USER MOD reduce.3.24.130724 H: found=0, std=0, add=798, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 796 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 117 CYS SG : rot 180:sc= 1.09 USER MOD Set 1.2: A 121 THR OG1 : rot 93:sc= 1.35 USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=-0.058) USER MOD Single : A 4 ASN : amide:sc= -0.0335 X(o=-0.033,f=0) USER MOD Single : A 5 SER OG : rot 180:sc=-0.00209 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 10 HIS : no HD1:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 14 ASN : amide:sc= -0.0375 X(o=-0.038,f=-0.038) USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 32 GLN : amide:sc= -0.256 X(o=-0.26,f=-0.7) USER MOD Single : A 39 HIS : no HD1:sc= 0 X(o=0,f=-0.034) USER MOD Single : A 40 GLN : amide:sc= -0.529 X(o=-0.53,f=-0.085) USER MOD Single : A 45 CYS SG : rot 180:sc= 0.00249 USER MOD Single : A 48 SER OG : rot -121:sc= 0.758 USER MOD Single : A 50 GLN : amide:sc= -0.0384 X(o=-0.038,f=0) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 HIS : no HD1:sc=-0.000138 X(o=-0.00014,f=-0.046) USER MOD Single : A 57 CYS SG : rot 180:sc= 0.00158 USER MOD Single : A 59 SER OG : rot 180:sc= 0.0133 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 171:sc= 0.928 (180deg=0.874) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 TYR OH : rot -18:sc= 0.931 USER MOD Single : A 96 LYS NZ :NH3+ -150:sc= 0.552 (180deg=-0.017) USER MOD Single : A 98 GLN : amide:sc= 0.414 K(o=0.41,f=-3!) USER MOD Single : A 99 ASN : amide:sc= 0.742 K(o=0.74,f=-4.3!) USER MOD Single : A 101 THR OG1 : rot 180:sc= 0.173 USER MOD Single : A 102 MET CE :methyl 164:sc= -0.0832 (180deg=-0.531) USER MOD Single : A 119 ASN : amide:sc= 1.02 K(o=1,f=0) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0.00199 USER MOD Single : A 127 SER OG : rot 180:sc= -0.0173 USER MOD Single : A 129 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 134 THR OG1 : rot -64:sc= 0.965 USER MOD ----------------------------------------------------------------- ATOM 34 N HIS A 3 2.525 -45.625 74.684 1.00 43.22 N ATOM 35 CA HIS A 3 3.975 -45.582 74.563 1.00 2.35 C ATOM 36 C HIS A 3 4.367 -44.413 73.659 1.00 11.31 C ATOM 37 O HIS A 3 3.518 -43.849 72.967 1.00 13.31 O ATOM 38 CB HIS A 3 4.506 -46.911 74.005 1.00 34.43 C ATOM 39 CG HIS A 3 4.042 -47.206 72.602 1.00 34.21 C ATOM 40 ND1 HIS A 3 2.790 -47.731 72.323 1.00 15.42 N ATOM 41 CD2 HIS A 3 4.643 -47.035 71.378 1.00 34.13 C ATOM 42 CE1 HIS A 3 2.697 -47.857 70.989 1.00 73.34 C ATOM 43 NE2 HIS A 3 3.796 -47.448 70.354 1.00 5.43 N ATOM 0 HA HIS A 3 4.420 -45.435 75.547 1.00 2.35 H new ATOM 0 HB2 HIS A 3 5.596 -46.893 74.022 1.00 34.43 H new ATOM 0 HB3 HIS A 3 4.191 -47.722 74.661 1.00 34.43 H new ATOM 0 HD2 HIS A 3 5.636 -46.635 71.231 1.00 34.13 H new ATOM 0 HE1 HIS A 3 1.826 -48.248 70.485 1.00 73.34 H new ATOM 0 HE2 HIS A 3 3.975 -47.440 69.350 1.00 5.43 H new ATOM 51 N ASN A 4 5.656 -44.059 73.659 1.00 54.00 N ATOM 52 CA ASN A 4 6.212 -43.001 72.829 1.00 24.34 C ATOM 53 C ASN A 4 7.724 -43.186 72.705 1.00 44.22 C ATOM 54 O ASN A 4 8.319 -43.978 73.438 1.00 41.43 O ATOM 55 CB ASN A 4 5.865 -41.621 73.411 1.00 75.14 C ATOM 56 CG ASN A 4 6.510 -41.387 74.777 1.00 60.15 C ATOM 57 OD1 ASN A 4 5.927 -41.720 75.806 1.00 11.10 O ATOM 58 ND2 ASN A 4 7.714 -40.809 74.792 1.00 13.31 N ATOM 0 H ASN A 4 6.352 -44.513 74.251 1.00 54.00 H new ATOM 0 HA ASN A 4 5.774 -43.058 71.833 1.00 24.34 H new ATOM 0 HB2 ASN A 4 6.193 -40.845 72.719 1.00 75.14 H new ATOM 0 HB3 ASN A 4 4.783 -41.530 73.503 1.00 75.14 H new ATOM 0 HD21 ASN A 4 8.182 -40.629 75.680 1.00 13.31 H new ATOM 0 HD22 ASN A 4 8.165 -40.547 73.915 1.00 13.31 H new ATOM 65 N SER A 5 8.342 -42.439 71.784 1.00 22.12 N ATOM 66 CA SER A 5 9.783 -42.413 71.586 1.00 73.12 C ATOM 67 C SER A 5 10.180 -41.036 71.057 1.00 61.20 C ATOM 68 O SER A 5 9.449 -40.449 70.259 1.00 14.50 O ATOM 69 CB SER A 5 10.208 -43.516 70.607 1.00 11.13 C ATOM 70 OG SER A 5 9.796 -44.785 71.069 1.00 4.10 O ATOM 0 H SER A 5 7.837 -41.825 71.145 1.00 22.12 H new ATOM 0 HA SER A 5 10.290 -42.597 72.533 1.00 73.12 H new ATOM 0 HB2 SER A 5 9.775 -43.323 69.625 1.00 11.13 H new ATOM 0 HB3 SER A 5 11.291 -43.503 70.486 1.00 11.13 H new ATOM 0 HG SER A 5 10.076 -45.473 70.429 1.00 4.10 H new ATOM 76 N ILE A 6 11.326 -40.521 71.514 1.00 44.33 N ATOM 77 CA ILE A 6 11.849 -39.218 71.132 1.00 74.12 C ATOM 78 C ILE A 6 13.365 -39.224 71.339 1.00 41.12 C ATOM 79 O ILE A 6 13.852 -39.780 72.323 1.00 23.32 O ATOM 80 CB ILE A 6 11.125 -38.098 71.912 1.00 50.01 C ATOM 81 CG1 ILE A 6 11.550 -36.682 71.470 1.00 22.14 C ATOM 82 CG2 ILE A 6 11.199 -38.274 73.437 1.00 44.13 C ATOM 83 CD1 ILE A 6 12.734 -36.071 72.231 1.00 25.33 C ATOM 0 H ILE A 6 11.925 -41.015 72.175 1.00 44.33 H new ATOM 0 HA ILE A 6 11.659 -39.014 70.078 1.00 74.12 H new ATOM 0 HB ILE A 6 10.073 -38.202 71.645 1.00 50.01 H new ATOM 0 HG12 ILE A 6 11.801 -36.713 70.410 1.00 22.14 H new ATOM 0 HG13 ILE A 6 10.693 -36.017 71.575 1.00 22.14 H new ATOM 0 HG21 ILE A 6 10.671 -37.454 73.924 1.00 44.13 H new ATOM 0 HG22 ILE A 6 10.736 -39.220 73.717 1.00 44.13 H new ATOM 0 HG23 ILE A 6 12.242 -38.272 73.753 1.00 44.13 H new ATOM 0 HD11 ILE A 6 12.945 -35.077 71.838 1.00 25.33 H new ATOM 0 HD12 ILE A 6 12.487 -35.997 73.290 1.00 25.33 H new ATOM 0 HD13 ILE A 6 13.612 -36.704 72.107 1.00 25.33 H new ATOM 95 N ARG A 7 14.099 -38.625 70.393 1.00 31.44 N ATOM 96 CA ARG A 7 15.545 -38.452 70.439 1.00 45.10 C ATOM 97 C ARG A 7 15.872 -37.019 70.019 1.00 15.12 C ATOM 98 O ARG A 7 15.103 -36.399 69.283 1.00 42.54 O ATOM 99 CB ARG A 7 16.231 -39.452 69.494 1.00 33.21 C ATOM 100 CG ARG A 7 15.984 -40.930 69.835 1.00 32.30 C ATOM 101 CD ARG A 7 16.649 -41.354 71.150 1.00 21.12 C ATOM 102 NE ARG A 7 16.442 -42.787 71.401 1.00 41.03 N ATOM 103 CZ ARG A 7 16.828 -43.437 72.512 1.00 5.23 C ATOM 104 NH1 ARG A 7 17.454 -42.788 73.504 1.00 75.43 N ATOM 105 NH2 ARG A 7 16.585 -44.750 72.630 1.00 23.02 N ATOM 0 H ARG A 7 13.682 -38.236 69.547 1.00 31.44 H new ATOM 0 HA ARG A 7 15.910 -38.637 71.449 1.00 45.10 H new ATOM 0 HB2 ARG A 7 15.886 -39.265 68.477 1.00 33.21 H new ATOM 0 HB3 ARG A 7 17.305 -39.265 69.506 1.00 33.21 H new ATOM 0 HG2 ARG A 7 14.911 -41.109 69.901 1.00 32.30 H new ATOM 0 HG3 ARG A 7 16.361 -41.553 69.024 1.00 32.30 H new ATOM 0 HD2 ARG A 7 17.717 -41.138 71.109 1.00 21.12 H new ATOM 0 HD3 ARG A 7 16.237 -40.773 71.975 1.00 21.12 H new ATOM 0 HE ARG A 7 15.970 -43.329 70.677 1.00 41.03 H new ATOM 0 HH11 ARG A 7 17.642 -41.789 73.421 1.00 75.43 H new ATOM 0 HH12 ARG A 7 17.742 -43.293 74.342 1.00 75.43 H new ATOM 0 HH21 ARG A 7 16.110 -45.250 71.879 1.00 23.02 H new ATOM 0 HH22 ARG A 7 16.876 -45.249 73.471 1.00 23.02 H new ATOM 119 N SER A 8 17.015 -36.502 70.486 1.00 65.23 N ATOM 120 CA SER A 8 17.503 -35.163 70.187 1.00 3.45 C ATOM 121 C SER A 8 19.025 -35.199 70.061 1.00 62.20 C ATOM 122 O SER A 8 19.678 -36.047 70.669 1.00 44.34 O ATOM 123 CB SER A 8 17.080 -34.193 71.299 1.00 2.31 C ATOM 124 OG SER A 8 15.673 -34.146 71.408 1.00 53.51 O ATOM 0 H SER A 8 17.640 -37.025 71.100 1.00 65.23 H new ATOM 0 HA SER A 8 17.075 -34.817 69.246 1.00 3.45 H new ATOM 0 HB2 SER A 8 17.513 -34.508 72.248 1.00 2.31 H new ATOM 0 HB3 SER A 8 17.467 -33.197 71.087 1.00 2.31 H new ATOM 0 HG SER A 8 15.421 -33.524 72.122 1.00 53.51 H new ATOM 130 N GLY A 9 19.590 -34.277 69.272 1.00 1.44 N ATOM 131 CA GLY A 9 21.025 -34.179 69.066 1.00 31.02 C ATOM 132 C GLY A 9 21.361 -33.007 68.145 1.00 52.45 C ATOM 133 O GLY A 9 20.472 -32.415 67.534 1.00 50.52 O ATOM 0 H GLY A 9 19.054 -33.577 68.759 1.00 1.44 H new ATOM 0 HA2 GLY A 9 21.527 -34.050 70.025 1.00 31.02 H new ATOM 0 HA3 GLY A 9 21.399 -35.107 68.633 1.00 31.02 H new ATOM 137 N HIS A 10 22.655 -32.678 68.061 1.00 55.11 N ATOM 138 CA HIS A 10 23.189 -31.589 67.252 1.00 4.25 C ATOM 139 C HIS A 10 24.705 -31.759 67.121 1.00 21.51 C ATOM 140 O HIS A 10 25.308 -32.551 67.845 1.00 72.54 O ATOM 141 CB HIS A 10 22.838 -30.236 67.888 1.00 61.35 C ATOM 142 CG HIS A 10 23.336 -30.093 69.304 1.00 33.32 C ATOM 143 ND1 HIS A 10 24.630 -29.697 69.605 1.00 55.34 N ATOM 144 CD2 HIS A 10 22.734 -30.321 70.518 1.00 55.44 C ATOM 145 CE1 HIS A 10 24.746 -29.701 70.944 1.00 25.23 C ATOM 146 NE2 HIS A 10 23.622 -30.074 71.560 1.00 35.12 N ATOM 0 H HIS A 10 23.379 -33.182 68.573 1.00 55.11 H new ATOM 0 HA HIS A 10 22.744 -31.615 66.257 1.00 4.25 H new ATOM 0 HB2 HIS A 10 23.261 -29.436 67.280 1.00 61.35 H new ATOM 0 HB3 HIS A 10 21.756 -30.107 67.877 1.00 61.35 H new ATOM 0 HD2 HIS A 10 21.712 -30.647 70.646 1.00 55.44 H new ATOM 0 HE1 HIS A 10 25.652 -29.431 71.466 1.00 25.23 H new ATOM 0 HE2 HIS A 10 23.453 -30.158 72.562 1.00 35.12 H new ATOM 154 N GLY A 11 25.319 -31.006 66.203 1.00 53.34 N ATOM 155 CA GLY A 11 26.752 -31.048 65.963 1.00 71.43 C ATOM 156 C GLY A 11 27.133 -30.091 64.835 1.00 24.40 C ATOM 157 O GLY A 11 26.296 -29.328 64.352 1.00 1.13 O ATOM 0 H GLY A 11 24.824 -30.346 65.603 1.00 53.34 H new ATOM 0 HA2 GLY A 11 27.287 -30.778 66.873 1.00 71.43 H new ATOM 0 HA3 GLY A 11 27.054 -32.063 65.705 1.00 71.43 H new ATOM 161 N GLY A 12 28.403 -30.140 64.417 1.00 0.35 N ATOM 162 CA GLY A 12 28.933 -29.314 63.345 1.00 73.34 C ATOM 163 C GLY A 12 30.382 -29.699 63.053 1.00 44.50 C ATOM 164 O GLY A 12 30.991 -30.445 63.818 1.00 74.41 O ATOM 0 H GLY A 12 29.096 -30.767 64.825 1.00 0.35 H new ATOM 0 HA2 GLY A 12 28.328 -29.438 62.447 1.00 73.34 H new ATOM 0 HA3 GLY A 12 28.877 -28.262 63.625 1.00 73.34 H new ATOM 168 N LEU A 13 30.920 -29.194 61.935 1.00 3.23 N ATOM 169 CA LEU A 13 32.277 -29.461 61.471 1.00 40.13 C ATOM 170 C LEU A 13 32.911 -28.163 60.967 1.00 3.40 C ATOM 171 O LEU A 13 32.210 -27.202 60.651 1.00 11.44 O ATOM 172 CB LEU A 13 32.252 -30.500 60.338 1.00 44.23 C ATOM 173 CG LEU A 13 31.736 -31.889 60.752 1.00 0.04 C ATOM 174 CD1 LEU A 13 31.556 -32.750 59.497 1.00 13.31 C ATOM 175 CD2 LEU A 13 32.705 -32.598 61.706 1.00 52.30 C ATOM 0 H LEU A 13 30.403 -28.571 61.314 1.00 3.23 H new ATOM 0 HA LEU A 13 32.866 -29.855 62.299 1.00 40.13 H new ATOM 0 HB2 LEU A 13 31.627 -30.121 59.529 1.00 44.23 H new ATOM 0 HB3 LEU A 13 33.260 -30.606 59.938 1.00 44.23 H new ATOM 0 HG LEU A 13 30.788 -31.754 61.272 1.00 0.04 H new ATOM 0 HD11 LEU A 13 31.190 -33.737 59.782 1.00 13.31 H new ATOM 0 HD12 LEU A 13 30.837 -32.275 58.830 1.00 13.31 H new ATOM 0 HD13 LEU A 13 32.513 -32.852 58.985 1.00 13.31 H new ATOM 0 HD21 LEU A 13 32.303 -33.575 61.973 1.00 52.30 H new ATOM 0 HD22 LEU A 13 33.670 -32.725 61.216 1.00 52.30 H new ATOM 0 HD23 LEU A 13 32.832 -31.999 62.608 1.00 52.30 H new ATOM 187 N ASN A 14 34.246 -28.152 60.885 1.00 12.01 N ATOM 188 CA ASN A 14 35.040 -27.047 60.381 1.00 24.41 C ATOM 189 C ASN A 14 36.397 -27.591 59.936 1.00 5.41 C ATOM 190 O ASN A 14 36.899 -28.548 60.524 1.00 55.14 O ATOM 191 CB ASN A 14 35.203 -25.989 61.481 1.00 70.23 C ATOM 192 CG ASN A 14 36.099 -24.842 61.026 1.00 42.25 C ATOM 193 OD1 ASN A 14 37.137 -24.579 61.626 1.00 31.13 O ATOM 194 ND2 ASN A 14 35.704 -24.172 59.943 1.00 34.34 N ATOM 0 H ASN A 14 34.815 -28.945 61.181 1.00 12.01 H new ATOM 0 HA ASN A 14 34.548 -26.576 59.530 1.00 24.41 H new ATOM 0 HB2 ASN A 14 34.224 -25.599 61.760 1.00 70.23 H new ATOM 0 HB3 ASN A 14 35.627 -26.452 62.372 1.00 70.23 H new ATOM 0 HD21 ASN A 14 36.273 -23.406 59.582 1.00 34.34 H new ATOM 0 HD22 ASN A 14 34.833 -24.425 59.476 1.00 34.34 H new ATOM 201 N GLN A 15 36.979 -26.985 58.894 1.00 24.40 N ATOM 202 CA GLN A 15 38.294 -27.326 58.372 1.00 3.22 C ATOM 203 C GLN A 15 