USER MOD reduce.3.24.130724 H: found=0, std=0, add=798, rem=0, adj=19 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 23:sc= 0.344 USER MOD Set 1.2: A 121 THR OG1 : rot 98:sc= 0.531 USER MOD Set 2.1: A 99 ASN : amide:sc= 0.543 K(o=0.58,f=-2.6!) USER MOD Set 2.2: A 101 THR OG1 : rot -116:sc= 0.0348 USER MOD Set 3.1: A 8 SER OG : rot -95:sc= 0.147 USER MOD Set 3.2: A 10 HIS : no HD1:sc= 0.142 K(o=0.29,f=-0.99) USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 4 ASN : amide:sc=-0.00669 X(o=-0.0067,f=0) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 14 ASN : amide:sc= 0.0711 K(o=0.071,f=-0.79) USER MOD Single : A 15 GLN : amide:sc= -0.0727 X(o=-0.073,f=-0.068) USER MOD Single : A 32 GLN : amide:sc= -0.122 K(o=-0.12,f=-2.8!) USER MOD Single : A 39 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 40 GLN : amide:sc= 0.305 X(o=0.31,f=-0.0039) USER MOD Single : A 45 CYS SG : rot 180:sc= 0.00492 USER MOD Single : A 48 SER OG : rot 180:sc= 0.0133 USER MOD Single : A 50 GLN : amide:sc= -0.475 X(o=-0.47,f=-0.047) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 HIS : no HD1:sc= -0.0191 X(o=-0.019,f=-0.27) USER MOD Single : A 57 CYS SG : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 159:sc= 1.29 (180deg=0.848) USER MOD Single : A 91 LYS NZ :NH3+ 148:sc= 0.268 (180deg=-0.668) USER MOD Single : A 95 TYR OH : rot 160:sc= 1.12 USER MOD Single : A 96 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00579) USER MOD Single : A 98 GLN : amide:sc=-0.00918 K(o=-0.0092,f=-0.89) USER MOD Single : A 102 MET CE :methyl -146:sc= 0 (180deg=-0.0106) USER MOD Single : A 119 ASN : amide:sc= -0.0578 X(o=-0.058,f=-0.22) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc= -0.0568 USER MOD Single : A 129 ASN : amide:sc= -0.109 X(o=-0.11,f=0) USER MOD Single : A 134 THR OG1 : rot 4:sc= 0.789 USER MOD ----------------------------------------------------------------- ATOM 34 N HIS A 3 67.569 -28.676 -24.300 1.00 71.04 N ATOM 35 CA HIS A 3 67.150 -29.260 -23.033 1.00 53.42 C ATOM 36 C HIS A 3 65.904 -30.117 -23.260 1.00 22.41 C ATOM 37 O HIS A 3 65.237 -29.985 -24.287 1.00 23.23 O ATOM 38 CB HIS A 3 66.870 -28.147 -22.013 1.00 40.50 C ATOM 39 CG HIS A 3 68.042 -27.228 -21.767 1.00 2.11 C ATOM 40 ND1 HIS A 3 69.310 -27.701 -21.467 1.00 50.53 N ATOM 41 CD2 HIS A 3 68.161 -25.860 -21.783 1.00 1.24 C ATOM 42 CE1 HIS A 3 70.113 -26.634 -21.331 1.00 21.54 C ATOM 43 NE2 HIS A 3 69.472 -25.477 -21.512 1.00 3.40 N ATOM 0 HA HIS A 3 67.944 -29.893 -22.637 1.00 53.42 H new ATOM 0 HB2 HIS A 3 66.024 -27.554 -22.361 1.00 40.50 H new ATOM 0 HB3 HIS A 3 66.574 -28.601 -21.068 1.00 40.50 H new ATOM 0 HD2 HIS A 3 67.349 -25.175 -21.979 1.00 1.24 H new ATOM 0 HE1 HIS A 3 71.166 -26.704 -21.100 1.00 21.54 H new ATOM 0 HE2 HIS A 3 69.854 -24.532 -21.463 1.00 3.40 H new ATOM 51 N ASN A 4 65.597 -30.999 -22.300 1.00 14.32 N ATOM 52 CA ASN A 4 64.442 -31.886 -22.368 1.00 42.25 C ATOM 53 C ASN A 4 63.149 -31.073 -22.374 1.00 53.31 C ATOM 54 O ASN A 4 62.346 -31.207 -23.295 1.00 71.02 O ATOM 55 CB ASN A 4 64.446 -32.871 -21.190 1.00 22.12 C ATOM 56 CG ASN A 4 65.448 -34.009 -21.378 1.00 22.11 C ATOM 57 OD1 ASN A 4 65.056 -35.129 -21.700 1.00 32.44 O ATOM 58 ND2 ASN A 4 66.736 -33.738 -21.164 1.00 73.15 N ATOM 0 H ASN A 4 66.151 -31.113 -21.451 1.00 14.32 H new ATOM 0 HA ASN A 4 64.501 -32.457 -23.294 1.00 42.25 H new ATOM 0 HB2 ASN A 4 64.682 -32.333 -20.272 1.00 22.12 H new ATOM 0 HB3 ASN A 4 63.447 -33.289 -21.067 1.00 22.12 H new ATOM 0 HD21 ASN A 4 67.436 -34.473 -21.266 1.00 73.15 H new ATOM 0 HD22 ASN A 4 67.022 -32.796 -20.898 1.00 73.15 H new ATOM 65 N SER A 5 62.954 -30.249 -21.335 1.00 10.11 N ATOM 66 CA SER A 5 61.779 -29.402 -21.150 1.00 72.53 C ATOM 67 C SER A 5 60.503 -30.236 -20.971 1.00 14.54 C ATOM 68 O SER A 5 60.559 -31.465 -20.959 1.00 13.15 O ATOM 69 CB SER A 5 61.666 -28.386 -22.297 1.00 53.31 C ATOM 70 OG SER A 5 62.898 -27.716 -22.473 1.00 61.31 O ATOM 0 H SER A 5 63.633 -30.154 -20.580 1.00 10.11 H new ATOM 0 HA SER A 5 61.901 -28.837 -20.226 1.00 72.53 H new ATOM 0 HB2 SER A 5 61.385 -28.896 -23.219 1.00 53.31 H new ATOM 0 HB3 SER A 5 60.878 -27.665 -22.079 1.00 53.31 H new ATOM 0 HG SER A 5 62.818 -27.072 -23.207 1.00 61.31 H new ATOM 76 N ILE A 6 59.358 -29.556 -20.816 1.00 13.31 N ATOM 77 CA ILE A 6 58.021 -30.133 -20.670 1.00 72.25 C ATOM 78 C ILE A 6 57.986 -31.334 -19.711 1.00 60.52 C ATOM 79 O ILE A 6 57.447 -32.390 -20.034 1.00 51.42 O ATOM 80 CB ILE A 6 57.373 -30.402 -22.046 1.00 43.15 C ATOM 81 CG1 ILE A 6 58.194 -31.359 -22.936 1.00 64.23 C ATOM 82 CG2 ILE A 6 57.140 -29.065 -22.768 1.00 43.20 C ATOM 83 CD1 ILE A 6 57.398 -31.867 -24.142 1.00 64.12 C ATOM 0 H ILE A 6 59.343 -28.536 -20.788 1.00 13.31 H new ATOM 0 HA ILE A 6 57.394 -29.387 -20.182 1.00 72.25 H new ATOM 0 HB ILE A 6 56.424 -30.905 -21.862 1.00 43.15 H new ATOM 0 HG12 ILE A 6 59.090 -30.846 -23.286 1.00 64.23 H new ATOM 