C ASN A 49 19.072 -0.327 -4.282 1.00 0.00 C ATOM 732 O ASN A 49 19.719 0.421 -3.551 1.00 0.00 O ATOM 733 CB ASN A 49 20.736 -1.874 -5.253 1.00 0.00 C ATOM 734 CG ASN A 49 21.357 -3.256 -5.107 1.00 0.00 C ATOM 735 OD1 ASN A 49 21.351 -3.950 -4.091 1.00 0.00 O ATOM 736 ND2 ASN A 49 21.883 -3.818 -6.229 1.00 0.00 N ATOM 0 H ASN A 49 18.562 -3.134 -5.523 1.00 0.00 H new ATOM 0 HA ASN A 49 19.846 -2.023 -3.305 1.00 0.00 H new ATOM 0 HB2 ASN A 49 20.422 -1.713 -6.284 1.00 0.00 H new ATOM 0 HB3 ASN A 49 21.475 -1.107 -5.021 1.00 0.00 H new ATOM 0 HD21 ASN A 49 22.247 -4.770 -6.200 1.00 0.00 H new ATOM 0 HD22 ASN A 49 21.913 -3.287 -7.099 1.00 0.00 H new ATOM 743 N GLU A 50 17.941 0.035 -4.913 1.00 0.00 N ATOM 744 CA GLU A 50 17.311 1.319 -4.943 1.00 0.00 C ATOM 745 C GLU A 50 16.840 1.795 -3.612 1.00 0.00 C ATOM 746 O GLU A 50 16.877 3.002 -3.383 1.00 0.00 O ATOM 747 CB GLU A 50 16.211 1.247 -6.016 1.00 0.00 C ATOM 748 CG GLU A 50 15.448 2.541 -6.309 1.00 0.00 C ATOM 749 CD GLU A 50 16.332 3.623 -6.912 1.00 0.00 C ATOM 750 OE1 GLU A 50 17.281 3.399 -7.710 1.00 0.00 O ATOM 751 OE2 GLU A 50 16.021 4.805 -6.605 1.00 0.00 O ATOM 0 H GLU A 50 17.414 -0.646 -5.459 1.00 0.00 H new ATOM 0 HA GLU A 50 18.037 2.087 -5.209 1.00 0.00 H new ATOM 0 HB2 GLU A 50 16.665 0.902 -6.945 1.00 0.00 H new ATOM 0 HB3 GLU A 50 15.490 0.488 -5.713 1.00 0.00 H new ATOM 0 HG2 GLU A 50 14.627 2.326 -6.993 1.00 0.00 H new ATOM 0 HG3 GLU A 50 15.005 2.913 -5.385 1.00 0.00 H new ATOM 758 N VAL A 51 16.373 0.892 -2.731 1.00 0.00 N ATOM 759 CA VAL A 51 15.944 1.226 -1.409 1.00 0.00 C ATOM 760 C VAL A 51 16.927 0.844 -0.356 1.00 0.00 C ATOM 761 O VAL A 51 16.808 1.339 0.764 1.00 0.00 O ATOM 762 CB VAL A 51 14.635 0.552 -1.124 1.00 0.00 C ATOM 763 CG1 VAL A 51 13.648 1.126 -2.154 1.00 0.00 C ATOM 764 CG2 VAL A 51 14.824 -0.971 -1.212 1.00 0.00 C ATOM 0 H VAL A 51 16.292 -0.102 -2.946 1.00 0.00 H new ATOM 0 HA VAL A 51 15.844 2.311 -1.376 1.00 0.00 H new ATOM 0 HB VAL A 51 14.248 0.736 -0.122 1.00 0.00 H new ATOM 0 HG11 VAL A 51 12.666 0.677 -2.006 1.00 0.00 H new ATOM 0 HG12 VAL A 51 13.577 2.206 -2.027 1.00 0.00 H new ATOM 0 HG13 VAL A 51 14.001 0.902 -3.161 1.00 0.00 H new ATOM 0 HG21 VAL A 51 13.876 -1.468 -1.006 1.00 0.00 H new ATOM 0 HG22 VAL A 51 15.164 -1.238 -2.213 1.00 0.00 H new ATOM 0 HG23 VAL A 51 15.567 -1.288 -0.480 1.00 0.00 H new ATOM 774 N ASP A 52 17.901 -0.011 -0.713 1.00 0.00 N ATOM 775 CA ASP A 52 18.971 -0.384 0.158 1.00 0.00 C ATOM 776 C ASP A 52 19.887 0.744 0.488 1.00 0.00 C ATOM 777 O ASP A 52 20.425 1.441 -0.372 1.00 0.00 O ATOM 778 CB ASP A 52 19.795 -1.536 -0.443 1.00 0.00 C ATOM 779 CG ASP A 52 20.821 -2.165 0.488 1.00 0.00 C ATOM 780 OD1 ASP A 52 20.471 -2.858 1.480 1.00 0.00 O ATOM 781 OD2 ASP A 52 22.022 -1.864 0.257 1.00 0.00 O ATOM 0 H ASP A 52 17.946 -0.454 -1.631 1.00 0.00 H new ATOM 0 HA ASP A 52 18.493 -0.704 1.084 1.00 0.00 H new ATOM 0 HB2 ASP A 52 19.109 -2.314 -0.777 1.00 0.00 H new ATOM 0 HB3 ASP A 52 20.312 -1.166 -1.328 1.00 0.00 H new ATOM 786 N ALA A 53 20.079 1.085 1.775 1.00 0.00 N ATOM 787 CA ALA A 53 20.879 2.161 2.274 1.00 0.00 C ATOM 788 C ALA A 53 22.176 1.716 2.856 1.00 0.00 C ATOM 789 O ALA A 53 23.209 2.235 2.436 1.00 0.00 O ATOM 790 CB ALA A 53 20.097 3.113 3.194 1.00 0.00 C ATOM 0 H ALA A 53 19.636 0.562 2.530 1.00 0.00 H new ATOM 0 HA ALA A 53 21.149 2.751 1.398 1.00 0.00 H new ATOM 0 HB1 ALA A 53 20.757 3.908 3.541 1.00 0.00 H new ATOM 0 HB2 ALA A 53 19.263 3.548 2.643 1.00 0.00 H new ATOM 0 HB3 ALA A 53 19.716 2.559 4.051 1.00 0.00 H new ATOM 796 N ASP A 54 22.094 0.672 3.701 1.00 0.00 N ATOM 797 CA ASP A 54 23.202 0.130 4.425 1.00 0.00 C ATOM 798 C ASP A 54 24.292 -0.585 3.704 1.00 0.00 C ATOM 799 O ASP A 54 25.432 -0.517 4.161 1.00 0.00 O ATOM 800 CB ASP A 54 22.612 -0.696 5.581 1.00 0.00 C ATOM 801 CG ASP A 54 21.679 -1.785 5.072 1.00 0.00 C ATOM 802 OD1 ASP A 54 22.071 -2.616 4.209 1.00 0.00 O ATOM 803 OD2 ASP A 54 20.548 -1.909 5.613 1.00 0.00 O ATOM 0 H ASP A 54 21.217 0.185 3.887 1.00 0.00 H new ATOM 0 HA ASP A 54 23.780 0.995 4.749 1.00 0.00 H new ATOM 0 HB2 ASP A 54 23.420 -1.148 6.156 1.00 0.00 H new ATOM 0 HB3 ASP A 54 22.068 -0.038 6.259 1.00 0.00 H new ATOM 808 N GLY A 55 24.047 -1.206 2.537 1.00 0.00 N ATOM 809 CA GLY A 55 25.085 -1.797 1.751 1.00 0.00 C ATOM 810 C GLY A 55 24.817 -3.259 1.649 1.00 0.00 C ATOM 811 O GLY A 55 25.436 -3.943 0.835 1.00 0.00 O ATOM 0 H GLY A 55 23.115 -1.299 2.133 1.00 0.00 H new ATOM 0 HA2 GLY A 55 25.114 -1.346 0.759 1.00 0.00 H new ATOM 0 HA3 GLY A 55 26.057 -1.620 2.211 1.00 0.00 H new ATOM 815 N ASN A 56 23.922 -3.878 2.439 1.00 0.00 N ATOM 816 CA ASN A 56 23.772 -5.293 2.581 1.00 0.00 C ATOM 817 C ASN A 56 23.143 -5.908 1.378 1.00 0.00 C ATOM 818 O ASN A 56 23.513 -7.032 1.045 1.00 0.00 O ATOM 819 CB ASN A 56 23.227 -6.003 3.831 1.00 0.00 C ATOM 820 CG ASN A 56 21.795 -5.624 4.181 1.00 0.00 C ATOM 821 OD1 ASN A 56 20.897 -5.259 3.423 1.00 0.00 O ATOM 822 ND2 ASN A 56 21.537 -5.760 5.509 1.00 0.00 N ATOM 0 H ASN A 56 23.261 -3.356 3.015 1.00 0.00 H new ATOM 0 HA ASN A 56 24.836 -5.475 2.729 1.00 0.00 H new ATOM 0 HB2 ASN A 56 23.280 -7.081 3.677 1.00 0.00 H new ATOM 0 HB3 ASN A 56 23.871 -5.771 4.679 1.00 0.00 H new ATOM 0 HD21 ASN A 56 20.604 -5.560 5.870 1.00 0.00 H new ATOM 0 HD22 ASN A 56 22.276 -6.062 6.144 1.00 0.00 H new ATOM 829 N GLY A 57 22.117 -5.285 0.771 1.00 0.00 N ATOM 830 CA GLY A 57 21.396 -5.845 -0.330 1.00 0.00 C ATOM 831 C GLY A 57 20.171 -6.625 0.002 1.00 0.00 C ATOM 832 O GLY A 57 19.563 -7.222 -0.885 1.00 0.00 O ATOM 0 H GLY A 57 21.779 -4.365 1.054 1.00 0.00 H new ATOM 0 HA2 GLY A 57 21.112 -5.033 -0.999 1.00 0.00 H new ATOM 0 HA3 GLY A 57 22.073 -6.494 -0.886 1.00 0.00 H new ATOM 836 N THR A 58 19.775 -6.630 1.287 1.00 0.00 N ATOM 837 CA THR A 58 18.471 -7.082 1.663 1.00 0.00 C ATOM 838 C THR A 58 17.762 -5.853 2.117 1.00 0.00 C ATOM 839 O THR A 58 18.402 -4.848 2.426 1.00 0.00 O ATOM 840 CB THR A 58 18.427 -8.004 2.846 1.00 0.00 C ATOM 841 OG1 THR A 58 19.366 -7.705 3.868 1.00 0.00 O ATOM 842 CG2 THR A 58 18.772 -9.365 2.218 1.00 0.00 C ATOM 0 H THR A 58 20.357 -6.321 2.066 1.00 0.00 H new ATOM 0 HA THR A 58 18.055 -7.621 0.812 1.00 0.00 H new ATOM 0 HB THR A 58 17.462 -7.941 3.349 1.00 0.00 H new ATOM 0 HG1 THR A 58 19.582 -6.749 3.844 1.00 0.00 H new ATOM 0 HG21 THR A 58 18.772 -10.133 2.991 1.00 0.00 H new ATOM 0 HG22 THR A 58 18.030 -9.614 1.459 1.00 0.00 H new ATOM 0 HG23 THR A 58 19.759 -9.314 1.758 1.00 0.00 H new ATOM 850 N ILE A 59 16.420 -5.895 2.042 1.00 0.00 N ATOM 851 CA ILE A 59 15.714 -4.751 2.530 1.00 0.00 C ATOM 852 C ILE A 59 15.277 -5.028 3.928 1.00 0.00 C ATOM 853 O ILE A 59 14.408 -5.782 4.363 1.00 0.00 O ATOM 854 CB ILE A 59 14.511 -4.469 1.680 1.00 0.00 C ATOM 855 CG1 ILE A 59 13.555 -3.404 2.242 1.00 0.00 C ATOM 856 CG2 ILE A 59 13.810 -5.731 1.150 1.00 0.00 C ATOM 857 CD1 ILE A 59 12.504 -2.860 1.275 1.00 0.00 C ATOM 0 H ILE A 59 15.856 -6.660 1.672 1.00 0.00 H new ATOM 0 HA ILE A 59 16.370 -3.881 2.497 1.00 0.00 H new ATOM 0 HB ILE A 59 14.927 -3.992 0.793 1.00 0.00 H new ATOM 0 HG12 ILE A 59 13.040 -3.827 3.104 1.00 0.00 H new ATOM 0 HG13 ILE A 59 14.151 -2.567 2.606 1.00 0.00 H new ATOM 0 HG21 ILE A 59 12.950 -5.443 0.545 1.00 0.00 H new ATOM 0 HG22 ILE A 59 14.507 -6.305 0.540 1.00 0.00 H new ATOM 0 HG23 ILE A 59 13.475 -6.341 1.989 1.00 0.00 H new ATOM 0 HD11 ILE A 59 11.890 -2.117 1.785 1.00 0.00 H new ATOM 0 HD12 ILE A 59 13.000 -2.397 0.422 1.00 0.00 H new ATOM 0 HD13 ILE A 59 11.871 -3.677 0.928 1.00 0.00 H new ATOM 869 N ASP A 60 15.975 -4.348 4.854 1.00 0.00 N ATOM 870 CA ASP A 60 15.758 -4.217 6.262 1.00 0.00 C ATOM 871 C ASP A 60 14.595 -3.371 6.649 1.00 0.00 C ATOM 872 O ASP A 60 14.030 -2.759 5.744 1.00 0.00 O ATOM 873 CB ASP A 60 17.009 -3.583 6.893 1.00 0.00 C ATOM 874 CG ASP A 60 18.227 -4.475 6.701 1.00 0.00 C ATOM 875 OD1 ASP A 60 18.946 -4.346 5.674 1.00 0.00 O ATOM 876 OD2 ASP A 60 18.410 -5.435 7.497 1.00 0.00 O ATOM 0 H ASP A 60 16.802 -3.821 4.573 1.00 0.00 H new ATOM 0 HA ASP A 60 15.549 -5.226 6.618 1.00 0.00 H new ATOM 0 HB2 ASP A 60 17.193 -2.608 6.443 1.00 0.00 H new ATOM 0 HB3 ASP A 60 16.840 -3.416 7.957 1.00 0.00 H new ATOM 881 N PHE A 61 14.359 -3.219 7.964 1.00 0.00 N ATOM 882 CA PHE A 61 13.304 -2.383 8.449 1.00 0.00 C ATOM 883 C PHE A 61 13.314 -0.938 8.087 1.00 0.00 C ATOM 884 O PHE A 61 12.331 -0.505 7.488 1.00 0.00 O ATOM 885 CB PHE A 61 13.199 -2.774 9.933 1.00 0.00 C ATOM 886 CG PHE A 61 11.977 -2.177 10.541 1.00 0.00 C ATOM 887 CD1 PHE A 61 10.814 -2.896 10.396 1.00 0.00 C ATOM 888 CD2 PHE A 61 12.015 -0.978 11.213 1.00 0.00 C ATOM 889 CE1 PHE A 61 9.664 -2.437 10.994 1.00 0.00 C ATOM 890 CE2 PHE A 61 10.862 -0.452 11.745 1.00 0.00 C ATOM 891 CZ PHE A 61 9.726 -1.218 11.626 1.00 0.00 C ATOM 0 H PHE A 61 14.902 -3.678 8.696 1.00 0.00 H new ATOM 0 HA PHE A 61 12.369 -2.565 7.919 1.00 0.00 H new ATOM 0 HB2 PHE A 61 13.168 -3.859 10.029 1.00 0.00 H new ATOM 0 HB3 PHE A 61 14.084 -2.432 10.469 1.00 0.00 H new ATOM 0 HD1 PHE A 61 10.804 -3.809 9.820 1.00 0.00 H new ATOM 0 HD2 PHE A 61 12.951 -0.450 11.323 1.00 0.00 H new ATOM 0 HE1 PHE A 61 8.749 -3.011 10.968 1.00 0.00 H new ATOM 0 HE2 PHE A 61 10.849 0.512 12.231 1.00 0.00 H new ATOM 0 HZ PHE A 61 8.815 -0.833 12.061 1.00 0.00 H new ATOM 901 N PRO A 62 14.294 -0.132 8.370 1.00 0.00 N ATOM 902 CA PRO A 62 14.245 1.276 8.104 1.00 0.00 C ATOM 903 C PRO A 62 14.241 1.605 6.651 1.00 0.00 C ATOM 904 O PRO A 62 13.911 2.751 6.351 1.00 0.00 O ATOM 905 CB PRO A 62 15.540 1.783 8.735 1.00 0.00 C ATOM 906 CG PRO A 62 16.482 0.579 8.891 1.00 0.00 C ATOM 907 CD PRO A 62 15.426 -0.490 9.211 1.00 0.00 C ATOM 0 HA PRO A 62 13.331 1.722 8.495 1.00 0.00 H new ATOM 0 HB2 PRO A 62 15.997 2.549 8.108 1.00 0.00 H new ATOM 0 HB3 PRO A 62 15.340 2.241 9.704 1.00 0.00 H new ATOM 0 HG2 PRO A 62 17.045 0.361 7.983 1.00 0.00 H new ATOM 0 HG3 PRO A 62 17.209 0.710 9.693 1.00 0.00 H new ATOM 0 HD2 PRO A 62 15.791 -1.492 8.984 1.00 0.00 H new ATOM 0 HD3 PRO A 62 15.157 -0.481 10.267 1.00 0.00 H new ATOM 915 N GLU A 63 14.614 0.633 5.798 1.00 0.00 N ATOM 916 CA GLU A 63 14.578 0.860 4.387 1.00 0.00 C ATOM 917 C GLU A 63 13.228 0.768 3.763 1.00 0.00 C ATOM 918 O GLU A 63 12.754 1.646 3.044 1.00 0.00 O ATOM 919 CB GLU A 63 15.536 -0.096 3.656 1.00 0.00 C ATOM 920 CG GLU A 63 17.006 0.160 3.999 1.00 0.00 C ATOM 921 CD GLU A 63 17.925 -0.956 3.525 1.00 0.00 C ATOM 922 OE1 GLU A 63 17.575 -2.167 3.544 1.00 0.00 O ATOM 923 OE2 GLU A 63 19.171 -0.773 3.564 1.00 0.00 O ATOM 0 H GLU A 63 14.935 -0.294 6.079 1.00 0.00 H new ATOM 0 HA GLU A 63 14.896 1.896 4.273 1.00 0.00 H new ATOM 0 HB2 GLU A 63 15.282 -1.124 3.913 1.00 0.00 H new ATOM 0 HB3 GLU A 63 15.395 0.008 2.580 1.00 0.00 H new ATOM 0 HG2 GLU A 63 17.321 1.101 3.547 1.00 0.00 H new ATOM 0 HG3 GLU A 63 17.108 0.275 5.078 1.00 0.00 H new ATOM 930 N PHE A 64 12.504 -0.346 3.972 1.00 0.00 N ATOM 931 CA PHE A 64 11.101 -0.419 3.705 1.00 0.00 C ATOM 932 C PHE A 64 10.228 0.638 4.287 1.00 0.00 C ATOM 933 O PHE A 64 9.395 1.238 3.609 1.00 0.00 O ATOM 934 CB PHE A 64 10.570 -1.835 3.987 1.00 0.00 C ATOM 935 CG PHE A 64 9.133 -2.063 3.663 1.00 0.00 C ATOM 936 CD1 PHE A 64 8.626 -1.840 2.405 1.00 0.00 C ATOM 937 CD2 PHE A 64 8.256 -2.271 4.701 1.00 0.00 C ATOM 938 CE1 PHE A 64 7.267 -1.796 2.204 1.00 0.00 C ATOM 939 CE2 PHE A 64 6.911 -2.410 4.450 1.00 0.00 C ATOM 940 CZ PHE A 64 6.388 -2.103 3.216 1.00 0.00 C ATOM 0 H PHE A 64 12.901 -1.213 4.334 1.00 0.00 H new ATOM 0 HA PHE A 64 11.031 -0.196 2.640 1.00 0.00 H new ATOM 0 HB2 PHE A 64 11.169 -2.547 3.419 1.00 0.00 H new ATOM 0 HB3 PHE A 64 10.725 -2.058 5.043 1.00 0.00 H new ATOM 0 HD1 PHE A 64 9.298 -1.699 1.571 1.00 0.00 H new ATOM 0 HD2 PHE A 64 8.624 -2.325 5.715 1.00 0.00 H new ATOM 0 HE1 PHE A 64 6.883 -1.515 1.234 1.00 0.00 H new ATOM 0 HE2 PHE A 64 6.257 -2.765 5.233 1.00 0.00 H new ATOM 0 HZ PHE A 64 5.321 -2.103 3.047 1.00 0.00 H new ATOM 950 N LEU A 65 10.475 0.978 5.565 1.00 0.00 N ATOM 951 CA LEU A 65 9.996 2.118 6.285 1.00 0.00 C ATOM 952 C LEU A 65 10.117 3.389 5.516 1.00 0.00 C ATOM 953 O LEU A 65 9.134 4.048 5.181 1.00 0.00 O ATOM 954 CB LEU A 65 10.728 2.205 7.635 1.00 0.00 C ATOM 955 CG LEU A 65 10.080 3.181 8.631 1.00 0.00 C ATOM 956 CD1 LEU A 65 8.746 2.715 9.239 1.00 0.00 C ATOM 957 CD2 LEU A 65 11.054 3.528 9.770 1.00 0.00 C ATOM 0 H LEU A 65 11.071 0.393 6.151 1.00 0.00 H new ATOM 0 HA LEU A 65 8.928 1.983 6.454 1.00 0.00 H new ATOM 0 HB2 LEU A 65 10.762 1.212 8.084 1.00 0.00 H new ATOM 0 HB3 LEU A 65 11.759 2.511 7.459 1.00 0.00 H new ATOM 0 HG LEU A 65 9.849 4.060 8.029 1.00 0.00 H new ATOM 0 HD11 LEU A 65 8.374 3.475 9.927 