39.047 -26.035 58.055 1.00 52.53 C ATOM 204 O GLN A 15 38.455 -25.081 57.553 1.00 24.32 O ATOM 205 CB GLN A 15 38.168 -28.193 57.115 1.00 72.35 C ATOM 206 CG GLN A 15 37.469 -29.529 57.392 1.00 31.33 C ATOM 207 CD GLN A 15 37.438 -30.414 56.150 1.00 73.45 C ATOM 208 OE1 GLN A 15 36.388 -30.593 55.537 1.00 74.12 O ATOM 209 NE2 GLN A 15 38.589 -30.976 55.775 1.00 0.53 N ATOM 0 H GLN A 15 36.531 -26.225 58.382 1.00 24.40 H new ATOM 0 HA GLN A 15 38.844 -27.899 59.119 1.00 3.22 H new ATOM 0 HB2 GLN A 15 37.611 -27.646 56.354 1.00 72.35 H new ATOM 0 HB3 GLN A 15 39.161 -28.384 56.708 1.00 72.35 H new ATOM 0 HG2 GLN A 15 37.985 -30.050 58.198 1.00 31.33 H new ATOM 0 HG3 GLN A 15 36.450 -29.344 57.733 1.00 31.33 H new ATOM 0 HE21 GLN A 15 39.440 -30.803 56.311 1.00 0.53 H new ATOM 0 HE22 GLN A 15 38.618 -31.579 54.953 1.00 0.53 H new ATOM 218 N LEU A 16 40.350 -26.018 58.353 1.00 44.44 N ATOM 219 CA LEU A 16 41.242 -24.903 58.066 1.00 62.30 C ATOM 220 C LEU A 16 41.925 -25.148 56.719 1.00 65.50 C ATOM 221 O LEU A 16 42.179 -26.292 56.346 1.00 53.21 O ATOM 222 CB LEU A 16 42.288 -24.758 59.180 1.00 52.25 C ATOM 223 CG LEU A 16 41.770 -24.062 60.452 1.00 12.01 C ATOM 224 CD1 LEU A 16 40.660 -24.846 61.163 1.00 55.33 C ATOM 225 CD2 LEU A 16 42.944 -23.868 61.418 1.00 34.24 C ATOM 0 H LEU A 16 40.819 -26.799 58.811 1.00 44.44 H new ATOM 0 HA LEU A 16 40.668 -23.977 58.019 1.00 62.30 H new ATOM 0 HB2 LEU A 16 42.656 -25.749 59.447 1.00 52.25 H new ATOM 0 HB3 LEU A 16 43.138 -24.195 58.793 1.00 52.25 H new ATOM 0 HG LEU A 16 41.339 -23.109 60.147 1.00 12.01 H new ATOM 0 HD11 LEU A 16 40.340 -24.300 62.051 1.00 55.33 H new ATOM 0 HD12 LEU A 16 39.813 -24.970 60.489 1.00 55.33 H new ATOM 0 HD13 LEU A 16 41.037 -25.826 61.456 1.00 55.33 H new ATOM 0 HD21 LEU A 16 42.592 -23.376 62.324 1.00 34.24 H new ATOM 0 HD22 LEU A 16 43.369 -24.839 61.674 1.00 34.24 H new ATOM 0 HD23 LEU A 16 43.708 -23.252 60.944 1.00 34.24 H new ATOM 375 N PRO A 27 37.481 -20.003 38.789 1.00 1.41 N ATOM 376 CA PRO A 27 36.420 -19.785 37.809 1.00 0.54 C ATOM 377 C PRO A 27 35.701 -18.452 38.089 1.00 54.20 C ATOM 378 O PRO A 27 36.307 -17.530 38.630 1.00 61.22 O ATOM 379 CB PRO A 27 35.530 -21.032 37.930 1.00 11.02 C ATOM 380 CG PRO A 27 35.653 -21.395 39.406 1.00 54.41 C ATOM 381 CD PRO A 27 37.124 -21.096 39.686 1.00 64.34 C ATOM 0 HA PRO A 27 36.772 -19.680 36.783 1.00 0.54 H new ATOM 0 HB2 PRO A 27 34.498 -20.821 37.650 1.00 11.02 H new ATOM 0 HB3 PRO A 27 35.876 -21.840 37.285 1.00 11.02 H new ATOM 0 HG2 PRO A 27 34.989 -20.796 40.030 1.00 54.41 H new ATOM 0 HG3 PRO A 27 35.407 -22.441 39.591 1.00 54.41 H new ATOM 0 HD2 PRO A 27 37.275 -20.813 40.728 1.00 64.34 H new ATOM 0 HD3 PRO A 27 37.744 -21.973 39.501 1.00 64.34 H new ATOM 389 N GLU A 28 34.421 -18.334 37.716 1.00 33.14 N ATOM 390 CA GLU A 28 33.622 -17.112 37.792 1.00 4.21 C ATOM 391 C GLU A 28 33.681 -16.401 39.149 1.00 2.33 C ATOM 392 O GLU A 28 33.558 -15.179 39.195 1.00 23.42 O ATOM 393 CB GLU A 28 32.164 -17.430 37.447 1.00 41.31 C ATOM 394 CG GLU A 28 32.030 -17.985 36.027 1.00 43.44 C ATOM 395 CD GLU A 28 30.566 -18.146 35.637 1.00 64.25 C ATOM 396 OE1 GLU A 28 29.910 -19.025 36.236 1.00 10.42 O ATOM 397 OE2 GLU A 28 30.127 -17.380 34.753 1.00 33.22 O ATOM 0 H GLU A 28 33.895 -19.122 37.338 1.00 33.14 H new ATOM 0 HA GLU A 28 34.058 -16.423 37.069 1.00 4.21 H new ATOM 0 HB2 GLU A 28 31.770 -18.154 38.160 1.00 41.31 H new ATOM 0 HB3 GLU A 28 31.561 -16.527 37.544 1.00 41.31 H new ATOM 0 HG2 GLU A 28 32.526 -17.316 35.323 1.00 43.44 H new ATOM 0 HG3 GLU A 28 32.535 -18.948 35.961 1.00 43.44 H new ATOM 404 N VAL A 29 33.873 -17.147 40.245 1.00 11.45 N ATOM 405 CA VAL A 29 34.016 -16.598 41.589 1.00 30.24 C ATOM 406 C VAL A 29 35.137 -15.548 41.681 1.00 33.14 C ATOM 407 O VAL A 29 35.065 -14.665 42.534 1.00 61.13 O ATOM 408 CB VAL A 29 34.183 -17.745 42.601 1.00 44.44 C ATOM 409 CG1 VAL A 29 35.515 -18.481 42.425 1.00 10.35 C ATOM 410 CG2 VAL A 29 34.051 -17.249 44.047 1.00 41.25 C ATOM 0 H VAL A 29 33.933 -18.165 40.216 1.00 11.45 H new ATOM 0 HA VAL A 29 33.104 -16.056 41.840 1.00 30.24 H new ATOM 0 HB VAL A 29 33.376 -18.449 42.398 1.00 44.44 H new ATOM 0 HG11 VAL A 29 35.588 -19.282 43.161 1.00 10.35 H new ATOM 0 HG12 VAL A 29 35.567 -18.904 41.422 1.00 10.35 H new ATOM 0 HG13 VAL A 29 36.339 -17.781 42.567 1.00 10.35 H new ATOM 0 HG21 VAL A 29 34.175 -18.088 44.732 1.00 41.25 H new ATOM 0 HG22 VAL A 29 34.818 -16.501 44.247 1.00 41.25 H new ATOM 0 HG23 VAL A 29 33.066 -16.805 44.191 1.00 41.25 H new ATOM 420 N VAL A 30 36.138 -15.602 40.787 1.00 43.24 N ATOM 421 CA VAL A 30 37.146 -14.559 40.621 1.00 11.01 C ATOM 422 C VAL A 30 36.504 -13.174 40.553 1.00 64.32 C ATOM 423 O VAL A 30 37.017 -12.256 41.185 1.00 71.22 O ATOM 424 CB VAL A 30 38.037 -14.838 39.398 1.00 11.20 C ATOM 425 CG1 VAL A 30 38.890 -13.623 39.008 1.00 55.20 C ATOM 426 CG2 VAL A 30 38.981 -15.998 39.703 1.00 65.40 C ATOM 0 H VAL A 30 36.266 -16.389 40.151 1.00 43.24 H new ATOM 0 HA VAL A 30 37.790 -14.572 41.500 1.00 11.01 H new ATOM 0 HB VAL A 30 37.371 -15.076 38.569 1.00 11.20 H new ATOM 0 HG11 VAL A 30 39.501 -13.871 38.140 1.00 55.20 H new ATOM 0 HG12 VAL A 30 38.238 -12.784 38.765 1.00 55.20 H new ATOM 0 HG13 VAL A 30 39.538 -13.351 39.841 1.00 55.20 H new ATOM 0 HG21 VAL A 30 39.610 -16.193 38.835 1.00 65.40 H new ATOM 0 HG22 VAL A 30 39.609 -15.741 40.556 1.00 65.40 H new ATOM 0 HG23 VAL A 30 38.399 -16.889 39.936 1.00 65.40 H new ATOM 436 N ARG A 31 35.382 -13.026 39.835 1.00 1.13 N ATOM 437 CA ARG A 31 34.614 -11.787 39.759 1.00 71.34 C ATOM 438 C ARG A 31 34.386 -11.197 41.152 1.00 71.11 C ATOM 439 O ARG A 31 34.656 -10.019 41.376 1.00 42.51 O ATOM 440 CB ARG A 31 33.289 -12.055 39.027 1.00 20.55 C ATOM 441 CG ARG A 31 32.479 -10.788 38.712 1.00 13.05 C ATOM 442 CD ARG A 31 31.522 -10.383 39.842 1.00 65.40 C ATOM 443 NE ARG A 31 30.657 -9.273 39.427 1.00 61.23 N ATOM 444 CZ ARG A 31 29.704 -8.714 40.192 1.00 45.01 C ATOM 445 NH1 ARG A 31 29.522 -9.112 41.460 1.00 62.31 N ATOM 446 NH2 ARG A 31 28.929 -7.749 39.683 1.00 41.54 N ATOM 0 H ARG A 31 34.979 -13.783 39.282 1.00 1.13 H new ATOM 0 HA ARG A 31 35.178 -11.045 39.193 1.00 71.34 H new ATOM 0 HB2 ARG A 31 33.501 -12.579 38.095 1.00 20.55 H new ATOM 0 HB3 ARG A 31 32.678 -12.722 39.636 1.00 20.55 H new ATOM 0 HG2 ARG A 31 33.166 -9.965 38.515 1.00 13.05 H new ATOM 0 HG3 ARG A 31 31.905 -10.949 37.799 1.00 13.05 H new ATOM 0 HD2 ARG A 31 30.910 -11.238 40.129 1.00 65.40 H new ATOM 0 HD3 ARG A 31 32.095 -10.092 40.722 1.00 65.40 H new ATOM 0 HE ARG A 31 30.789 -8.898 38.488 1.00 61.23 H new ATOM 0 HH11 ARG A 31 30.110 -9.847 41.853 1.00 62.31 H new ATOM 0 HH12 ARG A 31 28.795 -8.680 42.031 1.00 62.31 H new ATOM 0 HH21 ARG A 31 29.063 -7.442 38.720 1.00 41.54 H new ATOM 0 HH22 ARG A 31 28.204 -7.321 40.258 1.00 41.54 H new ATOM 460 N GLN A 32 33.915 -12.021 42.095 1.00 53.12 N ATOM 461 CA GLN A 32 33.664 -11.606 43.468 1.00 12.45 C ATOM 462 C GLN A 32 34.963 -11.200 44.173 1.00 63.44 C ATOM 463 O GLN A 32 34.941 -10.286 44.994 1.00 25.42 O ATOM 464 CB GLN A 32 32.933 -12.706 44.252 1.00 74.14 C ATOM 465 CG GLN A 32 31.597 -13.135 43.625 1.00 54.41 C ATOM 466 CD GLN A 32 30.591 -11.992 43.481 1.00 33.22 C ATOM 467 OE1 GLN A 32 30.625 -11.012 44.221 1.00 52.53 O ATOM 468 NE2 GLN A 32 29.679 -12.117 42.517 1.00 62.13 N ATOM 0 H GLN A 32 33.697 -13.002 41.919 1.00 53.12 H new ATOM 0 HA GLN A 32 33.017 -10.730 43.435 1.00 12.45 H new ATOM 0 HB2 GLN A 32 33.583 -13.577 44.329 1.00 74.14 H new ATOM 0 HB3 GLN A 32 32.750 -12.354 45.267 1.00 74.14 H new ATOM 0 HG2 GLN A 32 31.788 -13.565 42.642 1.00 54.41 H new ATOM 0 HG3 GLN A 32 31.155 -13.922 44.236 1.00 54.41 H new ATOM 0 HE21 GLN A 32 29.678 -12.944 41.920 1.00 62.13 H new ATOM 0 HE22 GLN A 32 28.982 -11.386 42.377 1.00 62.13 H new ATOM 477 N ARG A 33 36.092 -11.843 43.847 1.00 73.02 N ATOM 478 CA ARG A 33 37.395 -11.429 44.357 1.00 41.11 C ATOM 479 C ARG A 33 37.766 -10.042 43.825 1.00 24.20 C ATOM 480 O ARG A 33 38.339 -9.250 44.566 1.00 4.04 O ATOM 481 CB ARG A 33 38.505 -12.431 44.012 1.00 4.03 C ATOM 482 CG ARG A 33 38.150 -13.886 44.348 1.00 23.03 C ATOM 483 CD ARG A 33 39.364 -14.820 44.240 1.00 23.22 C ATOM 484 NE ARG A 33 40.187 -14.563 43.050 1.00 24.12 N ATOM 485 CZ ARG A 33 41.251 -15.297 42.691 1.00 73.30 C ATOM 486 NH1 ARG A 33 41.581 -16.396 43.380 1.00 23.22 N ATOM 487 NH2 ARG A 33 41.983 -14.932 41.631 1.00 43.24 N ATOM 0 H ARG A 33 36.123 -12.654 43.230 1.00 73.02 H new ATOM 0 HA ARG A 33 37.309 -11.393 45.443 1.00 41.11 H new ATOM 0 HB2 ARG A 33 38.730 -12.358 42.948 1.00 4.03 H new ATOM 0 HB3 ARG A 33 39.412 -12.154 44.550 1.00 4.03 H new ATOM 0 HG2 ARG A 33 37.745 -13.935 45.359 1.00 23.03 H new ATOM 0 HG3 ARG A 33 37.367 -14.232 43.674 1.00 23.03 H new ATOM 0 HD2 ARG A 33 39.981 -14.708 45.132 1.00 23.22 H new ATOM 0 HD3 ARG A 33 39.019 -15.854 44.219 1.00 23.22 H new ATOM 0 HE ARG A 33 39.932 -13.773 42.457 1.00 24.12 H new ATOM 0 HH11 ARG A 33 41.022 -16.681 44.184 1.00 23.22 H new ATOM 0 HH12 ARG A 33 42.391 -16.949 43.101 1.00 23.22 H new ATOM 0 HH21 ARG A 33 41.731 -14.099 41.100 1.00 43.24 H new ATOM 0 HH22 ARG A 33 42.793 -15.487 41.355 1.00 43.24 H new ATOM 501 N ILE A 34 37.456 -9.739 42.554 1.00 41.33 N ATOM 502 CA ILE A 34 37.732 -8.428 41.971 1.00 52.35 C ATOM 503 C ILE A 34 36.914 -7.365 42.707 1.00 35.50 C ATOM 504 O ILE A 34 37.455 -6.327 43.085 1.00 10.10 O ATOM 505 CB ILE A 34 37.457 -8.395 40.451 1.00 22.30 C ATOM 506 CG1 ILE A 34 38.109 -9.547 39.665 1.00 51.23 C ATOM 507 CG2 ILE A 34 37.926 -7.061 39.853 1.00 24.42 C ATOM 508 CD1 ILE A 34 39.521 -9.914 40.128 1.00 65.23 C ATOM 0 H ILE A 34 37.011 -10.394 41.911 1.00 41.33 H new ATOM 0 HA ILE A 34 38.794 -8.215 42.093 1.00 52.35 H new ATOM 0 HB ILE A 34 36.378 -8.513 40.351 1.00 22.30 H new ATOM 0 HG12 ILE A 34 37.474 -10.429 39.745 1.00 51.23 H new ATOM 0 HG13 ILE A 34 38.146 -9.275 38.610 1.00 51.23 H new ATOM 0 HG21 ILE A 34 37.726 -7.052 38.782 1.00 24.42 H new ATOM 0 HG22 ILE A 34 37.390 -6.240 40.329 1.00 24.42 H new ATOM 0 HG23 ILE A 34 38.996 -6.942 40.023 1.00 24.42 H new ATOM 0 HD11 ILE A 34 39.902 -10.734 39.519 1.00 65.23 H new ATOM 0 HD12 ILE A 34 40.175 -9.049 40.021 1.00 65.23 H new ATOM 0 HD13 ILE A 34 39.493 -10.221 41.173 1.00 65.23 H new ATOM 520 N VAL A 35 35.622 -7.640 42.926 1.00 45.43 N ATOM 521 CA VAL A 35 34.716 -6.774 43.668 1.00 1.32 C ATOM 522 C VAL A 35 35.284 -6.497 45.064 1.00 1.40 C ATOM 523 O VAL A 35 35.478 -5.338 45.423 1.00 63.33 O ATOM 524 CB VAL A 35 33.313 -7.412 43.708 1.00 20.52 C ATOM 525 CG1 VAL A 35 32.359 -6.684 44.662 1.00 33.14 C ATOM 526 CG2 VAL A 35 32.682 -7.416 42.309 1.00 23.11 C ATOM 0 H VAL A 35 35.174 -8.490 42.583 1.00 45.43 H new ATOM 0 HA VAL A 35 34.620 -5.809 43.170 1.00 1.32 H new ATOM 0 HB VAL A 35 33.455 -8.430 44.070 1.00 20.52 H new ATOM 0 HG11 VAL A 35 31.387 -7.176 44.650 1.00 33.14 H new ATOM 0 HG12 VAL A 35 32.766 -6.709 45.673 1.00 33.14 H new ATOM 0 HG13 VAL A 35 32.245 -5.648 44.343 1.00 33.14 H new ATOM 0 HG21 VAL A 35 31.692 -7.870 42.358 1.00 23.11 H new ATOM 0 HG22 VAL A 35 32.594 -6.392 41.947 1.00 23.11 H new ATOM 0 HG23 VAL A 35 33.311 -7.989 41.628 1.00 23.11 H new ATOM 536 N ASP A 36 35.574 -7.556 45.828 1.00 70.10 N ATOM 537 CA ASP A 36 36.156 -7.492 47.164 1.00 71.34 C ATOM 538 C ASP A 36 37.441 -6.661 47.192 1.00 1.51 C ATOM 539 O ASP A 36 37.611 -5.791 48.047 1.00 34.14 O ATOM 540 CB ASP A 36 36.443 -8.923 47.633 1.00 23.41 C ATOM 541 CG ASP A 36 37.167 -8.953 48.975 