0 HG13 ILE A 6 58.526 -32.209 -22.340 1.00 64.23 H new ATOM 0 HG21 ILE A 6 56.683 -29.251 -23.740 1.00 43.20 H new ATOM 0 HG22 ILE A 6 56.478 -28.439 -22.170 1.00 43.20 H new ATOM 0 HG23 ILE A 6 58.094 -28.556 -22.907 1.00 43.20 H new ATOM 0 HD11 ILE A 6 58.022 -32.536 -24.734 1.00 64.12 H new ATOM 0 HD12 ILE A 6 56.516 -32.406 -23.795 1.00 64.12 H new ATOM 0 HD13 ILE A 6 57.088 -31.021 -24.756 1.00 64.12 H new ATOM 95 N ARG A 7 58.558 -31.151 -18.514 1.00 64.11 N ATOM 96 CA ARG A 7 58.619 -32.173 -17.478 1.00 74.33 C ATOM 97 C ARG A 7 57.324 -32.176 -16.660 1.00 41.22 C ATOM 98 O ARG A 7 56.526 -31.243 -16.745 1.00 24.21 O ATOM 99 CB ARG A 7 59.836 -31.924 -16.573 1.00 73.13 C ATOM 100 CG ARG A 7 61.157 -31.733 -17.338 1.00 32.11 C ATOM 101 CD ARG A 7 61.520 -32.905 -18.258 1.00 21.32 C ATOM 102 NE ARG A 7 61.748 -34.147 -17.508 1.00 1.20 N ATOM 103 CZ ARG A 7 62.139 -35.305 -18.064 1.00 34.12 C ATOM 104 NH1 ARG A 7 62.312 -35.403 -19.390 1.00 52.10 N ATOM 105 NH2 ARG A 7 62.362 -36.372 -17.285 1.00 43.32 N ATOM 0 H ARG A 7 58.997 -30.272 -18.240 1.00 64.11 H new ATOM 0 HA ARG A 7 58.727 -33.152 -17.945 1.00 74.33 H new ATOM 0 HB2 ARG A 7 59.649 -31.039 -15.965 1.00 73.13 H new ATOM 0 HB3 ARG A 7 59.944 -32.764 -15.887 1.00 73.13 H new ATOM 0 HG2 ARG A 7 61.091 -30.823 -17.935 1.00 32.11 H new ATOM 0 HG3 ARG A 7 61.963 -31.585 -16.619 1.00 32.11 H new ATOM 0 HD2 ARG A 7 60.718 -33.060 -18.980 1.00 21.32 H new ATOM 0 HD3 ARG A 7 62.416 -32.655 -18.826 1.00 21.32 H new ATOM 0 HE ARG A 7 61.600 -34.129 -16.499 1.00 1.20 H new ATOM 0 HH11 ARG A 7 62.146 -34.593 -19.987 1.00 52.10 H new ATOM 0 HH12 ARG A 7 62.609 -36.288 -19.802 1.00 52.10 H new ATOM 0 HH21 ARG A 7 62.235 -36.302 -16.275 1.00 43.32 H new ATOM 0 HH22 ARG A 7 62.659 -37.254 -17.702 1.00 43.32 H new ATOM 119 N SER A 8 57.122 -33.230 -15.861 1.00 3.22 N ATOM 120 CA SER A 8 55.976 -33.369 -14.972 1.00 61.12 C ATOM 121 C SER A 8 56.321 -34.338 -13.838 1.00 2.31 C ATOM 122 O SER A 8 57.326 -35.045 -13.903 1.00 31.13 O ATOM 123 CB SER A 8 54.749 -33.839 -15.767 1.00 40.53 C ATOM 124 OG SER A 8 53.591 -33.806 -14.958 1.00 1.45 O ATOM 0 H SER A 8 57.765 -34.021 -15.818 1.00 3.22 H new ATOM 0 HA SER A 8 55.732 -32.403 -14.529 1.00 61.12 H new ATOM 0 HB2 SER A 8 54.608 -33.201 -16.640 1.00 40.53 H new ATOM 0 HB3 SER A 8 54.913 -34.852 -16.135 1.00 40.53 H new ATOM 0 HG SER A 8 53.442 -34.691 -14.565 1.00 1.45 H new ATOM 130 N GLY A 9 55.486 -34.350 -12.794 1.00 62.50 N ATOM 131 CA GLY A 9 55.681 -35.160 -11.605 1.00 14.50 C ATOM 132 C GLY A 9 54.517 -34.921 -10.650 1.00 22.13 C ATOM 133 O GLY A 9 54.498 -33.916 -9.942 1.00 3.35 O ATOM 0 H GLY A 9 54.640 -33.782 -12.759 1.00 62.50 H new ATOM 0 HA2 GLY A 9 55.739 -36.215 -11.873 1.00 14.50 H new ATOM 0 HA3 GLY A 9 56.624 -34.901 -11.123 1.00 14.50 H new ATOM 137 N HIS A 10 53.538 -35.831 -10.656 1.00 71.52 N ATOM 138 CA HIS A 10 52.305 -35.720 -9.888 1.00 25.54 C ATOM 139 C HIS A 10 51.742 -37.119 -9.624 1.00 10.01 C ATOM 140 O HIS A 10 52.207 -38.096 -10.211 1.00 4.50 O ATOM 141 CB HIS A 10 51.302 -34.852 -10.661 1.00 24.43 C ATOM 142 CG HIS A 10 50.915 -35.438 -11.996 1.00 15.20 C ATOM 143 ND1 HIS A 10 51.646 -35.215 -13.154 1.00 20.33 N ATOM 144 CD2 HIS A 10 49.895 -36.280 -12.369 1.00 24.50 C ATOM 145 CE1 HIS A 10 51.055 -35.914 -14.139 1.00 62.42 C ATOM 146 NE2 HIS A 10 49.979 -36.585 -13.723 1.00 63.12 N ATOM 0 H HIS A 10 53.587 -36.685 -11.211 1.00 71.52 H new ATOM 0 HA HIS A 10 52.501 -35.244 -8.927 1.00 25.54 H new ATOM 0 HB2 HIS A 10 50.405 -34.718 -10.056 1.00 24.43 H new ATOM 0 HB3 HIS A 10 51.732 -33.862 -10.817 1.00 24.43 H new ATOM 0 HD2 HIS A 10 49.132 -36.654 -11.702 1.00 24.50 H new ATOM 0 HE1 HIS A 10 51.413 -35.931 -15.158 1.00 62.42 H new ATOM 0 HE2 HIS A 10 49.361 -37.183 -14.271 1.00 63.12 H new ATOM 154 N GLY A 11 50.734 -37.216 -8.751 1.00 21.11 N ATOM 155 CA GLY A 11 50.093 -38.481 -8.428 1.00 25.44 C ATOM 156 C GLY A 11 48.882 -38.272 -7.522 1.00 64.23 C ATOM 157 O GLY A 11 48.780 -37.256 -6.835 1.00 20.43 O ATOM 0 H GLY A 11 50.344 -36.416 -8.252 1.00 21.11 H new ATOM 0 HA2 GLY A 11 49.782 -38.979 -9.346 1.00 25.44 H new ATOM 0 HA3 GLY A 11 50.809 -39.139 -7.936 1.00 25.44 H new ATOM 161 N GLY A 12 47.968 -39.249 -7.529 1.00 22.24 N ATOM 162 CA GLY A 12 46.757 -39.250 -6.724 1.00 12.34 C ATOM 163 C GLY A 12 47.013 -39.973 -5.404 1.00 63.31 C ATOM 164 O GLY A 12 46.884 -41.193 -5.336 1.00 64.21 O ATOM 0 H GLY A 12 48.060 -40.080 -8.113 1.00 22.24 H new ATOM 0 HA2 GLY A 12 46.436 -38.226 -6.532 1.00 12.34 H new ATOM 0 HA3 GLY A 12 45.949 -39.740 -7.267 1.00 12.34 H new ATOM 168 N LEU A 13 47.369 -39.217 -4.359 1.00 1.25 N ATOM 169 CA LEU A 13 47.601 -39.754 -3.024 1.00 63.50 C ATOM 170 C LEU A 13 46.288 -40.294 -2.442 1.00 34.42 C ATOM 171 O LEU A 13 45.206 -39.831 -2.801 1.00 31.34 O ATOM 172 CB LEU A 13 48.192 -38.672 -2.106 1.00 72.43 C ATOM 173 CG LEU A 13 49.698 -38.428 -2.309 1.00 5.21 C ATOM 174 CD1 LEU A 13 50.043 -37.871 -3.696 1.00 20.33 C ATOM 175 CD2 LEU A 13 50.188 -37.446 -1.238 1.00 1.30 C ATOM 0 H LEU A 13 47.504 -38.208 -4.422 1.00 1.25 H new ATOM 0 HA LEU A 13 48.317 -40.573 -3.093 1.00 63.50 H new ATOM 0 HB2 LEU A 13 47.658 -37.737 -2.274 1.00 72.43 H new ATOM 0 HB3 LEU A 13 48.018 -38.957 -1.068 1.00 72.43 H new ATOM 0 HG LEU A 13 50.195 -39.395 -2.224 1.00 5.21 H new ATOM 0 HD11 LEU A 13 51.120 -37.723 -3.771 1.00 20.33 H new ATOM 0 HD12 LEU A 13 49.720 -38.576 -4.462 1.00 20.33 H new ATOM 0 HD13 LEU A 13 49.535 -36.918 -3.842 1.00 20.33 H new ATOM 0 HD21 LEU A 13 51.255 -37.265 -1.371 1.00 1.30 H new ATOM 0 HD22 LEU A 13 49.646 -36.505 -1.332 1.00 1.30 H new ATOM 0 HD23 LEU A 13 50.013 -37.869 -0.249 1.00 1.30 H new ATOM 187 N ASN A 14 46.390 -41.288 -1.552 1.00 63.14 N ATOM 188 CA ASN A 14 45.233 -41.952 -0.966 1.00 63.44 C ATOM 189 C ASN A 14 44.485 -41.012 -0.017 1.00 33.41 C ATOM 190 O ASN A 14 45.103 -40.232 0.705 1.00 11.22 O ATOM 191 CB ASN A 14 45.678 -43.226 -0.238 1.00 43.54 C ATOM 192 CG ASN A 14 44.482 -44.015 0.289 1.00 55.54 C ATOM 193 OD1 ASN A 14 44.237 -44.053 1.492 1.00 32.44 O ATOM 194 ND2 ASN A 14 43.723 -44.641 -0.613 1.00 31.44 N ATOM 0 H ASN A 14 47.283 -41.652 -1.220 1.00 63.14 H new ATOM 0 HA ASN A 14 44.545 -42.228 -1.765 1.00 63.44 H new ATOM 0 HB2 ASN A 14 46.257 -43.851 -0.917 1.00 43.54 H new ATOM 0 HB3 ASN A 14 46.335 -42.962 0.591 1.00 43.54 H new ATOM 0 HD21 ASN A 14 42.907 -45.174 -0.311 1.00 31.44 H new ATOM 0 HD22 ASN A 14 43.959 -44.586 -1.604 1.00 31.44 H new ATOM 201 N GLN A 15 43.151 -41.100 -0.025 1.00 34.13 N ATOM 202 CA GLN A 15 42.271 -40.258 0.773 1.00 3.23 C ATOM 203 C GLN A 15 42.165 -40.747 2.221 1.00 33.33 C ATOM 204 O GLN A 15 41.994 -39.930 3.122 1.00 42.33 O ATOM 205 CB GLN A 15 40.883 -40.200 0.123 1.00 34.13 C ATOM 206 CG GLN A 15 40.913 -39.652 -1.311 1.00 35.44 C ATOM 207 CD GLN A 15 41.486 -38.237 -1.378 1.00 11.43 C ATOM 208 OE1 GLN A 15 42.606 -38.038 -1.839 1.00 73.32 O ATOM 209 NE2 GLN A 15 40.717 -37.251 -0.913 1.00 32.12 N ATOM 0 H GLN A 15 42.648 -41.775 -0.601 1.00 34.13 H new ATOM 0 HA GLN A 15 42.702 -39.257 0.804 1.00 3.23 H new ATOM 0 HB2 GLN A 15 40.450 -41.200 0.115 1.00 34.13 H new ATOM 0 HB3 GLN A 15 40.229 -39.575 0.731 1.00 34.13 H new ATOM 0 HG2 GLN A 15 41.510 -40.314 -1.938 1.00 35.44 H new ATOM 0 HG3 GLN A 15 39.902 -39.652 -1.719 1.00 35.44 H new ATOM 0 HE21 GLN A 15 39.792 -37.460 -0.538 1.00 32.12 H new ATOM 0 HE22 GLN A 15 41.054 -36.289 -0.933 1.00 32.12 H new ATOM 218 N LEU A 16 42.241 -42.068 2.435 1.00 21.33 N ATOM 219 CA LEU A 16 42.076 -42.722 3.729 1.00 35.12 C ATOM 220 C LEU A 16 40.706 -42.384 4.326 1.00 24.02 C ATOM 221 O LEU A 16 40.602 -41.638 5.300 1.00 20.15 O ATOM 222 CB LEU A 16 43.262 -42.399 4.654 1.00 61.10 C ATOM 223 CG LEU A 16 43.279 -43.183 5.980 1.00 60.23 C ATOM 224 CD1 LEU A 16 43.351 -44.699 5.761 1.00 64.42 C ATOM 225 CD2 LEU A 16 44.490 -42.734 6.805 1.00 33.01 C ATOM 0 H LEU A 16 42.426 -42.729 1.681 1.00 21.33 H new ATOM 0 HA LEU A 16 42.088 -43.804 3.601 1.00 35.12 H new ATOM 0 HB2 LEU A 16 44.189 -42.601 4.117 1.00 61.10 H new ATOM 0 HB3 LEU A 16 43.249 -41.333 4.879 1.00 61.10 H new ATOM 0 HG LEU A 16 42.347 -42.972 6.505 1.00 60.23 H new ATOM 0 HD11 LEU A 16 43.361 -45.206 6.726 1.00 64.42 H new ATOM 0 HD12 LEU A 16 42.483 -45.025 5.188 1.00 64.42 H new ATOM 0 HD13 LEU A 16 44.261 -44.945 5.213 1.00 64.42 H new ATOM 0 HD21 LEU A 16 44.512 -43.283 7.747 1.00 33.01 H new ATOM 0 HD22 LEU A 16 45.405 -42.934 6.247 1.00 33.01 H new ATOM 0 HD23 LEU A 16 44.415 -41.666 7.009 1.00 33.01 H new ATOM 375 N PRO A 27 35.478 -34.222 16.506 1.00 24.42 N ATOM 376 CA PRO A 27 34.832 -33.049 15.936 1.00 51.32 C ATOM 377 C PRO A 27 33.468 -33.450 15.354 1.00 55.24 C ATOM 378 O PRO A 27 33.026 -34.585 15.531 1.00 14.13 O ATOM 379 CB PRO A 27 35.809 -32.548 14.868 1.00 12.01 C ATOM 380 CG PRO A 27 36.426 -33.842 14.348 1.00 64.02 C ATOM 381 CD PRO A 27 36.497 -34.723 15.598 1.00 21.35 C ATOM 0 HA PRO A 27 34.626 -32.263 16.663 1.00 51.32 H new ATOM 0 HB2 PRO A 27 35.299 -31.996 14.078 1.00 12.01 H new ATOM 0 HB3 PRO A 27 36.561 -31.880 15.288 1.00 12.01 H new ATOM 0 HG2 PRO A 27 35.813 -34.296 13.570 1.00 64.02 H new ATOM 0 HG3 PRO A 27 37.413 -33.673 13.918 1.00 64.02 H new ATOM 0 HD2 PRO A 27 36.316 -35.768 15.348 1.00 21.35 H new ATOM 0 HD3 PRO A 27 37.485 -34.671 16.055 1.00 21.35 H new ATOM 389 N GLU A 28 32.811 -32.516 14.651 1.00 42.11 N ATOM 390 CA GLU A 28 31.505 -32.693 14.019 1.00 73.23 C ATOM 391 C GLU A 28 31.362 -34.052 13.325 1.00 44.24 C ATOM 392 O GLU A 28 30.326 -34.696 13.467 1.00 3.25 O ATOM 393 CB GLU A 28 31.264 -31.542 13.031 1.00 72.02 C ATOM 394 CG GLU A 28 29.894 -31.643 12.341 1.00 2.15 C ATOM 395 CD GLU A 28 29.640 -30.467 11.402 1.00 20.50 C ATOM 396 OE1 GLU A 28 29.653 -29.323 11.903 1.00 72.12 O ATOM 397 OE2 GLU A 28 