1.00 0.00 H new ATOM 0 HD12 LEU A 65 8.018 2.559 8.443 1.00 0.00 H new ATOM 0 HD13 LEU A 65 8.899 1.781 9.779 1.00 0.00 H new ATOM 0 HD21 LEU A 65 10.573 4.220 10.462 1.00 0.00 H new ATOM 0 HD22 LEU A 65 11.332 2.618 10.301 1.00 0.00 H new ATOM 0 HD23 LEU A 65 11.948 3.993 9.355 1.00 0.00 H new ATOM 969 N THR A 66 11.344 3.802 5.154 1.00 0.00 N ATOM 970 CA THR A 66 11.678 4.868 4.261 1.00 0.00 C ATOM 971 C THR A 66 10.905 4.792 2.990 1.00 0.00 C ATOM 972 O THR A 66 10.265 5.816 2.751 1.00 0.00 O ATOM 973 CB THR A 66 13.151 5.009 4.012 1.00 0.00 C ATOM 974 OG1 THR A 66 13.857 5.298 5.210 1.00 0.00 O ATOM 975 CG2 THR A 66 13.583 6.107 3.026 1.00 0.00 C ATOM 0 H THR A 66 12.179 3.346 5.522 1.00 0.00 H new ATOM 0 HA THR A 66 11.380 5.782 4.775 1.00 0.00 H new ATOM 0 HB THR A 66 13.391 4.038 3.578 1.00 0.00 H new ATOM 0 HG1 THR A 66 13.958 4.478 5.736 1.00 0.00 H new ATOM 0 HG21 THR A 66 14.669 6.106 2.933 1.00 0.00 H new ATOM 0 HG22 THR A 66 13.135 5.917 2.051 1.00 0.00 H new ATOM 0 HG23 THR A 66 13.251 7.078 3.394 1.00 0.00 H new ATOM 983 N MET A 67 10.927 3.722 2.176 1.00 0.00 N ATOM 984 CA MET A 67 10.269 3.592 0.913 1.00 0.00 C ATOM 985 C MET A 67 8.847 4.035 0.966 1.00 0.00 C ATOM 986 O MET A 67 8.340 4.800 0.147 1.00 0.00 O ATOM 987 CB MET A 67 10.304 2.124 0.455 1.00 0.00 C ATOM 988 CG MET A 67 9.613 1.858 -0.884 1.00 0.00 C ATOM 989 SD MET A 67 9.962 0.244 -1.645 1.00 0.00 S ATOM 990 CE MET A 67 8.582 -0.641 -0.864 1.00 0.00 C ATOM 0 H MET A 67 11.448 2.880 2.423 1.00 0.00 H new ATOM 0 HA MET A 67 10.802 4.233 0.210 1.00 0.00 H new ATOM 0 HB2 MET A 67 11.344 1.804 0.382 1.00 0.00 H new ATOM 0 HB3 MET A 67 9.834 1.507 1.221 1.00 0.00 H new ATOM 0 HG2 MET A 67 8.536 1.946 -0.740 1.00 0.00 H new ATOM 0 HG3 MET A 67 9.906 2.640 -1.585 1.00 0.00 H new ATOM 0 HE1 MET A 67 8.872 -1.675 -0.678 1.00 0.00 H new ATOM 0 HE2 MET A 67 8.329 -0.159 0.080 1.00 0.00 H new ATOM 0 HE3 MET A 67 7.716 -0.621 -1.525 1.00 0.00 H new ATOM 1000 N MET A 68 8.168 3.619 2.050 1.00 0.00 N ATOM 1001 CA MET A 68 6.757 3.804 2.189 1.00 0.00 C ATOM 1002 C MET A 68 6.401 5.104 2.825 1.00 0.00 C ATOM 1003 O MET A 68 5.369 5.677 2.480 1.00 0.00 O ATOM 1004 CB MET A 68 6.114 2.614 2.922 1.00 0.00 C ATOM 1005 CG MET A 68 6.298 1.280 2.196 1.00 0.00 C ATOM 1006 SD MET A 68 5.850 1.350 0.436 1.00 0.00 S ATOM 1007 CE MET A 68 4.142 0.871 0.822 1.00 0.00 C ATOM 0 H MET A 68 8.605 3.147 2.842 1.00 0.00 H new ATOM 0 HA MET A 68 6.344 3.842 1.181 1.00 0.00 H new ATOM 0 HB2 MET A 68 6.543 2.537 3.921 1.00 0.00 H new ATOM 0 HB3 MET A 68 5.049 2.807 3.047 1.00 0.00 H new ATOM 0 HG2 MET A 68 7.338 0.966 2.287 1.00 0.00 H new ATOM 0 HG3 MET A 68 5.691 0.520 2.688 1.00 0.00 H new ATOM 0 HE1 MET A 68 3.540 0.905 -0.086 1.00 0.00 H new ATOM 0 HE2 MET A 68 4.131 -0.141 1.227 1.00 0.00 H new ATOM 0 HE3 MET A 68 3.728 1.561 1.557 1.00 0.00 H new ATOM 1017 N ALA A 69 7.257 5.604 3.734 1.00 0.00 N ATOM 1018 CA ALA A 69 7.005 6.882 4.323 1.00 0.00 C ATOM 1019 C ALA A 69 7.021 8.001 3.339 1.00 0.00 C ATOM 1020 O ALA A 69 6.273 8.976 3.397 1.00 0.00 O ATOM 1021 CB ALA A 69 7.970 7.067 5.506 1.00 0.00 C ATOM 0 H ALA A 69 8.105 5.136 4.055 1.00 0.00 H new ATOM 0 HA ALA A 69 5.984 6.911 4.703 1.00 0.00 H new ATOM 0 HB1 ALA A 69 7.794 8.037 5.970 1.00 0.00 H new ATOM 0 HB2 ALA A 69 7.802 6.278 6.239 1.00 0.00 H new ATOM 0 HB3 ALA A 69 8.998 7.017 5.148 1.00 0.00 H new ATOM 1027 N ARG A 70 8.020 7.866 2.449 1.00 0.00 N ATOM 1028 CA ARG A 70 8.265 8.758 1.358 1.00 0.00 C ATOM 1029 C ARG A 70 7.056 9.057 0.540 1.00 0.00 C ATOM 1030 O ARG A 70 6.591 8.252 -0.265 1.00 0.00 O ATOM 1031 CB ARG A 70 9.485 8.451 0.473 1.00 0.00 C ATOM 1032 CG ARG A 70 9.814 9.581 -0.504 1.00 0.00 C ATOM 1033 CD ARG A 70 10.981 9.111 -1.375 1.00 0.00 C ATOM 1034 NE ARG A 70 11.044 10.143 -2.448 1.00 0.00 N ATOM 1035 CZ ARG A 70 12.172 10.543 -3.104 1.00 0.00 C ATOM 1036 NH1 ARG A 70 13.305 9.786 -3.034 1.00 0.00 N ATOM 1037 NH2 ARG A 70 11.992 11.427 -4.129 1.00 0.00 N ATOM 0 H ARG A 70 8.689 7.098 2.492 1.00 0.00 H new ATOM 0 HA ARG A 70 8.542 9.669 1.887 1.00 0.00 H new ATOM 0 HB2 ARG A 70 10.350 8.264 1.109 1.00 0.00 H new ATOM 0 HB3 ARG A 70 9.299 7.535 -0.088 1.00 0.00 H new ATOM 0 HG2 ARG A 70 8.947 9.819 -1.120 1.00 0.00 H new ATOM 0 HG3 ARG A 70 10.080 10.489 0.036 1.00 0.00 H new ATOM 0 HD2 ARG A 70 11.911 9.062 -0.809 1.00 0.00 H new ATOM 0 HD3 ARG A 70 10.803 8.116 -1.783 1.00 0.00 H new ATOM 0 HE ARG A 70 10.167 10.590 -2.716 1.00 0.00 H new ATOM 0 HH11 ARG A 70 13.308 8.922 -2.492 1.00 0.00 H new ATOM 0 HH12 ARG A 70 14.149 10.084 -3.524 1.00 0.00 H new ATOM 0 HH21 ARG A 70 11.054 11.750 -4.365 1.00 0.00 H new ATOM 0 HH22 ARG A 70 12.796 11.764 -4.659 1.00 0.00 H new ATOM 1051 N LYS A 71 6.449 10.248 0.688 1.00 0.00 N ATOM 1052 CA LYS A 71 5.300 10.751 0.002 1.00 0.00 C ATOM 1053 C LYS A 71 5.731 11.129 -1.373 1.00 0.00 C ATOM 1054 O LYS A 71 6.553 12.025 -1.556 1.00 0.00 O ATOM 1055 CB LYS A 71 4.756 11.981 0.748 1.00 0.00 C ATOM 1056 CG LYS A 71 3.403 12.416 0.182 1.00 0.00 C ATOM 1057 CD LYS A 71 3.389 13.759 -0.552 1.00 0.00 C ATOM 1058 CE LYS A 71 1.990 13.956 -1.139 1.00 0.00 C ATOM 1059 NZ LYS A 71 1.707 13.073 -2.292 1.00 0.00 N ATOM 0 H LYS A 71 6.803 10.928 1.360 1.00 0.00 H new ATOM 0 HA LYS A 71 4.510 10.001 -0.043 1.00 0.00 H new ATOM 0 HB2 LYS A 71 4.653 11.750 1.808 1.00 0.00 H new ATOM 0 HB3 LYS A 71 5.468 12.803 0.668 1.00 0.00 H new ATOM 0 HG2 LYS A 71 3.052 11.645 -0.504 1.00 0.00 H new ATOM 0 HG3 LYS A 71 2.686 12.464 1.002 1.00 0.00 H new ATOM 0 HD2 LYS A 71 3.634 14.571 0.133 1.00 0.00 H new ATOM 0 HD3 LYS A 71 4.140 13.771 -1.342 1.00 0.00 H new ATOM 0 HE2 LYS A 71 1.249 13.774 -0.361 1.00 0.00 H new ATOM 0 HE3 LYS A 71 1.877 14.995 -1.450 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 1.068 13.559 -2.953 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 2.597 12.841 -2.778 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 1.258 12.197 -1.956 1.00 0.00 H new ATOM 1073 N MET A 72 5.152 10.459 -2.386 1.00 0.00 N ATOM 1074 CA MET A 72 5.589 10.584 -3.742 1.00 0.00 C ATOM 1075 C MET A 72 4.662 11.512 -4.449 1.00 0.00 C ATOM 1076 O MET A 72 3.790 12.021 -3.746 1.00 0.00 O ATOM 1077 CB MET A 72 5.602 9.215 -4.443 1.00 0.00 C ATOM 1078 CG MET A 72 6.608 8.240 -3.827 1.00 0.00 C ATOM 1079 SD MET A 72 8.365 8.655 -4.043 1.00 0.00 S ATOM 1080 CE MET A 72 8.937 7.014 -3.515 1.00 0.00 C ATOM 0 H MET A 72 4.367 9.820 -2.261 1.00 0.00 H new ATOM 0 HA MET A 72 6.606 10.976 -3.762 1.00 0.00 H new ATOM 0 HB2 MET A 72 4.604 8.778 -4.395 1.00 0.00 H new ATOM 0 HB3 MET A 72 5.838 9.355 -5.498 1.00 0.00 H new ATOM 0 HG2 MET A 72 6.403 8.165 -2.759 1.00 0.00 H new ATOM 0 HG3 MET A 72 6.434 7.253 -4.255 1.00 0.00 H new ATOM 0 HE1 MET A 72 10.022 6.962 -3.601 1.00 0.00 H new ATOM 0 HE2 MET A 72 8.647 6.844 -2.478 1.00 0.00 H new ATOM 0 HE3 MET A 72 8.486 6.250 -4.148 1.00 0.00 H new ATOM 1090 N LYS A 73 4.828 11.867 -5.735 1.00 0.00 N ATOM 1091 CA LYS A 73 4.057 12.910 -6.338 1.00 0.00 C ATOM 1092 C LYS A 73 2.730 12.294 -6.619 1.00 0.00 C ATOM 1093 O LYS A 73 2.546 11.080 -6.701 1.00 0.00 O ATOM 1094 CB LYS A 73 4.562 13.678 -7.571 1.00 0.00 C ATOM 1095 CG LYS A 73 4.660 12.787 -8.811 1.00 0.00 C ATOM 1096 CD LYS A 73 5.232 13.590 -9.982 1.00 0.00 C ATOM 1097 CE LYS A 73 5.258 12.893 -11.343 1.00 0.00 C ATOM 1098 NZ LYS A 73 6.214 11.767 -11.252 1.00 0.00 N ATOM 0 H LYS A 73 5.502 11.428 -6.362 1.00 0.00 H new ATOM 0 HA LYS A 73 4.087 13.726 -5.616 1.00 0.00 H new ATOM 0 HB2 LYS A 73 3.890 14.511 -7.777 1.00 0.00 H new ATOM 0 HB3 LYS A 73 5.542 14.104 -7.355 1.00 0.00 H new ATOM 0 HG2 LYS A 73 5.296 11.927 -8.603 1.00 0.00 H new ATOM 0 HG3 LYS A 73 3.675 12.399 -9.071 1.00 0.00 H new ATOM 0 HD2 LYS A 73 4.653 14.508 -10.081 1.00 0.00 H new ATOM 0 HD3 LYS A 73 6.251 13.882 -9.729 1.00 0.00 H new ATOM 0 HE2 LYS A 73 4.264 12.531 -11.607 1.00 0.00 H new ATOM 0 HE3 LYS A 73 5.561 13.590 -12.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 6.810 11.748 -12.104 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 6.815 11.889 -10.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 5.690 10.872 -11.176 1.00 0.00 H new ATOM 1112 N ASP A 74 1.678 13.116 -6.778 1.00 0.00 N ATOM 1113 CA ASP A 74 0.307 12.734 -6.638 1.00 0.00 C ATOM 1114 C ASP A 74 -0.188 11.867 -7.744 1.00 0.00 C ATOM 1115 O ASP A 74 -0.976 10.954 -7.501 1.00 0.00 O ATOM 1116 CB ASP A 74 -0.668 13.897 -6.392 1.00 0.00 C ATOM 1117 CG ASP A 74 -0.323 14.589 -5.081 1.00 0.00 C ATOM 1118 OD1 ASP A 74 -0.155 14.012 -3.974 1.00 0.00 O ATOM 1119 OD2 ASP A 74 -0.345 15.849 -5.094 1.00 0.00 O ATOM 0 H ASP A 74 1.790 14.101 -7.017 1.00 0.00 H new ATOM 0 HA ASP A 74 0.317 12.140 -5.724 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -0.614 14.609 -7.215 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -1.692 13.525 -6.359 1.00 0.00 H new ATOM 1124 N THR A 75 0.307 12.174 -8.957 1.00 0.00 N ATOM 1125 CA THR A 75 0.080 11.411 -10.144 1.00 0.00 C ATOM 1126 C THR A 75 0.627 10.025 -10.147 1.00 0.00 C ATOM 1127 O THR A 75 0.070 9.089 -10.720 1.00 0.00 O ATOM 1128 CB THR A 75 0.566 12.207 -11.318 1.00 0.00 C ATOM 1129 OG1 THR A 75 1.866 12.740 -11.109 1.00 0.00 O ATOM 1130 CG2 THR A 75 -0.289 13.474 -11.490 1.00 0.00 C ATOM 0 H THR A 75 0.893 12.993 -9.117 1.00 0.00 H new ATOM 0 HA THR A 75 -0.995 11.241 -10.202 1.00 0.00 H new ATOM 0 HB THR A 75 0.530 11.518 -12.162 1.00 0.00 H new ATOM 0 HG1 THR A 75 2.142 13.249 -11.900 1.00 0.00 H new ATOM 0 HG21 THR A 75 0.073 14.044 -12.346 1.00 0.00 H new ATOM 0 HG22 THR A 75 -1.329 13.192 -11.656 1.00 0.00 H new ATOM 0 HG23 THR A 75 -0.218 14.085 -10.590 1.00 0.00 H new ATOM 1138 N ASP A 76 1.716 9.860 -9.376 1.00 0.00 N ATOM 1139 CA ASP A 76 2.480 8.672 -9.150 1.00 0.00 C ATOM 1140 C ASP A 76 1.679 7.819 -8.227 1.00 0.00 C ATOM 1141 O ASP A 76 1.360 6.654 -8.455 1.00 0.00 O ATOM 1142 CB ASP A 76 3.826 8.787 -8.416 1.00 0.00 C ATOM 1143 CG ASP A 76 4.873 9.335 -9.375 1.00 0.00 C ATOM 1144 OD1 ASP A 76 4.557 9.758 -10.519 1.00 0.00 O ATOM 1145 OD2 ASP A 76 6.043 9.560 -8.965 1.00 0.00 O ATOM 0 H ASP A 76 2.101 10.648 -8.855 1.00 0.00 H new ATOM 0 HA ASP A 76 2.691 8.314 -10.158 1.00 0.00 H new ATOM 0 HB2 ASP A 76 3.728 9.444 -7.552 1.00 0.00 H new ATOM 0 HB3 ASP A 76 4.134 7.811 -8.041 1.00 0.00 H new ATOM 1150 N SER A 77 1.185 8.384 -7.111 1.00 0.00 N ATOM 1151 CA SER A 77 0.561 7.786 -5.972 1.00 0.00 C ATOM 1152 C SER A 77 -0.781 7.256 -6.346 1.00 0.00 C ATOM 1153 O SER A 77 -1.267 6.217 -5.902 1.00 0.00 O ATOM 1154 CB SER A 77 0.386 8.917 -4.944 1.00 0.00 C ATOM 1155 OG SER A 77 -0.351 8.516 -3.798 1.00 0.00 O ATOM 0 H SER A 77 1.232 9.397 -6.998 1.00 0.00 H new ATOM 0 HA SER A 77 1.158 6.962 -5.580 1.00 0.00 H new ATOM 0 HB2 SER A 77 1.368 9.272 -4.632 1.00 0.00 H new ATOM 0 HB3 SER A 77 -0.120 9.757 -5.419 1.00 0.00 H new ATOM 0 HG SER A 77 -0.430 9.272 -3.179 1.00 0.00 H new ATOM 1161 N GLU A 78 -1.407 8.049 -7.233 1.00 0.00 N ATOM 1162 CA GLU A 78 -2.675 7.733 -7.813 1.00 0.00 C ATOM 1163 C GLU A 78 -2.588 6.464 -8.589 1.00 0.00 C ATOM 1164 O GLU A 78 -3.410 5.556 -8.474 1.00 0.00 O ATOM 1165 CB GLU A 78 -3.046 8.975 -8.642 1.00 0.00 C ATOM 1166 CG GLU A 78 -4.298 8.936 -9.521 1.00 0.00 C ATOM 1167 CD GLU A 78 -4.560 10.333 -10.065 1.00 0.00 C ATOM 1168 OE1 GLU A 78 -4.724 11.294 -9.267 1.00 0.00 O ATOM 1169 OE2 GLU A 78 -4.673 10.511 -11.307 1.00 0.00 O ATOM 0 H GLU A 78 -1.020 8.936 -7.556 1.00 0.00 H new ATOM 0 HA GLU A 78 -3.461 7.536 -7.083 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -3.156 9.811 -7.951 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -2.198 9.204 -9.288 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -4.161 8.231 -10.341 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -5.154 8.590 -8.943 1.00 0.00 H new ATOM 1176 N GLU A 79 -1.551 6.351 -9.437 1.00 0.00 N ATOM 1177 CA GLU A 79 -1.313 5.208 -10.262 1.00 0.00 C ATOM 1178 C GLU A 79 -0.934 4.034 -9.425 1.00 0.00 C ATOM 1179 O GLU A 79 -1.211 2.876 -9.733 1.00 0.00 O ATOM 1180 CB GLU A 79 -0.174 5.445 -11.268 1.00 0.00 C ATOM 1181 CG GLU A 79 -0.591 6.081 -12.595 1.00 0.00 C ATOM 1182 CD GLU A 79 -1.586 5.283 -13.424 1.00 0.00 C ATOM 1183 OE1 GLU A 79 -1.158 4.309 -14.099 1.00 0.00 O ATOM 1184 OE2 GLU A 79 -2.784 5.662 -13.525 1.00 0.00 O ATOM 0 H GLU A 79 -0.851 7.084 -9.553 1.00 0.00 H new ATOM 0 HA GLU A 79 -2.240 5.022 -10.804 1.00 0.00 H new ATOM 0 HB2 GLU A 79 0.575 6.083 -10.799 1.00 0.00 H new ATOM 0 HB3 GLU A 79 0.307 4.490 -11.478 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -1.022 7.061 -12.388 1.00 0.00 H new ATOM 0 HG3 GLU A 79 0.304 6.246 -13.195 1.00 