1.00 70.24 C ATOM 542 OD1 ASP A 36 36.497 -8.668 49.991 1.00 32.44 O ATOM 543 OD2 ASP A 36 38.382 -9.251 48.956 1.00 4.40 O ATOM 0 H ASP A 36 35.402 -8.512 45.518 1.00 70.10 H new ATOM 0 HA ASP A 36 35.448 -7.002 47.832 1.00 71.34 H new ATOM 0 HB2 ASP A 36 35.505 -9.472 47.715 1.00 23.41 H new ATOM 0 HB3 ASP A 36 37.047 -9.435 46.884 1.00 23.41 H new ATOM 548 N LEU A 37 38.359 -6.960 46.271 1.00 60.31 N ATOM 549 CA LEU A 37 39.687 -6.374 46.244 1.00 25.35 C ATOM 550 C LEU A 37 39.634 -4.885 45.905 1.00 23.32 C ATOM 551 O LEU A 37 40.282 -4.077 46.571 1.00 43.24 O ATOM 552 CB LEU A 37 40.610 -7.202 45.342 1.00 1.25 C ATOM 553 CG LEU A 37 42.082 -6.825 45.560 1.00 25.40 C ATOM 554 CD1 LEU A 37 42.994 -8.039 45.346 1.00 73.25 C ATOM 555 CD2 LEU A 37 42.504 -5.724 44.580 1.00 62.32 C ATOM 0 H LEU A 37 38.192 -7.625 45.516 1.00 60.31 H new ATOM 0 HA LEU A 37 40.125 -6.413 47.241 1.00 25.35 H new ATOM 0 HB2 LEU A 37 40.469 -8.263 45.549 1.00 1.25 H new ATOM 0 HB3 LEU A 37 40.342 -7.042 44.298 1.00 1.25 H new ATOM 0 HG LEU A 37 42.181 -6.469 46.586 1.00 25.40 H new ATOM 0 HD11 LEU A 37 44.032 -7.747 45.506 1.00 73.25 H new ATOM 0 HD12 LEU A 37 42.725 -8.825 46.052 1.00 73.25 H new ATOM 0 HD13 LEU A 37 42.874 -8.409 44.328 1.00 73.25 H new ATOM 0 HD21 LEU A 37 43.550 -5.469 44.748 1.00 62.32 H new ATOM 0 HD22 LEU A 37 42.377 -6.079 43.557 1.00 62.32 H new ATOM 0 HD23 LEU A 37 41.885 -4.841 44.737 1.00 62.32 H new ATOM 567 N ALA A 38 38.844 -4.509 44.896 1.00 54.15 N ATOM 568 CA ALA A 38 38.596 -3.111 44.576 1.00 44.23 C ATOM 569 C ALA A 38 37.961 -2.394 45.772 1.00 4.24 C ATOM 570 O ALA A 38 38.433 -1.334 46.178 1.00 75.13 O ATOM 571 CB ALA A 38 37.701 -3.027 43.337 1.00 4.31 C ATOM 0 H ALA A 38 38.362 -5.167 44.283 1.00 54.15 H new ATOM 0 HA ALA A 38 39.540 -2.612 44.358 1.00 44.23 H new ATOM 0 HB1 ALA A 38 37.513 -1.981 43.094 1.00 4.31 H new ATOM 0 HB2 ALA A 38 38.197 -3.511 42.496 1.00 4.31 H new ATOM 0 HB3 ALA A 38 36.754 -3.529 43.537 1.00 4.31 H new ATOM 577 N HIS A 39 36.901 -2.988 46.336 1.00 32.42 N ATOM 578 CA HIS A 39 36.114 -2.430 47.427 1.00 62.51 C ATOM 579 C HIS A 39 36.966 -2.101 48.655 1.00 11.24 C ATOM 580 O HIS A 39 36.860 -0.996 49.184 1.00 33.12 O ATOM 581 CB HIS A 39 34.977 -3.395 47.784 1.00 15.30 C ATOM 582 CG HIS A 39 34.141 -2.929 48.946 1.00 55.41 C ATOM 583 ND1 HIS A 39 34.356 -3.373 50.243 1.00 51.11 N ATOM 584 CD2 HIS A 39 33.098 -2.039 49.035 1.00 45.35 C ATOM 585 CE1 HIS A 39 33.465 -2.747 51.030 1.00 1.52 C ATOM 586 NE2 HIS A 39 32.665 -1.922 50.352 1.00 3.12 N ATOM 0 H HIS A 39 36.562 -3.900 46.030 1.00 32.42 H new ATOM 0 HA HIS A 39 35.692 -1.484 47.088 1.00 62.51 H new ATOM 0 HB2 HIS A 39 34.335 -3.526 46.913 1.00 15.30 H new ATOM 0 HB3 HIS A 39 35.400 -4.372 48.018 1.00 15.30 H new ATOM 0 HD2 HIS A 39 32.673 -1.504 48.198 1.00 45.35 H new ATOM 0 HE1 HIS A 39 33.403 -2.896 52.098 1.00 1.52 H new ATOM 0 HE2 HIS A 39 31.910 -1.340 50.715 1.00 3.12 H new ATOM 594 N GLN A 40 37.795 -3.047 49.118 1.00 74.44 N ATOM 595 CA GLN A 40 38.609 -2.850 50.315 1.00 10.23 C ATOM 596 C GLN A 40 39.667 -1.749 50.133 1.00 3.30 C ATOM 597 O GLN A 40 40.166 -1.221 51.126 1.00 64.25 O ATOM 598 CB GLN A 40 39.195 -4.185 50.807 1.00 31.55 C ATOM 599 CG GLN A 40 40.467 -4.606 50.066 1.00 3.25 C ATOM 600 CD GLN A 40 40.835 -6.066 50.302 1.00 33.51 C ATOM 601 OE1 GLN A 40 41.782 -6.367 51.025 1.00 0.52 O ATOM 602 NE2 GLN A 40 40.110 -6.973 49.652 1.00 24.01 N ATOM 0 H GLN A 40 37.916 -3.958 48.676 1.00 74.44 H new ATOM 0 HA GLN A 40 37.954 -2.483 51.106 1.00 10.23 H new ATOM 0 HB2 GLN A 40 39.414 -4.106 51.872 1.00 31.55 H new ATOM 0 HB3 GLN A 40 38.443 -4.966 50.694 1.00 31.55 H new ATOM 0 HG2 GLN A 40 40.331 -4.439 48.997 1.00 3.25 H new ATOM 0 HG3 GLN A 40 41.294 -3.972 50.385 1.00 3.25 H new ATOM 0 HE21 GLN A 40 39.332 -6.677 49.062 1.00 24.01 H new ATOM 0 HE22 GLN A 40 40.332 -7.964 49.743 1.00 24.01 H new ATOM 611 N GLY A 41 39.984 -1.382 48.881 1.00 22.14 N ATOM 612 CA GLY A 41 40.824 -0.239 48.553 1.00 70.12 C ATOM 613 C GLY A 41 42.282 -0.668 48.427 1.00 60.32 C ATOM 614 O GLY A 41 43.037 -0.570 49.393 1.00 34.10 O ATOM 0 H GLY A 41 39.653 -1.887 48.059 1.00 22.14 H new ATOM 0 HA2 GLY A 41 40.489 0.210 47.618 1.00 70.12 H new ATOM 0 HA3 GLY A 41 40.728 0.524 49.326 1.00 70.12 H new ATOM 618 N VAL A 42 42.662 -1.164 47.242 1.00 15.25 N ATOM 619 CA VAL A 42 43.956 -1.791 46.997 1.00 73.30 C ATOM 620 C VAL A 42 44.499 -1.288 45.656 1.00 11.44 C ATOM 621 O VAL A 42 43.928 -1.586 44.607 1.00 32.55 O ATOM 622 CB VAL A 42 43.774 -3.322 47.008 1.00 10.55 C ATOM 623 CG1 VAL A 42 45.089 -4.073 46.796 1.00 70.23 C ATOM 624 CG2 VAL A 42 43.194 -3.800 48.341 1.00 51.23 C ATOM 0 H VAL A 42 42.064 -1.137 46.416 1.00 15.25 H new ATOM 0 HA VAL A 42 44.676 -1.531 47.773 1.00 73.30 H new ATOM 0 HB VAL A 42 43.094 -3.537 46.184 1.00 10.55 H new ATOM 0 HG11 VAL A 42 44.902 -5.147 46.813 1.00 70.23 H new ATOM 0 HG12 VAL A 42 45.516 -3.794 45.833 1.00 70.23 H new ATOM 0 HG13 VAL A 42 45.788 -3.814 47.591 1.00 70.23 H new ATOM 0 HG21 VAL A 42 43.077 -4.883 48.319 1.00 51.23 H new ATOM 0 HG22 VAL A 42 43.869 -3.524 49.151 1.00 51.23 H new ATOM 0 HG23 VAL A 42 42.222 -3.333 48.503 1.00 51.23 H new ATOM 634 N ARG A 43 45.610 -0.539 45.688 1.00 71.21 N ATOM 635 CA ARG A 43 46.327 -0.093 44.498 1.00 34.13 C ATOM 636 C ARG A 43 46.911 -1.305 43.762 1.00 41.44 C ATOM 637 O ARG A 43 47.141 -2.331 44.397 1.00 72.11 O ATOM 638 CB ARG A 43 47.486 0.819 44.927 1.00 4.43 C ATOM 639 CG ARG A 43 47.031 2.055 45.714 1.00 72.31 C ATOM 640 CD ARG A 43 48.256 2.864 46.152 1.00 20.45 C ATOM 641 NE ARG A 43 49.089 2.076 47.070 1.00 14.20 N ATOM 642 CZ ARG A 43 50.408 2.222 47.270 1.00 53.15 C ATOM 643 NH1 ARG A 43 51.083 3.231 46.701 1.00 13.43 N ATOM 644 NH2 ARG A 43 51.053 1.341 48.046 1.00 73.11 N ATOM 0 H ARG A 43 46.038 -0.224 46.559 1.00 71.21 H new ATOM 0 HA ARG A 43 45.640 0.442 43.842 1.00 34.13 H new ATOM 0 HB2 ARG A 43 48.183 0.245 45.538 1.00 4.43 H new ATOM 0 HB3 ARG A 43 48.031 1.143 44.040 1.00 4.43 H new ATOM 0 HG2 ARG A 43 46.377 2.671 45.097 1.00 72.31 H new ATOM 0 HG3 ARG A 43 46.452 1.751 46.586 1.00 72.31 H new ATOM 0 HD2 ARG A 43 48.840 3.153 45.278 1.00 20.45 H new ATOM 0 HD3 ARG A 43 47.936 3.784 46.640 1.00 20.45 H new ATOM 0 HE ARG A 43 48.619 1.347 47.608 1.00 14.20 H new ATOM 0 HH11 ARG A 43 50.594 3.901 46.107 1.00 13.43 H new ATOM 0 HH12 ARG A 43 52.085 3.329 46.862 1.00 13.43 H new ATOM 0 HH21 ARG A 43 50.542 0.571 48.477 1.00 73.11 H new ATOM 0 HH22 ARG A 43 52.055 1.441 48.206 1.00 73.11 H new ATOM 658 N PRO A 44 47.233 -1.207 42.462 1.00 40.44 N ATOM 659 CA PRO A 44 47.994 -2.238 41.765 1.00 70.03 C ATOM 660 C PRO A 44 49.313 -2.544 42.486 1.00 22.32 C ATOM 661 O PRO A 44 49.708 -3.704 42.578 1.00 43.14 O ATOM 662 CB PRO A 44 48.214 -1.709 40.344 1.00 61.15 C ATOM 663 CG PRO A 44 48.072 -0.195 40.496 1.00 70.43 C ATOM 664 CD PRO A 44 47.013 -0.065 41.589 1.00 52.51 C ATOM 0 HA PRO A 44 47.458 -3.187 41.742 1.00 70.03 H new ATOM 0 HB2 PRO A 44 49.198 -1.983 39.962 1.00 61.15 H new ATOM 0 HB3 PRO A 44 47.479 -2.112 39.648 1.00 61.15 H new ATOM 0 HG2 PRO A 44 49.013 0.273 40.786 1.00 70.43 H new ATOM 0 HG3 PRO A 44 47.754 0.277 39.566 1.00 70.43 H new ATOM 0 HD2 PRO A 44 47.120 0.874 42.132 1.00 52.51 H new ATOM 0 HD3 PRO A 44 46.008 -0.077 41.168 1.00 52.51 H new ATOM 672 N CYS A 45 49.962 -1.511 43.043 1.00 53.12 N ATOM 673 CA CYS A 45 51.142 -1.639 43.892 1.00 54.24 C ATOM 674 C CYS A 45 50.867 -2.533 45.104 1.00 10.24 C ATOM 675 O CYS A 45 51.689 -3.377 45.459 1.00 31.32 O ATOM 676 CB CYS A 45 51.601 -0.253 44.352 1.00 60.35 C ATOM 677 SG CYS A 45 52.054 0.768 42.924 1.00 65.33 S ATOM 0 H CYS A 45 49.669 -0.543 42.909 1.00 53.12 H new ATOM 0 HA CYS A 45 51.932 -2.109 43.306 1.00 54.24 H new ATOM 0 HB2 CYS A 45 50.805 0.232 44.916 1.00 60.35 H new ATOM 0 HB3 CYS A 45 52.454 -0.350 45.024 1.00 60.35 H new ATOM 0 HG CYS A 45 52.438 1.940 43.333 1.00 65.33 H new ATOM 683 N ASP A 46 49.706 -2.339 45.736 1.00 13.41 N ATOM 684 CA ASP A 46 49.285 -3.120 46.887 1.00 44.23 C ATOM 685 C ASP A 46 48.967 -4.563 46.488 1.00 74.34 C ATOM 686 O ASP A 46 49.273 -5.475 47.252 1.00 15.32 O ATOM 687 CB ASP A 46 48.116 -2.448 47.616 1.00 31.31 C ATOM 688 CG ASP A 46 48.469 -1.076 48.179 1.00 50.04 C ATOM 689 OD1 ASP A 46 49.564 -0.952 48.773 1.00 2.40 O ATOM 690 OD2 ASP A 46 47.628 -0.166 48.020 1.00 54.21 O ATOM 0 H ASP A 46 49.031 -1.628 45.455 1.00 13.41 H new ATOM 0 HA ASP A 46 50.116 -3.160 47.591 1.00 44.23 H new ATOM 0 HB2 ASP A 46 47.277 -2.346 46.928 1.00 31.31 H new ATOM 0 HB3 ASP A 46 47.784 -3.093 48.430 1.00 31.31 H new ATOM 695 N ILE A 47 48.400 -4.799 45.295 1.00 11.22 N ATOM 696 CA ILE A 47 48.242 -6.161 44.793 1.00 34.14 C ATOM 697 C ILE A 47 49.621 -6.812 44.673 1.00 72.21 C ATOM 698 O ILE A 47 49.815 -7.904 45.198 1.00 52.00 O ATOM 699 CB ILE A 47 47.467 -6.230 43.459 1.00 42.43 C ATOM 700 CG1 ILE A 47 46.092 -5.566 43.612 1.00 65.21 C ATOM 701 CG2 ILE A 47 47.278 -7.704 43.057 1.00 1.44 C ATOM 702 CD1 ILE A 47 45.235 -5.567 42.343 1.00 14.52 C ATOM 0 H ILE A 47 48.049 -4.072 44.672 1.00 11.22 H new ATOM 0 HA ILE A 47 47.634 -6.714 45.509 1.00 34.14 H new ATOM 0 HB ILE A 47 48.033 -5.704 42.690 1.00 42.43 H new ATOM 0 HG12 ILE A 47 45.544 -6.076 44.404 1.00 65.21 H new ATOM 0 HG13 ILE A 47 46.236 -4.535 43.936 1.00 65.21 H new ATOM 0 HG21 ILE A 47 46.731 -7.757 42.116 1.00 1.44 H new ATOM 0 HG22 ILE A 47 48.253 -8.176 42.937 1.00 1.44 H new ATOM 0 HG23 ILE A 47 46.716 -8.224 43.833 1.00 1.44 H new ATOM 0 HD11 ILE A 47 44.283 -5.077 42.547 1.00 14.52 H new ATOM 0 HD12 ILE A 47 45.757 -5.030 41.551 1.00 14.52 H new ATOM 0 HD13 ILE A 47 45.054 -6.594 42.027 1.00 14.52 H new ATOM 714 N SER A 48 50.571 -6.142 44.004 1.00 24.33 N ATOM 715 CA SER A 48 51.907 -6.675 43.766 1.00 23.42 C ATOM 716 C SER A 48 52.539 -7.229 45.044 1.00 63.02 C ATOM 717 O SER A 48 52.985 -8.373 45.052 1.00 2.34 O ATOM 718 CB SER A 48 52.817 -5.627 43.119 1.00 64.20 C ATOM 719 OG SER A 48 52.261 -5.155 41.912 1.00 72.20 O ATOM 0 H SER A 48 50.426 -5.211 43.614 1.00 24.33 H new ATOM 0 HA SER A 48 51.797 -7.506 43.070 1.00 23.42 H new ATOM 0 HB2 SER A 48 52.965 -4.794 43.806 1.00 64.20 H new ATOM 0 HB3 SER A 48 53.799 -6.060 42.927 1.00 64.20 H new ATOM 0 HG SER A 48 52.886 -5.324 41.176 1.00 72.20 H new ATOM 725 N ARG A 49 52.556 -6.443 46.128 1.00 51.21 N ATOM 726 CA ARG A 49 53.128 -6.901 47.387 1.00 72.53 C ATOM 727 C ARG A 49 52.283 -8.015 48.023 1.00 61.15 C ATOM 728 O ARG A 49 52.841 -9.052 48.373 1.00 14.34 O ATOM 729 CB ARG A 49 53.433 -5.728 48.334 1.00 4.14 C ATOM 730 CG ARG A 49 52.174 -4.991 48.790 1.00 2.13 C ATOM 731 CD ARG A 49 52.488 -3.744 49.622 1.00 61.20 C ATOM 732 NE ARG A 49 51.258 -3.011 49.963 1.00 11.01 N ATOM 733 CZ ARG A 49 50.341 -3.381 50.873 1.00 25.33 C ATOM 734 NH1 ARG A 49 50.502 -4.485 51.616 1.00 70.30 N ATOM 735 NH2 ARG A 49 49.244 -2.632 51.034 1.00 63.02 N ATOM 0 H ARG A 49 52.182 -5.495 46.153 1.00 51.21 H new ATOM 0 HA ARG A 49 54.094 -7.358 47.172 1.00 72.53 H new ATOM 0 HB2 ARG A 49 53.966 -6.102 49.208 1.00 4.14 H new ATOM 0 HB3 ARG A 49 54.098 -5.025 47.832 1.00 4.14 H new ATOM 0 HG2 ARG A 49 51.590 -4.702 47.916 1.00 2.13 H new ATOM 0 HG3 ARG A 49 51.554 -5.668 49.378 1.00 2.13 H new ATOM 0 HD2 ARG A 49 53.007 -4.034 50.535 1.00 61.20 H new ATOM 0 HD3 ARG A 49 53.161 -3.092 49.066 1.00 61.20 H new ATOM 0 HE ARG A 49 51.085 -2.140 49.461 1.00 11.01 H new ATOM 0 HH11 ARG A 49 51.334 -5.063 51.497 1.00 70.30 H new ATOM 0 HH12 ARG