29.436 -30.734 10.198 1.00 71.35 O ATOM 0 H GLU A 28 33.194 -31.582 14.504 1.00 42.11 H new ATOM 0 HA GLU A 28 30.746 -32.674 14.802 1.00 73.23 H new ATOM 0 HB2 GLU A 28 31.333 -30.592 13.560 1.00 72.02 H new ATOM 0 HB3 GLU A 28 32.050 -31.544 12.276 1.00 72.02 H new ATOM 0 HG2 GLU A 28 29.839 -32.575 11.778 1.00 2.15 H new ATOM 0 HG3 GLU A 28 29.109 -31.680 13.096 1.00 2.15 H new ATOM 404 N VAL A 29 32.399 -34.480 12.588 1.00 33.41 N ATOM 405 CA VAL A 29 32.400 -35.689 11.767 1.00 70.42 C ATOM 406 C VAL A 29 31.940 -36.947 12.515 1.00 2.34 C ATOM 407 O VAL A 29 31.432 -37.867 11.877 1.00 52.51 O ATOM 408 CB VAL A 29 33.786 -35.885 11.123 1.00 42.33 C ATOM 409 CG1 VAL A 29 34.772 -36.592 12.064 1.00 62.44 C ATOM 410 CG2 VAL A 29 33.669 -36.674 9.813 1.00 2.33 C ATOM 0 H VAL A 29 33.284 -33.975 12.550 1.00 33.41 H new ATOM 0 HA VAL A 29 31.657 -35.540 10.984 1.00 70.42 H new ATOM 0 HB VAL A 29 34.178 -34.889 10.915 1.00 42.33 H new ATOM 0 HG11 VAL A 29 35.734 -36.706 11.564 1.00 62.44 H new ATOM 0 HG12 VAL A 29 34.902 -35.998 12.968 1.00 62.44 H new ATOM 0 HG13 VAL A 29 34.381 -37.575 12.329 1.00 62.44 H new ATOM 0 HG21 VAL A 29 34.659 -36.801 9.375 1.00 2.33 H new ATOM 0 HG22 VAL A 29 33.233 -37.653 10.015 1.00 2.33 H new ATOM 0 HG23 VAL A 29 33.031 -36.130 9.116 1.00 2.33 H new ATOM 420 N VAL A 30 32.095 -36.994 13.848 1.00 31.23 N ATOM 421 CA VAL A 30 31.636 -38.114 14.663 1.00 54.41 C ATOM 422 C VAL A 30 30.165 -38.434 14.386 1.00 71.13 C ATOM 423 O VAL A 30 29.787 -39.598 14.418 1.00 71.15 O ATOM 424 CB VAL A 30 31.906 -37.857 16.157 1.00 22.54 C ATOM 425 CG1 VAL A 30 30.940 -36.834 16.769 1.00 50.53 C ATOM 426 CG2 VAL A 30 31.804 -39.161 16.959 1.00 11.12 C ATOM 0 H VAL A 30 32.544 -36.252 14.385 1.00 31.23 H new ATOM 0 HA VAL A 30 32.210 -38.997 14.382 1.00 54.41 H new ATOM 0 HB VAL A 30 32.916 -37.451 16.213 1.00 22.54 H new ATOM 0 HG11 VAL A 30 31.179 -36.694 17.823 1.00 50.53 H new ATOM 0 HG12 VAL A 30 31.037 -35.883 16.245 1.00 50.53 H new ATOM 0 HG13 VAL A 30 29.917 -37.198 16.674 1.00 50.53 H new ATOM 0 HG21 VAL A 30 31.998 -38.957 18.012 1.00 11.12 H new ATOM 0 HG22 VAL A 30 30.803 -39.578 16.849 1.00 11.12 H new ATOM 0 HG23 VAL A 30 32.538 -39.876 16.587 1.00 11.12 H new ATOM 436 N ARG A 31 29.349 -37.416 14.081 1.00 31.40 N ATOM 437 CA ARG A 31 27.939 -37.575 13.749 1.00 63.33 C ATOM 438 C ARG A 31 27.698 -38.620 12.654 1.00 32.14 C ATOM 439 O ARG A 31 26.760 -39.404 12.766 1.00 71.24 O ATOM 440 CB ARG A 31 27.314 -36.210 13.436 1.00 52.42 C ATOM 441 CG ARG A 31 27.792 -35.536 12.141 1.00 2.24 C ATOM 442 CD ARG A 31 26.776 -35.677 11.006 1.00 54.13 C ATOM 443 NE ARG A 31 27.213 -34.909 9.832 1.00 32.14 N ATOM 444 CZ ARG A 31 26.453 -34.647 8.756 1.00 32.01 C ATOM 445 NH1 ARG A 31 25.212 -35.146 8.657 1.00 72.12 N ATOM 446 NH2 ARG A 31 26.942 -33.878 7.775 1.00 72.43 N ATOM 0 H ARG A 31 29.662 -36.445 14.060 1.00 31.40 H new ATOM 0 HA ARG A 31 27.429 -37.977 14.624 1.00 63.33 H new ATOM 0 HB2 ARG A 31 26.232 -36.331 13.382 1.00 52.42 H new ATOM 0 HB3 ARG A 31 27.519 -35.538 14.270 1.00 52.42 H new ATOM 0 HG2 ARG A 31 27.977 -34.479 12.331 1.00 2.24 H new ATOM 0 HG3 ARG A 31 28.741 -35.976 11.834 1.00 2.24 H new ATOM 0 HD2 ARG A 31 26.662 -36.728 10.740 1.00 54.13 H new ATOM 0 HD3 ARG A 31 25.799 -35.324 11.337 1.00 54.13 H new ATOM 0 HE ARG A 31 28.167 -34.547 9.834 1.00 32.14 H new ATOM 0 HH11 ARG A 31 24.836 -35.731 9.403 1.00 72.12 H new ATOM 0 HH12 ARG A 31 24.644 -34.940 7.835 1.00 72.12 H new ATOM 0 HH21 ARG A 31 27.885 -33.496 7.848 1.00 72.43 H new ATOM 0 HH22 ARG A 31 26.372 -33.674 6.954 1.00 72.43 H new ATOM 460 N GLN A 32 28.556 -38.675 11.627 1.00 2.22 N ATOM 461 CA GLN A 32 28.496 -39.696 10.587 1.00 62.54 C ATOM 462 C GLN A 32 28.710 -41.093 11.174 1.00 71.45 C ATOM 463 O GLN A 32 28.055 -42.040 10.748 1.00 42.44 O ATOM 464 CB GLN A 32 29.534 -39.412 9.491 1.00 30.45 C ATOM 465 CG GLN A 32 29.212 -38.156 8.668 1.00 0.13 C ATOM 466 CD GLN A 32 27.904 -38.280 7.906 1.00 33.12 C ATOM 467 OE1 GLN A 32 26.890 -37.709 8.300 1.00 2.31 O ATOM 468 NE2 GLN A 32 27.917 -39.019 6.801 1.00 35.30 N ATOM 0 H GLN A 32 29.314 -38.005 11.499 1.00 2.22 H new ATOM 0 HA GLN A 32 27.501 -39.663 10.142 1.00 62.54 H new ATOM 0 HB2 GLN A 32 30.516 -39.297 9.950 1.00 30.45 H new ATOM 0 HB3 GLN A 32 29.593 -40.272 8.823 1.00 30.45 H new ATOM 0 HG2 GLN A 32 29.161 -37.293 9.332 1.00 0.13 H new ATOM 0 HG3 GLN A 32 30.023 -37.969 7.964 1.00 0.13 H new ATOM 0 HE21 GLN A 32 28.778 -39.478 6.505 1.00 35.30 H new ATOM 0 HE22 GLN A 32 27.066 -39.127 6.249 1.00 35.30 H new ATOM 477 N ARG A 33 29.613 -41.223 12.154 1.00 73.42 N ATOM 478 CA ARG A 33 29.859 -42.480 12.845 1.00 54.12 C ATOM 479 C ARG A 33 28.655 -42.879 13.702 1.00 51.31 C ATOM 480 O ARG A 33 28.297 -44.056 13.723 1.00 5.54 O ATOM 481 CB ARG A 33 31.143 -42.405 13.686 1.00 64.45 C ATOM 482 CG ARG A 33 32.372 -41.935 12.891 1.00 52.03 C ATOM 483 