0.00 H new ATOM 1191 N GLU A 80 -0.292 4.269 -8.267 1.00 0.00 N ATOM 1192 CA GLU A 80 0.141 3.210 -7.409 1.00 0.00 C ATOM 1193 C GLU A 80 -1.022 2.588 -6.717 1.00 0.00 C ATOM 1194 O GLU A 80 -1.082 1.360 -6.659 1.00 0.00 O ATOM 1195 CB GLU A 80 1.079 3.839 -6.365 1.00 0.00 C ATOM 1196 CG GLU A 80 1.579 2.837 -5.323 1.00 0.00 C ATOM 1197 CD GLU A 80 2.893 3.360 -4.759 1.00 0.00 C ATOM 1198 OE1 GLU A 80 3.847 3.594 -5.547 1.00 0.00 O ATOM 1199 OE2 GLU A 80 2.913 3.703 -3.547 1.00 0.00 O ATOM 0 H GLU A 80 -0.071 5.203 -7.922 1.00 0.00 H new ATOM 0 HA GLU A 80 0.644 2.433 -7.986 1.00 0.00 H new ATOM 0 HB2 GLU A 80 1.935 4.281 -6.875 1.00 0.00 H new ATOM 0 HB3 GLU A 80 0.556 4.650 -5.858 1.00 0.00 H new ATOM 0 HG2 GLU A 80 0.844 2.716 -4.527 1.00 0.00 H new ATOM 0 HG3 GLU A 80 1.722 1.856 -5.776 1.00 0.00 H new ATOM 1206 N ILE A 81 -2.016 3.408 -6.333 1.00 0.00 N ATOM 1207 CA ILE A 81 -3.180 2.988 -5.615 1.00 0.00 C ATOM 1208 C ILE A 81 -4.065 2.224 -6.539 1.00 0.00 C ATOM 1209 O ILE A 81 -4.573 1.215 -6.052 1.00 0.00 O ATOM 1210 CB ILE A 81 -3.899 4.044 -4.828 1.00 0.00 C ATOM 1211 CG1 ILE A 81 -2.999 4.621 -3.723 1.00 0.00 C ATOM 1212 CG2 ILE A 81 -5.117 3.506 -4.059 1.00 0.00 C ATOM 1213 CD1 ILE A 81 -3.220 6.072 -3.297 1.00 0.00 C ATOM 0 H ILE A 81 -2.008 4.408 -6.532 1.00 0.00 H new ATOM 0 HA ILE A 81 -2.832 2.337 -4.813 1.00 0.00 H new ATOM 0 HB ILE A 81 -4.194 4.777 -5.579 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -3.113 3.993 -2.839 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -1.964 4.524 -4.052 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -5.591 4.321 -3.512 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -5.831 3.078 -4.762 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -4.794 2.737 -3.357 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -2.511 6.333 -2.511 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -3.070 6.729 -4.153 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -4.237 6.190 -2.922 1.00 0.00 H new ATOM 1225 N ARG A 82 -4.147 2.512 -7.851 1.00 0.00 N ATOM 1226 CA ARG A 82 -4.907 1.905 -8.899 1.00 0.00 C ATOM 1227 C ARG A 82 -4.404 0.520 -9.117 1.00 0.00 C ATOM 1228 O ARG A 82 -5.172 -0.440 -9.061 1.00 0.00 O ATOM 1229 CB ARG A 82 -4.850 2.770 -10.170 1.00 0.00 C ATOM 1230 CG ARG A 82 -5.767 3.994 -10.117 1.00 0.00 C ATOM 1231 CD ARG A 82 -5.478 4.981 -11.249 1.00 0.00 C ATOM 1232 NE ARG A 82 -6.448 6.106 -11.131 1.00 0.00 N ATOM 1233 CZ ARG A 82 -6.286 7.258 -11.844 1.00 0.00 C ATOM 1234 NH1 ARG A 82 -5.369 7.276 -12.854 1.00 0.00 N ATOM 1235 NH2 ARG A 82 -7.079 8.314 -11.496 1.00 0.00 N ATOM 0 H ARG A 82 -3.597 3.285 -8.224 1.00 0.00 H new ATOM 0 HA ARG A 82 -5.959 1.839 -8.621 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -3.824 3.101 -10.329 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -5.124 2.158 -11.029 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -6.806 3.670 -10.176 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -5.644 4.497 -9.158 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -4.455 5.350 -11.182 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -5.577 4.491 -12.218 1.00 0.00 H new ATOM 0 HE ARG A 82 -7.248 6.013 -10.505 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -4.823 6.440 -13.062 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -5.230 8.125 -13.401 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -7.752 8.218 -10.735 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -6.999 9.199 -11.997 1.00 0.00 H new ATOM 1249 N GLU A 83 -3.105 0.335 -9.412 1.00 0.00 N ATOM 1250 CA GLU A 83 -2.499 -0.921 -9.727 1.00 0.00 C ATOM 1251 C GLU A 83 -2.475 -1.856 -8.567 1.00 0.00 C ATOM 1252 O GLU A 83 -2.603 -3.078 -8.597 1.00 0.00 O ATOM 1253 CB GLU A 83 -1.111 -0.675 -10.344 1.00 0.00 C ATOM 1254 CG GLU A 83 -1.023 -0.007 -11.718 1.00 0.00 C ATOM 1255 CD GLU A 83 -1.649 -0.836 -12.830 1.00 0.00 C ATOM 1256 OE1 GLU A 83 -1.923 -2.061 -12.721 1.00 0.00 O ATOM 1257 OE2 GLU A 83 -1.819 -0.274 -13.945 1.00 0.00 O ATOM 0 H GLU A 83 -2.439 1.108 -9.432 1.00 0.00 H new ATOM 0 HA GLU A 83 -3.113 -1.431 -10.469 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -0.542 -0.064 -9.643 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -0.605 -1.638 -10.412 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -1.517 0.963 -11.675 1.00 0.00 H new ATOM 0 HG3 GLU A 83 0.024 0.179 -11.958 1.00 0.00 H new ATOM 1264 N ALA A 84 -2.292 -1.358 -7.331 1.00 0.00 N ATOM 1265 CA ALA A 84 -2.425 -2.085 -6.107 1.00 0.00 C ATOM 1266 C ALA A 84 -3.802 -2.612 -5.888 1.00 0.00 C ATOM 1267 O ALA A 84 -4.045 -3.802 -5.698 1.00 0.00 O ATOM 1268 CB ALA A 84 -1.918 -1.157 -4.989 1.00 0.00 C ATOM 0 H ALA A 84 -2.034 -0.383 -7.178 1.00 0.00 H new ATOM 0 HA ALA A 84 -1.824 -2.994 -6.128 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -1.998 -1.667 -4.029 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -0.876 -0.898 -5.176 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -2.520 -0.249 -4.969 1.00 0.00 H new ATOM 1274 N PHE A 85 -4.795 -1.727 -6.086 1.00 0.00 N ATOM 1275 CA PHE A 85 -6.199 -1.986 -6.001 1.00 0.00 C ATOM 1276 C PHE A 85 -6.688 -2.989 -6.988 1.00 0.00 C ATOM 1277 O PHE A 85 -7.492 -3.883 -6.733 1.00 0.00 O ATOM 1278 CB PHE A 85 -6.951 -0.658 -6.191 1.00 0.00 C ATOM 1279 CG PHE A 85 -8.432 -0.781 -6.083 1.00 0.00 C ATOM 1280 CD1 PHE A 85 -9.242 -1.130 -7.138 1.00 0.00 C ATOM 1281 CD2 PHE A 85 -9.033 -0.545 -4.869 1.00 0.00 C ATOM 1282 CE1 PHE A 85 -10.606 -1.190 -6.973 1.00 0.00 C ATOM 1283 CE2 PHE A 85 -10.353 -0.853 -4.635 1.00 0.00 C ATOM 1284 CZ PHE A 85 -11.160 -1.121 -5.716 1.00 0.00 C ATOM 0 H PHE A 85 -4.599 -0.755 -6.324 1.00 0.00 H new ATOM 0 HA PHE A 85 -6.390 -2.418 -5.018 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -6.600 0.056 -5.446 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -6.701 -0.247 -7.169 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -8.806 -1.358 -8.099 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -8.450 -0.104 -4.074 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -11.247 -1.292 -7.836 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -10.745 -0.884 -3.629 1.00 0.00 H new ATOM 0 HZ PHE A 85 -12.220 -1.276 -5.579 1.00 0.00 H new ATOM 1294 N ARG A 86 -6.172 -2.869 -8.225 1.00 0.00 N ATOM 1295 CA ARG A 86 -6.344 -3.821 -9.278 1.00 0.00 C ATOM 1296 C ARG A 86 -6.158 -5.271 -8.987 1.00 0.00 C ATOM 1297 O ARG A 86 -6.756 -6.187 -9.549 1.00 0.00 O ATOM 1298 CB ARG A 86 -5.557 -3.496 -10.559 1.00 0.00 C ATOM 1299 CG ARG A 86 -5.892 -4.274 -11.833 1.00 0.00 C ATOM 1300 CD ARG A 86 -4.748 -4.371 -12.845 1.00 0.00 C ATOM 1301 NE ARG A 86 -4.338 -2.987 -13.214 1.00 0.00 N ATOM 1302 CZ ARG A 86 -4.905 -2.231 -14.199 1.00 0.00 C ATOM 1303 NH1 ARG A 86 -6.099 -2.573 -14.765 1.00 0.00 N ATOM 1304 NH2 ARG A 86 -4.281 -1.072 -14.561 1.00 0.00 N ATOM 0 H ARG A 86 -5.606 -2.067 -8.504 1.00 0.00 H new ATOM 0 HA ARG A 86 -7.416 -3.685 -9.418 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -5.692 -2.436 -10.772 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -4.499 -3.646 -10.346 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -6.200 -5.282 -11.556 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -6.747 -3.801 -12.316 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -3.907 -4.916 -12.417 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -5.068 -4.922 -13.730 1.00 0.00 H new ATOM 0 HE ARG A 86 -3.570 -2.570 -12.687 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -6.590 -3.411 -14.453 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -6.501 -1.990 -15.500 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -3.416 -0.793 -14.099 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -4.680 -0.485 -15.294 1.00 0.00 H new ATOM 1318 N VAL A 87 -5.311 -5.561 -7.984 1.00 0.00 N ATOM 1319 CA VAL A 87 -4.935 -6.859 -7.515 1.00 0.00 C ATOM 1320 C VAL A 87 -6.057 -7.478 -6.754 1.00 0.00 C ATOM 1321 O VAL A 87 -6.236 -8.689 -6.876 1.00 0.00 O ATOM 1322 CB VAL A 87 -3.583 -6.892 -6.866 1.00 0.00 C ATOM 1323 CG1 VAL A 87 -3.373 -8.112 -5.953 1.00 0.00 C ATOM 1324 CG2 VAL A 87 -2.441 -6.878 -7.896 1.00 0.00 C ATOM 0 H VAL A 87 -4.849 -4.821 -7.456 1.00 0.00 H new ATOM 0 HA VAL A 87 -4.776 -7.514 -8.372 1.00 0.00 H new ATOM 0 HB VAL A 87 -3.557 -5.986 -6.261 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -2.375 -8.072 -5.517 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -4.118 -8.103 -5.157 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -3.477 -9.026 -6.537 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -1.483 -6.903 -7.377 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -2.525 -7.750 -8.545 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -2.504 -5.971 -8.497 1.00 0.00 H new ATOM 1334 N PHE A 88 -6.856 -6.659 -6.047 1.00 0.00 N ATOM 1335 CA PHE A 88 -8.082 -7.166 -5.514 1.00 0.00 C ATOM 1336 C PHE A 88 -9.147 -7.326 -6.544 1.00 0.00 C ATOM 1337 O PHE A 88 -9.770 -8.386 -6.584 1.00 0.00 O ATOM 1338 CB PHE A 88 -8.449 -6.246 -4.337 1.00 0.00 C ATOM 1339 CG PHE A 88 -7.353 -6.153 -3.332 1.00 0.00 C ATOM 1340 CD1 PHE A 88 -6.349 -5.219 -3.433 1.00 0.00 C ATOM 1341 CD2 PHE A 88 -7.531 -6.794 -2.128 1.00 0.00 C ATOM 1342 CE1 PHE A 88 -5.454 -5.068 -2.401 1.00 0.00 C ATOM 1343 CE2 PHE A 88 -6.739 -6.506 -1.042 1.00 0.00 C ATOM 1344 CZ PHE A 88 -5.686 -5.632 -1.168 1.00 0.00 C ATOM 0 H PHE A 88 -6.663 -5.677 -5.849 1.00 0.00 H new ATOM 0 HA PHE A 88 -7.966 -8.188 -5.153 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -8.679 -5.250 -4.715 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -9.352 -6.620 -3.854 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -6.264 -4.607 -4.319 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -8.308 -7.538 -2.034 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -4.552 -4.496 -2.561 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -6.945 -6.968 -0.088 1.00 0.00 H new ATOM 0 HZ PHE A 88 -5.058 -5.394 -0.322 1.00 0.00 H new ATOM 1354 N ASP A 89 -9.558 -6.298 -7.307 1.00 0.00 N ATOM 1355 CA ASP A 89 -10.613 -6.438 -8.261 1.00 0.00 C ATOM 1356 C ASP A 89 -10.327 -7.346 -9.408 1.00 0.00 C ATOM 1357 O ASP A 89 -9.393 -7.006 -10.132 1.00 0.00 O ATOM 1358 CB ASP A 89 -10.857 -4.955 -8.586 1.00 0.00 C ATOM 1359 CG ASP A 89 -12.037 -4.796 -9.535 1.00 0.00 C ATOM 1360 OD1 ASP A 89 -13.100 -5.419 -9.271 1.00 0.00 O ATOM 1361 OD2 ASP A 89 -11.960 -4.015 -10.521 1.00 0.00 O ATOM 0 H ASP A 89 -9.155 -5.362 -7.262 1.00 0.00 H new ATOM 0 HA ASP A 89 -11.500 -6.959 -7.901 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -11.048 -4.403 -7.666 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -9.962 -4.525 -9.036 1.00 0.00 H new ATOM 1366 N LYS A 90 -11.025 -8.463 -9.679 1.00 0.00 N ATOM 1367 CA LYS A 90 -10.626 -9.490 -10.591 1.00 0.00 C ATOM 1368 C LYS A 90 -11.039 -8.948 -11.916 1.00 0.00 C ATOM 1369 O LYS A 90 -10.309 -9.075 -12.898 1.00 0.00 O ATOM 1370 CB LYS A 90 -11.396 -10.763 -10.204 1.00 0.00 C ATOM 1371 CG LYS A 90 -11.085 -11.861 -11.223 1.00 0.00 C ATOM 1372 CD LYS A 90 -9.631 -12.255 -11.495 1.00 0.00 C ATOM 1373 CE LYS A 90 -9.451 -13.561 -12.271 1.00 0.00 C ATOM 1374 NZ LYS A 90 -8.070 -14.085 -12.364 1.00 0.00 N ATOM 0 H LYS A 90 -11.922 -8.661 -9.235 1.00 0.00 H new ATOM 0 HA LYS A 90 -9.566 -9.744 -10.591 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -11.110 -11.086 -9.203 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -12.467 -10.563 -10.181 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -11.611 -12.760 -10.903 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -11.523 -11.556 -12.174 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -9.150 -11.450 -12.051 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -9.109 -12.341 -10.542 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -10.075 -14.324 -11.806 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -9.829 -13.413 -13.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -8.057 -14.923 -12.980 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -7.447 -13.353 -12.