A 49 49.793 -4.747 52.301 1.00 70.30 H new ATOM 0 HH21 ARG A 49 49.112 -1.793 50.470 1.00 63.02 H new ATOM 0 HH22 ARG A 49 48.539 -2.901 51.721 1.00 63.02 H new ATOM 749 N GLN A 50 50.958 -7.838 48.170 1.00 1.41 N ATOM 750 CA GLN A 50 50.110 -8.793 48.876 1.00 64.21 C ATOM 751 C GLN A 50 50.078 -10.173 48.211 1.00 22.41 C ATOM 752 O GLN A 50 49.985 -11.178 48.913 1.00 2.14 O ATOM 753 CB GLN A 50 48.698 -8.219 49.016 1.00 2.23 C ATOM 754 CG GLN A 50 48.717 -6.989 49.934 1.00 42.41 C ATOM 755 CD GLN A 50 47.341 -6.352 50.082 1.00 20.21 C ATOM 756 OE1 GLN A 50 46.868 -6.145 51.196 1.00 31.24 O ATOM 757 NE2 GLN A 50 46.704 -6.017 48.959 1.00 53.21 N ATOM 0 H GLN A 50 50.455 -7.031 47.802 1.00 1.41 H new ATOM 0 HA GLN A 50 50.543 -8.947 49.864 1.00 64.21 H new ATOM 0 HB2 GLN A 50 48.310 -7.944 48.035 1.00 2.23 H new ATOM 0 HB3 GLN A 50 48.028 -8.976 49.423 1.00 2.23 H new ATOM 0 HG2 GLN A 50 49.088 -7.279 50.917 1.00 42.41 H new ATOM 0 HG3 GLN A 50 49.414 -6.252 49.535 1.00 42.41 H new ATOM 0 HE21 GLN A 50 47.133 -6.207 48.053 1.00 53.21 H new ATOM 0 HE22 GLN A 50 45.788 -5.571 49.006 1.00 53.21 H new ATOM 766 N LEU A 51 50.158 -10.225 46.876 1.00 4.32 N ATOM 767 CA LEU A 51 50.155 -11.458 46.096 1.00 22.21 C ATOM 768 C LEU A 51 51.584 -11.953 45.829 1.00 43.14 C ATOM 769 O LEU A 51 51.757 -13.098 45.418 1.00 2.42 O ATOM 770 CB LEU A 51 49.400 -11.234 44.775 1.00 31.34 C ATOM 771 CG LEU A 51 47.861 -11.253 44.880 1.00 21.13 C ATOM 772 CD1 LEU A 51 47.340 -12.662 45.178 1.00 73.24 C ATOM 773 CD2 LEU A 51 47.279 -10.273 45.905 1.00 34.54 C ATOM 0 H LEU A 51 50.228 -9.387 46.298 1.00 4.32 H new ATOM 0 HA LEU A 51 49.645 -12.230 46.672 1.00 22.21 H new ATOM 0 HB2 LEU A 51 49.707 -10.274 44.359 1.00 31.34 H new ATOM 0 HB3 LEU A 51 49.708 -12.002 44.065 1.00 31.34 H new ATOM 0 HG LEU A 51 47.519 -10.922 43.900 1.00 21.13 H new ATOM 0 HD11 LEU A 51 46.252 -12.641 45.246 1.00 73.24 H new ATOM 0 HD12 LEU A 51 47.641 -13.338 44.378 1.00 73.24 H new ATOM 0 HD13 LEU A 51 47.756 -13.011 46.123 1.00 73.24 H new ATOM 0 HD21 LEU A 51 46.192 -10.355 45.911 1.00 34.54 H new ATOM 0 HD22 LEU A 51 47.666 -10.511 46.896 1.00 34.54 H new ATOM 0 HD23 LEU A 51 47.565 -9.255 45.638 1.00 34.54 H new ATOM 785 N ARG A 52 52.596 -11.108 46.072 1.00 71.01 N ATOM 786 CA ARG A 52 54.004 -11.384 45.827 1.00 63.00 C ATOM 787 C ARG A 52 54.251 -11.639 44.338 1.00 11.23 C ATOM 788 O ARG A 52 54.654 -12.729 43.939 1.00 52.53 O ATOM 789 CB ARG A 52 54.551 -12.517 46.709 1.00 63.11 C ATOM 790 CG ARG A 52 54.404 -12.258 48.214 1.00 61.31 C ATOM 791 CD ARG A 52 53.085 -12.805 48.778 1.00 61.55 C ATOM 792 NE ARG A 52 53.112 -12.916 50.243 1.00 71.20 N ATOM 793 CZ ARG A 52 52.950 -11.909 51.117 1.00 75.12 C ATOM 794 NH1 ARG A 52 52.769 -10.649 50.700 1.00 34.51 N ATOM 795 NH2 ARG A 52 52.971 -12.170 52.431 1.00 41.11 N ATOM 0 H ARG A 52 52.441 -10.178 46.460 1.00 71.01 H new ATOM 0 HA ARG A 52 54.564 -10.494 46.114 1.00 63.00 H new ATOM 0 HB2 ARG A 52 54.033 -13.443 46.457 1.00 63.11 H new ATOM 0 HB3 ARG A 52 55.605 -12.668 46.477 1.00 63.11 H new ATOM 0 HG2 ARG A 52 55.240 -12.718 48.742 1.00 61.31 H new ATOM 0 HG3 ARG A 52 54.459 -11.186 48.402 1.00 61.31 H new ATOM 0 HD2 ARG A 52 52.265 -12.151 48.480 1.00 61.55 H new ATOM 0 HD3 ARG A 52 52.885 -13.785 48.345 1.00 61.55 H new ATOM 0 HE ARG A 52 53.269 -13.845 50.633 1.00 71.20 H new ATOM 0 HH11 ARG A 52 52.752 -10.440 49.702 1.00 34.51 H new ATOM 0 HH12 ARG A 52 52.648 -9.899 51.381 1.00 34.51 H new ATOM 0 HH21 ARG A 52 53.109 -13.126 52.759 1.00 41.11 H new ATOM 0 HH22 ARG A 52 52.849 -11.413 53.103 1.00 41.11 H new ATOM 809 N VAL A 53 54.004 -10.605 43.530 1.00 12.34 N ATOM 810 CA VAL A 53 54.197 -10.593 42.085 1.00 62.21 C ATOM 811 C VAL A 53 54.734 -9.224 41.653 1.00 61.20 C ATOM 812 O VAL A 53 54.864 -8.319 42.476 1.00 21.44 O ATOM 813 CB VAL A 53 52.886 -10.940 41.353 1.00 3.14 C ATOM 814 CG1 VAL A 53 52.362 -12.332 41.726 1.00 14.25 C ATOM 815 CG2 VAL A 53 51.787 -9.904 41.612 1.00 71.14 C ATOM 0 H VAL A 53 53.649 -9.717 43.884 1.00 12.34 H new ATOM 0 HA VAL A 53 54.928 -11.355 41.814 1.00 62.21 H new ATOM 0 HB VAL A 53 53.135 -10.932 40.292 1.00 3.14 H new ATOM 0 HG11 VAL A 53 51.437 -12.530 41.184 1.00 14.25 H new ATOM 0 HG12 VAL A 53 53.105 -13.084 41.461 1.00 14.25 H new ATOM 0 HG13 VAL A 53 52.171 -12.373 42.798 1.00 14.25 H new ATOM 0 HG21 VAL A 53 50.883 -10.191 41.076 1.00 71.14 H new ATOM 0 HG22 VAL A 53 51.576 -9.857 42.680 1.00 71.14 H new ATOM 0 HG23 VAL A 53 52.120 -8.926 41.265 1.00 71.14 H new ATOM 825 N SER A 54 55.043 -9.077 40.358 1.00 0.12 N ATOM 826 CA SER A 54 55.616 -7.863 39.793 1.00 72.24 C ATOM 827 C SER A 54 54.519 -6.854 39.432 1.00 25.43 C ATOM 828 O SER A 54 54.363 -5.848 40.121 1.00 51.51 O ATOM 829 CB SER A 54 56.497 -8.226 38.590 1.00 25.35 C ATOM 830 OG SER A 54 57.498 -9.139 38.988 1.00 53.25 O ATOM 0 H SER A 54 54.897 -9.814 39.668 1.00 0.12 H new ATOM 0 HA SER A 54 56.247 -7.377 40.538 1.00 72.24 H new ATOM 0 HB2 SER A 54 55.887 -8.663 37.800 1.00 25.35 H new ATOM 0 HB3 SER A 54 56.955 -7.327 38.179 1.00 25.35 H new ATOM 0 HG SER A 54 58.057 -9.369 38.216 1.00 53.25 H new ATOM 836 N HIS A 55 53.787 -7.109 38.337 1.00 75.31 N ATOM 837 CA HIS A 55 52.790 -6.201 37.765 1.00 2.10 C ATOM 838 C HIS A 55 52.073 -6.856 36.577 1.00 53.12 C ATOM 839 O HIS A 55 50.868 -6.681 36.409 1.00 20.34 O ATOM 840 CB HIS A 55 53.420 -4.862 37.349 1.00 44.43 C ATOM 841 CG HIS A 55 54.651 -4.998 36.488 1.00 1.31 C ATOM 842 ND1 HIS A 55 55.931 -4.976 37.018 1.00 33.11 N ATOM 843 CD2 HIS A 55 54.821 -5.163 35.134 1.00 11.42 C ATOM 844 CE1 HIS A 55 56.788 -5.142 35.997 1.00 1.22 C ATOM 845 NE2 HIS A 55 56.172 -5.268 34.820 1.00 24.03 N ATOM 0 H HIS A 55 53.878 -7.979 37.812 1.00 75.31 H new ATOM 0 HA HIS A 55 52.052 -5.993 38.540 1.00 2.10 H new ATOM 0 HB2 HIS A 55 52.676 -4.276 36.810 1.00 44.43 H new ATOM 0 HB3 HIS A 55 53.679 -4.301 38.247 1.00 44.43 H new ATOM 0 HD2 HIS A 55 54.017 -5.205 34.414 1.00 11.42 H new ATOM 0 HE1 HIS A 55 57.861 -5.170 36.116 1.00 1.22 H new ATOM 0 HE2 HIS A 55 56.594 -5.409 33.902 1.00 24.03 H new ATOM 853 N GLY A 56 52.801 -7.622 35.755 1.00 24.23 N ATOM 854 CA GLY A 56 52.227 -8.360 34.636 1.00 1.44 C ATOM 855 C GLY A 56 51.125 -9.313 35.104 1.00 63.11 C ATOM 856 O GLY A 56 50.078 -9.415 34.468 1.00 3.41 O ATOM 0 H GLY A 56 53.809 -7.744 35.853 1.00 24.23 H new ATOM 0 HA2 GLY A 56 51.819 -7.660 33.907 1.00 1.44 H new ATOM 0 HA3 GLY A 56 53.010 -8.926 34.131 1.00 1.44 H new ATOM 860 N CYS A 57 51.360 -9.992 36.233 1.00 74.33 N ATOM 861 CA CYS A 57 50.393 -10.881 36.858 1.00 50.22 C ATOM 862 C CYS A 57 49.182 -10.090 37.352 1.00 11.12 C ATOM 863 O CYS A 57 48.053 -10.531 37.155 1.00 24.42 O ATOM 864 CB CYS A 57 51.045 -11.632 38.023 1.00 21.40 C ATOM 865 SG CYS A 57 52.446 -12.621 37.435 1.00 53.41 S ATOM 0 H CYS A 57 52.243 -9.933 36.740 1.00 74.33 H new ATOM 0 HA CYS A 57 50.055 -11.605 36.116 1.00 50.22 H new ATOM 0 HB2 CYS A 57 51.384 -10.922 38.777 1.00 21.40 H new ATOM 0 HB3 CYS A 57 50.311 -12.279 38.503 1.00 21.40 H new ATOM 0 HG CYS A 57 52.986 -13.248 38.438 1.00 53.41 H new ATOM 871 N VAL A 58 49.424 -8.934 37.988 1.00 12.53 N ATOM 872 CA VAL A 58 48.392 -8.079 38.561 1.00 11.44 C ATOM 873 C VAL A 58 47.318 -7.767 37.523 1.00 3.14 C ATOM 874 O VAL A 58 46.143 -8.023 37.769 1.00 1.20 O ATOM 875 CB VAL A 58 49.003 -6.793 39.143 1.00 44.42 C ATOM 876 CG1 VAL A 58 47.913 -5.848 39.659 1.00 3.33 C ATOM 877 CG2 VAL A 58 49.970 -7.130 40.281 1.00 51.51 C ATOM 0 H VAL A 58 50.366 -8.566 38.117 1.00 12.53 H new ATOM 0 HA VAL A 58 47.917 -8.616 39.383 1.00 11.44 H new ATOM 0 HB VAL A 58 49.547 -6.292 38.343 1.00 44.42 H new ATOM 0 HG11 VAL A 58 48.374 -4.948 40.065 1.00 3.33 H new ATOM 0 HG12 VAL A 58 47.248 -5.577 38.839 1.00 3.33 H new ATOM 0 HG13 VAL A 58 47.340 -6.346 40.441 1.00 3.33 H new ATOM 0 HG21 VAL A 58 50.394 -6.210 40.683 1.00 51.51 H new ATOM 0 HG22 VAL A 58 49.434 -7.657 41.070 1.00 51.51 H new ATOM 0 HG23 VAL A 58 50.772 -7.764 39.902 1.00 51.51 H new ATOM 887 N SER A 59 47.719 -7.240 36.361 1.00 34.03 N ATOM 888 CA SER A 59 46.829 -6.925 35.263 1.00 15.15 C ATOM 889 C SER A 59 45.922 -8.109 34.906 1.00 60.03 C ATOM 890 O SER A 59 44.710 -7.944 34.781 1.00 12.23 O ATOM 891 CB SER A 59 47.695 -6.505 34.075 1.00 15.22 C ATOM 892 OG SER A 59 48.569 -5.461 34.451 1.00 64.50 O ATOM 0 H SER A 59 48.695 -7.020 36.164 1.00 34.03 H new ATOM 0 HA SER A 59 46.160 -6.113 35.549 1.00 15.15 H new ATOM 0 HB2 SER A 59 48.270 -7.358 33.716 1.00 15.22 H new ATOM 0 HB3 SER A 59 47.061 -6.178 33.251 1.00 15.22 H new ATOM 0 HG SER A 59 49.119 -5.202 33.682 1.00 64.50 H new ATOM 898 N LYS A 60 46.515 -9.301 34.761 1.00 72.50 N ATOM 899 CA LYS A 60 45.823 -10.509 34.332 1.00 51.04 C ATOM 900 C LYS A 60 44.784 -10.966 35.362 1.00 62.41 C ATOM 901 O LYS A 60 43.634 -11.206 34.996 1.00 65.24 O ATOM 902 CB LYS A 60 46.844 -11.616 34.042 1.00 14.24 C ATOM 903 CG LYS A 60 47.712 -11.262 32.828 1.00 12.04 C ATOM 904 CD LYS A 60 48.859 -12.265 32.670 1.00 54.50 C ATOM 905 CE LYS A 60 49.741 -11.873 31.479 1.00 3.13 C ATOM 906 NZ LYS A 60 50.868 -12.807 31.307 1.00 22.33 N ATOM 0 H LYS A 60 47.508 -9.449 34.944 1.00 72.50 H new ATOM 0 HA LYS A 60 45.277 -10.284 33.416 1.00 51.04 H new ATOM 0 HB2 LYS A 60 47.479 -11.767 34.915 1.00 14.24 H new ATOM 0 HB3 LYS A 60 46.324 -12.556 33.859 1.00 14.24 H new ATOM 0 HG2 LYS A 60 47.100 -11.257 31.926 1.00 12.04 H new ATOM 0 HG3 LYS A 60 48.116 -10.256 32.944 1.00 12.04 H new ATOM 0 HD2 LYS A 60 49.456 -12.293 33.581 1.00 54.50 H new ATOM 0 HD3 LYS A 60 48.458 -13.268 32.521 1.00 54.50 H new ATOM 0 HE2 LYS A 60 49.140 -11.857 30.570 1.00 3.13 H new ATOM 0 HE3 LYS A 60 50.124 -10.863 31.626 1.00 3.13 H new ATOM 0 HZ1 LYS A 60 51.443 -12.511 30.493 1.00 22.33 H new ATOM 0 HZ2 LYS A 60 51.456 -12.804 32.165 1.00 22.33 H new ATOM 0 HZ3 LYS A 60 50.502 -13.766 31.142 1.00 22.33 H new ATOM 920 N ILE A 61 45.179 -11.109 36.636 1.00 44.14 N ATOM 921 CA ILE A 61 44.273 -11.578 37.680 1.00 44.23 C ATOM 922 C ILE A 61 43.179 -10.546 37.968 1.00 23.54 C ATOM 923 O ILE A 61 42.014 -10.917 38.074 1.00 64.14 O ATOM 924 CB ILE A 61 45.031 -12.027 38.946 1.00 10.22 C ATOM 925 CG1 ILE A 61 45.735 -10.861 39.661 1.00 11.03 C ATOM 926 CG2 ILE A 61 45.994 -13.170 38.590 1.00 64.04 C ATOM 927 CD1 ILE A 61 46.659 -11.303 40.797 1.00 12.22 C ATOM 0 H ILE A 61 46.123 -10.904 36.963 1.00 44.14 H new ATOM 0 HA ILE A 61 43.769 -12.470 37.308 1.00 44.23 H new ATOM 0 HB ILE A 61 44.304 -12.401 39.667 1.00 10.22 H new ATOM 0 HG12 ILE A 61 46.316 -10.297 38.931 1.00 11.03 H new ATOM 0 HG13 ILE A 61 44.981 -10.183 40.061 1.00 11.03 H new ATOM 0 HG21 ILE A 61 46.529 -13.487 39.485 1.00 64.04 H new ATOM 0 HG22 ILE A 61 45.428 -14.011 38.189 1.00 64.04 H new ATOM 0 HG23 ILE A 61 46.709 -12.824 37.843 1.00 64.04 H new ATOM 0 HD11 ILE A 61 47.120 -10.427 41.253 1.00 12.22 H new ATOM 0 HD12 ILE A 61 46.081 -11.841 41.548 1.00 12.22 H new ATOM 0 HD13 ILE A 61 47.436 -11.956 40.401 1.00 12.22 H new ATOM 939 N LEU A 62 43.554 -9.265 38.081 1.00 20.14 N ATOM 940 CA LEU A 62 42.662 -8.173 38.439 1.00 64.00 C ATOM 941 C LEU A 62 41.605 -7.972 37.352 1.00 64.23 C ATOM 942 O LEU A 62 40.414 -7.959 37.653 1.00 34.24 O ATOM 943 CB LEU A 62 43.497 -6.905 38.702 1.00 12.13 C ATOM 944 CG LEU A 62 42.779 -5.696 39.332 1.00 54.31 C ATOM 945 CD1 LEU A 62 41.846 -4.953 38.369 1.00 43.24 C ATOM 946 CD2 LEU A 62 42.041 -6.071 40.620 1.00 41.51 C ATOM 0 H LEU A 62 44.514 -8.960 37.920 1.00 20.14 H new ATOM 0 HA LEU