CD ARG A 33 32.653 -42.771 11.637 1.00 60.21 C ATOM 484 NE ARG A 33 32.622 -44.213 11.934 1.00 42.11 N ATOM 485 CZ ARG A 33 31.901 -45.138 11.274 1.00 1.34 C ATOM 486 NH1 ARG A 33 31.315 -44.867 10.101 1.00 11.34 N ATOM 487 NH2 ARG A 33 31.742 -46.358 11.801 1.00 23.43 N ATOM 0 H ARG A 33 30.192 -40.452 12.486 1.00 73.42 H new ATOM 0 HA ARG A 33 30.002 -43.256 12.093 1.00 54.12 H new ATOM 0 HB2 ARG A 33 30.980 -41.726 14.523 1.00 64.45 H new ATOM 0 HB3 ARG A 33 31.348 -43.388 14.109 1.00 64.45 H new ATOM 0 HG2 ARG A 33 32.228 -40.895 12.598 1.00 52.03 H new ATOM 0 HG3 ARG A 33 33.247 -41.965 13.540 1.00 52.03 H new ATOM 0 HD2 ARG A 33 31.913 -42.540 10.871 1.00 60.21 H new ATOM 0 HD3 ARG A 33 33.628 -42.503 11.230 1.00 60.21 H new ATOM 0 HE ARG A 33 33.199 -44.540 12.709 1.00 42.11 H new ATOM 0 HH11 ARG A 33 31.409 -43.940 9.686 1.00 11.34 H new ATOM 0 HH12 ARG A 33 30.774 -45.587 9.623 1.00 11.34 H new ATOM 0 HH21 ARG A 33 32.167 -46.584 12.700 1.00 23.43 H new ATOM 0 HH22 ARG A 33 31.196 -47.061 11.303 1.00 23.43 H new ATOM 501 N ILE A 34 28.019 -41.915 14.386 1.00 75.54 N ATOM 502 CA ILE A 34 26.815 -42.182 15.165 1.00 34.12 C ATOM 503 C ILE A 34 25.720 -42.709 14.236 1.00 74.22 C ATOM 504 O ILE A 34 25.120 -43.739 14.529 1.00 3.03 O ATOM 505 CB ILE A 34 26.332 -40.944 15.951 1.00 31.12 C ATOM 506 CG1 ILE A 34 27.431 -40.230 16.755 1.00 43.32 C ATOM 507 CG2 ILE A 34 25.194 -41.345 16.904 1.00 41.11 C ATOM 508 CD1 ILE A 34 28.369 -41.166 17.514 1.00 1.42 C ATOM 0 H ILE A 34 28.325 -40.942 14.411 1.00 75.54 H new ATOM 0 HA ILE A 34 27.055 -42.939 15.912 1.00 34.12 H new ATOM 0 HB ILE A 34 25.991 -40.233 15.198 1.00 31.12 H new ATOM 0 HG12 ILE A 34 28.022 -39.617 16.074 1.00 43.32 H new ATOM 0 HG13 ILE A 34 26.960 -39.552 17.467 1.00 43.32 H new ATOM 0 HG21 ILE A 34 24.856 -40.468 17.457 1.00 41.11 H new ATOM 0 HG22 ILE A 34 24.364 -41.753 16.328 1.00 41.11 H new ATOM 0 HG23 ILE A 34 25.554 -42.099 17.604 1.00 41.11 H new ATOM 0 HD11 ILE A 34 29.112 -40.578 18.053 1.00 1.42 H new ATOM 0 HD12 ILE A 34 27.794 -41.761 18.223 1.00 1.42 H new ATOM 0 HD13 ILE A 34 28.872 -41.828 16.809 1.00 1.42 H new ATOM 520 N VAL A 35 25.483 -42.018 13.113 1.00 43.30 N ATOM 521 CA VAL A 35 24.512 -42.405 12.098 1.00 12.23 C ATOM 522 C VAL A 35 24.802 -43.825 11.598 1.00 65.34 C ATOM 523 O VAL A 35 23.901 -44.663 11.586 1.00 53.54 O ATOM 524 CB VAL A 35 24.520 -41.364 10.959 1.00 24.42 C ATOM 525 CG1 VAL A 35 23.766 -41.848 9.714 1.00 75.41 C ATOM 526 CG2 VAL A 35 23.889 -40.044 11.426 1.00 31.34 C ATOM 0 H VAL A 35 25.976 -41.155 12.886 1.00 43.30 H new ATOM 0 HA VAL A 35 23.510 -42.421 12.526 1.00 12.23 H new ATOM 0 HB VAL A 35 25.566 -41.213 10.693 1.00 24.42 H new ATOM 0 HG11 VAL A 35 23.803 -41.077 8.944 1.00 75.41 H new ATOM 0 HG12 VAL A 35 24.231 -42.759 9.338 1.00 75.41 H new ATOM 0 HG13 VAL A 35 22.727 -42.052 9.974 1.00 75.41 H new ATOM 0 HG21 VAL A 35 23.905 -39.324 10.608 1.00 31.34 H new ATOM 0 HG22 VAL A 35 22.858 -40.222 11.733 1.00 31.34 H new ATOM 0 HG23 VAL A 35 24.456 -39.648 12.269 1.00 31.34 H new ATOM 536 N ASP A 36 26.051 -44.090 11.193 1.00 2.44 N ATOM 537 CA ASP A 36 26.479 -45.369 10.642 1.00 15.45 C ATOM 538 C ASP A 36 26.202 -46.515 11.615 1.00 53.32 C ATOM 539 O ASP A 36 25.575 -47.507 11.248 1.00 34.41 O ATOM 540 CB ASP A 36 27.972 -45.301 10.300 1.00 3.32 C ATOM 541 CG ASP A 36 28.484 -46.603 9.687 1.00 64.31 C ATOM 542 OD1 ASP A 36 27.819 -47.099 8.755 1.00 12.41 O ATOM 543 OD2 ASP A 36 29.552 -47.066 10.150 1.00 2.25 O ATOM 0 H ASP A 36 26.803 -43.403 11.243 1.00 2.44 H new ATOM 0 HA ASP A 36 25.908 -45.567 9.735 1.00 15.45 H new ATOM 0 HB2 ASP A 36 28.146 -44.481 9.604 1.00 3.32 H new ATOM 0 HB3 ASP A 36 28.540 -45.079 11.203 1.00 3.32 H new ATOM 548 N LEU A 37 26.674 -46.377 12.858 1.00 62.45 N ATOM 549 CA LEU A 37 26.520 -47.402 13.878 1.00 44.54 C ATOM 550 C LEU A 37 25.042 -47.592 14.222 1.00 74.04 C ATOM 551 O LEU A 37 24.554 -48.719 14.206 1.00 72.11 O ATOM 552 CB LEU A 37 27.359 -47.027 15.111 1.00 64.43 C ATOM 553 CG LEU A 37 27.514 -48.171 16.130 1.00 14.05 C ATOM 554 CD1 LEU A 37 28.558 -49.194 15.667 1.00 62.44 C ATOM 555 CD2 LEU A 37 27.961 -47.599 17.481 1.00 53.32 C ATOM 0 H LEU A 37 27.173 -45.548 13.179 1.00 62.45 H new ATOM 0 HA LEU A 37 26.885 -48.357 13.501 1.00 44.54 H new ATOM 0 HB2 LEU A 37 28.349 -46.709 14.782 1.00 64.43 H new ATOM 0 HB3 LEU A 37 26.898 -46.172 15.606 1.00 64.43 H new ATOM 0 HG LEU A 37 26.548 -48.668 16.222 1.00 14.05 H new ATOM 0 HD11 LEU A 37 28.643 -49.988 16.409 1.00 62.44 H new ATOM 0 HD12 LEU A 37 28.251 -49.621 14.712 1.00 62.44 H new ATOM 0 HD13 LEU A 37 29.523 -48.701 15.551 1.00 62.44 H new ATOM 0 HD21 LEU A 37 28.070 -48.410 18.201 1.00 53.32 H new ATOM 0 HD22 LEU A 37 28.917 -47.088 17.362 1.00 53.32 H new ATOM 0 HD23 LEU A 37 27.214 -46.892 17.842 1.00 53.32 H new ATOM 567 N ALA A 38 24.330 -46.495 14.504 1.00 24.31 N ATOM 568 CA