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -7.734 -14.348 -11.416 1.00 0.00 H new ATOM 1388 N ASP A 91 -12.309 -8.551 -12.118 1.00 0.00 N ATOM 1389 CA ASP A 91 -12.985 -8.434 -13.372 1.00 0.00 C ATOM 1390 C ASP A 91 -12.590 -7.191 -14.093 1.00 0.00 C ATOM 1391 O ASP A 91 -12.499 -7.099 -15.316 1.00 0.00 O ATOM 1392 CB ASP A 91 -14.489 -8.698 -13.184 1.00 0.00 C ATOM 1393 CG ASP A 91 -14.926 -7.994 -11.908 1.00 0.00 C ATOM 1394 OD1 ASP A 91 -14.769 -6.775 -11.630 1.00 0.00 O ATOM 1395 OD2 ASP A 91 -15.298 -8.702 -10.935 1.00 0.00 O ATOM 0 H ASP A 91 -12.911 -8.291 -11.337 1.00 0.00 H new ATOM 0 HA ASP A 91 -12.664 -9.213 -14.064 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -15.053 -8.325 -14.039 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -14.684 -9.768 -13.116 1.00 0.00 H new ATOM 1400 N GLY A 92 -12.645 -6.075 -13.345 1.00 0.00 N ATOM 1401 CA GLY A 92 -12.446 -4.744 -13.830 1.00 0.00 C ATOM 1402 C GLY A 92 -13.589 -3.805 -13.653 1.00 0.00 C ATOM 1403 O GLY A 92 -13.557 -2.827 -14.397 1.00 0.00 O ATOM 0 H GLY A 92 -12.840 -6.103 -12.344 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -11.575 -4.323 -13.328 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -12.207 -4.798 -14.892 1.00 0.00 H new ATOM 1407 N ASN A 93 -14.553 -4.003 -12.737 1.00 0.00 N ATOM 1408 CA ASN A 93 -15.585 -3.032 -12.545 1.00 0.00 C ATOM 1409 C ASN A 93 -15.237 -1.959 -11.571 1.00 0.00 C ATOM 1410 O ASN A 93 -16.017 -1.017 -11.443 1.00 0.00 O ATOM 1411 CB ASN A 93 -16.903 -3.768 -12.253 1.00 0.00 C ATOM 1412 CG ASN A 93 -16.896 -4.491 -10.913 1.00 0.00 C ATOM 1413 OD1 ASN A 93 -15.949 -4.660 -10.147 1.00 0.00 O ATOM 1414 ND2 ASN A 93 -18.141 -4.751 -10.433 1.00 0.00 N ATOM 0 H ASN A 93 -14.619 -4.824 -12.136 1.00 0.00 H new ATOM 0 HA ASN A 93 -15.712 -2.463 -13.466 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -17.724 -3.051 -12.269 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -17.094 -4.489 -13.048 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -18.260 -5.072 -9.472 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -18.956 -4.625 -11.033 1.00 0.00 H new ATOM 1421 N GLY A 94 -14.188 -2.128 -10.746 1.00 0.00 N ATOM 1422 CA GLY A 94 -13.986 -1.173 -9.701 1.00 0.00 C ATOM 1423 C GLY A 94 -14.525 -1.608 -8.382 1.00 0.00 C ATOM 1424 O GLY A 94 -14.650 -0.795 -7.467 1.00 0.00 O ATOM 0 H GLY A 94 -13.509 -2.887 -10.795 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -12.918 -0.977 -9.601 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -14.458 -0.232 -9.984 1.00 0.00 H new ATOM 1428 N TYR A 95 -15.008 -2.856 -8.247 1.00 0.00 N ATOM 1429 CA TYR A 95 -15.584 -3.277 -7.008 1.00 0.00 C ATOM 1430 C TYR A 95 -15.173 -4.645 -6.584 1.00 0.00 C ATOM 1431 O TYR A 95 -15.514 -5.558 -7.335 1.00 0.00 O ATOM 1432 CB TYR A 95 -17.079 -3.384 -7.351 1.00 0.00 C ATOM 1433 CG TYR A 95 -17.789 -2.075 -7.395 1.00 0.00 C ATOM 1434 CD1 TYR A 95 -18.258 -1.547 -6.215 1.00 0.00 C ATOM 1435 CD2 TYR A 95 -17.905 -1.476 -8.627 1.00 0.00 C ATOM 1436 CE1 TYR A 95 -18.895 -0.333 -6.314 1.00 0.00 C ATOM 1437 CE2 TYR A 95 -18.533 -0.252 -8.637 1.00 0.00 C ATOM 1438 CZ TYR A 95 -19.032 0.344 -7.503 1.00 0.00 C ATOM 1439 OH TYR A 95 -19.506 1.671 -7.582 1.00 0.00 O ATOM 0 H TYR A 95 -15.001 -3.563 -8.982 1.00 0.00 H new ATOM 0 HA TYR A 95 -15.294 -2.591 -6.212 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -17.184 -3.875 -8.319 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -17.565 -4.024 -6.614 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -18.134 -2.054 -5.270 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -17.528 -1.936 -9.528 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -19.306 0.109 -5.418 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -18.639 0.265 -9.579 1.00 0.00 H new ATOM 0 HH TYR A 95 -19.523 1.957 -8.519 1.00 0.00 H new ATOM 1449 N ILE A 96 -14.598 -4.793 -5.377 1.00 0.00 N ATOM 1450 CA ILE A 96 -14.216 -6.062 -4.840 1.00 0.00 C ATOM 1451 C ILE A 96 -15.399 -6.674 -4.172 1.00 0.00 C ATOM 1452 O ILE A 96 -16.088 -6.084 -3.341 1.00 0.00 O ATOM 1453 CB ILE A 96 -13.102 -5.831 -3.862 1.00 0.00 C ATOM 1454 CG1 ILE A 96 -11.960 -4.977 -4.437 1.00 0.00 C ATOM 1455 CG2 ILE A 96 -12.575 -7.218 -3.456 1.00 0.00 C ATOM 1456 CD1 ILE A 96 -11.153 -4.403 -3.273 1.00 0.00 C ATOM 0 H ILE A 96 -14.393 -4.009 -4.758 1.00 0.00 H new ATOM 0 HA ILE A 96 -13.873 -6.741 -5.620 1.00 0.00 H new ATOM 0 HB ILE A 96 -13.486 -5.271 -3.009 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -11.321 -5.582 -5.080 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -12.361 -4.173 -5.053 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -11.759 -7.103 -2.742 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -13.380 -7.793 -2.998 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -12.212 -7.742 -4.340 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -10.337 -3.793 -3.662 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -11.801 -3.787 -2.650 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -10.744 -5.219 -2.677 1.00 0.00 H new ATOM 1468 N SER A 97 -15.624 -7.979 -4.407 1.00 0.00 N ATOM 1469 CA SER A 97 -16.619 -8.818 -3.816 1.00 0.00 C ATOM 1470 C SER A 97 -15.843 -9.866 -3.095 1.00 0.00 C ATOM 1471 O SER A 97 -14.620 -9.994 -3.117 1.00 0.00 O ATOM 1472 CB SER A 97 -17.575 -9.347 -4.899 1.00 0.00 C ATOM 1473 OG SER A 97 -16.967 -10.001 -6.002 1.00 0.00 O ATOM 0 H SER A 97 -15.052 -8.494 -5.076 1.00 0.00 H new ATOM 0 HA SER A 97 -17.279 -8.308 -3.114 1.00 0.00 H new ATOM 0 HB2 SER A 97 -18.274 -10.041 -4.431 1.00 0.00 H new ATOM 0 HB3 SER A 97 -18.162 -8.510 -5.277 1.00 0.00 H new ATOM 0 HG SER A 97 -16.319 -9.398 -6.423 1.00 0.00 H new ATOM 1479 N ALA A 98 -16.529 -10.763 -2.365 1.00 0.00 N ATOM 1480 CA ALA A 98 -15.952 -11.815 -1.587 1.00 0.00 C ATOM 1481 C ALA A 98 -15.172 -12.897 -2.251 1.00 0.00 C ATOM 1482 O ALA A 98 -14.095 -13.286 -1.802 1.00 0.00 O ATOM 1483 CB ALA A 98 -17.105 -12.402 -0.754 1.00 0.00 C ATOM 0 H ALA A 98 -17.548 -10.753 -2.315 1.00 0.00 H new ATOM 0 HA ALA A 98 -15.152 -11.342 -1.017 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -16.728 -13.215 -0.134 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -17.526 -11.624 -0.117 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -17.879 -12.783 -1.421 1.00 0.00 H new ATOM 1489 N ALA A 99 -15.569 -13.176 -3.506 1.00 0.00 N ATOM 1490 CA ALA A 99 -14.930 -14.046 -4.444 1.00 0.00 C ATOM 1491 C ALA A 99 -13.618 -13.539 -4.936 1.00 0.00 C ATOM 1492 O ALA A 99 -12.660 -14.268 -5.191 1.00 0.00 O ATOM 1493 CB ALA A 99 -15.835 -14.116 -5.685 1.00 0.00 C ATOM 0 H ALA A 99 -16.412 -12.754 -3.896 1.00 0.00 H new ATOM 0 HA ALA A 99 -14.767 -14.997 -3.937 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -15.383 -14.772 -6.429 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -16.812 -14.508 -5.401 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -15.953 -13.118 -6.106 1.00 0.00 H new ATOM 1499 N GLU A 100 -13.466 -12.203 -4.917 1.00 0.00 N ATOM 1500 CA GLU A 100 -12.271 -11.545 -5.347 1.00 0.00 C ATOM 1501 C GLU A 100 -11.305 -11.355 -4.229 1.00 0.00 C ATOM 1502 O GLU A 100 -10.116 -11.538 -4.485 1.00 0.00 O ATOM 1503 CB GLU A 100 -12.763 -10.229 -5.973 1.00 0.00 C ATOM 1504 CG GLU A 100 -13.875 -10.444 -7.002 1.00 0.00 C ATOM 1505 CD GLU A 100 -14.266 -9.141 -7.684 1.00 0.00 C ATOM 1506 OE1 GLU A 100 -13.465 -8.596 -8.490 1.00 0.00 O ATOM 1507 OE2 GLU A 100 -15.324 -8.532 -7.370 1.00 0.00 O ATOM 0 H GLU A 100 -14.192 -11.564 -4.594 1.00 0.00 H new ATOM 0 HA GLU A 100 -11.703 -12.131 -6.069 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -13.126 -9.570 -5.184 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -11.924 -9.723 -6.451 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -13.544 -11.163 -7.752 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -14.748 -10.875 -6.511 1.00 0.00 H new ATOM 1514 N LEU A 101 -11.705 -11.277 -2.947 1.00 0.00 N ATOM 1515 CA LEU A 101 -10.822 -11.362 -1.825 1.00 0.00 C ATOM 1516 C LEU A 101 -10.268 -12.697 -1.465 1.00 0.00 C ATOM 1517 O LEU A 101 -9.097 -12.912 -1.155 1.00 0.00 O ATOM 1518 CB LEU A 101 -11.633 -10.917 -0.597 1.00 0.00 C ATOM 1519 CG LEU A 101 -10.864 -10.584 0.693 1.00 0.00 C ATOM 1520 CD1 LEU A 101 -9.942 -9.387 0.406 1.00 0.00 C ATOM 1521 CD2 LEU A 101 -11.747 -10.210 1.896 1.00 0.00 C ATOM 0 H LEU A 101 -12.682 -11.150 -2.682 1.00 0.00 H new ATOM 0 HA LEU A 101 -9.963 -10.754 -2.109 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -12.210 -10.036 -0.879 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -12.348 -11.706 -0.365 1.00 0.00 H new ATOM 0 HG LEU A 101 -10.328 -11.493 0.968 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -9.385 -9.132 1.308 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -9.244 -9.648 -0.390 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -10.542 -8.532 0.096 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -11.115 -9.992 2.757 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -12.342 -9.330 1.651 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -12.410 -11.042 2.133 1.00 0.00 H new ATOM 1533 N ARG A 102 -11.061 -13.770 -1.638 1.00 0.00 N ATOM 1534 CA ARG A 102 -10.683 -15.149 -1.656 1.00 0.00 C ATOM 1535 C ARG A 102 -9.600 -15.449 -2.635 1.00 0.00 C ATOM 1536 O ARG A 102 -8.596 -16.071 -2.293 1.00 0.00 O ATOM 1537 CB ARG A 102 -11.898 -16.044 -1.952 1.00 0.00 C ATOM 1538 CG ARG A 102 -12.806 -16.320 -0.752 1.00 0.00 C ATOM 1539 CD ARG A 102 -13.608 -17.621 -0.812 1.00 0.00 C ATOM 1540 NE ARG A 102 -14.283 -17.649 -2.140 1.00 0.00 N ATOM 1541 CZ ARG A 102 -15.572 -17.209 -2.240 1.00 0.00 C ATOM 1542 NH1 ARG A 102 -16.386 -16.832 -1.212 1.00 0.00 N ATOM 1543 NH2 ARG A 102 -16.172 -17.225 -3.466 1.00 0.00 N ATOM 0 H ARG A 102 -12.065 -13.658 -1.779 1.00 0.00 H new ATOM 0 HA ARG A 102 -10.293 -15.364 -0.661 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -12.492 -15.577 -2.738 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -11.542 -16.996 -2.345 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -12.192 -16.334 0.149 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -13.504 -15.489 -0.649 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -12.954 -18.484 -0.693 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -14.340 -17.662 -0.005 1.00 0.00 H new ATOM 0 HE ARG A 102 -13.789 -17.992 -2.964 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -16.043 -16.864 -0.252 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -17.337 -16.518 -1.404 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -15.658 -17.560 -4.281 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -17.134 -16.902 -3.567 1.00 0.00 H new ATOM 1557 N HIS A 103 -9.753 -15.000 -3.894 1.00 0.00 N ATOM 1558 CA HIS A 103 -8.824 -15.259 -4.949 1.00 0.00 C ATOM 1559 C HIS A 103 -7.485 -14.685 -4.634 1.00 0.00 C ATOM 1560 O HIS A 103 -6.503 -15.422 -4.708 1.00 0.00 O ATOM 1561 CB HIS A 103 -9.342 -14.608 -6.243 1.00 0.00 C ATOM 1562 CG HIS A 103 -8.567 -14.848 -7.504 1.00 0.00 C ATOM 1563 ND1 HIS A 103 -8.206 -16.099 -7.963 1.00 0.00 N ATOM 1564 CD2 HIS A 103 -8.163 -13.960 -8.452 1.00 0.00 C ATOM 1565 CE1 HIS A 103 -7.589 -15.919 -9.161 1.00 0.00 C ATOM 1566 NE2 HIS A 103 -7.566 -14.641 -9.493 1.00 0.00 N ATOM 0 H HIS A 103 -10.552 -14.437 -4.187 1.00 0.00 H new ATOM 0 HA HIS A 103 -8.728 -16.338 -5.067 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -10.363 -14.953 -6.406 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -9.392 -13.531 -6.080 1.00 0.00 H new ATOM 0 HD1 HIS A 103 -8.371 -16.989 -7.493 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -8.290 -12.889 -8.398 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -7.173 -16.715 -9.761 1.00 0.00 H new ATOM 1574 N VAL A 104 -7.450 -13.397 -4.249 1.00 0.00 N ATOM 1575 CA VAL A 104 -6.246 -12.681 -3.961 1.00 0.00 C ATOM 1576 C VAL A 104 -5.516 -13.269 -2.803 1.00 0.00 C ATOM 1577 O VAL A 104 -4.321 -13.551 -2.882 1.00 0.00 O ATOM 1578 CB VAL A 104 -6.390 -11.190 -4.026 1.00 0.00 C ATOM 1579 CG1 VAL A 104 -7.259 -10.839 -2.807 1.00 0.00 C ATOM 1580 CG2 VAL A 104 -4.973 -10.591 -4.063 1.00 0.00 C ATOM 0 H VAL A 104 -8.292 -12.833 -4.134 1.00 0.00 H new ATOM 0 HA VAL A 104 -5.551 -12.835 -4.787 1.00 0.00 H new ATOM 0 HB VAL A 104 -6.881 -10.780 -4.909 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -7.418 -9.761 -2.772 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -8.221 -11.346 -2.888 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -6.755 -11.161 -1.896 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -5.039 -9.504 -4.111 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -4.431 -10.883 -3.163 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -4.444 -10.961 -4.941 1.00 0.00 H new ATOM 1590 N MET A 105 -6.239 -13.532 -1.700 1.00 0.00 N ATOM 1591 CA MET A 105 -5.664 -14.261 -0.612 1.00 0.00 C ATOM 1592 C MET A 105 -5.084 -15.585 -0.973 1.00 0.00 C ATOM 1593 O MET A 105 -4.044 -15.935 -0.418 1.00 0.00 O ATOM 1594 CB MET A 105 -6.742 -14.368 0.479 1.00 0.00 C ATOM 1595 CG MET A 105 -7.076 -13.043 1.168 1.00 0.00 C ATOM 1596 SD