A 62 42.121 -8.410 39.355 1.00 64.00 H new ATOM 0 HB2 LEU A 62 44.328 -7.179 39.352 1.00 12.13 H new ATOM 0 HB3 LEU A 62 43.927 -6.583 37.754 1.00 12.13 H new ATOM 0 HG LEU A 62 43.578 -4.999 39.583 1.00 54.31 H new ATOM 0 HD11 LEU A 62 41.379 -4.116 38.888 1.00 43.24 H new ATOM 0 HD12 LEU A 62 42.421 -4.579 37.521 1.00 43.24 H new ATOM 0 HD13 LEU A 62 41.074 -5.635 38.012 1.00 43.24 H new ATOM 0 HD21 LEU A 62 41.550 -5.188 41.028 1.00 41.51 H new ATOM 0 HD22 LEU A 62 41.293 -6.834 40.402 1.00 41.51 H new ATOM 0 HD23 LEU A 62 42.754 -6.459 41.348 1.00 41.51 H new ATOM 958 N GLY A 63 42.043 -7.804 36.098 1.00 42.35 N ATOM 959 CA GLY A 63 41.182 -7.407 34.998 1.00 23.44 C ATOM 960 C GLY A 63 41.484 -8.220 33.746 1.00 13.22 C ATOM 961 O GLY A 63 42.281 -7.795 32.911 1.00 42.33 O ATOM 0 H GLY A 63 43.016 -7.943 35.825 1.00 42.35 H new ATOM 0 HA2 GLY A 63 40.138 -7.543 35.281 1.00 23.44 H new ATOM 0 HA3 GLY A 63 41.319 -6.346 34.789 1.00 23.44 H new ATOM 1314 N LYS A 87 -0.837 -0.609 4.071 1.00 31.01 N ATOM 1315 CA LYS A 87 -0.925 -1.681 3.098 1.00 34.11 C ATOM 1316 C LYS A 87 -1.949 -2.734 3.528 1.00 11.23 C ATOM 1317 O LYS A 87 -2.670 -3.251 2.680 1.00 70.45 O ATOM 1318 CB LYS A 87 0.460 -2.303 2.877 1.00 14.53 C ATOM 1319 CG LYS A 87 1.544 -1.336 2.364 1.00 63.41 C ATOM 1320 CD LYS A 87 1.606 -1.170 0.836 1.00 65.31 C ATOM 1321 CE LYS A 87 0.316 -0.592 0.247 1.00 75.11 C ATOM 1322 NZ LYS A 87 0.494 -0.071 -1.119 1.00 31.12 N ATOM 0 HA LYS A 87 -1.270 -1.266 2.151 1.00 34.11 H new ATOM 0 HB2 LYS A 87 0.799 -2.736 3.818 1.00 14.53 H new ATOM 0 HB3 LYS A 87 0.362 -3.123 2.165 1.00 14.53 H new ATOM 0 HG2 LYS A 87 1.376 -0.357 2.813 1.00 63.41 H new ATOM 0 HG3 LYS A 87 2.515 -1.685 2.715 1.00 63.41 H new ATOM 0 HD2 LYS A 87 2.441 -0.517 0.580 1.00 65.31 H new ATOM 0 HD3 LYS A 87 1.807 -2.139 0.378 1.00 65.31 H new ATOM 0 HE2 LYS A 87 -0.452 -1.365 0.238 1.00 75.11 H new ATOM 0 HE3 LYS A 87 -0.045 0.209 0.892 1.00 75.11 H new ATOM 0 HZ1 LYS A 87 -0.434 0.166 -1.524 1.00 31.12 H new ATOM 0 HZ2 LYS A 87 1.088 0.782 -1.090 1.00 31.12 H new ATOM 0 HZ3 LYS A 87 0.954 -0.793 -1.709 1.00 31.12 H new ATOM 1336 N VAL A 88 -2.043 -3.014 4.836 1.00 53.33 N ATOM 1337 CA VAL A 88 -3.051 -3.897 5.412 1.00 11.22 C ATOM 1338 C VAL A 88 -4.454 -3.459 4.981 1.00 11.10 C ATOM 1339 O VAL A 88 -5.249 -4.291 4.553 1.00 4.22 O ATOM 1340 CB VAL A 88 -2.915 -3.925 6.946 1.00 71.44 C ATOM 1341 CG1 VAL A 88 -4.046 -4.723 7.610 1.00 41.15 C ATOM 1342 CG2 VAL A 88 -1.573 -4.545 7.358 1.00 40.22 C ATOM 0 H VAL A 88 -1.406 -2.623 5.530 1.00 53.33 H new ATOM 0 HA VAL A 88 -2.893 -4.910 5.041 1.00 11.22 H new ATOM 0 HB VAL A 88 -2.972 -2.890 7.283 1.00 71.44 H new ATOM 0 HG11 VAL A 88 -3.910 -4.716 8.691 1.00 41.15 H new ATOM 0 HG12 VAL A 88 -5.006 -4.269 7.362 1.00 41.15 H new ATOM 0 HG13 VAL A 88 -4.027 -5.751 7.248 1.00 41.15 H new ATOM 0 HG21 VAL A 88 -1.496 -4.556 8.445 1.00 40.22 H new ATOM 0 HG22 VAL A 88 -1.512 -5.565 6.980 1.00 40.22 H new ATOM 0 HG23 VAL A 88 -0.757 -3.955 6.942 1.00 40.22 H new ATOM 1352 N VAL A 89 -4.751 -2.156 5.079 1.00 61.14 N ATOM 1353 CA VAL A 89 -6.046 -1.604 4.705 1.00 2.03 C ATOM 1354 C VAL A 89 -6.301 -1.820 3.207 1.00 64.44 C ATOM 1355 O VAL A 89 -7.396 -2.226 2.821 1.00 3.11 O ATOM 1356 CB VAL A 89 -6.145 -0.119 5.104 1.00 23.13 C ATOM 1357 CG1 VAL A 89 -7.555 0.419 4.827 1.00 70.54 C ATOM 1358 CG2 VAL A 89 -5.841 0.077 6.595 1.00 54.13 C ATOM 0 H VAL A 89 -4.092 -1.458 5.422 1.00 61.14 H new ATOM 0 HA VAL A 89 -6.828 -2.131 5.251 1.00 2.03 H new ATOM 0 HB VAL A 89 -5.411 0.424 4.509 1.00 23.13 H new ATOM 0 HG11 VAL A 89 -7.607 1.469 5.115 1.00 70.54 H new ATOM 0 HG12 VAL A 89 -7.779 0.322 3.765 1.00 70.54 H new ATOM 0 HG13 VAL A 89 -8.282 -0.152 5.405 1.00 70.54 H new ATOM 0 HG21 VAL A 89 -5.919 1.135 6.846 1.00 54.13 H new ATOM 0 HG22 VAL A 89 -6.556 -0.491 7.190 1.00 54.13 H new ATOM 0 HG23 VAL A 89 -4.831 -0.274 6.810 1.00 54.13 H new ATOM 1368 N GLU A 90 -5.287 -1.573 2.368 1.00 20.11 N ATOM 1369 CA GLU A 90 -5.384 -1.750 0.924 1.00 15.21 C ATOM 1370 C GLU A 90 -5.698 -3.198 0.526 1.00 43.50 C ATOM 1371 O GLU A 90 -6.303 -3.408 -0.525 1.00 34.22 O ATOM 1372 CB GLU A 90 -4.108 -1.247 0.234 1.00 11.12 C ATOM 1373 CG GLU A 90 -3.949 0.271 0.396 1.00 64.40 C ATOM 1374 CD GLU A 90 -2.660 0.795 -0.234 1.00 34.00 C ATOM 1375 OE1 GLU A 90 -2.290 0.289 -1.317 1.00 21.22 O ATOM 1376 OE2 GLU A 90 -2.051 1.694 0.384 1.00 23.05 O ATOM 0 H GLU A 90 -4.373 -1.243 2.679 1.00 20.11 H new ATOM 0 HA GLU A 90 -6.226 -1.149 0.582 1.00 15.21 H new ATOM 0 HB2 GLU A 90 -3.240 -1.753 0.656 1.00 11.12 H new ATOM 0 HB3 GLU A 90 -4.141 -1.501 -0.826 1.00 11.12 H new ATOM 0 HG2 GLU A 90 -4.802 0.773 -0.060 1.00 64.40 H new ATOM 0 HG3 GLU A 90 -3.960 0.523 1.456 1.00 64.40 H new ATOM 1383 N LYS A 91 -5.328 -4.192 1.347 1.00 41.25 N ATOM 1384 CA LYS A 91 -5.639 -5.587 1.049 1.00 42.12 C ATOM 1385 C LYS A 91 -7.139 -5.863 1.022 1.00 45.11 C ATOM 1386 O LYS A 91 -7.563 -6.729 0.265 1.00 10.31 O ATOM 1387 CB LYS A 91 -4.933 -6.565 1.996 1.00 2.11 C ATOM 1388 CG LYS A 91 -3.403 -6.490 1.943 1.00 32.45 C ATOM 1389 CD LYS A 91 -2.877 -6.471 0.502 1.00 23.42 C ATOM 1390 CE LYS A 91 -1.359 -6.635 0.430 1.00 74.32 C ATOM 1391 NZ LYS A 91 -0.915 -6.659 -0.975 1.00 1.20 N ATOM 0 H LYS A 91 -4.815 -4.051 2.218 1.00 41.25 H new ATOM 0 HA LYS A 91 -5.252 -5.758 0.045 1.00 42.12 H new ATOM 0 HB2 LYS A 91 -5.261 -6.367 3.016 1.00 2.11 H new ATOM 0 HB3 LYS A 91 -5.245 -7.580 1.752 1.00 2.11 H new ATOM 0 HG2 LYS A 91 -3.066 -5.594 2.464 1.00 32.45 H new ATOM 0 HG3 LYS A 91 -2.980 -7.344 2.472 1.00 32.45 H new ATOM 0 HD2 LYS A 91 -3.353 -7.271 -0.065 1.00 23.42 H new ATOM 0 HD3 LYS A 91 -3.160 -5.531 0.028 1.00 23.42 H new ATOM 0 HE2 LYS A 91 -0.872 -5.816 0.959 1.00 74.32 H new ATOM 0 HE3 LYS A 91 -1.062 -7.558 0.929 1.00 74.32 H new ATOM 0 HZ1 LYS A 91 0.118 -6.771 -1.011 1.00 1.20 H new ATOM 0 HZ2 LYS A 91 -1.367 -7.455 -1.468 1.00 1.20 H new ATOM 0 HZ3 LYS A 91 -1.183 -5.768 -1.439 1.00 1.20 H new ATOM 1405 N ILE A 92 -7.953 -5.138 1.797 1.00 32.25 N ATOM 1406 CA ILE A 92 -9.399 -5.262 1.684 1.00 44.32 C ATOM 1407 C ILE A 92 -9.845 -4.790 0.298 1.00 14.23 C ATOM 1408 O ILE A 92 -10.683 -5.435 -0.331 1.00 44.21 O ATOM 1409 CB ILE A 92 -10.098 -4.510 2.828 1.00 52.32 C ATOM 1410 CG1 ILE A 92 -9.795 -5.208 4.170 1.00 3.11 C ATOM 1411 CG2 ILE A 92 -11.613 -4.455 2.562 1.00 3.42 C ATOM 1412 CD1 ILE A 92 -8.459 -4.781 4.790 1.00 34.12 C ATOM 0 H ILE A 92 -7.635 -4.469 2.499 1.00 32.25 H new ATOM 0 HA ILE A 92 -9.692 -6.307 1.783 1.00 44.32 H new ATOM 0 HB ILE A 92 -9.722 -3.488 2.881 1.00 52.32 H new ATOM 0 HG12 ILE A 92 -10.599 -4.992 4.873 1.00 3.11 H new ATOM 0 HG13 ILE A 92 -9.787 -6.287 4.016 1.00 3.11 H new ATOM 0 HG21 ILE A 92 -12.106 -3.921 3.375 1.00 3.42 H new ATOM 0 HG22 ILE A 92 -11.799 -3.936 1.622 1.00 3.42 H new ATOM 0 HG23 ILE A 92 -12.009 -5.469 2.501 1.00 3.42 H new ATOM 0 HD11 ILE A 92 -8.309 -5.310 5.731 1.00 34.12 H new ATOM 0 HD12 ILE A 92 -7.646 -5.022 4.105 1.00 34.12 H new ATOM 0 HD13 ILE A 92 -8.471 -3.707 4.975 1.00 34.12 H new ATOM 1424 N GLY A 93 -9.251 -3.693 -0.189 1.00 0.03 N ATOM 1425 CA GLY A 93 -9.430 -3.220 -1.551 1.00 22.23 C ATOM 1426 C GLY A 93 -9.141 -4.333 -2.558 1.00 42.33 C ATOM 1427 O GLY A 93 -9.978 -4.616 -3.412 1.00 63.04 O ATOM 0 H GLY A 93 -8.626 -3.108 0.366 1.00 0.03 H new ATOM 0 HA2 GLY A 93 -10.450 -2.860 -1.684 1.00 22.23 H new ATOM 0 HA3 GLY A 93 -8.767 -2.375 -1.737 1.00 22.23 H new ATOM 1431 N ASP A 94 -7.973 -4.977 -2.436 1.00 71.13 N ATOM 1432 CA ASP A 94 -7.565 -6.074 -3.304 1.00 13.14 C ATOM 1433 C ASP A 94 -8.542 -7.244 -3.227 1.00 65.54 C ATOM 1434 O ASP A 94 -8.893 -7.815 -4.253 1.00 24.21 O ATOM 1435 CB ASP A 94 -6.154 -6.555 -2.941 1.00 24.12 C ATOM 1436 CG ASP A 94 -5.066 -5.497 -3.118 1.00 11.34 C ATOM 1437 OD1 ASP A 94 -5.277 -4.581 -3.946 1.00 45.42 O ATOM 1438 OD2 ASP A 94 -4.028 -5.636 -2.435 1.00 44.14 O ATOM 0 H ASP A 94 -7.282 -4.744 -1.723 1.00 71.13 H new ATOM 0 HA ASP A 94 -7.564 -5.695 -4.326 1.00 13.14 H new ATOM 0 HB2 ASP A 94 -6.153 -6.891 -1.904 1.00 24.12 H new ATOM 0 HB3 ASP A 94 -5.908 -7.420 -3.557 1.00 24.12 H new ATOM 1443 N TYR A 95 -8.980 -7.617 -2.022 1.00 41.01 N ATOM 1444 CA TYR A 95 -9.883 -8.735 -1.822 1.00 41.51 C ATOM 1445 C TYR A 95 -11.279 -8.476 -2.378 1.00 32.35 C ATOM 1446 O TYR A 95 -11.933 -9.433 -2.773 1.00 31.52 O ATOM 1447 CB TYR A 95 -9.899 -9.163 -0.351 1.00 1.33 C ATOM 1448 CG TYR A 95 -8.571 -9.668 0.192 1.00 64.23 C ATOM 1449 CD1 TYR A 95 -7.698 -10.421 -0.619 1.00 3.31 C ATOM 1450 CD2 TYR A 95 -8.227 -9.428 1.536 1.00 73.50 C ATOM 1451 CE1 TYR A 95 -6.470 -10.866 -0.114 1.00 52.21 C ATOM 1452 CE2 TYR A 95 -7.029 -9.943 2.062 1.00 23.21 C ATOM 1453 CZ TYR A 95 -6.155 -10.671 1.239 1.00 24.44 C ATOM 1454 OH TYR A 95 -5.011 -11.201 1.750 1.00 12.04 O ATOM 0 H TYR A 95 -8.712 -7.145 -1.158 1.00 41.01 H new ATOM 0 HA TYR A 95 -9.498 -9.573 -2.402 1.00 41.51 H new ATOM 0 HB2 TYR A 95 -10.222 -8.315 0.254 1.00 1.33 H new ATOM 0 HB3 TYR A 95 -10.646 -9.947 -0.226 1.00 1.33 H new ATOM 0 HD1 TYR A 95 -7.978 -10.656 -1.635 1.00 3.31 H new ATOM 0 HD2 TYR A 95 -8.885 -8.847 2.165 1.00 73.50 H new ATOM 0 HE1 TYR A 95 -5.765 -11.360 -0.767 1.00 52.21 H new ATOM 0 HE2 TYR A 95 -6.781 -9.778 3.100 1.00 23.21 H new ATOM 0 HH TYR A 95 -4.681 -11.905 1.153 1.00 12.04 H new ATOM 1464 N LYS A 96 -11.719 -7.215 -2.486 1.00 63.15 N ATOM 1465 CA LYS A 96 -12.932 -6.902 -3.236 1.00 35.20 C ATOM 1466 C LYS A 96 -12.760 -7.141 -4.747 1.00 30.32 C ATOM 1467 O LYS A 96 -13.761 -7.196 -5.458 1.00 33.22 O ATOM 1468 CB LYS A 96 -13.426 -5.477 -2.931 1.00 24.41 C ATOM 1469 CG LYS A 96 -14.509 -5.465 -1.843 1.00 41.05 C ATOM 1470 CD LYS A 96 -13.933 -5.621 -0.429 1.00 4.53 C ATOM 1471 CE LYS A 96 -15.005 -5.950 0.620 1.00 35.02 C ATOM 1472 NZ LYS A 96 -16.253 -5.190 0.433 1.00 34.11 N ATOM 0 H LYS A 96 -11.257 -6.408 -2.068 1.00 63.15 H new ATOM 0 HA LYS A 96 -13.705 -7.594 -2.901 1.00 35.20 H new ATOM 0 HB2 LYS A 96 -12.585 -4.862 -2.612 1.00 24.41 H new ATOM 0 HB3 LYS A 96 -13.822 -5.028 -3.842 1.00 24.41 H new ATOM 0 HG2 LYS A 96 -15.067 -4.530 -1.902 1.00 41.05 H new ATOM 0 HG3 LYS A 96 -15.217 -6.271 -2.033 1.00 41.05 H new ATOM 0 HD2 LYS A 96 -13.182 -6.411 -0.433 1.00 4.53 H new ATOM 0 HD3 LYS A 96 -13.425 -4.699 -0.145 1.00 4.53 H new ATOM 0 HE2 LYS A 96 -15.227 -7.016 0.581 1.00 35.02 H new ATOM 0 HE3 LYS A 96 -14.607 -5.744 1.614 1.00 35.02 H new ATOM 0 HZ1 LYS A 96 -16.710 -5.041 1.355 1.00 34.11 H new ATOM 0 HZ2 LYS A 96 -16.037 -4.269 0.000 1.00 34.11 H new ATOM 0 HZ3 LYS A 96 -16.894 -5.723 -0.189 1.00 34.11 H new ATOM 1486 N ARG A 97 -11.520 -7.310 -5.236 1.00 3.42 N ATOM 1487 CA ARG A 97 -11.240 -7.737 -6.604 1.00 44.54 C ATOM 1488 C ARG A 97 -11.166 -9.266 -6.659 1.00 2.21 C ATOM 1489 O ARG A 97 -11.824 -9.884 -7.494 1.00 73.33 O ATOM 1490 CB ARG A 97 -9.928 -7.134 -7.130 1.00 75.12 C ATOM 1491 CG ARG A 97 -9.814 -5.631 -6.864 1.00 73.32 C ATOM 1492 CD ARG A 97 -8.428 -5.129 -7.281 1.00 62.03 C ATOM 1493 NE ARG A 97 -8.194 -3.753 -6.826 1.00 74.30 N ATOM 1494 CZ ARG A 97 -8.718 -2.652 -7.388 1.00 63.22 C ATOM 1495 NH1 ARG A 97 -9.530 -2.745 -8.451 1.00 34.03 N ATOM 1496 NH2 ARG A 97 -8.423 -1.447 -6.882 1.00 43.15 N ATOM 0 H ARG A 97 -10.679 -7.150 -4.681 1.00 3.42 H new ATOM 0 HA ARG A 97 -12.049 -7.380 -7.241 1.00 44.54 H new ATOM 0 HB2 ARG A 97 -9.086 -7.645 -6.663 1.00 75.12 H new ATOM 0 HB3 ARG A 97 -9.855 -7.315 -8.202 1.00 75.12 H new ATOM 0 HG2 ARG A 97 -10.585 -5.096 -7.418 1.00 