ALA A 38 22.919 -46.513 14.859 1.00 63.50 C ATOM 569 C ALA A 38 22.053 -47.153 13.772 1.00 51.33 C ATOM 570 O ALA A 38 21.034 -47.758 14.100 1.00 3.22 O ATOM 571 CB ALA A 38 22.436 -45.092 15.163 1.00 43.10 C ATOM 0 H ALA A 38 24.731 -45.557 14.490 1.00 24.31 H new ATOM 0 HA ALA A 38 22.815 -47.130 15.752 1.00 63.50 H new ATOM 0 HB1 ALA A 38 21.379 -45.116 15.428 1.00 43.10 H new ATOM 0 HB2 ALA A 38 23.009 -44.683 15.995 1.00 43.10 H new ATOM 0 HB3 ALA A 38 22.576 -44.464 14.283 1.00 43.10 H new ATOM 577 N HIS A 39 22.448 -47.034 12.496 1.00 31.41 N ATOM 578 CA HIS A 39 21.699 -47.577 11.369 1.00 65.44 C ATOM 579 C HIS A 39 21.388 -49.067 11.542 1.00 53.14 C ATOM 580 O HIS A 39 20.260 -49.479 11.272 1.00 4.50 O ATOM 581 CB HIS A 39 22.439 -47.329 10.051 1.00 72.45 C ATOM 582 CG HIS A 39 21.665 -47.801 8.848 1.00 24.25 C ATOM 583 ND1 HIS A 39 20.479 -47.204 8.446 1.00 21.43 N ATOM 584 CD2 HIS A 39 21.867 -48.836 7.968 1.00 33.52 C ATOM 585 CE1 HIS A 39 20.037 -47.881 7.372 1.00 74.02 C ATOM 586 NE2 HIS A 39 20.841 -48.889 7.029 1.00 14.13 N ATOM 0 H HIS A 39 23.305 -46.553 12.222 1.00 31.41 H new ATOM 0 HA HIS A 39 20.745 -47.050 11.338 1.00 65.44 H new ATOM 0 HB2 HIS A 39 22.644 -46.263 9.950 1.00 72.45 H new ATOM 0 HB3 HIS A 39 23.403 -47.838 10.080 1.00 72.45 H new ATOM 0 HD2 HIS A 39 22.706 -49.515 8.000 1.00 33.52 H new ATOM 0 HE1 HIS A 39 19.128 -47.635 6.843 1.00 74.02 H new ATOM 0 HE2 HIS A 39 20.730 -49.546 6.257 1.00 14.13 H new ATOM 594 N GLN A 40 22.362 -49.876 11.989 1.00 43.43 N ATOM 595 CA GLN A 40 22.132 -51.309 12.165 1.00 63.03 C ATOM 596 C GLN A 40 21.207 -51.609 13.356 1.00 71.14 C ATOM 597 O GLN A 40 20.628 -52.691 13.423 1.00 70.24 O ATOM 598 CB GLN A 40 23.467 -52.057 12.259 1.00 43.34 C ATOM 599 CG GLN A 40 24.057 -52.023 13.671 1.00 53.51 C ATOM 600 CD GLN A 40 25.568 -52.215 13.651 1.00 73.10 C ATOM 601 OE1 GLN A 40 26.060 -53.339 13.707 1.00 23.05 O ATOM 602 NE2 GLN A 40 26.305 -51.106 13.581 1.00 65.33 N ATOM 0 H GLN A 40 23.302 -49.563 12.231 1.00 43.43 H new ATOM 0 HA GLN A 40 21.606 -51.675 11.283 1.00 63.03 H new ATOM 0 HB2 GLN A 40 23.322 -53.093 11.954 1.00 43.34 H new ATOM 0 HB3 GLN A 40 24.178 -51.615 11.560 1.00 43.34 H new ATOM 0 HG2 GLN A 40 23.817 -51.071 14.144 1.00 53.51 H new ATOM 0 HG3 GLN A 40 23.598 -52.804 14.277 1.00 53.51 H new ATOM 0 HE21 GLN A 40 25.851 -50.194 13.536 1.00 65.33 H new ATOM 0 HE22 GLN A 40 27.323 -51.170 13.572 1.00 65.33 H new ATOM 611 N GLY A 41 21.072 -50.655 14.288 1.00 51.14 N ATOM 612 CA GLY A 41 20.186 -50.742 15.437 1.00 3.15 C ATOM 613 C GLY A 41 20.871 -51.416 16.624 1.00 62.33 C ATOM 614 O GLY A 41 20.322 -52.357 17.196 1.00 22.41 O ATOM 0 H GLY A 41 21.595 -49.780 14.254 1.00 51.14 H new ATOM 0 HA2 GLY A 41 19.861 -49.742 15.723 1.00 3.15 H new ATOM 0 HA3 GLY A 41 19.291 -51.302 15.166 1.00 3.15 H new ATOM 618 N VAL A 42 22.054 -50.921 17.012 1.00 50.02 N ATOM 619 CA VAL A 42 22.767 -51.424 18.179 1.00 72.42 C ATOM 620 C VAL A 42 22.075 -50.912 19.443 1.00 13.45 C ATOM 621 O VAL A 42 21.838 -49.712 19.575 1.00 12.01 O ATOM 622 CB VAL A 42 24.244 -50.990 18.170 1.00 74.21 C ATOM 623 CG1 VAL A 42 25.019 -51.789 19.220 1.00 5.02 C ATOM 624 CG2 VAL A 42 24.925 -51.225 16.822 1.00 40.00 C ATOM 0 H VAL A 42 22.536 -50.165 16.525 1.00 50.02 H new ATOM 0 HA VAL A 42 22.747 -52.514 18.157 1.00 72.42 H new ATOM 0 HB VAL A 42 24.252 -49.921 18.382 1.00 74.21 H new ATOM 0 HG11 VAL A 42 26.065 -51.481 19.213 1.00 5.02 H new ATOM 0 HG12 VAL A 42 24.593 -51.604 20.206 1.00 5.02 H new ATOM 0 HG13 VAL A 42 24.952 -52.852 18.990 1.00 5.02 H new ATOM 0 HG21 VAL A 42 25.964 -50.900 16.878 1.00 40.00 H new ATOM 0 HG22 VAL A 42 24.890 -52.286 16.577 1.00 40.00 H new ATOM 0 HG23 VAL A 42 24.408 -50.657 16.049 1.00 40.00 H new ATOM 634 N ARG A 43 21.770 -51.816 20.380 1.00 54.03 N ATOM 635 CA ARG A 43 21.230 -51.460 21.681 1.00 63.12 C ATOM 636 C ARG A 43 22.300 -50.707 22.481 1.00 64.21 C ATOM 637 O ARG A 43 23.481 -51.009 22.329 1.00 54.02 O ATOM 638 CB ARG A 43 20.813 -52.745 22.409 1.00 31.33 C ATOM 639 CG ARG A 43 19.932 -53.673 21.556 1.00 71.00 C ATOM 640 CD ARG A 43 18.681 -52.986 20.997 1.00 30.30 C ATOM 641 NE ARG A 43 17.884 -52.348 22.055 1.00 20.14 N ATOM 642 CZ ARG A 43 16.895 -51.465 21.842 1.00 41.53 C ATOM 643 NH1 ARG A 43 16.556 -51.104 20.596 1.00 25.15 N ATOM 644 NH2 ARG A 43 16.238 -50.942 22.887 1.00 70.44 N ATOM 0 H ARG A 43 21.895 -52.820 20.249 1.00 54.03 H new ATOM 0 HA ARG A 43 20.359 -50.814 21.571 1.00 63.12 H new ATOM 0 HB2 ARG A 43 21.708 -53.287 22.715 1.00 31.33 H new ATOM 0 HB3 ARG A 43 20.274 -52.480 23.318 1.00 31.33 H new ATOM 0 HG2 ARG A 43 20.524 -54.062 20.727 1.00 71.00 H new ATOM 0 HG3 ARG A 43 19.628 -54.528 22.160 1.00 71.00 H new ATOM 0 HD2 ARG A 43 18.976 -52.236 20.263 1.00 30.30 H new ATOM 0 HD3 ARG A 43 18.068 -53.720 20.474 1.00 30.30 H new ATOM 0 HE ARG A 43 18.098 -52.594 23.021 1.00 20.14 H