MET A 105 -5.648 -12.366 2.065 1.00 0.00 S ATOM 1597 CE MET A 105 -6.534 -10.931 2.739 1.00 0.00 C ATOM 0 H MET A 105 -7.208 -13.245 -1.561 1.00 0.00 H new ATOM 0 HA MET A 105 -4.792 -13.713 -0.254 1.00 0.00 H new ATOM 0 HB2 MET A 105 -7.652 -14.773 0.036 1.00 0.00 H new ATOM 0 HB3 MET A 105 -6.410 -15.082 1.233 1.00 0.00 H new ATOM 0 HG2 MET A 105 -7.412 -12.321 0.423 1.00 0.00 H new ATOM 0 HG3 MET A 105 -7.903 -13.193 1.862 1.00 0.00 H new ATOM 0 HE1 MET A 105 -5.863 -10.355 3.376 1.00 0.00 H new ATOM 0 HE2 MET A 105 -6.885 -10.303 1.920 1.00 0.00 H new ATOM 0 HE3 MET A 105 -7.387 -11.273 3.326 1.00 0.00 H new ATOM 1607 N THR A 106 -5.752 -16.446 -1.761 1.00 0.00 N ATOM 1608 CA THR A 106 -5.317 -17.762 -2.114 1.00 0.00 C ATOM 1609 C THR A 106 -4.081 -17.730 -2.944 1.00 0.00 C ATOM 1610 O THR A 106 -3.129 -18.465 -2.683 1.00 0.00 O ATOM 1611 CB THR A 106 -6.339 -18.589 -2.836 1.00 0.00 C ATOM 1612 OG1 THR A 106 -7.426 -18.734 -1.933 1.00 0.00 O ATOM 1613 CG2 THR A 106 -5.807 -19.964 -3.276 1.00 0.00 C ATOM 0 H THR A 106 -6.652 -16.208 -2.177 1.00 0.00 H new ATOM 0 HA THR A 106 -5.128 -18.236 -1.151 1.00 0.00 H new ATOM 0 HB THR A 106 -6.631 -18.094 -3.762 1.00 0.00 H new ATOM 0 HG1 THR A 106 -7.951 -17.907 -1.918 1.00 0.00 H new ATOM 0 HG21 THR A 106 -6.596 -20.511 -3.792 1.00 0.00 H new ATOM 0 HG22 THR A 106 -4.960 -19.828 -3.948 1.00 0.00 H new ATOM 0 HG23 THR A 106 -5.488 -20.528 -2.400 1.00 0.00 H new ATOM 1621 N ASN A 107 -4.059 -16.793 -3.909 1.00 0.00 N ATOM 1622 CA ASN A 107 -2.961 -16.510 -4.781 1.00 0.00 C ATOM 1623 C ASN A 107 -1.824 -16.023 -3.949 1.00 0.00 C ATOM 1624 O ASN A 107 -0.666 -16.421 -4.064 1.00 0.00 O ATOM 1625 CB ASN A 107 -3.215 -15.442 -5.857 1.00 0.00 C ATOM 1626 CG ASN A 107 -4.220 -15.900 -6.904 1.00 0.00 C ATOM 1627 OD1 ASN A 107 -4.569 -17.077 -6.970 1.00 0.00 O ATOM 1628 ND2 ASN A 107 -4.682 -14.976 -7.789 1.00 0.00 N ATOM 0 H ASN A 107 -4.863 -16.193 -4.092 1.00 0.00 H new ATOM 0 HA ASN A 107 -2.768 -17.443 -5.311 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -3.579 -14.531 -5.382 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -2.274 -15.192 -6.346 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -5.331 -15.255 -8.525 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -4.380 -14.005 -7.716 1.00 0.00 H new ATOM 1635 N LEU A 108 -2.034 -15.122 -2.973 1.00 0.00 N ATOM 1636 CA LEU A 108 -1.076 -14.505 -2.110 1.00 0.00 C ATOM 1637 C LEU A 108 -0.367 -15.497 -1.254 1.00 0.00 C ATOM 1638 O LEU A 108 0.850 -15.577 -1.095 1.00 0.00 O ATOM 1639 CB LEU A 108 -1.708 -13.426 -1.215 1.00 0.00 C ATOM 1640 CG LEU A 108 -0.859 -12.619 -0.219 1.00 0.00 C ATOM 1641 CD1 LEU A 108 -0.112 -11.503 -0.968 1.00 0.00 C ATOM 1642 CD2 LEU A 108 -1.677 -12.037 0.947 1.00 0.00 C ATOM 0 H LEU A 108 -2.978 -14.793 -2.769 1.00 0.00 H new ATOM 0 HA LEU A 108 -0.351 -14.031 -2.772 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -2.191 -12.707 -1.876 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -2.497 -13.911 -0.640 1.00 0.00 H new ATOM 0 HG LEU A 108 -0.146 -13.310 0.231 1.00 0.00 H new ATOM 0 HD11 LEU A 108 0.490 -10.931 -0.262 1.00 0.00 H new ATOM 0 HD12 LEU A 108 0.537 -11.944 -1.724 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -0.833 -10.842 -1.449 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -1.017 -11.480 1.612 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -2.445 -11.370 0.555 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -2.149 -12.848 1.501 1.00 0.00 H new ATOM 1654 N GLY A 109 -1.184 -16.286 -0.533 1.00 0.00 N ATOM 1655 CA GLY A 109 -0.728 -17.363 0.290 1.00 0.00 C ATOM 1656 C GLY A 109 -1.230 -17.474 1.688 1.00 0.00 C ATOM 1657 O GLY A 109 -0.678 -18.186 2.526 1.00 0.00 O ATOM 0 H GLY A 109 -2.197 -16.170 -0.523 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -0.974 -18.293 -0.222 1.00 0.00 H new ATOM 0 HA3 GLY A 109 0.359 -17.303 0.336 1.00 0.00 H new ATOM 1661 N GLU A 110 -2.291 -16.734 2.055 1.00 0.00 N ATOM 1662 CA GLU A 110 -2.983 -16.804 3.304 1.00 0.00 C ATOM 1663 C GLU A 110 -4.015 -17.878 3.257 1.00 0.00 C ATOM 1664 O GLU A 110 -4.566 -18.255 2.225 1.00 0.00 O ATOM 1665 CB GLU A 110 -3.635 -15.475 3.721 1.00 0.00 C ATOM 1666 CG GLU A 110 -2.752 -14.426 4.400 1.00 0.00 C ATOM 1667 CD GLU A 110 -2.263 -14.730 5.809 1.00 0.00 C ATOM 1668 OE1 GLU A 110 -1.377 -15.578 6.096 1.00 0.00 O ATOM 1669 OE2 GLU A 110 -2.873 -14.105 6.718 1.00 0.00 O ATOM 0 H GLU A 110 -2.694 -16.035 1.431 1.00 0.00 H new ATOM 0 HA GLU A 110 -2.230 -17.033 4.059 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -4.068 -15.021 2.830 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -4.460 -15.704 4.395 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -1.879 -14.260 3.769 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -3.306 -13.488 4.430 1.00 0.00 H new ATOM 1676 N LYS A 111 -4.367 -18.397 4.447 1.00 0.00 N ATOM 1677 CA LYS A 111 -5.467 -19.304 4.562 1.00 0.00 C ATOM 1678 C LYS A 111 -6.426 -18.604 5.462 1.00 0.00 C ATOM 1679 O LYS A 111 -6.010 -18.052 6.479 1.00 0.00 O ATOM 1680 CB LYS A 111 -5.003 -20.659 5.123 1.00 0.00 C ATOM 1681 CG LYS A 111 -6.029 -21.793 5.176 1.00 0.00 C ATOM 1682 CD LYS A 111 -6.860 -22.129 3.936 1.00 0.00 C ATOM 1683 CE LYS A 111 -5.985 -22.580 2.766 1.00 0.00 C ATOM 1684 NZ LYS A 111 -6.732 -22.177 1.554 1.00 0.00 N ATOM 0 H LYS A 111 -3.893 -18.190 5.326 1.00 0.00 H new ATOM 0 HA LYS A 111 -5.928 -19.545 3.604 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -4.158 -20.999 4.525 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -4.632 -20.494 6.135 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -5.497 -22.699 5.465 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -6.726 -21.562 5.981 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -7.573 -22.916 4.180 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -7.439 -21.254 3.640 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -5.004 -22.106 2.801 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -5.820 -23.657 2.788 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -6.195 -22.453 0.707 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -7.659 -22.648 1.545 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -6.868 -21.146 1.557 1.00 0.00 H new ATOM 1698 N LEU A 112 -7.704 -18.559 5.043 1.00 0.00 N ATOM 1699 CA LEU A 112 -8.731 -17.903 5.791 1.00 0.00 C ATOM 1700 C LEU A 112 -10.029 -18.550 5.451 1.00 0.00 C ATOM 1701 O LEU A 112 -10.173 -19.115 4.368 1.00 0.00 O ATOM 1702 CB LEU A 112 -8.755 -16.369 5.677 1.00 0.00 C ATOM 1703 CG LEU A 112 -9.369 -15.801 4.386 1.00 0.00 C ATOM 1704 CD1 LEU A 112 -9.258 -14.272 4.508 1.00 0.00 C ATOM 1705 CD2 LEU A 112 -8.674 -16.216 3.078 1.00 0.00 C ATOM 0 H LEU A 112 -8.028 -18.983 4.174 1.00 0.00 H new ATOM 0 HA LEU A 112 -8.514 -18.037 6.851 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -9.309 -15.969 6.526 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -7.732 -16.002 5.762 1.00 0.00 H new ATOM 0 HG LEU A 112 -10.384 -16.191 4.311 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -9.679 -13.804 3.618 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -9.807 -13.936 5.388 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -8.210 -13.990 4.605 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -9.188 -15.760 2.232 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -7.637 -15.882 3.095 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -8.704 -17.301 2.978 1.00 0.00 H new ATOM 1717 N THR A 113 -10.964 -18.585 6.416 1.00 0.00 N ATOM 1718 CA THR A 113 -12.287 -19.114 6.294 1.00 0.00 C ATOM 1719 C THR A 113 -13.360 -18.202 5.808 1.00 0.00 C ATOM 1720 O THR A 113 -13.119 -16.999 5.714 1.00 0.00 O ATOM 1721 CB THR A 113 -12.763 -19.953 7.443 1.00 0.00 C ATOM 1722 OG1 THR A 113 -12.374 -19.300 8.642 1.00 0.00 O ATOM 1723 CG2 THR A 113 -12.217 -21.391 7.406 1.00 0.00 C ATOM 0 H THR A 113 -10.781 -18.216 7.349 1.00 0.00 H new ATOM 0 HA THR A 113 -12.108 -19.788 5.457 1.00 0.00 H new ATOM 0 HB THR A 113 -13.847 -20.050 7.380 1.00 0.00 H new ATOM 0 HG1 THR A 113 -12.674 -19.826 9.413 1.00 0.00 H new ATOM 0 HG21 THR A 113 -12.597 -21.947 8.263 1.00 0.00 H new ATOM 0 HG22 THR A 113 -12.538 -21.879 6.486 1.00 0.00 H new ATOM 0 HG23 THR A 113 -11.128 -21.368 7.443 1.00 0.00 H new ATOM 1731 N ASP A 114 -14.550 -18.670 5.391 1.00 0.00 N ATOM 1732 CA ASP A 114 -15.616 -17.870 4.872 1.00 0.00 C ATOM 1733 C ASP A 114 -16.096 -16.864 5.859 1.00 0.00 C ATOM 1734 O ASP A 114 -16.598 -15.784 5.552 1.00 0.00 O ATOM 1735 CB ASP A 114 -16.727 -18.716 4.227 1.00 0.00 C ATOM 1736 CG ASP A 114 -16.197 -19.493 3.031 1.00 0.00 C ATOM 1737 OD1 ASP A 114 -15.624 -20.604 3.194 1.00 0.00 O ATOM 1738 OD2 ASP A 114 -16.315 -18.923 1.913 1.00 0.00 O ATOM 0 H ASP A 114 -14.781 -19.663 5.418 1.00 0.00 H new ATOM 0 HA ASP A 114 -15.210 -17.282 4.049 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -17.135 -19.409 4.963 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -17.545 -18.068 3.911 1.00 0.00 H new ATOM 1743 N GLU A 115 -16.146 -17.300 7.131 1.00 0.00 N ATOM 1744 CA GLU A 115 -16.570 -16.507 8.242 1.00 0.00 C ATOM 1745 C GLU A 115 -15.798 -15.247 8.438 1.00 0.00 C ATOM 1746 O GLU A 115 -16.385 -14.304 8.967 1.00 0.00 O ATOM 1747 CB GLU A 115 -16.532 -17.191 9.619 1.00 0.00 C ATOM 1748 CG GLU A 115 -15.243 -17.783 10.191 1.00 0.00 C ATOM 1749 CD GLU A 115 -15.364 -18.408 11.574 1.00 0.00 C ATOM 1750 OE1 GLU A 115 -15.960 -19.514 11.665 1.00 0.00 O ATOM 1751 OE2 GLU A 115 -14.754 -17.858 12.530 1.00 0.00 O ATOM 0 H GLU A 115 -15.879 -18.248 7.396 1.00 0.00 H new ATOM 0 HA GLU A 115 -17.599 -16.318 7.936 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -16.892 -16.461 10.344 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -17.264 -17.998 9.590 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -14.875 -18.541 9.500 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -14.490 -16.996 10.232 1.00 0.00 H new ATOM 1758 N GLU A 116 -14.528 -15.180 8.000 1.00 0.00 N ATOM 1759 CA GLU A 116 -13.652 -14.056 8.115 1.00 0.00 C ATOM 1760 C GLU A 116 -13.625 -13.195 6.900 1.00 0.00 C ATOM 1761 O GLU A 116 -13.544 -11.971 6.994 1.00 0.00 O ATOM 1762 CB GLU A 116 -12.216 -14.442 8.511 1.00 0.00 C ATOM 1763 CG GLU A 116 -11.330 -13.366 9.141 1.00 0.00 C ATOM 1764 CD GLU A 116 -9.965 -13.926 9.514 1.00 0.00 C ATOM 1765 OE1 GLU A 116 -9.310 -14.622 8.694 1.00 0.00 O ATOM 1766 OE2 GLU A 116 -9.363 -13.559 10.558 1.00 0.00 O ATOM 0 H GLU A 116 -14.083 -15.969 7.532 1.00 0.00 H new ATOM 0 HA GLU A 116 -14.083 -13.472 8.928 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -12.275 -15.277 9.210 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -11.711 -14.809 7.618 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -11.208 -12.537 8.443 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -11.817 -12.965 10.030 1.00 0.00 H new ATOM 1773 N VAL A 117 -13.796 -13.823 5.722 1.00 0.00 N ATOM 1774 CA VAL A 117 -14.014 -13.091 4.513 1.00 0.00 C ATOM 1775 C VAL A 117 -15.259 -12.275 4.570 1.00 0.00 C ATOM 1776 O VAL A 117 -15.174 -11.089 4.256 1.00 0.00 O ATOM 1777 CB VAL A 117 -13.925 -14.081 3.390 1.00 0.00 C ATOM 1778 CG1 VAL A 117 -14.390 -13.418 2.082 1.00 0.00 C ATOM 1779 CG2 VAL A 117 -12.476 -14.579 3.256 1.00 0.00 C ATOM 0 H VAL A 117 -13.783 -14.836 5.607 1.00 0.00 H new ATOM 0 HA VAL A 117 -13.252 -12.329 4.348 1.00 0.00 H new ATOM 0 HB VAL A 117 -14.570 -14.934 3.600 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -14.325 -14.138 1.266 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -15.422 -13.084 2.190 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -13.753 -12.562 1.862 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -12.413 -15.298 2.440 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -11.819 -13.735 3.048 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -12.168 -15.057 4.186 1.00 0.00 H new ATOM 1789 N ASP A 118 -16.419 -12.820 4.980 1.00 0.00 N ATOM 1790 CA ASP A 118 -17.632 -12.091 5.185 1.00 0.00 C ATOM 1791 C ASP A 118 -17.424 -10.925 6.090 1.00 0.00 C ATOM 1792 O ASP A 118 -17.927 -9.841 5.802 1.00 0.00 O ATOM 1793 CB ASP A 118 -18.529 -13.158 5.834 1.00 0.00 C ATOM 1794 CG ASP A 118 -19.920 -12.668 6.210 1.00 0.00 C ATOM 1795 OD1 ASP A 118 -20.594 -12.167 5.271 1.00 0.00 O ATOM 1796 OD2 ASP A 118 -20.253 -12.626 7.425 1.00 0.00 O ATOM 0 H ASP A 118 -16.515 -13.816 5.178 1.00 0.00 H new ATOM 0 HA ASP A 118 -18.047 -11.658 4.275 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -18.627 -13.999 5.148 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -18.035 -13.534 6.730 1.00 0.00 H new ATOM 1801 N GLU A 119 -16.565 -10.939 7.125 1.00 0.00 N ATOM 1802 CA GLU A 119 -16.292 -9.956 8.127 1.00 0.00 C ATOM 1803 C GLU A 119 -15.398 -8.855 7.669 1.00 0.00 C ATOM 1804 O GLU A 119 -15.698 -7.672 7.822 1.00 0.00 O ATOM 1805 CB GLU A 119 -15.770 -10.619 9.413 1.00 0.00 C ATOM 1806 CG GLU A 119 -15.257 -9.601 10.433 1.00 0.00 C ATOM 1807 CD GLU A 119 -16.189 -8.698 11.228 1.00 0.00 C ATOM 1808 OE1 GLU A 119 -17.424 -8.740 10.982 1.00 0.00 O ATOM 1809 OE2 GLU A 119 -15.714 -7.855 12.036 1.00 0.00 O ATOM 0 H GLU A 119 -15.981 -11.761 7.275 1.00 0.00 H new ATOM 0 HA GLU A 119 -17.244 -9.473 8.346 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -16.569 -11.208 9.863 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -14.967 -11.311 9.160 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -14.668 -10.159 11.161 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -14.568 -8.946 9.900 1.00 0.00 H new ATOM 1816 N MET A 120 -14.297 -9.223 6.990 1.00 0.00 N ATOM 1817 CA MET A 120 -13.480 -8.387 6.166 1.00 0.00 C ATOM 1818 C MET A 120 -14.187 -7.576 5.135 1.00 0.00 C ATOM 1819 O MET A 120 -14.089 -6.358 4.992 1.00 0.00 O ATOM 1820 CB MET A 120 -12.332 -9.130 5.462 1.00 0.00 C ATOM 1821 CG MET A 120 -11.301 -9.744 6.411 1.00 0.00 C ATOM 1822 SD MET A 120 -10.046 -10.703 5.512 1.00 0.00 S ATOM 1823 CE MET A 120 -8.833 -9.360 5.357 1.00 0.00 C ATOM 0 H MET A 120 -13.952 -10.182 7.021 1.00 0.00 H new ATOM 0 HA MET A 120 -13.088 -7.701 6.917 1.00 0.00 H new ATOM 0 HB2 MET A 120 -12.754 -9.921 4.842 1.00 0.00 H new ATOM 0 HB3 MET A 120 -11.824 -8.437 4.792 1.00 0.00 H new ATOM 0 HG2 MET A 120 -10.815 -8.952 6.981 1.00 0.00 H new ATOM 0 HG3 MET A 120 -11.807 -10.390 7.129 1.00 0.00 H new ATOM 0 HE1 MET A 120 -7.880 -9.768 5.021 1.00 0.00 H new ATOM 0 HE2 MET A 120 -9.191 -8.629 4.632 1.00 0.00 H new ATOM 0 HE3 MET A 120 -8.700 -8.877 6.325 1.00 0.00 H new ATOM 1833 N ILE A 121 -15.044 -8.253 4.349 1.00 0.00 N ATOM 1834 CA ILE A 121 -15.846 -7.598 3.363 1.00 0.00 C ATOM 1835 C ILE A 121 -16.816 -6.604 3.902 1.00 0.00 C ATOM 1836 O ILE A 121 -16.811 -5.507 3.344 1.00 0.00 O ATOM 1837 CB ILE A 121 -16.567 -8.610 2.524 1.00 0.00 C ATOM 1838 CG1 ILE A 121 -15.516 -9.121 1.524 1.00 0.00 C ATOM 1839 CG2 ILE A 121 -17.850 -8.270 1.747 1.00 0.00 C ATOM 1840 CD1 ILE A 121 -14.826 -8.260 0.467 1.00 0.00 C ATOM 0 H ILE A 121 -15.182 -9.262 4.398 1.00 0.00 H new ATOM 0 HA ILE A 121 -15.143 -7.025 2.758 1.00 0.00 H new ATOM 0 HB ILE A 121 -16.974 -9.305 3.258 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -14.717 -9.557 2.124 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -15.990 -9.939 0.982 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -18.196 -9.154 1.211 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -18.622 -7.943 2.444 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -17.643 -7.472 1.034 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -14.129 -8.874 -0.104 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -15.574 -7.840 -0.205 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -14.282 -7.451 0.955 1.00 0.00 H new ATOM 1852 N ARG A 122 -17.510 -6.879 5.021 1.00 0.00 N ATOM 1853 CA ARG A 122 -18.298 -5.898 5.700 1.00 0.00 C ATOM 1854 C ARG A 122 -17.621 -4.700 6.271 1.00 0.00 C ATOM 1855 O ARG A 122 -18.065 -3.572 6.057 1.00 0.00 O ATOM 1856 CB ARG A 122 -18.856 -6.697 6.890 1.00 0.00 C ATOM 1857 CG ARG A 122 -19.982 -6.047 7.696 1.00 0.00 C ATOM 1858 CD ARG A 122 -20.274 -6.678 9.059 1.00 0.00 C ATOM 1859 NE ARG A 122 -19.038 -6.714 9.889 1.00 0.00 N ATOM 1860 CZ ARG A 122 -18.463 -5.680 10.571 1.00 0.00 C ATOM 1861 NH1 ARG A 122 -18.945 -4.403 10.539 1.00 0.00 N ATOM 1862 NH2 ARG A 122 -17.366 -5.857 11.363 1.00 0.00 N ATOM 0 H ARG A 122 -17.524 -7.799 5.462 1.00 0.00 H new ATOM 0 HA ARG A 122 -18.985 -5.469 4.971 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -19.217 -7.655 6.515 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -18.032 -6.911 7.571 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -19.735 -4.996 7.848 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -20.894 -6.077 7.100 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -21.048 -6.108 9.573 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -20.659 -7.689 8.924 1.00 0.00 H new ATOM 0 HE ARG A 122 -18.566 -7.616 9.956 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -19.774 -4.184 9.986 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -18.476 -3.668 11.068 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -16.951 -6.784 11.459 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -16.961 -5.063 11.859 1.00 0.00 H new ATOM 1876 N GLU A 123 -16.536 -4.924 7.033 1.00 0.00 N ATOM 1877 CA GLU A 123 -15.777 -3.895 7.673 1.00 0.00 C ATOM 1878 C GLU A 123 -15.233 -2.821 6.794 1.00 0.00 C ATOM 1879 O GLU A 123 -15.118 -1.660 7.181 1.00 0.00 O ATOM 1880 CB GLU A 123 -14.676 -4.402 8.619 1.00 0.00 C ATOM 1881 CG GLU A 123 -14.015 -3.330 9.487 1.00 0.00 C ATOM 1882 CD GLU A 123 -13.003 -3.951 10.440 1.00 0.00 C ATOM 1883 OE1 GLU A 123 -11.977 -4.514 9.974 1.00 0.00 O ATOM 1884 OE2 GLU A 123 -13.206 -3.908 11.682 1.00 0.00 O ATOM 0 H GLU A 123 -16.173 -5.860 7.211 1.00 0.00 H new ATOM 0 HA GLU A 123 -16.558 -3.428 8.272 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -15.103 -5.163 9.272 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -13.905 -4.890 8.023 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -13.519 -2.596 8.851 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -14.776 -2.796 10.056 1.00 0.00 H new ATOM 1891 N ALA A 124 -14.760 -3.231 5.603 1.00 0.00 N ATOM 1892 CA ALA A 124 -14.229 -2.359 4.602 1.00 0.00 C ATOM 1893 C ALA A 124 -15.274 -1.583 3.877 1.00 0.00 C ATOM 1894 O ALA A 124 -15.115 -0.410 3.541 1.00 0.00 O ATOM 1895 CB ALA A 124 -13.599 -3.245 3.513 1.00 0.00 C ATOM 0 H ALA A 124 -14.747 -4.213 5.326 1.00 0.00 H new ATOM 0 HA ALA A 124 -13.548 -1.676 5.110 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -13.181 -2.615 2.728 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -12.807 -3.852 3.951 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -14.362 -3.897 3.087 1.00 0.00 H new ATOM 1901 N ASP A 125 -16.442 -2.111 3.471 1.00 0.00 N ATOM 1902 CA ASP A 125 -17.571 -1.438 2.909 1.00 0.00 C ATOM 1903 C ASP A 125 -18.179 -0.444 3.839 1.00 0.00 C ATOM 1904 O ASP A 125 -18.220 -0.723 5.036 1.00 0.00 O ATOM 1905 CB ASP A 125 -18.498 -2.606 2.532 1.00 0.00 C ATOM 1906 CG ASP A 125 -19.749 -2.247 1.743 1.00 0.00 C ATOM 1907 OD1 ASP A 125 -19.961 -1.078 1.324 1.00 0.00 O ATOM 1908 OD2 ASP A 125 -20.564 -3.172 1.481 1.00 0.00 O ATOM 0 H ASP A 125 -16.610 -3.114 3.546 1.00 0.00 H new ATOM 0 HA ASP A 125 -17.326 -0.812 2.051 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -17.922 -3.326 1.951 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -18.805 -3.109 3.449 1.00 0.00 H new ATOM 1913 N ILE A 126 -18.635 0.708 3.317 1.00 0.00 N ATOM 1914 CA ILE A 126 -19.178 1.708 4.182 1.00 0.00 C ATOM 1915 C ILE A 126 -20.659 1.545 4.190 1.00 0.00 C ATOM 1916 O ILE A 126 -21.361 1.675 5.192 1.00 0.00 O ATOM 1917 CB ILE A 126 -18.876 3.098 3.706 1.00 0.00 C ATOM 1918 CG1 ILE A 126 -17.381 3.162 3.351 1.00 0.00 C ATOM 1919 CG2 ILE A 126 -19.391 4.092 4.761 1.00 0.00 C ATOM 1920 CD1 ILE A 126 -17.055 4.595 2.931 1.00 0.00 C ATOM 0 H ILE A 126 -18.629 0.944 2.325 1.00 0.00 H new ATOM 0 HA ILE A 126 -18.734 1.581 5.169 1.00 0.00 H new ATOM 0 HB ILE A 126 -19.393 3.382 2.789 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -16.773 2.868 4.207 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -17.151 2.467 2.544 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -19.181 5.111 4.434 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -20.466 3.965 4.886 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -18.891 3.906 5.711 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -15.998 4.667 2.674 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -17.659 4.867 2.065 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -17.275 5.274 3.754 1.00 0.00 H new ATOM 1932 N ASP A 127 -21.294 1.190 3.059 1.00 0.00 N ATOM 1933 CA ASP A 127 -22.710 1.029 2.944 1.00 0.00 C ATOM 1934 C ASP A 127 -23.120 -0.264 3.560 1.00 0.00 C ATOM 1935 O ASP A 127 -24.035 -0.343 4.378 1.00 0.00 O ATOM 1936 CB ASP A 127 -23.087 0.976 1.454 1.00 0.00 C ATOM 1937 CG ASP A 127 -22.208 1.918 0.644 1.00 0.00 C ATOM 1938 OD1 ASP A 127 -22.491 3.139 0.780 1.00 0.00 O ATOM 1939 OD2 ASP A 127 -21.333 1.514 -0.167 1.00 0.00 O ATOM 0 H ASP A 127 -20.799 1.007 2.186 1.00 0.00 H new ATOM 0 HA ASP A 127 -23.205 1.861 3.444 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -22.977 -0.043 1.082 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -24.135 1.250 1.329 1.00 0.00 H new ATOM 1944 N GLY A 128 -22.376 -1.351 3.288 1.00 0.00 N ATOM 1945 CA GLY A 128 -22.679 -2.695 3.672 1.00 0.00 C ATOM 1946 C GLY A 128 -23.459 -3.417 2.628 1.00 0.00 C ATOM 1947 O GLY A 128 -24.284 -4.294 2.880 1.00 0.00 O ATOM 0 H GLY A 128 -21.503 -1.285 2.764 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -21.751 -3.233 3.867 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -23.244 -2.686 4.604 1.00 0.00 H new ATOM 1951 N ASP A 129 -23.422 -2.995 1.351 1.00 0.00 N ATOM 1952 CA ASP A 129 -24.044 -3.586 0.207 1.00 0.00 C ATOM 1953 C ASP A 129 -23.443 -4.932 -0.008 1.00 0.00 C ATOM 1954 O ASP A 129 -24.127 -5.952 -0.072 1.00 0.00 O ATOM 1955 CB ASP A 129 -24.077 -2.663 -1.022 1.00 0.00 C ATOM 1956 CG ASP A 129 -22.699 -2.332 -1.577 1.00 0.00 C ATOM 1957 OD1 ASP A 129 -22.045 -3.175 -2.247 1.00 0.00 O ATOM 1958 OD2 ASP A 129 -22.138 -1.253 -1.248 1.00 0.00 O ATOM 0 H ASP A 129 -22.903 -2.154 1.097 1.00 0.00 H new ATOM 0 HA ASP A 129 -25.108 -3.729 0.394 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -24.670 -3.136 -1.805 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -24.584 -1.736 -0.755 1.00 0.00 H new ATOM 1963 N GLY A 130 -22.099 -4.988 -0.044 1.00 0.00 N ATOM 1964 CA GLY A 130 -21.459 -6.208 -0.426 1.00 0.00 C ATOM 1965 C GLY A 130 -20.158 -5.927 -1.095 1.00 0.00 C ATOM 1966 O GLY A 130 -19.252 -6.744 -0.937 1.00 0.00 O ATOM 0 H GLY A 130 -21.473 -4.216 0.183 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -21.295 -6.831 0.454 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -22.107 -6.770 -1.099 1.00 0.00 H new ATOM 1970 N GLN A 131 -20.006 -4.849 -1.885 1.00 0.00 N ATOM 1971 CA GLN A 131 -18.812 -4.544 -2.609 1.00 0.00 C ATOM 1972 C GLN A 131 -18.120 -3.326 -2.101 1.00 0.00 C ATOM 1973 O GLN A 131 -18.646 -2.264 -1.771 1.00 0.00 O ATOM 1974 CB GLN A 131 -18.981 -4.630 -4.136 1.00 0.00 C ATOM 1975 CG GLN A 131 -19.757 -5.831 -4.679 1.00 0.00 C ATOM 1976 CD GLN A 131 -19.694 -5.722 -6.195 1.00 0.00 C ATOM 1977 OE1 GLN A 131 -18.931 -6.354 -6.925 1.00 0.00 O ATOM 1978 NE2 GLN A 131 -20.650 -4.954 -6.782 1.00 0.00 N ATOM 0 H GLN A 131 -20.746 -4.162 -2.025 1.00 0.00 H new ATOM 0 HA GLN A 131 -18.107 -5.348 -2.397 1.00 0.00 H new ATOM 0 HB2 GLN A 131 -19.481 -3.722 -4.474 1.00 0.00 H new ATOM 0 HB3 GLN A 131 -17.989 -4.635 -4.588 1.00 0.00 H new ATOM 0 HG2 GLN A 131 -19.316 -6.767 -4.337 1.00 0.00 H new ATOM 0 HG3 GLN A 131 -20.789 -5.818 -4.330 1.00 0.00 H new ATOM 0 HE21 GLN A 131 -21.298 -4.418 -6.206 1.00 0.00 H new ATOM 0 HE22 GLN A 131 -20.719 -4.914 -7.799 1.00 0.00 H new ATOM 1987 N VAL A 132 -16.783 -3.472 -2.100 1.00 0.00 N ATOM 1988 CA VAL A 132 -15.806 -2.529 -1.652 1.00 0.00 C ATOM 1989 C VAL A 132 -15.176 -1.884 -2.838 1.00 0.00 C ATOM 1990 O VAL A 132 -14.607 -2.572 -3.684 1.00 0.00 O ATOM 1991 CB VAL A 132 -14.755 -3.282 -0.892 1.00 0.00 C ATOM 1992 CG1 VAL A 132 -14.072 -2.125 -0.144 1.00 0.00 C ATOM 1993 CG2 VAL A 132 -15.439 -4.251 0.087 1.00 0.00 C ATOM 0 H VAL A 132 -16.349 -4.328 -2.444 1.00 0.00 H new ATOM 0 HA VAL A 132 -16.266 -1.768 -1.022 1.00 0.00 H new ATOM 0 HB VAL A 132 -14.074 -3.888 -1.490 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -13.262 -2.517 0.471 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -13.669 -1.414 -0.865 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -14.800 -1.623 0.493 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -14.681 -4.802 0.643 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -16.061 -3.687 0.782 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -16.061 -4.952 -0.470 1.00 0.00 H new ATOM 2003 N ASN A 133 -15.252 -0.551 -3.004 1.00 0.00 N ATOM 2004 CA ASN A 133 -14.803 0.064 -4.215 1.00 0.00 C ATOM 2005 C ASN A 133 -13.530 0.793 -3.954 1.00 0.00 C ATOM 2006 O ASN A 133 -12.901 0.575 -2.920 1.00 0.00 O ATOM 2007 CB ASN A 133 -15.923 0.856 -4.910 1.00 0.00 C ATOM 2008 CG ASN A 133 -16.358 2.168 -4.272 1.00 0.00 C ATOM 2009 OD1 ASN A 133 -15.543 3.051 -4.009 1.00 0.00 O ATOM 2010 ND2 ASN A 133 -17.667 2.366 -3.964 1.00 0.00 N ATOM 0 H ASN A 133 -15.621 0.096 -2.307 1.00 0.00 H new ATOM 0 HA ASN A 133 -14.556 -0.690 -4.963 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -15.601 1.068 -5.930 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -16.798 0.210 -4.980 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -17.961 3.237 -3.521 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -18.356 1.644 -4.175 1.00 0.00 H new ATOM 2017 N TYR A 134 -13.168 1.724 -4.855 1.00 0.00 N ATOM 2018 CA TYR A 134 -11.974 2.507 -4.784 1.00 0.00 C ATOM 2019 C TYR A 134 -11.916 3.438 -3.623 1.00 0.00 C ATOM 2020 O TYR A 134 -10.959 3.364 -2.854 1.00 0.00 O ATOM 2021 CB TYR A 134 -11.761 3.180 -6.151 1.00 0.00 C ATOM 2022 CG TYR A 134 -10.429 3.839 -6.259 1.00 0.00 C ATOM 2023 CD1 TYR A 134 -9.344 3.094 -6.659 1.00 0.00 C ATOM 2024 CD2 TYR A 134 -10.211 5.167 -5.978 1.00 0.00 C ATOM 2025 CE1 TYR A 134 -8.096 3.641 -6.843 1.00 0.00 C ATOM 2026 CE2 TYR A 134 -8.968 5.750 -6.068 1.00 0.00 C ATOM 2027 CZ TYR A 134 -7.920 4.946 -6.448 1.00 0.00 C ATOM 2028 OH TYR A 134 -6.595 5.430 -6.420 1.00 0.00 O ATOM 0 H TYR A 134 -13.737 1.941 -5.673 1.00 0.00 H new ATOM 0 HA TYR A 134 -11.131 1.847 -4.581 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -11.859 2.434 -6.939 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -12.544 3.921 -6.314 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -9.478 2.037 -6.836 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -11.049 5.777 -5.674 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -7.289 3.070 -7.279 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -8.822 6.797 -5.849 1.00 0.00 H new ATOM 0 HH TYR A 134 -6.594 6.365 -6.126 1.00 0.00 H new ATOM 2038 N GLU A 135 -12.950 4.272 -3.412 1.00 0.00 N ATOM 2039 CA GLU A 135 -13.204 5.149 -2.311 1.00 0.00 C ATOM 2040 C GLU A 135 -13.054 4.506 -0.975 1.00 0.00 C ATOM 2041 O GLU A 135 -12.271 4.930 -0.125 1.00 0.00 O ATOM 2042 CB GLU A 135 -14.623 5.737 -2.395 1.00 0.00 C ATOM 2043 CG GLU A 135 -15.038 6.734 -1.312 1.00 0.00 C ATOM 2044 CD GLU A 135 -14.559 8.159 -1.549 1.00 0.00 C ATOM 2045 OE1 GLU A 135 -13.453 8.566 -1.104 1.00 0.00 O ATOM 2046 OE2 GLU A 135 -15.308 8.944 -2.191 1.00 0.00 O ATOM 0 H GLU A 135 -13.699 4.336 -4.102 1.00 0.00 H new ATOM 0 HA GLU A 135 -12.446 5.928 -2.396 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -14.727 6.228 -3.362 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -15.332 4.909 -2.380 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -16.125 6.737 -1.237 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -14.653 6.390 -0.352 1.00 0.00 H new ATOM 2053 N GLU A 136 -13.884 3.476 -0.732 1.00 0.00 N ATOM 2054 CA GLU A 136 -14.102 2.795 0.506 1.00 0.00 C ATOM 2055 C GLU A 136 -12.880 2.182 1.099 1.00 0.00 C ATOM 2056 O GLU A 136 -12.600 2.271 2.293 1.00 0.00 O ATOM 2057 CB GLU A 136 -15.154 1.684 0.347 1.00 0.00 C ATOM 2058 CG GLU A 136 -16.466 2.307 -0.135 1.00 0.00 C ATOM 2059 CD GLU A 136 -17.608 1.316 -0.314 1.00 0.00 C ATOM 2060 OE1 GLU A 136 -17.625 0.514 -1.285 1.00 0.00 O ATOM 2061 OE2 GLU A 136 -18.612 1.339 0.448 1.00 0.00 O ATOM 0 H GLU A 136 -14.458 3.083 -1.478 1.00 0.00 H new ATOM 0 HA GLU A 136 -14.445 3.576 1.185 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -14.807 0.936 -0.367 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -15.307 1.171 1.297 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -16.774 3.072 0.578 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -16.287 2.811 -1.085 1.00 0.00 H new ATOM 2068 N PHE A 137 -12.025 1.620 0.226 1.00 0.00 N ATOM 2069 CA PHE A 137 -10.659 1.270 0.462 1.00 0.00 C ATOM 2070 C PHE A 137 -9.812 2.380 0.984 1.00 0.00 C ATOM 2071 O PHE A 137 -9.050 2.205 1.934 1.00 0.00 O ATOM 2072 CB PHE A 137 -10.147 0.708 -0.875 1.00 0.00 C ATOM 2073 CG PHE A 137 -8.810 0.058 -0.978 1.00 0.00 C ATOM 2074 CD1 PHE A 137 -7.707 0.836 -1.240 1.00 0.00 C ATOM 2075 CD2 PHE A 137 -8.646 -1.307 -0.986 1.00 0.00 C ATOM 2076 CE1 PHE A 137 -6.476 0.263 -1.459 1.00 0.00 C ATOM 2077 CE2 PHE A 137 -7.453 -1.922 -1.288 1.00 0.00 C ATOM 2078 CZ PHE A 137 -6.381 -1.105 -1.561 1.00 0.00 C ATOM 0 H PHE A 137 -12.316 1.392 -0.725 1.00 0.00 H new ATOM 0 HA PHE A 137 -10.595 0.537 1.266 1.00 0.00 H new ATOM 0 HB2 PHE A 137 -10.882 -0.021 -1.216 1.00 0.00 H new ATOM 0 HB3 PHE A 137 -10.157 1.530 -1.591 1.00 0.00 H new ATOM 0 HD1 PHE A 137 -7.809 1.911 -1.274 1.00 0.00 H new ATOM 0 HD2 PHE A 137 -9.496 -1.927 -0.743 1.00 0.00 H new ATOM 0 HE1 PHE A 137 -5.594 0.880 -1.550 1.00 0.00 H new ATOM 0 HE2 PHE A 137 -7.362 -2.998 -1.310 1.00 0.00 H new ATOM 0 HZ PHE A 137 -5.443 -1.548 -1.862 1.00 0.00 H new ATOM 2088 N VAL A 138 -9.819 3.503 0.244 1.00 0.00 N ATOM 2089 CA VAL A 138 -8.910 4.559 0.563 1.00 0.00 C ATOM 2090 C VAL A 138 -9.292 5.185 1.860 1.00 0.00 C ATOM 2091 O VAL A 138 -8.450 5.513 2.694 1.00 0.00 O ATOM 2092 CB VAL A 138 -8.663 5.582 -0.506 1.00 0.00 C ATOM 2093 CG1 VAL A 138 -7.765 6.741 -0.041 1.00 0.00 C ATOM 2094 CG2 VAL A 138 -8.235 4.956 -1.844 1.00 0.00 C ATOM 0 H VAL A 138 -10.433 3.678 -0.551 1.00 0.00 H new ATOM 0 HA VAL A 138 -7.938 4.074 0.650 1.00 0.00 H new ATOM 0 HB VAL A 138 -9.628 6.046 -0.707 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -7.626 7.445 -0.861 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -8.235 7.251 0.800 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -6.796 6.349 0.269 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -8.071 5.744 -2.579 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -7.312 4.393 -1.704 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -9.018 4.286 -2.200 1.00 0.00 H new ATOM 2104 N GLN A 139 -10.596 5.292 2.174 1.00 0.00 N ATOM 2105 CA GLN A 139 -11.138 5.617 3.456 1.00 0.00 C ATOM 2106 C GLN A 139 -10.784 4.689 4.567 1.00 0.00 C ATOM 2107 O GLN A 139 -10.516 5.060 5.708 1.00 0.00 O ATOM 2108 CB GLN A 139 -12.675 5.670 3.438 1.00 0.00 C ATOM 2109 CG GLN A 139 -13.375 6.598 2.443 1.00 0.00 C ATOM 2110 CD GLN A 139 -13.322 8.045 2.914 1.00 0.00 C ATOM 2111 OE1 GLN A 139 -12.841 8.366 4.000 1.00 0.00 O ATOM 2112 NE2 GLN A 139 -13.696 9.032 2.057 1.00 0.00 N ATOM 0 H GLN A 139 -11.325 5.139 1.477 1.00 0.00 H new ATOM 0 HA GLN A 139 -10.683 6.588 3.650 1.00 0.00 H new ATOM 0 HB2 GLN A 139 -13.037 4.658 3.254 1.00 0.00 H new ATOM 0 HB3 GLN A 139 -13.006 5.950 4.438 1.00 0.00 H new ATOM 0 HG2 GLN A 139 -12.901 6.513 1.465 1.00 0.00 H new ATOM 0 HG3 GLN A 139 -14.413 6.289 2.321 1.00 0.00 H new ATOM 0 HE21 GLN A 139 -14.098 8.795 1.150 1.00 0.00 H new ATOM 0 HE22 GLN A 139 -13.575 10.010 2.321 1.00 0.00 H new ATOM 2121 N MET A 140 -10.689 3.389 4.233 1.00 0.00 N ATOM 2122 CA MET A 140 -10.298 2.349 5.134 1.00 0.00 C ATOM 2123 C MET A 140 -8.851 2.369 5.491 1.00 0.00 C ATOM 2124 O MET A 140 -8.392 2.276 6.628 1.00 0.00 O ATOM 2125 CB MET A 140 -10.608 0.962 4.546 1.00 0.00 C ATOM 2126 CG MET A 140 -10.279 -0.190 5.497 1.00 0.00 C ATOM 2127 SD MET A 140 -10.653 -1.825 4.797 1.00 0.00 S ATOM 2128 CE MET A 140 -9.394 -1.817 3.489 1.00 0.00 C ATOM 0 H MET A 140 -10.894 3.048 3.294 1.00 0.00 H new ATOM 0 HA MET A 140 -10.878 2.538 6.037 1.00 0.00 H new ATOM 0 HB2 MET A 140 -11.665 0.915 4.283 1.00 0.00 H new ATOM 0 HB3 MET A 140 -10.044 0.833 3.622 1.00 0.00 H new ATOM 0 HG2 MET A 140 -9.222 -0.147 5.758 1.00 0.00 H new ATOM 0 HG3 MET A 140 -10.841 -0.061 6.422 1.00 0.00 H new ATOM 0 HE1 MET A 140 -9.226 -2.836 3.140 1.00 0.00 H new ATOM 0 HE2 MET A 140 -9.737 -1.200 2.658 1.00 0.00 H new ATOM 0 HE3 MET A 140 -8.463 -1.410 3.883 1.00 0.00 H new ATOM 2138 N MET A 141 -8.003 2.500 4.455 1.00 0.00 N ATOM 2139 CA MET A 141 -6.578 2.413 4.532 1.00 0.00 C ATOM 2140 C MET A 141 -5.810 3.673 4.741 1.00 0.00 C ATOM 2141 O MET A 141 -4.610 3.553 4.983 1.00 0.00 O ATOM 2142 CB MET A 141 -6.054 1.824 3.212 1.00 0.00 C ATOM 2143 CG MET A 141 -6.509 0.374 3.036 1.00 0.00 C ATOM 2144 SD MET A 141 -5.467 -0.654 1.957 1.00 0.00 S ATOM 2145 CE MET A 141 -6.465 -2.169 1.875 1.00 0.00 C ATOM 0 H MET A 141 -8.333 2.677 3.506 1.00 0.00 H new ATOM 0 HA MET A 141 -6.416 1.808 5.424 1.00 0.00 H new ATOM 0 HB2 MET A 141 -6.411 2.424 2.375 1.00 0.00 H new ATOM 0 HB3 MET A 141 -4.965 1.871 3.196 1.00 0.00 H new ATOM 0 HG2 MET A 141 -6.556 -0.095 4.019 1.00 0.00 H new ATOM 0 HG3 MET A 141 -7.523 0.377 2.636 1.00 0.00 H new ATOM 0 HE1 MET A 141 -5.997 -2.877 1.191 1.00 0.00 H new ATOM 0 HE2 MET A 141 -6.533 -2.614 2.868 1.00 0.00 H new ATOM 0 HE3 MET A 141 -7.466 -1.927 1.517 1.00 0.00 H new ATOM 2155 N THR A 142 -6.365 4.897 4.710 1.00 0.00 N ATOM 2156 CA THR A 142 -5.570 6.048 5.007 1.00 0.00 C ATOM 2157 C THR A 142 -5.467 6.298 6.505 1.00 0.00 C ATOM 2158 O THR A 142 -4.314 6.380 7.008 1.00 0.00 O ATOM 2159 CB THR A 142 -6.139 7.299 4.406 1.00 0.00 C ATOM 2160 OG1 THR A 142 -6.047 7.200 2.992 1.00 0.00 O ATOM 2161 CG2 THR A 142 -5.320 8.545 4.782 1.00 0.00 C ATOM 0 H THR A 142 -7.341 5.089 4.485 1.00 0.00 H new ATOM 0 HA THR A 142 -4.590 5.830 4.583 1.00 0.00 H new ATOM 0 HB THR A 142 -7.161 7.397 4.772 1.00 0.00 H new ATOM 0 HG1 THR A 142 -6.785 6.651 2.654 1.00 0.00 H new ATOM 0 HG21 THR A 142 -5.769 9.427 4.325 1.00 0.00 H new ATOM 0 HG22 THR A 142 -5.312 8.662 5.866 1.00 0.00 H new ATOM 0 HG23 THR A 142 -4.297 8.430 4.422 1.00 0.00 H new ATOM 2170 N ARG B 1 -9.391 -4.466 10.217 1.00 0.00 N ATOM 2171 CA ARG B 1 -8.776 -3.734 9.087 1.00 0.00 C ATOM 2172 C ARG B 1 -7.351 -4.096 8.843 1.00 0.00 C ATOM 2173 O ARG B 1 -6.700 -3.801 7.841 1.00 0.00 O ATOM 2174 CB ARG B 1 -8.813 -2.225 9.379 1.00 0.00 C ATOM 2175 CG ARG B 1 -10.215 -1.669 9.635 1.00 0.00 C ATOM 2176 CD ARG B 1 -10.256 -0.145 9.766 1.00 0.00 C ATOM 2177 NE ARG B 1 -9.787 0.283 11.114 1.00 0.00 N ATOM 2178 CZ ARG B 1 -8.541 0.528 11.614 1.00 0.00 C ATOM 2179 NH1 ARG B 1 -7.408 0.290 10.890 1.00 0.00 N ATOM 2180 NH2 ARG B 1 -8.440 0.958 12.905 1.00 0.00 N ATOM 0 H1 ARG B 1 -10.414 -4.281 10.234 1.00 0.00 H new ATOM 0 H2 ARG B 1 -9.225 -5.486 10.101 1.00 0.00 H new ATOM 0 H3 ARG B 1 -8.966 -4.145 11.111 1.00 0.00 H new ATOM 0 HA ARG B 1 -9.354 -4.007 8.204 1.00 0.00 H new ATOM 0 HB2 ARG B 1 -8.189 -2.019 10.248 1.00 0.00 H new ATOM 0 HB3 ARG B 1 -8.372 -1.693 8.537 1.00 0.00 H new ATOM 0 HG2 ARG B 1 -10.872 -1.973 8.820 1.00 0.00 H new ATOM 0 HG3 ARG B 1 -10.612 -2.114 10.547 1.00 0.00 H new ATOM 0 HD2 ARG B 1 -9.629 0.308 8.997 1.00 0.00 H new ATOM 0 HD3 ARG B 1 -11.272 0.212 9.599 1.00 0.00 H new ATOM 0 HE ARG B 1 -10.539 0.418 11.790 1.00 0.00 H new ATOM 0 HH11 ARG B 1 -7.477 -0.083 9.943 1.00 0.00 H new ATOM 0 HH12 ARG B 1 -6.493 0.485 11.296 1.00 0.00 H new ATOM 0 HH21 ARG B 1 -9.281 1.088 13.467 1.00 0.00 H new ATOM 0 HH22 ARG B 1 -7.523 1.150 13.308 1.00 0.00 H new ATOM 2193 N ARG B 2 -6.723 -4.831 9.777 1.00 0.00 N ATOM 2194 CA ARG B 2 -5.332 -5.164 9.805 1.00 0.00 C ATOM 2195 C ARG B 2 -4.919 -6.118 8.737 1.00 0.00 C ATOM 2196 O ARG B 2 -3.992 -5.889 7.961 1.00 0.00 O ATOM 2197 CB ARG B 2 -4.913 -5.581 11.225 1.00 0.00 C ATOM 2198 CG ARG B 2 -3.402 -5.680 11.446 1.00 0.00 C ATOM 2199 CD ARG B 2 -2.985 -5.721 12.917 1.00 0.00 C ATOM 2200 NE ARG B 2 -3.395 -4.431 13.540 1.00 0.00 N ATOM 2201 CZ ARG B 2 -3.350 -4.156 14.877 1.00 0.00 C ATOM 2202 NH1 ARG B 2 -2.648 -4.918 15.765 1.00 0.00 N ATOM 2203 NH2 ARG B 2 -4.183 -3.184 15.352 1.00 0.00 N ATOM 0 H ARG B 2 -7.227 -5.222 10.573 1.00 0.00 H new ATOM 0 HA ARG B 2 -4.771 -4.263 9.557 1.00 0.00 H new ATOM 0 HB2 ARG B 2 -5.323 -4.863 11.935 1.00 0.00 H new ATOM 0 HB3 ARG B 2 -5.363 -6.547 11.452 1.00 0.00 H new ATOM 0 HG2 ARG B 2 -3.032 -6.577 10.950 1.00 0.00 H new ATOM 0 HG3 ARG B 2 -2.919 -4.828 10.967 1.00 0.00 H new ATOM 0 HD2 ARG B 2 -3.460 -6.560 13.426 1.00 0.00 H new ATOM 0 HD3 ARG B 2 -1.908 -5.863 13.005 1.00 0.00 H new ATOM 0 HE ARG B 2 -3.736 -3.696 12.920 1.00 0.00 H new ATOM 0 HH11 ARG B 2 -2.127 -5.732 15.439 1.00 0.00 H new ATOM 0 HH12 ARG B 2 -2.644 -4.673 16.755 1.00 0.00 H new ATOM 0 HH21 ARG B 2 -4.809 -2.693 14.714 1.00 0.00 H new ATOM 0 HH22 ARG B 2 -4.179 -2.949 16.345 1.00 0.00 H new ATOM 2217 N LYS B 3 -5.559 -7.274 8.490 1.00 0.00 N ATOM 2218 CA LYS B 3 -5.101 -8.143 7.450 1.00 0.00 C ATOM 2219 C LYS B 3 -5.381 -7.644 6.075 1.00 0.00 C ATOM 2220 O LYS B 3 -4.650 -8.027 5.162 1.00 0.00 O ATOM 2221 CB LYS B 3 -5.839 -9.486 7.580 1.00 0.00 C ATOM 2222 CG LYS B 3 -5.452 -10.639 6.653 1.00 0.00 C ATOM 2223 CD LYS B 3 -5.402 -11.984 7.381 