73.32 H new ATOM 0 HG3 ARG A 97 -9.981 -5.427 -5.806 1.00 73.32 H new ATOM 0 HD2 ARG A 97 -7.663 -5.785 -6.867 1.00 62.03 H new ATOM 0 HD3 ARG A 97 -8.335 -5.175 -8.366 1.00 62.03 H new ATOM 0 HE ARG A 97 -7.585 -3.623 -6.018 1.00 74.30 H new ATOM 0 HH11 ARG A 97 -9.756 -3.660 -8.842 1.00 34.03 H new ATOM 0 HH12 ARG A 97 -9.922 -1.901 -8.869 1.00 34.03 H new ATOM 0 HH21 ARG A 97 -7.804 -1.370 -6.075 1.00 43.15 H new ATOM 0 HH22 ARG A 97 -8.817 -0.606 -7.304 1.00 43.15 H new ATOM 1510 N GLN A 98 -10.336 -9.863 -5.790 1.00 61.13 N ATOM 1511 CA GLN A 98 -10.045 -11.293 -5.791 1.00 54.53 C ATOM 1512 C GLN A 98 -11.319 -12.088 -5.501 1.00 2.21 C ATOM 1513 O GLN A 98 -11.746 -12.897 -6.322 1.00 4.40 O ATOM 1514 CB GLN A 98 -8.937 -11.635 -4.783 1.00 65.44 C ATOM 1515 CG GLN A 98 -7.595 -10.985 -5.152 1.00 73.52 C ATOM 1516 CD GLN A 98 -6.504 -11.282 -4.126 1.00 4.21 C ATOM 1517 OE1 GLN A 98 -6.394 -12.399 -3.628 1.00 42.13 O ATOM 1518 NE2 GLN A 98 -5.683 -10.281 -3.810 1.00 44.42 N ATOM 0 H GLN A 98 -9.843 -9.352 -5.058 1.00 61.13 H new ATOM 0 HA GLN A 98 -9.681 -11.571 -6.780 1.00 54.53 H new ATOM 0 HB2 GLN A 98 -9.238 -11.304 -3.789 1.00 65.44 H new ATOM 0 HB3 GLN A 98 -8.814 -12.717 -4.735 1.00 65.44 H new ATOM 0 HG2 GLN A 98 -7.277 -11.344 -6.131 1.00 73.52 H new ATOM 0 HG3 GLN A 98 -7.727 -9.906 -5.236 1.00 73.52 H new ATOM 0 HE21 GLN A 98 -5.804 -9.366 -4.244 1.00 44.42 H new ATOM 0 HE22 GLN A 98 -4.933 -10.430 -3.134 1.00 44.42 H new ATOM 1527 N ASN A 99 -11.939 -11.824 -4.345 1.00 22.12 N ATOM 1528 CA ASN A 99 -13.281 -12.267 -4.017 1.00 22.31 C ATOM 1529 C ASN A 99 -14.255 -11.214 -4.562 1.00 43.45 C ATOM 1530 O ASN A 99 -13.851 -10.072 -4.778 1.00 72.23 O ATOM 1531 CB ASN A 99 -13.413 -12.376 -2.490 1.00 23.43 C ATOM 1532 CG ASN A 99 -12.568 -13.479 -1.854 1.00 51.23 C ATOM 1533 OD1 ASN A 99 -11.535 -13.893 -2.380 1.00 13.32 O ATOM 1534 ND2 ASN A 99 -13.001 -13.942 -0.684 1.00 72.55 N ATOM 0 H ASN A 99 -11.502 -11.282 -3.599 1.00 22.12 H new ATOM 0 HA ASN A 99 -13.497 -13.242 -4.454 1.00 22.31 H new ATOM 0 HB2 ASN A 99 -13.133 -11.421 -2.046 1.00 23.43 H new ATOM 0 HB3 ASN A 99 -14.460 -12.549 -2.241 1.00 23.43 H new ATOM 0 HD21 ASN A 99 -12.472 -14.663 -0.194 1.00 72.55 H new ATOM 0 HD22 ASN A 99 -13.862 -13.576 -0.278 1.00 72.55 H new ATOM 1541 N PRO A 100 -15.538 -11.548 -4.776 1.00 5.15 N ATOM 1542 CA PRO A 100 -16.542 -10.562 -5.151 1.00 71.33 C ATOM 1543 C PRO A 100 -16.828 -9.591 -3.994 1.00 43.14 C ATOM 1544 O PRO A 100 -16.171 -9.637 -2.955 1.00 14.25 O ATOM 1545 CB PRO A 100 -17.765 -11.373 -5.595 1.00 52.40 C ATOM 1546 CG PRO A 100 -17.613 -12.713 -4.877 1.00 45.32 C ATOM 1547 CD PRO A 100 -16.102 -12.887 -4.726 1.00 23.05 C ATOM 0 HA PRO A 100 -16.210 -9.915 -5.963 1.00 71.33 H new ATOM 0 HB2 PRO A 100 -18.694 -10.876 -5.316 1.00 52.40 H new ATOM 0 HB3 PRO A 100 -17.785 -11.502 -6.677 1.00 52.40 H new ATOM 0 HG2 PRO A 100 -18.112 -12.705 -3.908 1.00 45.32 H new ATOM 0 HG3 PRO A 100 -18.052 -13.527 -5.455 1.00 45.32 H new ATOM 0 HD2 PRO A 100 -15.858 -13.378 -3.784 1.00 23.05 H new ATOM 0 HD3 PRO A 100 -15.699 -13.510 -5.524 1.00 23.05 H new ATOM 1555 N THR A 101 -17.797 -8.691 -4.207 1.00 41.21 N ATOM 1556 CA THR A 101 -18.162 -7.576 -3.335 1.00 33.22 C ATOM 1557 C THR A 101 -18.134 -7.942 -1.844 1.00 45.25 C ATOM 1558 O THR A 101 -17.284 -7.443 -1.110 1.00 30.14 O ATOM 1559 CB THR A 101 -19.540 -7.036 -3.757 1.00 12.54 C ATOM 1560 OG1 THR A 101 -20.484 -8.089 -3.802 1.00 65.22 O ATOM 1561 CG2 THR A 101 -19.484 -6.366 -5.135 1.00 2.34 C ATOM 0 H THR A 101 -18.379 -8.727 -5.044 1.00 41.21 H new ATOM 0 HA THR A 101 -17.410 -6.796 -3.455 1.00 33.22 H new ATOM 0 HB THR A 101 -19.839 -6.294 -3.017 1.00 12.54 H new ATOM 0 HG1 THR A 101 -21.357 -7.734 -4.070 1.00 65.22 H new ATOM 0 HG21 THR A 101 -20.475 -5.997 -5.401 1.00 2.34 H new ATOM 0 HG22 THR A 101 -18.782 -5.533 -5.106 1.00 2.34 H new ATOM 0 HG23 THR A 101 -19.156 -7.092 -5.879 1.00 2.34 H new ATOM 1569 N MET A 102 -19.053 -8.820 -1.425 1.00 11.21 N ATOM 1570 CA MET A 102 -19.141 -9.471 -0.130 1.00 4.02 C ATOM 1571 C MET A 102 -19.052 -8.554 1.099 1.00 64.42 C ATOM 1572 O MET A 102 -19.017 -7.327 1.003 1.00 41.40 O ATOM 1573 CB MET A 102 -18.135 -10.623 -0.108 1.00 22.41 C ATOM 1574 CG MET A 102 -18.524 -11.706 -1.113 1.00 13.02 C ATOM 1575 SD MET A 102 -17.697 -13.304 -0.891 1.00 13.02 S ATOM 1576 CE MET A 102 -18.459 -13.834 0.669 1.00 75.12 C ATOM 0 H MET A 102 -19.813 -9.111 -2.040 1.00 11.21 H new ATOM 0 HA MET A 102 -20.157 -9.853 -0.029 1.00 4.02 H new ATOM 0 HB2 MET A 102 -17.139 -10.246 -0.341 1.00 22.41 H new ATOM 0 HB3 MET A 102 -18.088 -11.051 0.893 1.00 22.41 H new ATOM 0 HG2 MET A 102 -19.601 -11.862 -1.055 1.00 13.02 H new ATOM 0 HG3 MET A 102 -18.309 -11.341 -2.117 1.00 13.02 H new ATOM 0 HE1 MET A 102 -18.290 -14.901 0.812 1.00 75.12 H new ATOM 0 HE2 MET A 102 -18.015 -13.282 1.497 1.00 75.12 H new ATOM 0 HE3 MET A 102 -19.531 -13.638 0.636 1.00 75.12 H new ATOM 1586 N PHE A 103 -19.085 -9.196 2.270 1.00 55.11 N ATOM 1587 CA PHE A 103 -19.211 -8.574 3.579 1.00 35.44 C ATOM 1588 C PHE A 103 -17.868 -8.567 4.308 1.00 64.13 C ATOM 1589 O PHE A 103 -17.056 -9.475 4.131 1.00 72.02 O ATOM 1590 CB PHE A 103 -20.228 -9.368 4.403 1.00 23.32 C ATOM 1591 CG PHE A 103 -21.574 -9.559 3.731 1.00 54.24 C ATOM 1592 CD1 PHE A 103 -22.519 -8.518 3.738 1.00 13.14 C ATOM 1593 CD2 PHE A 103 -21.865 -10.765 3.064 1.00 11.05 C ATOM 1594 CE1 PHE A 103 -23.755 -8.686 3.089 1.00 43.22 C ATOM 1595 CE2 PHE A 103 -23.103 -10.934 2.421 1.00 73.23 C ATOM 1596 CZ PHE A 103 -24.049 -9.895 2.434 1.00 41.03 C ATOM 0 H PHE A 103 -19.021 -10.212 2.327 1.00 55.11 H new ATOM 0 HA PHE A 103 -19.541 -7.543 3.453 1.00 35.44 H new ATOM 0 HB2 PHE A 103 -19.807 -10.348 4.629 1.00 23.32 H new ATOM 0 HB3 PHE A 103 -20.381 -8.860 5.355 1.00 23.32 H new ATOM 0 HD1 PHE A 103 -22.296 -7.589 4.242 1.00 13.14 H new ATOM 0 HD2 PHE A 103 -21.135 -11.561 3.047 1.00 11.05 H new ATOM 0 HE1 PHE A 103 -24.480 -7.885 3.094 1.00 43.22 H new ATOM 0 HE2 PHE A 103 -23.327 -11.862 1.917 1.00 73.23 H new ATOM 0 HZ PHE A 103 -25.001 -10.025 1.941 1.00 41.03 H new ATOM 1606 N ALA A 104 -17.667 -7.556 5.161 1.00 70.32 N ATOM 1607 CA ALA A 104 -16.465 -7.359 5.963 1.00 22.02 C ATOM 1608 C ALA A 104 -16.092 -8.585 6.807 1.00 52.05 C ATOM 1609 O ALA A 104 -14.908 -8.795 7.059 1.00 14.22 O ATOM 1610 CB ALA A 104 -16.657 -6.131 6.856 1.00 12.13 C ATOM 0 H ALA A 104 -18.366 -6.829 5.314 1.00 70.32 H new ATOM 0 HA ALA A 104 -15.633 -7.204 5.276 1.00 22.02 H new ATOM 0 HB1 ALA A 104 -15.762 -5.976 7.459 1.00 12.13 H new ATOM 0 HB2 ALA A 104 -16.832 -5.253 6.234 1.00 12.13 H new ATOM 0 HB3 ALA A 104 -17.514 -6.288 7.511 1.00 12.13 H new ATOM 1616 N TRP A 105 -17.072 -9.386 7.253 1.00 73.14 N ATOM 1617 CA TRP A 105 -16.795 -10.551 8.087 1.00 73.21 C ATOM 1618 C TRP A 105 -16.030 -11.625 7.310 1.00 73.41 C ATOM 1619 O TRP A 105 -15.084 -12.195 7.848 1.00 52.20 O ATOM 1620 CB TRP A 105 -18.075 -11.089 8.741 1.00 3.45 C ATOM 1621 CG TRP A 105 -19.199 -11.468 7.829 1.00 64.12 C ATOM 1622 CD1 TRP A 105 -20.292 -10.710 7.587 1.00 4.52 C ATOM 1623 CD2 TRP A 105 -19.379 -12.687 7.045 1.00 12.43 C ATOM 1624 NE1 TRP A 105 -21.120 -11.350 6.690 1.00 40.22 N ATOM 1625 CE2 TRP A 105 -20.593 -12.564 6.307 1.00 51.34 C ATOM 1626 CE3 TRP A 105 -18.645 -13.881 6.874 1.00 12.45 C ATOM 1627 CZ2 TRP A 105 -21.034 -13.555 5.419 1.00 54.52 C ATOM 1628 CZ3 TRP A 105 -19.082 -14.884 5.988 1.00 73.23 C ATOM 1629 CH2 TRP A 105 -20.272 -14.721 5.257 1.00 44.30 C ATOM 0 H TRP A 105 -18.061 -9.243 7.047 1.00 73.14 H new ATOM 0 HA TRP A 105 -16.142 -10.235 8.901 1.00 73.21 H new ATOM 0 HB2 TRP A 105 -17.810 -11.965 9.333 1.00 3.45 H new ATOM 0 HB3 TRP A 105 -18.443 -10.334 9.436 1.00 3.45 H new ATOM 0 HD1 TRP A 105 -20.488 -9.745 8.031 1.00 4.52 H new ATOM 0 HE1 TRP A 105 -22.007 -10.974 6.354 1.00 40.22 H new ATOM 0 HE3 TRP A 105 -17.732 -14.027 7.433 1.00 12.45 H new ATOM 0 HZ2 TRP A 105 -21.952 -13.422 4.865 1.00 54.52 H new ATOM 0 HZ3 TRP A 105 -18.499 -15.785 5.869 1.00 73.23 H new ATOM 0 HH2 TRP A 105 -20.598 -15.491 4.573 1.00 44.30 H new ATOM 1640 N GLU A 106 -16.390 -11.881 6.045 1.00 12.41 N ATOM 1641 CA GLU A 106 -15.638 -12.809 5.211 1.00 60.33 C ATOM 1642 C GLU A 106 -14.218 -12.280 5.015 1.00 14.44 C ATOM 1643 O GLU A 106 -13.252 -13.029 5.134 1.00 73.42 O ATOM 1644 CB GLU A 106 -16.363 -13.029 3.877 1.00 54.25 C ATOM 1645 CG GLU A 106 -15.691 -14.131 3.040 1.00 54.14 C ATOM 1646 CD GLU A 106 -14.621 -13.588 2.095 1.00 70.44 C ATOM 1647 OE1 GLU A 106 -15.007 -12.874 1.143 1.00 34.33 O ATOM 1648 OE2 GLU A 106 -13.436 -13.914 2.318 1.00 41.21 O ATOM 0 H GLU A 106 -17.195 -11.457 5.584 1.00 12.41 H new ATOM 0 HA GLU A 106 -15.569 -13.779 5.702 1.00 60.33 H new ATOM 0 HB2 GLU A 106 -17.402 -13.299 4.067 1.00 54.25 H new ATOM 0 HB3 GLU A 106 -16.374 -12.098 3.311 1.00 54.25 H new ATOM 0 HG2 GLU A 106 -15.240 -14.865 3.708 1.00 54.14 H new ATOM 0 HG3 GLU A 106 -16.451 -14.654 2.459 1.00 54.14 H new ATOM 1655 N ILE A 107 -14.092 -10.973 4.759 1.00 42.24 N ATOM 1656 CA ILE A 107 -12.798 -10.335 4.586 1.00 24.04 C ATOM 1657 C ILE A 107 -11.946 -10.424 5.860 1.00 45.13 C ATOM 1658 O ILE A 107 -10.725 -10.524 5.759 1.00 71.34 O ATOM 1659 CB ILE A 107 -12.972 -8.896 4.082 1.00 43.44 C ATOM 1660 CG1 ILE A 107 -13.829 -8.803 2.804 1.00 2.22 C ATOM 1661 CG2 ILE A 107 -11.596 -8.271 3.829 1.00 13.44 C ATOM 1662 CD1 ILE A 107 -13.394 -9.728 1.663 1.00 34.51 C ATOM 0 H ILE A 107 -14.884 -10.337 4.668 1.00 42.24 H new ATOM 0 HA ILE A 107 -12.244 -10.879 3.821 1.00 24.04 H new ATOM 0 HB ILE A 107 -13.504 -8.348 4.860 1.00 43.44 H new ATOM 0 HG12 ILE A 107 -14.864 -9.030 3.061 1.00 2.22 H new ATOM 0 HG13 ILE A 107 -13.808 -7.774 2.445 1.00 2.22 H new ATOM 0 HG21 ILE A 107 -11.721 -7.249 3.471 1.00 13.44 H new ATOM 0 HG22 ILE A 107 -11.024 -8.263 4.757 1.00 13.44 H new ATOM 0 HG23 ILE A 107 -11.063 -8.856 3.079 1.00 13.44 H new ATOM 0 HD11 ILE A 107 -14.057 -9.590 0.809 1.00 34.51 H new ATOM 0 HD12 ILE A 107 -12.372 -9.489 1.371 1.00 34.51 H new ATOM 0 HD13 ILE A 107 -13.443 -10.765 1.996 1.00 34.51 H new ATOM 1674 N ARG A 108 -12.562 -10.425 7.051 1.00 32.23 N ATOM 1675 CA ARG A 108 -11.843 -10.670 8.296 1.00 54.43 C ATOM 1676 C ARG A 108 -11.118 -12.015 8.217 1.00 62.34 C ATOM 1677 O ARG A 108 -9.913 -12.080 8.453 1.00 52.24 O ATOM 1678 CB ARG A 108 -12.793 -10.615 9.504 1.00 53.43 C ATOM 1679 CG ARG A 108 -12.036 -10.588 10.842 1.00 35.25 C ATOM 1680 CD ARG A 108 -11.961 -9.191 11.473 1.00 35.31 C ATOM 1681 NE ARG A 108 -11.407 -8.194 10.547 1.00 73.12 N ATOM 1682 CZ ARG A 108 -10.888 -7.006 10.891 1.00 54.52 C ATOM 1683 NH1 ARG A 108 -10.835 -6.613 12.171 1.00 64.14 N ATOM 1684 NH2 ARG A 108 -10.413 -6.199 9.936 1.00 14.34 N ATOM 0 H ARG A 108 -13.561 -10.257 7.172 1.00 32.23 H new ATOM 0 HA ARG A 108 -11.101 -9.884 8.435 1.00 54.43 H new ATOM 0 HB2 ARG A 108 -13.423 -9.729 9.428 1.00 53.43 H new ATOM 0 HB3 ARG A 108 -13.456 -11.480 9.482 1.00 53.43 H new ATOM 0 HG2 ARG A 108 -12.524 -11.268 11.540 1.00 35.25 H new ATOM 0 HG3 ARG A 108 -11.024 -10.963 10.686 1.00 35.25 H new ATOM 0 HD2 ARG A 108 -12.958 -8.881 11.785 1.00 35.31 H new ATOM 0 HD3 ARG A 108 -11.345 -9.232 12.371 1.00 35.31 H new ATOM 0 HE ARG A 108 -11.418 -8.426 9.554 1.00 73.12 H new ATOM 0 HH11 ARG A 108 -11.194 -7.222 12.907 1.00 64.14 H new ATOM 0 HH12 ARG A 108 -10.436 -5.705 12.410 1.00 64.14 H new ATOM 0 HH21 ARG A 108 -10.448 -6.490 8.959 1.00 14.34 H new ATOM 0 HH22 ARG A 108 -10.016 -5.293 10.185 