new ATOM 0 HH11 ARG A 43 17.051 -51.501 19.797 1.00 25.15 H new ATOM 0 HH12 ARG A 43 15.803 -50.432 20.447 1.00 25.15 H new ATOM 0 HH21 ARG A 43 16.490 -51.215 23.837 1.00 70.44 H new ATOM 0 HH22 ARG A 43 15.486 -50.271 22.732 1.00 70.44 H new ATOM 658 N PRO A 44 21.932 -49.746 23.344 1.00 72.23 N ATOM 659 CA PRO A 44 22.890 -48.974 24.128 1.00 42.21 C ATOM 660 C PRO A 44 23.785 -49.888 24.971 1.00 23.21 C ATOM 661 O PRO A 44 24.997 -49.688 25.024 1.00 41.44 O ATOM 662 CB PRO A 44 22.053 -48.014 24.981 1.00 34.14 C ATOM 663 CG PRO A 44 20.680 -48.683 25.047 1.00 31.11 C ATOM 664 CD PRO A 44 20.571 -49.372 23.689 1.00 0.42 C ATOM 0 HA PRO A 44 23.579 -48.417 23.493 1.00 42.21 H new ATOM 0 HB2 PRO A 44 22.482 -47.884 25.974 1.00 34.14 H new ATOM 0 HB3 PRO A 44 21.994 -47.025 24.528 1.00 34.14 H new ATOM 0 HG2 PRO A 44 20.617 -49.397 25.868 1.00 31.11 H new ATOM 0 HG3 PRO A 44 19.883 -47.955 25.196 1.00 31.11 H new ATOM 0 HD2 PRO A 44 19.923 -50.247 23.742 1.00 0.42 H new ATOM 0 HD3 PRO A 44 20.144 -48.704 22.941 1.00 0.42 H new ATOM 672 N CYS A 45 23.190 -50.919 25.583 1.00 30.14 N ATOM 673 CA CYS A 45 23.912 -51.939 26.330 1.00 13.14 C ATOM 674 C CYS A 45 24.899 -52.726 25.458 1.00 51.22 C ATOM 675 O CYS A 45 25.902 -53.208 25.974 1.00 1.55 O ATOM 676 CB CYS A 45 22.922 -52.873 27.041 1.00 62.23 C ATOM 677 SG CYS A 45 21.881 -53.766 25.851 1.00 72.25 S ATOM 0 H CYS A 45 22.180 -51.064 25.569 1.00 30.14 H new ATOM 0 HA CYS A 45 24.516 -51.429 27.081 1.00 13.14 H new ATOM 0 HB2 CYS A 45 23.470 -53.588 27.655 1.00 62.23 H new ATOM 0 HB3 CYS A 45 22.291 -52.292 27.714 1.00 62.23 H new ATOM 0 HG CYS A 45 21.061 -54.545 26.491 1.00 72.25 H new ATOM 683 N ASP A 46 24.617 -52.870 24.156 1.00 53.44 N ATOM 684 CA ASP A 46 25.425 -53.658 23.233 1.00 23.42 C ATOM 685 C ASP A 46 26.583 -52.856 22.636 1.00 11.31 C ATOM 686 O ASP A 46 27.646 -53.426 22.393 1.00 24.32 O ATOM 687 CB ASP A 46 24.540 -54.278 22.149 1.00 4.24 C ATOM 688 CG ASP A 46 25.309 -55.354 21.392 1.00 53.22 C ATOM 689 OD1 ASP A 46 25.483 -56.438 21.991 1.00 15.25 O ATOM 690 OD2 ASP A 46 25.721 -55.070 20.247 1.00 11.22 O ATOM 0 H ASP A 46 23.808 -52.433 23.714 1.00 53.44 H new ATOM 0 HA ASP A 46 25.885 -54.466 23.803 1.00 23.42 H new ATOM 0 HB2 ASP A 46 23.647 -54.709 22.601 1.00 4.24 H new ATOM 0 HB3 ASP A 46 24.205 -53.505 21.457 1.00 4.24 H new ATOM 695 N ILE A 47 26.413 -51.540 22.439 1.00 12.34 N ATOM 696 CA ILE A 47 27.518 -50.648 22.080 1.00 71.51 C ATOM 697 C ILE A 47 28.661 -50.850 23.082 1.00 30.32 C ATOM 698 O ILE A 47 29.810 -51.029 22.682 1.00 55.14 O ATOM 699 CB ILE A 47 27.056 -49.175 22.021 1.00 3.45 C ATOM 700 CG1 ILE A 47 26.016 -48.989 20.902 1.00 73.35 C ATOM 701 CG2 ILE A 47 28.258 -48.245 21.781 1.00 53.44 C ATOM 702 CD1 ILE A 47 25.416 -47.584 20.825 1.00 0.40 C ATOM 0 H ILE A 47 25.512 -51.070 22.524 1.00 12.34 H new ATOM 0 HA ILE A 47 27.876 -50.895 21.081 1.00 71.51 H new ATOM 0 HB ILE A 47 26.599 -48.917 22.976 1.00 3.45 H new ATOM 0 HG12 ILE A 47 26.483 -49.224 19.946 1.00 73.35 H new ATOM 0 HG13 ILE A 47 25.210 -49.708 21.049 1.00 73.35 H new ATOM 0 HG21 ILE A 47 27.916 -47.211 21.742 1.00 53.44 H new ATOM 0 HG22 ILE A 47 28.975 -48.360 22.594 1.00 53.44 H new ATOM 0 HG23 ILE A 47 28.736 -48.505 20.837 1.00 53.44 H new ATOM 0 HD11 ILE A 47 24.694 -47.541 20.010 1.00 0.40 H new ATOM 0 HD12 ILE A 47 24.917 -47.350 21.765 1.00 0.40 H new ATOM 0 HD13 ILE A 47 26.210 -46.859 20.645 1.00 0.40 H new ATOM 714 N SER A 48 28.324 -50.865 24.378 1.00 60.10 N ATOM 715 CA SER A 48 29.259 -51.112 25.464 1.00 40.04 C ATOM 716 C SER A 48 30.069 -52.397 25.245 1.00 62.24 C ATOM 717 O SER A 48 31.277 -52.399 25.467 1.00 22.14 O ATOM 718 CB SER A 48 28.503 -51.160 26.797 1.00 41.11 C ATOM 719 OG SER A 48 27.606 -50.073 26.895 1.00 72.12 O ATOM 0 H SER A 48 27.370 -50.701 24.700 1.00 60.10 H new ATOM 0 HA SER A 48 29.975 -50.290 25.488 1.00 40.04 H new ATOM 0 HB2 SER A 48 27.956 -52.099 26.878 1.00 41.11 H new ATOM 0 HB3 SER A 48 29.211 -51.131 27.625 1.00 41.11 H new ATOM 0 HG SER A 48 27.130 -50.118 27.750 1.00 72.12 H new ATOM 725 N ARG A 49 29.415 -53.479 24.800 1.00 3.12 N ATOM 726 CA ARG A 49 30.065 -54.762 24.559 1.00 64.35 C ATOM 727 C ARG A 49 31.041 -54.657 23.392 1.00 52.22 C ATOM 728 O ARG A 49 32.220 -54.969 23.545 1.00 12.32 O ATOM 729 CB ARG A 49 29.038 -55.868 24.279 1.00 43.24 C ATOM 730 CG ARG A 49 28.012 -55.981 25.405 1.00 51.33 C ATOM 731 CD ARG A 49 27.089 -57.181 25.186 1.00 13.34 C ATOM 732 NE ARG A 49 25.957 -57.137 26.122 1.00 3.04 N ATOM 733 CZ ARG A 49 24.683 -56.811 25.832 1.00 23.31 C ATOM 734 NH1 ARG A 49 24.283 -56.535 24.583 1.00 1.11 N ATOM 735 NH2 ARG A 49 23.786 -56.762 26.825 1.00 5.21 N ATOM 0 H ARG A 49 28.415 -53.482 24.598 1.00 3.12 H new ATOM 0 HA ARG A 49 30.614 -55.026 25.463 1.00 64.35 H new ATOM 0 HB2 ARG A 49 28.526 -55.661 23.339 1.00 43.24 H new ATOM 0 HB3 ARG A 49 29.553 -56.821 24.158 