1.00 0.00 C ATOM 2224 CE LYS B 3 -6.811 -12.418 7.789 1.00 0.00 C ATOM 2225 NZ LYS B 3 -6.831 -13.785 8.356 1.00 0.00 N ATOM 0 H LYS B 3 -6.379 -7.604 8.999 1.00 0.00 H new ATOM 0 HA LYS B 3 -4.021 -8.219 7.572 1.00 0.00 H new ATOM 0 HB2 LYS B 3 -5.713 -9.832 8.606 1.00 0.00 H new ATOM 0 HB3 LYS B 3 -6.902 -9.292 7.437 1.00 0.00 H new ATOM 0 HG2 LYS B 3 -6.169 -10.699 5.834 1.00 0.00 H new ATOM 0 HG3 LYS B 3 -4.478 -10.433 6.209 1.00 0.00 H new ATOM 0 HD2 LYS B 3 -4.954 -12.739 6.735 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -4.768 -11.904 8.264 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -7.208 -11.716 8.522 1.00 0.00 H new ATOM 0 HE3 LYS B 3 -7.468 -12.377 6.920 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -7.735 -14.244 8.124 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -6.048 -14.339 7.954 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -6.724 -13.734 9.389 1.00 0.00 H new ATOM 2239 N TRP B 4 -6.384 -6.756 5.961 1.00 0.00 N ATOM 2240 CA TRP B 4 -6.577 -6.022 4.749 1.00 0.00 C ATOM 2241 C TRP B 4 -5.394 -5.170 4.440 1.00 0.00 C ATOM 2242 O TRP B 4 -4.791 -5.209 3.369 1.00 0.00 O ATOM 2243 CB TRP B 4 -7.697 -4.969 4.764 1.00 0.00 C ATOM 2244 CG TRP B 4 -9.111 -5.420 4.490 1.00 0.00 C ATOM 2245 CD1 TRP B 4 -10.136 -5.509 5.388 1.00 0.00 C ATOM 2246 CD2 TRP B 4 -9.635 -5.662 3.170 1.00 0.00 C ATOM 2247 NE1 TRP B 4 -11.264 -5.857 4.692 1.00 0.00 N ATOM 2248 CE2 TRP B 4 -11.003 -5.905 3.343 1.00 0.00 C ATOM 2249 CE3 TRP B 4 -9.069 -5.530 1.932 1.00 0.00 C ATOM 2250 CZ2 TRP B 4 -11.806 -6.014 2.242 1.00 0.00 C ATOM 2251 CZ3 TRP B 4 -9.854 -5.725 0.820 1.00 0.00 C ATOM 2252 CH2 TRP B 4 -11.208 -5.868 1.012 1.00 0.00 C ATOM 0 H TRP B 4 -7.056 -6.547 6.700 1.00 0.00 H new ATOM 0 HA TRP B 4 -6.794 -6.826 4.046 1.00 0.00 H new ATOM 0 HB2 TRP B 4 -7.686 -4.487 5.741 1.00 0.00 H new ATOM 0 HB3 TRP B 4 -7.444 -4.205 4.029 1.00 0.00 H new ATOM 0 HD1 TRP B 4 -10.070 -5.337 6.452 1.00 0.00 H new ATOM 0 HE1 TRP B 4 -12.171 -6.053 5.116 1.00 0.00 H new ATOM 0 HE3 TRP B 4 -8.024 -5.277 1.830 1.00 0.00 H new ATOM 0 HZ2 TRP B 4 -12.865 -6.207 2.334 1.00 0.00 H new ATOM 0 HZ3 TRP B 4 -9.422 -5.764 -0.169 1.00 0.00 H new ATOM 0 HH2 TRP B 4 -11.844 -5.866 0.139 1.00 0.00 H new ATOM 2263 N GLN B 5 -4.976 -4.359 5.428 1.00 0.00 N ATOM 2264 CA GLN B 5 -3.793 -3.556 5.386 1.00 0.00 C ATOM 2265 C GLN B 5 -2.497 -4.241 5.122 1.00 0.00 C ATOM 2266 O GLN B 5 -1.641 -3.830 4.339 1.00 0.00 O ATOM 2267 CB GLN B 5 -3.769 -2.820 6.736 1.00 0.00 C ATOM 2268 CG GLN B 5 -3.053 -1.469 6.767 1.00 0.00 C ATOM 2269 CD GLN B 5 -3.857 -0.291 6.236 1.00 0.00 C ATOM 2270 OE1 GLN B 5 -5.064 -0.141 6.420 1.00 0.00 O ATOM 2271 NE2 GLN B 5 -3.122 0.710 5.681 1.00 0.00 N ATOM 0 H GLN B 5 -5.491 -4.258 6.303 1.00 0.00 H new ATOM 0 HA GLN B 5 -3.863 -2.907 4.513 1.00 0.00 H new ATOM 0 HB2 GLN B 5 -4.799 -2.667 7.059 1.00 0.00 H new ATOM 0 HB3 GLN B 5 -3.298 -3.472 7.471 1.00 0.00 H new ATOM 0 HG2 GLN B 5 -2.763 -1.255 7.795 1.00 0.00 H new ATOM 0 HG3 GLN B 5 -2.134 -1.551 6.187 1.00 0.00 H new ATOM 0 HE21 GLN B 5 -2.121 0.584 5.529 1.00 0.00 H new ATOM 0 HE22 GLN B 5 -3.572 1.587 5.417 1.00 0.00 H new ATOM 2280 N LYS B 6 -2.317 -5.429 5.726 1.00 0.00 N ATOM 2281 CA LYS B 6 -1.109 -6.159 5.495 1.00 0.00 C ATOM 2282 C LYS B 6 -0.889 -6.461 4.053 1.00 0.00 C ATOM 2283 O LYS B 6 0.234 -6.534 3.555 1.00 0.00 O ATOM 2284 CB LYS B 6 -1.259 -7.454 6.311 1.00 0.00 C ATOM 2285 CG LYS B 6 -0.245 -8.580 6.098 1.00 0.00 C ATOM 2286 CD LYS B 6 -0.411 -9.750 7.070 1.00 0.00 C ATOM 2287 CE LYS B 6 -1.551 -10.687 6.665 1.00 0.00 C ATOM 2288 NZ LYS B 6 -1.724 -11.787 7.640 1.00 0.00 N ATOM 0 H LYS B 6 -2.985 -5.874 6.356 1.00 0.00 H new ATOM 0 HA LYS B 6 -0.240 -5.574 5.797 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -1.235 -7.184 7.367 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -2.250 -7.859 6.108 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -0.337 -8.951 5.077 1.00 0.00 H new ATOM 0 HG3 LYS B 6 0.762 -8.174 6.200 1.00 0.00 H new ATOM 0 HD2 LYS B 6 0.520 -10.314 7.117 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -0.601 -9.363 8.071 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -2.479 -10.120 6.587 1.00 0.00 H new ATOM 0 HE3 LYS B 6 -1.348 -11.103 5.678 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -2.008 -12.653 7.139 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -0.827 -11.953 8.138 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -2.459 -11.528 8.328 1.00 0.00 H new ATOM 2302 N THR B 7 -2.016 -6.747 3.377 1.00 0.00 N ATOM 2303 CA THR B 7 -2.061 -7.124 1.999 1.00 0.00 C ATOM 2304 C THR B 7 -2.043 -5.894 1.160 1.00 0.00 C ATOM 2305 O THR B 7 -1.457 -5.869 0.078 1.00 0.00 O ATOM 2306 CB THR B 7 -3.335 -7.876 1.747 1.00 0.00 C ATOM 2307 OG1 THR B 7 -3.466 -8.886 2.737 1.00 0.00 O ATOM 2308 CG2 THR B 7 -3.258 -8.501 0.344 1.00 0.00 C ATOM 0 H THR B 7 -2.938 -6.714 3.812 1.00 0.00 H new ATOM 0 HA THR B 7 -1.204 -7.750 1.751 1.00 0.00 H new ATOM 0 HB THR B 7 -4.200 -7.215 1.798 1.00 0.00 H new ATOM 0 HG1 THR B 7 -3.866 -8.502 3.545 1.00 0.00 H new ATOM 0 HG21 THR B 7 -4.176 -9.053 0.141 1.00 0.00 H new ATOM 0 HG22 THR B 7 -3.136 -7.713 -0.399 1.00 0.00 H new ATOM 0 HG23 THR B 7 -2.407 -9.181 0.295 1.00 0.00 H new ATOM 2316 N GLY B 8 -2.651 -4.751 1.527 1.00 0.00 N ATOM 2317 CA GLY B 8 -2.469 -3.454 0.954 1.00 0.00 C ATOM 2318 C GLY B 8 -1.073 -2.936 1.016 1.00 0.00 C ATOM 2319 O GLY B 8 -0.520 -2.359 0.081 1.00 0.00 O ATOM 0 H GLY B 8 -3.327 -4.736 2.290 1.00 0.00 H new ATOM 0 HA2 GLY B 8 -2.785 -3.485 -0.089 1.00 0.00 H new ATOM 0 HA3 GLY B 8 -3.126 -2.750 1.465 1.00 0.00 H new ATOM 2323 N HIS B 9 -0.421 -3.114 2.179 1.00 0.00 N ATOM 2324 CA HIS B 9 0.960 -2.750 2.255 1.00 0.00 C ATOM 2325 C HIS B 9 1.856 -3.624 1.446 1.00 0.00 C ATOM 2326 O HIS B 9 2.707 -3.076 0.748 1.00 0.00 O ATOM 2327 CB HIS B 9 1.472 -2.749 3.705 1.00 0.00 C ATOM 2328 CG HIS B 9 0.796 -1.713 4.554 1.00 0.00 C ATOM 2329 ND1 HIS B 9 0.969 -1.670 5.922 1.00 0.00 N ATOM 2330 CD2 HIS B 9 0.188 -0.550 4.198 1.00 0.00 C ATOM 2331 CE1 HIS B 9 0.507 -0.456 6.325 1.00 0.00 C ATOM 2332 NE2 HIS B 9 0.065 0.261 5.308 1.00 0.00 N ATOM 0 H HIS B 9 -0.828 -3.494 3.034 1.00 0.00 H new ATOM 0 HA HIS B 9 0.998 -1.743 1.839 1.00 0.00 H new ATOM 0 HB2 HIS B 9 1.312 -3.734 4.144 1.00 0.00 H new ATOM 0 HB3 HIS B 9 2.547 -2.570 3.707 1.00 0.00 H new ATOM 0 HD1 HIS B 9 1.364 -2.402 6.513 1.00 0.00 H new ATOM 0 HD2 HIS B 9 -0.146 -0.300 3.202 1.00 0.00 H new ATOM 0 HE1 HIS B 9 0.502 -0.120 7.351 1.00 0.00 H new ATOM 2340 N ALA B 10 1.602 -4.944 1.402 1.00 0.00 N ATOM 2341 CA ALA B 10 2.174 -5.879 0.484 1.00 0.00 C ATOM 2342 C ALA B 10 2.090 -5.544 -0.966 1.00 0.00 C ATOM 2343 O ALA B 10 3.099 -5.297 -1.625 1.00 0.00 O ATOM 2344 CB ALA B 10 1.523 -7.272 0.538 1.00 0.00 C ATOM 0 H ALA B 10 0.953 -5.387 2.052 1.00 0.00 H new ATOM 0 HA ALA B 10 3.207 -5.848 0.831 1.00 0.00 H new ATOM 0 HB1 ALA B 10 2.008 -7.928 -0.185 1.00 0.00 H new ATOM 0 HB2 ALA B 10 1.637 -7.688 1.539 1.00 0.00 H new ATOM 0 HB3 ALA B 10 0.463 -7.188 0.298 1.00 0.00 H new ATOM 2350 N VAL B 11 0.896 -5.392 -1.566 1.00 0.00 N ATOM 2351 CA VAL B 11 0.742 -5.247 -2.981 1.00 0.00 C ATOM 2352 C VAL B 11 1.144 -3.924 -3.534 1.00 0.00 C ATOM 2353 O VAL B 11 1.601 -3.613 -4.633 1.00 0.00 O ATOM 2354 CB VAL B 11 -0.577 -5.714 -3.523 1.00 0.00 C ATOM 2355 CG1 VAL B 11 -1.700 -4.664 -3.492 1.00 0.00 C ATOM 2356 CG2 VAL B 11 -0.466 -6.077 -5.013 1.00 0.00 C ATOM 0 H VAL B 11 0.014 -5.369 -1.054 1.00 0.00 H new ATOM 0 HA VAL B 11 1.483 -5.950 -3.360 1.00 0.00 H new ATOM 0 HB VAL B 11 -0.822 -6.553 -2.872 1.00 0.00 H new ATOM 0 HG11 VAL B 11 -2.613 -5.095 -3.904 1.00 0.00 H new ATOM 0 HG12 VAL B 11 -1.878 -4.352 -2.463 1.00 0.00 H new ATOM 0 HG13 VAL B 11 -1.406 -3.800 -4.087 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -1.436 -6.412 -5.379 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -0.148 -5.201 -5.578 1.00 0.00 H new ATOM 0 HG23 VAL B 11 0.265 -6.876 -5.139 1.00 0.00 H new ATOM 2366 N ARG B 12 1.112 -2.854 -2.719 1.00 0.00 N ATOM 2367 CA ARG B 12 1.612 -1.530 -2.920 1.00 0.00 C ATOM 2368 C ARG B 12 3.101 -1.526 -2.866 1.00 0.00 C ATOM 2369 O ARG B 12 3.820 -0.744 -3.485 1.00 0.00 O ATOM 2370 CB ARG B 12 1.047 -0.552 -1.876 1.00 0.00 C ATOM 2371 CG ARG B 12 1.227 0.927 -2.227 1.00 0.00 C ATOM 2372 CD ARG B 12 0.712 1.933 -1.196 1.00 0.00 C ATOM 2373 NE ARG B 12 1.041 3.298 -1.696 1.00 0.00 N ATOM 2374 CZ ARG B 12 0.322 4.435 -1.466 1.00 0.00 C ATOM 2375 NH1 ARG B 12 -0.693 4.500 -0.556 1.00 0.00 N ATOM 2376 NH2 ARG B 12 0.607 5.631 -2.057 1.00 0.00 N ATOM 0 H ARG B 12 0.677 -2.934 -1.800 1.00 0.00 H new ATOM 0 HA ARG B 12 1.287 -1.198 -3.906 1.00 0.00 H new ATOM 0 HB2 ARG B 12 -0.016 -0.754 -1.745 1.00 0.00 H new ATOM 0 HB3 ARG B 12 1.528 -0.746 -0.917 1.00 0.00 H new ATOM 0 HG2 ARG B 12 2.289 1.114 -2.388 1.00 0.00 H new ATOM 0 HG3 ARG B 12 0.723 1.118 -3.174 1.00 0.00 H new ATOM 0 HD2 ARG B 12 -0.364 1.824 -1.059 1.00 0.00 H new ATOM 0 HD3 ARG B 12 1.176 1.758 -0.225 1.00 0.00 H new ATOM 0 HE ARG B 12 1.883 3.391 -2.264 1.00 0.00 H new ATOM 0 HH11 ARG B 12 -0.943 3.675 -0.012 1.00 0.00 H new ATOM 0 HH12 ARG B 12 -1.201 5.374 -0.420 1.00 0.00 H new ATOM 0 HH21 ARG B 12 1.390 5.705 -2.706 1.00 0.00 H new ATOM 0 HH22 ARG B 12 0.037 6.451 -1.850 1.00 0.00 H new ATOM 2390 N ALA B 13 3.693 -2.346 -1.980 1.00 0.00 N ATOM 2391 CA ALA B 13 5.103 -2.568 -1.882 1.00 0.00 C ATOM 2392 C ALA B 13 5.662 -3.329 -3.035 1.00 0.00 C ATOM 2393 O ALA B 13 6.719 -3.062 -3.604 1.00 0.00 O ATOM 2394 CB ALA B 13 5.580 -3.273 -0.601 1.00 0.00 C ATOM 0 H ALA B 13 3.160 -2.883 -1.296 1.00 0.00 H new ATOM 0 HA ALA B 13 5.480 -1.545 -1.870 1.00 0.00 H new ATOM 0 HB1 ALA B 13 6.663 -3.390 -0.632 1.00 0.00 H new ATOM 0 HB2 ALA B 13 5.304 -2.675 0.268 1.00 0.00 H new ATOM 0 HB3 ALA B 13 5.111 -4.254 -0.530 1.00 0.00 H new ATOM 2400 N ILE B 14 4.934 -4.301 -3.613 1.00 0.00 N ATOM 2401 CA ILE B 14 5.227 -5.217 -4.672 1.00 0.00 C ATOM 2402 C ILE B 14 5.226 -4.416 -5.928 1.00 0.00 C ATOM 2403 O ILE B 14 6.223 -4.462 -6.647 1.00 0.00 O ATOM 2404 CB ILE B 14 4.274 -6.375 -4.678 1.00 0.00 C ATOM 2405 CG1 ILE B 14 4.748 -7.384 -3.618 1.00 0.00 C ATOM 2406 CG2 ILE B 14 4.078 -7.121 -6.009 1.00 0.00 C ATOM 2407 CD1 ILE B 14 3.748 -8.428 -3.125 1.00 0.00 C ATOM 0 H ILE B 14 3.985 -4.465 -3.276 1.00 0.00 H new ATOM 0 HA ILE B 14 6.202 -5.688 -4.548 1.00 0.00 H new ATOM 0 HB ILE B 14 3.299 -5.934 -4.472 1.00 0.00 H new ATOM 0 HG12 ILE B 14 5.611 -7.913 -4.023 1.00 0.00 H new ATOM 0 HG13 ILE B 14 5.097 -6.820 -2.753 1.00 0.00 H new ATOM 0 HG21 ILE B 14 3.364 -7.933 -5.869 1.00 0.00 H new ATOM 0 HG22 ILE B 14 3.698 -6.430 -6.761 1.00 0.00 H new ATOM 0 HG23 ILE B 14 5.032 -7.530 -6.341 1.00 0.00 H new ATOM 0 HD11 ILE B 14 4.225 -9.067 -2.382 1.00 0.00 H new ATOM 0 HD12 ILE B 14 2.891 -7.927 -2.676 1.00 0.00 H new ATOM 0 HD13 ILE B 14 3.413 -9.036 -3.965 1.00 0.00 H new ATOM 2419 N GLY B 15 4.116 -3.705 -6.198 1.00 0.00 N ATOM 2420 CA GLY B 15 3.900 -2.690 -7.181 1.00 0.00 C ATOM 2421 C GLY B 15 4.985 -1.689 -7.383 1.00 0.00 C ATOM 2422 O GLY B 15 5.350 -1.280 -8.484 1.00 0.00 O ATOM 0 H GLY B 15 3.267 -3.866 -5.656 1.00 0.00 H new ATOM 0 HA2 GLY B 15 3.712 -3.181 -8.136 1.00 0.00 H new ATOM 0 HA3 GLY B 15 2.990 -2.152 -6.915 1.00 0.00 H new ATOM 2426 N ARG B 16 5.505 -1.194 -6.245 1.00 0.00 N ATOM 2427 CA ARG B 16 6.580 -0.263 -6.096 1.00 0.00 C ATOM 2428 C ARG B 16 7.882 -0.885 -6.467 1.00 0.00 C ATOM 2429 O ARG B 16 8.547 -0.357 -7.357 1.00 0.00 O ATOM 2430 CB ARG B 16 6.693 0.187 -4.629 1.00 0.00 C ATOM 2431 CG ARG B 16 7.717 1.300 -4.396 1.00 0.00 C ATOM 2432 CD ARG B 16 7.351 2.670 -4.971 1.00 0.00 C ATOM 2433 NE ARG B 16 6.218 3.234 -4.186 1.00 0.00 N ATOM 2434 CZ ARG B 16 6.307 3.808 -2.951 1.00 0.00 C ATOM 2435 NH1 ARG B 16 7.479 4.170 -2.351 1.00 0.00 N ATOM 2436 NH2 ARG B 16 5.156 4.176 -2.315 1.00 0.00 N ATOM 0 H ARG B 16 5.132 -1.477 -5.339 1.00 0.00 H new ATOM 0 HA ARG B 16 6.367 0.583 -6.750 1.00 0.00 H new ATOM 0 HB2 ARG B 16 5.716 0.529 -4.289 1.00 0.00 H new ATOM 0 HB3 ARG B 16 6.961 -0.673 -4.016 1.00 0.00 H new ATOM 0 HG2 ARG B 16 7.872 1.407 -3.322 1.00 0.00 H new ATOM 0 HG3 ARG B 16 8.669 0.989 -4.826 1.00 0.00 H new ATOM 0 HD2 ARG B 16 8.210 3.339 -4.927 1.00 0.00 H new ATOM 0 HD3 ARG B 16 7.073 2.576 -6.021 1.00 0.00 H new ATOM 0 HE ARG B 16 5.291 3.187 -4.610 1.00 0.00 H new ATOM 0 HH11 ARG B 16 8.366 4.015 -2.830 1.00 0.00 H new ATOM 0 HH12 ARG B 16 7.467 4.595 -1.424 1.00 0.00 H new ATOM 0 HH21 ARG B 16 4.253 4.020 -2.764 1.00 0.00 H new ATOM 0 HH22 ARG B 16 5.199 4.607 -1.391 1.00 0.00 H new