1.00 14.34 H new ATOM 1698 N ASP A 109 -11.846 -13.075 7.845 1.00 12.33 N ATOM 1699 CA ASP A 109 -11.275 -14.401 7.668 1.00 35.21 C ATOM 1700 C ASP A 109 -10.184 -14.378 6.595 1.00 34.24 C ATOM 1701 O ASP A 109 -9.133 -14.978 6.791 1.00 43.53 O ATOM 1702 CB ASP A 109 -12.364 -15.425 7.336 1.00 23.13 C ATOM 1703 CG ASP A 109 -13.480 -15.453 8.379 1.00 54.25 C ATOM 1704 OD1 ASP A 109 -13.149 -15.684 9.562 1.00 74.13 O ATOM 1705 OD2 ASP A 109 -14.645 -15.245 7.973 1.00 45.12 O ATOM 0 H ASP A 109 -12.848 -13.030 7.660 1.00 12.33 H new ATOM 0 HA ASP A 109 -10.814 -14.705 8.608 1.00 35.21 H new ATOM 0 HB2 ASP A 109 -12.790 -15.194 6.360 1.00 23.13 H new ATOM 0 HB3 ASP A 109 -11.916 -16.416 7.262 1.00 23.13 H new ATOM 1710 N ARG A 110 -10.421 -13.671 5.483 1.00 13.42 N ATOM 1711 CA ARG A 110 -9.487 -13.545 4.369 1.00 74.50 C ATOM 1712 C ARG A 110 -8.126 -13.015 4.835 1.00 41.21 C ATOM 1713 O ARG A 110 -7.092 -13.590 4.495 1.00 44.51 O ATOM 1714 CB ARG A 110 -10.106 -12.641 3.292 1.00 30.21 C ATOM 1715 CG ARG A 110 -9.463 -12.774 1.909 1.00 64.43 C ATOM 1716 CD ARG A 110 -9.733 -14.143 1.269 1.00 33.21 C ATOM 1717 NE ARG A 110 -9.488 -14.109 -0.178 1.00 61.14 N ATOM 1718 CZ ARG A 110 -8.283 -13.996 -0.759 1.00 33.35 C ATOM 1719 NH1 ARG A 110 -7.161 -13.994 -0.026 1.00 23.05 N ATOM 1720 NH2 ARG A 110 -8.221 -13.878 -2.091 1.00 11.54 N ATOM 0 H ARG A 110 -11.291 -13.160 5.334 1.00 13.42 H new ATOM 0 HA ARG A 110 -9.306 -14.532 3.943 1.00 74.50 H new ATOM 0 HB2 ARG A 110 -11.168 -12.870 3.209 1.00 30.21 H new ATOM 0 HB3 ARG A 110 -10.028 -11.604 3.617 1.00 30.21 H new ATOM 0 HG2 ARG A 110 -9.845 -11.989 1.256 1.00 64.43 H new ATOM 0 HG3 ARG A 110 -8.387 -12.622 1.995 1.00 64.43 H new ATOM 0 HD2 ARG A 110 -9.095 -14.896 1.731 1.00 33.21 H new ATOM 0 HD3 ARG A 110 -10.765 -14.439 1.459 1.00 33.21 H new ATOM 0 HE ARG A 110 -10.300 -14.177 -0.792 1.00 61.14 H new ATOM 0 HH11 ARG A 110 -7.215 -14.079 0.989 1.00 23.05 H new ATOM 0 HH12 ARG A 110 -6.253 -13.907 -0.483 1.00 23.05 H new ATOM 0 HH21 ARG A 110 -9.079 -13.875 -2.643 1.00 11.54 H new ATOM 0 HH22 ARG A 110 -7.316 -13.791 -2.554 1.00 11.54 H new ATOM 1734 N LEU A 111 -8.132 -11.929 5.619 1.00 44.40 N ATOM 1735 CA LEU A 111 -6.936 -11.288 6.153 1.00 65.15 C ATOM 1736 C LEU A 111 -6.104 -12.268 6.980 1.00 20.15 C ATOM 1737 O LEU A 111 -4.908 -12.419 6.732 1.00 42.54 O ATOM 1738 CB LEU A 111 -7.330 -10.064 6.998 1.00 34.15 C ATOM 1739 CG LEU A 111 -7.855 -8.906 6.134 1.00 71.13 C ATOM 1740 CD1 LEU A 111 -8.766 -7.991 6.957 1.00 61.23 C ATOM 1741 CD2 LEU A 111 -6.694 -8.081 5.569 1.00 72.12 C ATOM 0 H LEU A 111 -8.994 -11.464 5.903 1.00 44.40 H new ATOM 0 HA LEU A 111 -6.321 -10.958 5.316 1.00 65.15 H new ATOM 0 HB2 LEU A 111 -8.095 -10.353 7.718 1.00 34.15 H new ATOM 0 HB3 LEU A 111 -6.466 -9.726 7.569 1.00 34.15 H new ATOM 0 HG LEU A 111 -8.423 -9.337 5.310 1.00 71.13 H new ATOM 0 HD11 LEU A 111 -9.128 -7.177 6.329 1.00 61.23 H new ATOM 0 HD12 LEU A 111 -9.614 -8.564 7.333 1.00 61.23 H new ATOM 0 HD13 LEU A 111 -8.206 -7.579 7.797 1.00 61.23 H new ATOM 0 HD21 LEU A 111 -7.088 -7.267 4.961 1.00 72.12 H new ATOM 0 HD22 LEU A 111 -6.107 -7.669 6.390 1.00 72.12 H new ATOM 0 HD23 LEU A 111 -6.060 -8.719 4.954 1.00 72.12 H new ATOM 1753 N LEU A 112 -6.727 -12.925 7.967 1.00 14.23 N ATOM 1754 CA LEU A 112 -6.022 -13.824 8.872 1.00 30.44 C ATOM 1755 C LEU A 112 -5.546 -15.079 8.134 1.00 4.23 C ATOM 1756 O LEU A 112 -4.413 -15.514 8.332 1.00 73.11 O ATOM 1757 CB LEU A 112 -6.903 -14.183 10.079 1.00 33.24 C ATOM 1758 CG LEU A 112 -7.454 -12.972 10.856 1.00 42.13 C ATOM 1759 CD1 LEU A 112 -8.097 -13.446 12.163 1.00 1.41 C ATOM 1760 CD2 LEU A 112 -6.376 -11.932 11.174 1.00 62.11 C ATOM 0 H LEU A 112 -7.726 -12.845 8.155 1.00 14.23 H new ATOM 0 HA LEU A 112 -5.139 -13.308 9.248 1.00 30.44 H new ATOM 0 HB2 LEU A 112 -7.741 -14.787 9.733 1.00 33.24 H new ATOM 0 HB3 LEU A 112 -6.324 -14.803 10.763 1.00 33.24 H new ATOM 0 HG LEU A 112 -8.193 -12.492 10.215 1.00 42.13 H new ATOM 0 HD11 LEU A 112 -8.486 -12.587 12.710 1.00 1.41 H new ATOM 0 HD12 LEU A 112 -8.913 -14.133 11.939 1.00 1.41 H new ATOM 0 HD13 LEU A 112 -7.350 -13.956 12.772 1.00 1.41 H new ATOM 0 HD21 LEU A 112 -6.822 -11.102 11.722 1.00 62.11 H new ATOM 0 HD22 LEU A 112 -5.596 -12.391 11.782 1.00 62.11 H new ATOM 0 HD23 LEU A 112 -5.942 -11.562 10.245 1.00 62.11 H new ATOM 1772 N ALA A 113 -6.404 -15.647 7.279 1.00 45.24 N ATOM 1773 CA ALA A 113 -6.124 -16.846 6.498 1.00 71.03 C ATOM 1774 C ALA A 113 -4.906 -16.656 5.594 1.00 24.41 C ATOM 1775 O ALA A 113 -4.030 -17.519 5.560 1.00 53.41 O ATOM 1776 CB ALA A 113 -7.352 -17.220 5.665 1.00 3.31 C ATOM 0 H ALA A 113 -7.337 -15.271 7.110 1.00 45.24 H new ATOM 0 HA ALA A 113 -5.896 -17.656 7.190 1.00 71.03 H new ATOM 0 HB1 ALA A 113 -7.138 -18.116 5.083 1.00 3.31 H new ATOM 0 HB2 ALA A 113 -8.197 -17.410 6.327 1.00 3.31 H new ATOM 0 HB3 ALA A 113 -7.598 -16.400 4.990 1.00 3.31 H new ATOM 1782 N GLU A 114 -4.848 -15.532 4.870 1.00 33.12 N ATOM 1783 CA GLU A 114 -3.723 -15.216 4.004 1.00 4.12 C ATOM 1784 C GLU A 114 -2.483 -14.896 4.850 1.00 75.41 C ATOM 1785 O GLU A 114 -1.370 -15.262 4.479 1.00 11.13 O ATOM 1786 CB GLU A 114 -4.114 -14.051 3.091 1.00 12.35 C ATOM 1787 CG GLU A 114 -3.115 -13.845 1.942 1.00 45.53 C ATOM 1788 CD GLU A 114 -3.732 -14.218 0.598 1.00 64.21 C ATOM 1789 OE1 GLU A 114 -4.396 -13.332 0.016 1.00 1.44 O ATOM 1790 OE2 GLU A 114 -3.553 -15.382 0.183 1.00 14.13 O ATOM 0 H GLU A 114 -5.581 -14.823 4.873 1.00 33.12 H new ATOM 0 HA GLU A 114 -3.472 -16.072 3.378 1.00 4.12 H new ATOM 0 HB2 GLU A 114 -5.106 -14.234 2.678 1.00 12.35 H new ATOM 0 HB3 GLU A 114 -4.178 -13.137 3.681 1.00 12.35 H new ATOM 0 HG2 GLU A 114 -2.792 -12.804 1.920 1.00 45.53 H new ATOM 0 HG3 GLU A 114 -2.226 -14.451 2.117 1.00 45.53 H new ATOM 1797 N GLY A 115 -2.687 -14.228 5.992 1.00 43.12 N ATOM 1798 CA GLY A 115 -1.635 -13.856 6.928 1.00 74.12 C ATOM 1799 C GLY A 115 -1.164 -12.432 6.655 1.00 35.54 C ATOM 1800 O GLY A 115 0.037 -12.176 6.586 1.00 14.00 O ATOM 0 H GLY A 115 -3.614 -13.927 6.292 1.00 43.12 H new ATOM 0 HA2 GLY A 115 -2.004 -13.935 7.951 1.00 74.12 H new ATOM 0 HA3 GLY A 115 -0.797 -14.547 6.838 1.00 74.12 H new ATOM 1804 N VAL A 116 -2.117 -11.507 6.505 1.00 72.30 N ATOM 1805 CA VAL A 116 -1.855 -10.103 6.233 1.00 25.01 C ATOM 1806 C VAL A 116 -1.452 -9.395 7.526 1.00 1.14 C ATOM 1807 O VAL A 116 -0.422 -8.722 7.572 1.00 75.40 O ATOM 1808 CB VAL A 116 -3.097 -9.460 5.593 1.00 51.51 C ATOM 1809 CG1 VAL A 116 -2.861 -7.973 5.310 1.00 24.41 C ATOM 1810 CG2 VAL A 116 -3.448 -10.170 4.281 1.00 51.55 C ATOM 0 H VAL A 116 -3.111 -11.725 6.572 1.00 72.30 H new ATOM 0 HA VAL A 116 -1.029 -10.007 5.529 1.00 25.01 H new ATOM 0 HB VAL A 116 -3.923 -9.561 6.297 1.00 51.51 H new ATOM 0 HG11 VAL A 116 -3.754 -7.542 4.858 1.00 24.41 H new ATOM 0 HG12 VAL A 116 -2.642 -7.455 6.244 1.00 24.41 H new ATOM 0 HG13 VAL A 116 -2.019 -7.862 4.627 1.00 24.41 H new ATOM 0 HG21 VAL A 116 -4.329 -9.704 3.840 1.00 51.55 H new ATOM 0 HG22 VAL A 116 -2.610 -10.090 3.589 1.00 51.55 H new ATOM 0 HG23 VAL A 116 -3.655 -11.221 4.480 1.00 51.55 H new ATOM 1820 N CYS A 117 -2.282 -9.533 8.566 1.00 44.44 N ATOM 1821 CA CYS A 117 -2.087 -8.896 9.858 1.00 21.14 C ATOM 1822 C CYS A 117 -2.836 -9.723 10.904 1.00 5.30 C ATOM 1823 O CYS A 117 -3.943 -10.183 10.637 1.00 24.42 O ATOM 1824 CB CYS A 117 -2.589 -7.449 9.782 1.00 13.13 C ATOM 1825 SG CYS A 117 -1.973 -6.481 11.181 1.00 53.03 S ATOM 0 H CYS A 117 -3.125 -10.105 8.524 1.00 44.44 H new ATOM 0 HA CYS A 117 -1.035 -8.857 10.139 1.00 21.14 H new ATOM 0 HB2 CYS A 117 -2.261 -6.994 8.847 1.00 13.13 H new ATOM 0 HB3 CYS A 117 -3.679 -7.437 9.778 1.00 13.13 H new ATOM 0 HG CYS A 117 -2.411 -5.260 11.091 1.00 53.03 H new ATOM 1831 N ASP A 118 -2.210 -9.956 12.061 1.00 14.04 N ATOM 1832 CA ASP A 118 -2.630 -10.956 13.038 1.00 64.11 C ATOM 1833 C ASP A 118 -3.968 -10.616 13.701 1.00 40.01 C ATOM 1834 O ASP A 118 -4.421 -9.474 13.645 1.00 30.10 O ATOM 1835 CB ASP A 118 -1.536 -11.154 14.097 1.00 70.14 C ATOM 1836 CG ASP A 118 -0.201 -11.559 13.475 1.00 13.35 C ATOM 1837 OD1 ASP A 118 0.389 -10.698 12.785 1.00 34.05 O ATOM 1838 OD2 ASP A 118 0.208 -12.718 13.701 1.00 60.11 O ATOM 0 H ASP A 118 -1.378 -9.441 12.348 1.00 14.04 H new ATOM 0 HA ASP A 118 -2.782 -11.889 12.495 1.00 64.11 H new ATOM 0 HB2 ASP A 118 -1.407 -10.231 14.662 1.00 70.14 H new ATOM 0 HB3 ASP A 118 -1.852 -11.919 14.806 1.00 70.14 H new ATOM 1843 N ASN A 119 -4.566 -11.639 14.329 1.00 2.21 N ATOM 1844 CA ASN A 119 -5.894 -11.673 14.937 1.00 41.53 C ATOM 1845 C ASN A 119 -6.328 -10.358 15.588 1.00 44.23 C ATOM 1846 O ASN A 119 -7.426 -9.877 15.317 1.00 44.34 O ATOM 1847 CB ASN A 119 -5.947 -12.830 15.945 1.00 4.23 C ATOM 1848 CG ASN A 119 -7.322 -12.952 16.603 1.00 74.01 C ATOM 1849 OD1 ASN A 119 -8.244 -13.512 16.016 1.00 34.32 O ATOM 1850 ND2 ASN A 119 -7.463 -12.432 17.824 1.00 22.24 N ATOM 0 H ASN A 119 -4.090 -12.535 14.430 1.00 2.21 H new ATOM 0 HA ASN A 119 -6.610 -11.829 14.130 1.00 41.53 H new ATOM 0 HB2 ASN A 119 -5.703 -13.764 15.439 1.00 4.23 H new ATOM 0 HB3 ASN A 119 -5.189 -12.677 16.713 1.00 4.23 H new ATOM 0 HD21 ASN A 119 -8.361 -12.492 18.303 1.00 22.24 H new ATOM 0 HD22 ASN A 119 -6.672 -11.975 18.278 1.00 22.24 H new ATOM 1857 N ASP A 120 -5.483 -9.802 16.462 1.00 70.51 N ATOM 1858 CA ASP A 120 -5.778 -8.599 17.230 1.00 12.25 C ATOM 1859 C ASP A 120 -5.270 -7.356 16.501 1.00 63.42 C ATOM 1860 O ASP A 120 -5.949 -6.330 16.472 1.00 54.53 O ATOM 1861 CB ASP A 120 -5.138 -8.712 18.616 1.00 71.22 C ATOM 1862 CG ASP A 120 -5.748 -9.852 19.428 1.00 53.34 C ATOM 1863 OD1 ASP A 120 -5.371 -11.012 19.151 1.00 62.23 O ATOM 1864 OD2 ASP A 120 -6.586 -9.545 20.302 1.00 73.52 O ATOM 0 H ASP A 120 -4.558 -10.187 16.656 1.00 70.51 H new ATOM 0 HA ASP A 120 -6.858 -8.502 17.342 1.00 12.25 H new ATOM 0 HB2 ASP A 120 -4.065 -8.874 18.509 1.00 71.22 H new ATOM 0 HB3 ASP A 120 -5.266 -7.773 19.154 1.00 71.22 H new ATOM 1869 N THR A 121 -4.061 -7.446 15.938 1.00 73.10 N ATOM 1870 CA THR A 121 -3.344 -6.318 15.356 1.00 52.12 C ATOM 1871 C THR A 121 -4.044 -5.747 14.116 1.00 31.02 C ATOM 1872 O THR A 121 -3.911 -4.556 13.836 1.00 54.04 O ATOM 1873 CB THR A 121 -1.889 -6.711 15.057 1.00 12.01 C ATOM 1874 OG1 THR A 121 -1.826 -7.698 14.049 1.00 5.23 O ATOM 1875 CG2 THR A 121 -1.164 -7.230 16.303 1.00 70.43 C ATOM 0 H THR A 121 -3.547 -8.325 15.875 1.00 73.10 H new ATOM 0 HA THR A 121 -3.343 -5.515 16.093 1.00 52.12 H new ATOM 0 HB THR A 121 -1.391 -5.804 14.716 1.00 12.01 H new ATOM 0 HG1 THR A 121 -1.716 -7.267 13.176 1.00 5.23 H new ATOM 0 HG21 THR A 121 -0.139 -7.496 16.044 1.00 70.43 H new ATOM 0 HG22 THR A 121 -1.155 -6.454 17.068 1.00 70.43 H new ATOM 0 HG23 THR A 121 -1.681 -8.110 16.685 1.00 70.43 H new ATOM 1883 N VAL A 122 -4.784 -6.586 13.377 1.00 4.40 N ATOM 1884 CA VAL A 122 -5.575 -6.193 12.215 1.00 42.14 C ATOM 1885 C VAL A 122 -6.539 -5.048 12.583 1.00 52.20 C ATOM 1886 O VAL A 122 -7.154 -5.099 13.648 1.00 31.31 O ATOM 1887 CB VAL A 122 -6.301 -7.444 11.680 1.00 53.54 C ATOM 1888 CG1 VAL A 122 -7.350 -7.976 12.661 1.00 33.11 C ATOM 1889 CG2 VAL A 122 -6.965 -7.215 10.320 1.00 12.11 C ATOM 0 H VAL A 122 -4.847 -7.583 13.582 1.00 4.40 H new ATOM 0 HA VAL A 122 -4.936 -5.804 11.422 1.00 42.14 H new ATOM 0 HB VAL A 122 -5.514 -8.189 11.560 1.00 53.54 H new ATOM 0 HG11 VAL A 122 -7.832 -8.857 12.236 1.00 33.11 H new ATOM 0 HG12 VAL A 122 -6.867 -8.244 13.600 1.00 33.11 H new ATOM 0 HG13 VAL A 122 -8.099 -7.206 12.845 1.00 33.11 H new ATOM 0 HG21 VAL A 122 -7.459 -8.132 9.997 1.00 12.11 H new ATOM 0 HG22 VAL A 122 -7.702 -6.416 10.405 1.00 12.11 H new ATOM 0 HG23 VAL A 122 -6.208 -6.934 9.588 1.00 12.11 H new ATOM 1899 N PRO A 123 -6.670 -3.996 11.750 1.00 4.50 N ATOM 1900 CA PRO A 123 -7.476 -2.823 12.064 1.00 40.44 C ATOM 1901 C PRO A 123 -8.971 -3.152 12.099 1.00 11.24 C ATOM 1902 O PRO A 123 -9.394 -4.210 11.640 1.00 34.12 O ATOM 1903 CB PRO A 123 -7.145 -1.790 10.980 1.00 71.23 C ATOM 1904 CG PRO A 123 -6.727 -2.653 9.792 1.00 13.01 C ATOM 1905 CD PRO A 123 -6.005 -3.815 10.471 1.00 44.12 C ATOM 0 HA PRO A 123 -7.247 -2.440 13.058 1.00 40.44 H new ATOM 0 HB2 PRO A 123 -8.007 -1.166 10.741 1.00 71.23 H new ATOM 0 HB3 PRO A 123 -6.344 -1.120 11.293 1.00 71.23 H new ATOM 0 HG2 PRO A 123 -7.586 -2.991 9.213 1.00 13.01 H new ATOM 0 HG3 PRO A 123 -6.073 -2.113 9.107 1.00 13.01 H new ATOM 0 HD2 PRO A 123 -6.065 -4.720 9.867 1.00 44.12 H new ATOM 0 HD3 PRO A 123 -4.947 -3.592 10.608 1.00 44.12 H new ATOM 1913 N SER A 124 -9.763 -2.240 12.675 1.00 31.43 N ATOM 1914 CA SER A 124 -11.175 -2.438 12.974 1.00 64.22 C ATOM 1915 C SER A 124 -12.002 -2.827 11.748 1.00 21.12 C ATOM 1916 O SER A 124 -11.761 -2.337 10.646 1.00 3.30 O ATOM 1917 CB SER A 124 -11.738 -1.148 13.579 1.00 61.52 C ATOM 1918 OG SER A 124 -11.038 -0.814 14.759 1.00 23.10 O ATOM 0 H SER A 124 -9.423 -1.319 12.952 1.00 31.43 H new ATOM 0 HA SER A 124 -11.245 -3.268 13.677 1.00 64.22 H new ATOM 0 HB2 SER A 124 -11.658 -0.335 12.858 1.00 61.52 H new ATOM 0 HB3 SER A 124 -12.798 -1.274 13.800 1.00 61.52 H new ATOM 0 HG SER A 124 -11.406 0.013 15.135 1.00 23.10 H new ATOM 1924 N VAL A 125 -13.020 -3.669 11.974 1.00 61.53 N ATOM 1925 CA VAL A 125 -14.052 -4.008 10.998 1.00 41.03 C ATOM 1926 C VAL A 125 -14.736 -2.725 10.508 1.00 41.13 C ATOM 1927 O VAL A 125 -14.947 -2.540 9.311 1.00 32.53 O ATOM 1928 CB VAL A 125 -15.065 -4.977 11.635 1.00 22.50 C ATOM 1929 CG1 VAL A 125 -16.184 -5.341 10.650 1.00 1.13 C ATOM 1930 CG2 VAL A 125 -14.371 -6.276 12.069 1.00 25.32 C ATOM 0 H VAL A 125 -13.147 -4.144 12.868 1.00 61.53 H new ATOM 0 HA VAL A 125 -13.604 -4.504 10.137 1.00 41.03 H new ATOM 0 HB VAL A 125 -15.491 -4.469 12.500 1.00 22.50 H new ATOM 0 HG11 VAL A 125 -16.883 -6.026 11.130 1.00 1.13 H new ATOM 0 HG12 VAL A 125 -16.712 -4.436 10.349 1.00 1.13 H new ATOM 0 HG13 VAL A 125 -15.753 -5.819 9.770 1.00 1.13 H new ATOM 0 HG21 VAL A 125 -15.103 -6.948 12.517 1.00 25.32 H new ATOM 0 HG22 VAL A 125 -13.922 -6.756 11.200 1.00 25.32 H new ATOM 0 HG23 VAL A 125 -13.594 -6.047 12.799 1.00 25.32 H new ATOM 1940 N SER A 126 -15.053 -1.829 11.448 1.00 60.31 N ATOM 1941 CA SER A 126 -15.624 -0.519 11.182 1.00 40.25 C ATOM 1942 C SER A 126 -14.769 0.296 10.207 1.00 4.42 C ATOM 1943 O SER A 126 -15.318 1.037 9.392 1.00 52.44 O ATOM 1944 CB SER A 126 -15.770 0.234 12.508 1.00 33.11 C ATOM 1945 OG SER A 126 -16.478 -0.557 13.439 1.00 65.21 O ATOM 0 H SER A 126 -14.912 -2.007 12.442 1.00 60.31 H new ATOM 0 HA SER A 126 -16.598 -0.658 10.713 1.00 40.25 H new ATOM 0 HB2 SER A 126 -14.786 0.483 12.904 1.00 33.11 H new ATOM 0 HB3 SER A 126 -16.295 1.175 12.345 1.00 33.11 H new ATOM 0 HG SER A 126 -16.565 -0.068 14.284 1.00 65.21 H new ATOM 1951 N SER A 127 -13.436 0.172 10.294 1.00 70.03 N ATOM 1952 CA SER A 127 -12.523 0.981 9.504 1.00 70.12 C ATOM 1953 C SER A 127 -12.550 0.517 8.055 1.00 75.44 C ATOM 1954 O SER A 127 -12.899 1.307 7.183 1.00 54.44 O ATOM 1955 CB SER A 127 -11.107 0.959 10.090 1.00 45.35 C ATOM 1956 OG SER A 127 -11.103 1.607 11.344 1.00 42.23 O ATOM 0 H SER A 127 -12.972 -0.492 10.914 1.00 70.03 H new ATOM 0 HA SER A 127 -12.853 2.020 9.535 1.00 70.12 H new ATOM 0 HB2 SER A 127 -10.764 -0.070 10.200 1.00 45.35 H new ATOM 0 HB3 SER A 127 -10.414 1.455 9.411 1.00 45.35 H new ATOM 0 HG SER A 127 -10.197 1.590 11.718 1.00 42.23 H new ATOM 1962 N ILE A 128 -12.218 -0.757 7.805 1.00 5.35 N ATOM 1963 CA ILE A 128 -12.210 -1.341 6.465 1.00 1.43 C ATOM 1964 C ILE A 128 -13.522 -1.083 5.714 1.00 62.23 C ATOM 1965 O ILE A 128 -13.499 -0.823 4.512 1.00 41.11 O ATOM 1966 CB ILE A 128 -11.857 -2.837 6.504 1.00 42.23 C ATOM 1967 CG1 ILE A 128 -12.765 -3.639 7.448 1.00 22.14 C ATOM 1968 CG2 ILE A 128 -10.372 -2.995 6.859 1.00 11.25 C ATOM 1969 CD1 ILE A 128 -12.594 -5.153 7.325 1.00 3.31 C ATOM 0 H ILE A 128 -11.946 -1.414 8.537 1.00 5.35 H new ATOM 0 HA ILE A 128 -11.424 -0.837 5.902 1.00 1.43 H new ATOM 0 HB ILE A 128 -12.034 -3.257 5.514 1.00 42.23 H new ATOM 0 HG12 ILE A 128 -12.559 -3.341 8.476 1.00 22.14 H new ATOM 0 HG13 ILE A 128 -13.804 -3.382 7.244 1.00 22.14 H new ATOM 0 HG21 ILE A 128 -10.116 -4.054 6.888 1.00 11.25 H new ATOM 0 HG22 ILE A 128 -9.763 -2.495 6.106 1.00 11.25 H new ATOM 0 HG23 ILE A 128 -10.182 -2.549 7.835 1.00 11.25 H new ATOM 0 HD11 ILE A 128 -13.267 -5.653 8.022 1.00 3.31 H new ATOM 0 HD12 ILE A 128 -12.829 -5.464 6.307 1.00 3.31 H new ATOM 0 HD13 ILE A 128 -11.564 -5.423 7.559 1.00 3.31 H new ATOM 1981 N ASN A 129 -14.654 -1.124 6.426 1.00 61.14 N ATOM 1982 CA ASN A 129 -15.962 -0.845 5.860 1.00 51.15 C ATOM 1983 C ASN A 129 -16.045 0.596 5.343 1.00 71.13 C ATOM 1984 O ASN A 129 -16.370 0.808 4.176 1.00 71.31 O ATOM 1985 CB ASN A 129 -17.045 -1.146 6.904 1.00 65.24 C ATOM 1986 CG ASN A 129 -18.442 -0.884 6.347 1.00 0.21 C ATOM 1987 OD1 ASN A 129 -18.983 -1.709 5.615 1.00 71.51 O ATOM 1988 ND2 ASN A 129 -19.029 0.265 6.689 1.00 64.22 N ATOM 0 H ASN A 129 -14.679 -1.355 7.419 1.00 61.14 H new ATOM 0 HA ASN A 129 -16.127 -1.493 4.999 1.00 51.15 H new ATOM 0 HB2 ASN A 129 -16.967 -2.186 7.222 1.00 65.24 H new ATOM 0 HB3 ASN A 129 -16.882 -0.529 7.788 1.00 65.24 H new ATOM 0 HD21 ASN A 129 -19.962 0.485 6.340 1.00 64.22 H new ATOM 0 HD22 ASN A 129 -18.545 0.923 7.300 1.00 64.22 H new ATOM 1995 N ARG A 130 -15.771 1.586 6.204 1.00 41.21 N ATOM 1996 CA ARG A 130 -16.000 2.991 5.870 1.00 3.51 C ATOM 1997 C ARG A 130 -14.995 3.593 4.881 1.00 54.03 C ATOM 1998 O ARG A 130 -15.298 4.649 4.332 1.00 71.23 O ATOM 1999 CB ARG A 130 -16.185 3.856 7.128 1.00 23.23 C ATOM 2000 CG ARG A 130 -14.975 3.941 8.067 1.00 14.11 C ATOM 2001 CD ARG A 130 -14.025 5.105 7.755 1.00 25.01 C ATOM 2002 NE ARG A 130 -12.750 4.955 8.472 1.00 31.22 N ATOM 2003 CZ ARG A 130 -12.567 5.092 9.797 1.00 54.01 C ATOM 2004 NH1 ARG A 130 -13.570 5.480 10.599 1.00 34.11 N ATOM 2005 NH2 ARG A 130 -11.364 4.833 10.326 1.00 11.24 N ATOM 0 H ARG A 130 -15.390 1.435 7.138 1.00 41.21 H new ATOM 0 HA ARG A 130 -16.943 2.999 5.323 1.00 3.51 H new ATOM 0 HB2 ARG A 130 -16.449 4.866 6.815 1.00 23.23 H new ATOM 0 HB3 ARG A 130 -17.032 3.465 7.693 1.00 23.23 H new ATOM 0 HG2 ARG A 130 -15.330 4.040 9.093 1.00 14.11 H new ATOM 0 HG3 ARG A 130 -14.418 3.006 8.011 1.00 14.11 H new ATOM 0 HD2 ARG A 130 -13.839 5.149 6.682 1.00 25.01 H new ATOM 0 HD3 ARG A 130 -14.495 6.047 8.036 1.00 25.01 H new ATOM 0 HE ARG A 130 -11.928 4.726 7.913 1.00 31.22 H new ATOM 0 HH11 ARG A 130 -14.490 5.677 10.206 1.00 34.11 H new ATOM 0 HH12 ARG A 130 -13.412 5.578 11.602 1.00 34.11 H new ATOM 0 HH21 ARG A 130 -10.596 4.535 9.725 1.00 11.24 H new ATOM 0 HH22 ARG A 130 -11.216 4.934 11.330 1.00 11.24 H new ATOM 2019 N ILE A 131 -13.831 2.965 4.629 1.00 41.25 N ATOM 2020 CA ILE A 131 -12.844 3.501 3.678 1.00 32.51 C ATOM 2021 C ILE A 131 -13.494 3.786 2.319 1.00 41.14 C ATOM 2022 O ILE A 131 -13.184 4.794 1.685 1.00 14.35 O ATOM 2023 CB ILE A 131 -11.634 2.563 3.471 1.00 31.12 C ATOM 2024 CG1 ILE A 131 -11.050 1.947 4.749 1.00 44.10 C ATOM 2025 CG2 ILE A 131 -10.515 3.291 2.710 1.00 52.33 C ATOM 2026 CD1 ILE A 131 -10.721 2.943 5.868 1.00 2.53 C ATOM 0 H ILE A 131 -13.553 2.088 5.070 1.00 41.25 H new ATOM 0 HA ILE A 131 -12.477 4.427 4.119 1.00 32.51 H new ATOM 0 HB ILE A 131 -12.033 1.730 2.893 1.00 31.12 H new ATOM 0 HG12 ILE A 131 -11.758 1.214 5.135 1.00 44.10 H new ATOM 0 HG13 ILE A 131 -10.141 1.406 4.488 1.00 44.10 H new ATOM 0 HG21 ILE A 131 -9.670 2.616 2.572 1.00 52.33 H new ATOM 0 HG22 ILE A 131 -10.886 3.611 1.736 1.00 52.33 H new ATOM 0 HG23 ILE A 131 -10.194 4.163 3.281 1.00 52.33 H new ATOM 0 HD11 ILE A 131 -10.315 2.406 6.725 1.00 2.53 H new ATOM 0 HD12 ILE A 131 -9.986 3.663 5.509 1.00 2.53 H new ATOM 0 HD13 ILE A 131 -11.628 3.468 6.166 1.00 2.53 H new ATOM 2038 N ILE A 132 -14.399 2.894 1.891 1.00 30.01 N ATOM 2039 CA ILE A 132 -15.135 2.957 0.635 1.00 30.23 C ATOM 2040 C ILE A 132 -15.731 4.346 0.367 1.00 31.11 C ATOM 2041 O ILE A 132 -15.792 4.754 -0.792 1.00 31.35 O ATOM 2042 CB ILE A 132 -16.210 1.849 0.604 1.00 51.14 C ATOM 2043 CG1 ILE A 132 -15.638 0.432 0.823 1.00 3.14 C ATOM 2044 CG2 ILE A 132 -17.016 1.892 -0.703 1.00 34.34 C ATOM 2045 CD1 ILE A 132 -14.562 0.014 -0.185 1.00 2.53 C ATOM 0 H ILE A 132 -14.644 2.072 2.443 1.00 30.01 H new ATOM 0 HA ILE A 132 -14.430 2.782 -0.177 1.00 30.23 H new ATOM 0 HB ILE A 132 -16.871 2.059 1.445 1.00 51.14 H new ATOM 0 HG12 ILE A 132 -15.218 0.376 1.827 1.00 3.14 H new ATOM 0 HG13 ILE A 132 -16.457 -0.286 0.779 1.00 3.14 H new ATOM 0 HG21 ILE A 132 -17.765 1.100 -0.695 1.00 34.34 H new ATOM 0 HG22 ILE A 132 -17.511 2.859 -0.793 1.00 34.34 H new ATOM 0 HG23 ILE A 132 -16.345 1.748 -1.549 1.00 34.34 H new ATOM 0 HD11 ILE A 132 -14.219 -0.994 0.046 1.00 2.53 H new ATOM 0 HD12 ILE A 132 -14.979 0.033 -1.192 1.00 2.53 H new ATOM 0 HD13 ILE A 132 -13.721 0.705 -0.128 1.00 2.53 H new ATOM 2057 N ARG A 133 -16.139 5.084 1.413 1.00 64.34 N ATOM 2058 CA ARG A 133 -16.686 6.425 1.281 1.00 13.05 C ATOM 2059 C ARG A 133 -15.799 7.328 0.415 1.00 65.23 C ATOM 2060 O ARG A 133 -16.309 8.069 -0.422 1.00 44.21 O ATOM 2061 CB ARG A 133 -16.964 7.041 2.665 1.00 24.33 C ATOM 2062 CG ARG A 133 -15.734 7.666 3.343 1.00 21.43 C ATOM 2063 CD ARG A 133 -16.111 8.239 4.711 1.00 42.24 C ATOM 2064 NE ARG A 133 -14.969 8.904 5.353 1.00 30.02 N ATOM 2065 CZ ARG A 133 -14.484 10.119 5.037 1.00 21.34 C ATOM 2066 NH1 ARG A 133 -15.008 10.844 4.038 1.00 73.12 N ATOM 2067 NH2 ARG A 133 -13.454 10.616 5.733 1.00 55.42 N ATOM 0 H ARG A 133 -16.094 4.755 2.377 1.00 64.34 H new ATOM 0 HA ARG A 133 -17.639 6.343 0.758 1.00 13.05 H new ATOM 0 HB2 ARG A 133 -17.733 7.806 2.560 1.00 24.33 H new ATOM 0 HB3 ARG A 133 -17.370 6.268 3.318 1.00 24.33 H new ATOM 0 HG2 ARG A 133 -14.954 6.914 3.459 1.00 21.43 H new ATOM 0 HG3 ARG A 133 -15.325 8.455 2.712 1.00 21.43 H new ATOM 0 HD2 ARG A 133 -16.929 8.950 4.595 1.00 42.24 H new ATOM 0 HD3 ARG A 133 -16.474 7.437 5.354 1.00 42.24 H new ATOM 0 HE ARG A 133 -14.502 8.399 6.106 1.00 30.02 H new ATOM 0 HH11 ARG A 133 -15.792 10.477 3.498 1.00 73.12 H new ATOM 0 HH12 ARG A 133 -14.623 11.762 3.818 1.00 73.12 H new ATOM 0 HH21 ARG A 133 -13.045 10.075 6.494 1.00 55.42 H new ATOM 0 HH22 ARG A 133 -13.079 11.536 5.502 1.00 55.42 H new ATOM 2081 N THR A 134 -14.474 7.255 0.601 1.00 61.11 N ATOM 2082 CA THR A 134 -13.532 8.110 -0.115 1.00 14.21 C ATOM 2083 C THR A 134 -13.570 7.865 -1.627 1.00 15.45 C ATOM 2084 O THR A 134 -13.281 8.779 -2.396 1.00 42.05 O ATOM 2085 CB THR A 134 -12.106 7.959 0.440 1.00 50.22 C ATOM 2086 OG1 THR A 134 -11.608 6.652 0.237 1.00 1.14 O ATOM 2087 CG2 THR A 134 -12.037 8.305 1.932 1.00 22.24 C ATOM 0 H THR A 134 -14.032 6.604 1.250 1.00 61.11 H new ATOM 0 HA THR A 134 -13.846 9.141 0.050 1.00 14.21 H new ATOM 0 HB THR A 134 -11.484 8.665 -0.110 1.00 50.22 H new ATOM 0 HG1 THR A 134 -12.154 6.012 0.740 1.00 1.14 H new ATOM 0 HG21 THR A 134 -11.013 8.186 2.286 1.00 22.24 H new ATOM 0 HG22 THR A 134 -12.355 9.337 2.081 1.00 22.24 H new ATOM 0 HG23 THR A 134 -12.694 7.639 2.491 1.00 22.24 H new