1.00 43.24 H new ATOM 0 HG2 ARG A 49 28.526 -56.082 26.361 1.00 51.33 H new ATOM 0 HG3 ARG A 49 27.420 -55.067 25.456 1.00 51.33 H new ATOM 0 HD2 ARG A 49 26.721 -57.181 24.160 1.00 13.34 H new ATOM 0 HD3 ARG A 49 27.647 -58.107 25.325 1.00 13.34 H new ATOM 0 HE ARG A 49 26.157 -57.379 27.093 1.00 3.04 H new ATOM 0 HH11 ARG A 49 24.952 -56.568 23.814 1.00 1.11 H new ATOM 0 HH12 ARG A 49 23.309 -56.292 24.401 1.00 1.11 H new ATOM 0 HH21 ARG A 49 24.072 -56.970 27.782 1.00 5.21 H new ATOM 0 HH22 ARG A 49 22.816 -56.517 26.625 1.00 5.21 H new ATOM 749 N GLN A 50 30.544 -54.228 22.224 1.00 22.23 N ATOM 750 CA GLN A 50 31.322 -54.187 20.995 1.00 13.55 C ATOM 751 C GLN A 50 32.564 -53.297 21.107 1.00 4.13 C ATOM 752 O GLN A 50 33.571 -53.589 20.466 1.00 30.20 O ATOM 753 CB GLN A 50 30.425 -53.728 19.845 1.00 32.41 C ATOM 754 CG GLN A 50 29.312 -54.750 19.579 1.00 31.40 C ATOM 755 CD GLN A 50 28.435 -54.310 18.416 1.00 40.34 C ATOM 756 OE1 GLN A 50 28.327 -55.004 17.409 1.00 32.33 O ATOM 757 NE2 GLN A 50 27.816 -53.139 18.556 1.00 61.03 N ATOM 0 H GLN A 50 29.585 -53.899 22.113 1.00 22.23 H new ATOM 0 HA GLN A 50 31.689 -55.195 20.799 1.00 13.55 H new ATOM 0 HB2 GLN A 50 29.986 -52.760 20.085 1.00 32.41 H new ATOM 0 HB3 GLN A 50 31.023 -53.592 18.944 1.00 32.41 H new ATOM 0 HG2 GLN A 50 29.752 -55.723 19.360 1.00 31.40 H new ATOM 0 HG3 GLN A 50 28.702 -54.870 20.474 1.00 31.40 H new ATOM 0 HE21 GLN A 50 27.936 -52.598 19.412 1.00 61.03 H new ATOM 0 HE22 GLN A 50 27.221 -52.784 17.807 1.00 61.03 H new ATOM 766 N LEU A 51 32.502 -52.228 21.912 1.00 14.14 N ATOM 767 CA LEU A 51 33.615 -51.307 22.134 1.00 3.23 C ATOM 768 C LEU A 51 34.449 -51.712 23.360 1.00 41.34 C ATOM 769 O LEU A 51 35.560 -51.215 23.524 1.00 32.01 O ATOM 770 CB LEU A 51 33.076 -49.873 22.263 1.00 72.10 C ATOM 771 CG LEU A 51 32.767 -49.173 20.924 1.00 41.30 C ATOM 772 CD1 LEU A 51 34.050 -48.718 20.216 1.00 43.42 C ATOM 773 CD2 LEU A 51 31.915 -50.001 19.954 1.00 10.41 C ATOM 0 H LEU A 51 31.662 -51.978 22.434 1.00 14.14 H new ATOM 0 HA LEU A 51 34.285 -51.353 21.276 1.00 3.23 H new ATOM 0 HB2 LEU A 51 32.166 -49.895 22.863 1.00 72.10 H new ATOM 0 HB3 LEU A 51 33.805 -49.274 22.810 1.00 72.10 H new ATOM 0 HG LEU A 51 32.169 -48.306 21.205 1.00 41.30 H new ATOM 0 HD11 LEU A 51 33.793 -48.229 19.276 1.00 43.42 H new ATOM 0 HD12 LEU A 51 34.589 -48.018 20.854 1.00 43.42 H new ATOM 0 HD13 LEU A 51 34.681 -49.584 20.014 1.00 43.42 H new ATOM 0 HD21 LEU A 51 31.747 -49.431 19.040 1.00 10.41 H new ATOM 0 HD22 LEU A 51 32.435 -50.928 19.713 1.00 10.41 H new ATOM 0 HD23 LEU A 51 30.956 -50.233 20.418 1.00 10.41 H new ATOM 785 N ARG A 52 33.932 -52.623 24.199 1.00 54.20 N ATOM 786 CA ARG A 52 34.541 -53.101 25.433 1.00 75.30 C ATOM 787 C ARG A 52 34.743 -51.954 26.422 1.00 2.02 C ATOM 788 O ARG A 52 35.866 -51.620 26.792 1.00 71.12 O ATOM 789 CB ARG A 52 35.838 -53.891 25.197 1.00 74.22 C ATOM 790 CG ARG A 52 35.651 -55.142 24.326 1.00 14.14 C ATOM 791 CD ARG A 52 35.787 -54.882 22.821 1.00 75.32 C ATOM 792 NE ARG A 52 37.079 -54.256 22.502 1.00 42.40 N ATOM 793 CZ ARG A 52 37.338 -53.440 21.466 1.00 41.32 C ATOM 794 NH1 ARG A 52 36.404 -53.155 20.549 1.00 61.14 N ATOM 795 NH2 ARG A 52 38.560 -52.904 21.348 1.00 42.13 N ATOM 0 H ARG A 52 33.030 -53.064 24.018 1.00 54.20 H new ATOM 0 HA ARG A 52 33.841 -53.809 25.876 1.00 75.30 H new ATOM 0 HB2 ARG A 52 36.570 -53.237 24.724 1.00 74.22 H new ATOM 0 HB3 ARG A 52 36.252 -54.189 26.160 1.00 74.22 H new ATOM 0 HG2 ARG A 52 36.385 -55.891 24.622 1.00 14.14 H new ATOM 0 HG3 ARG A 52 34.666 -55.565 24.523 1.00 14.14 H new ATOM 0 HD2 ARG A 52 35.692 -55.822 22.277 1.00 75.32 H new ATOM 0 HD3 ARG A 52 34.975 -54.236 22.486 1.00 75.32 H new ATOM 0 HE ARG A 52 37.856 -54.462 23.130 1.00 42.40 H new ATOM 0 HH11 ARG A 52 35.471 -53.560 20.628 1.00 61.14 H new ATOM 0 HH12 ARG A 52 36.625 -52.533 19.772 1.00 61.14 H new ATOM 0 HH21 ARG A 52 39.279 -53.117 22.039 1.00 42.13 H new ATOM 0 HH22 ARG A 52 38.771 -52.283 20.567 1.00 42.13 H new ATOM 809 N VAL A 53 33.622 -51.365 26.844 1.00 73.33 N ATOM 810 CA VAL A 53 33.546 -50.260 27.790 1.00 70.24 C ATOM 811 C VAL A 53 32.291 -50.431 28.657 1.00 1.44 C ATOM 812 O VAL A 53 31.557 -51.403 28.486 1.00 44.11 O ATOM 813 CB VAL A 53 33.553 -48.914 27.041 1.00 13.13 C ATOM 814 CG1 VAL A 53 34.860 -48.678 26.275 1.00 2.31 C ATOM 815 CG2 VAL A 53 32.372 -48.796 26.072 1.00 1.34 C ATOM 0 H VAL A 53 32.702 -51.662 26.518 1.00 73.33 H new ATOM 0 HA VAL A 53 34.418 -50.264 28.444 1.00 70.24 H new ATOM 0 HB VAL A 53 33.461 -48.148 27.811 1.00 13.13 H new ATOM 0 HG11 VAL A 53 34.814 -47.716 25.764 1.00 2.31 H new ATOM 0 HG12 VAL A 53 35.696 -48.678 26.974 1.00 2.31 H new ATOM 0 HG13 VAL A 53 35.000 -49.472 25.541 1.00 2.31 H new ATOM 0 HG21 VAL A 53 32.413 -47.833 25.564 1.00 1.34 H new ATOM 0 HG22 VAL A 53 32.424 -49.598 25.335 1.00 1.34 H new ATOM 0 HG23 VAL A 53 31.437 -48.874 26.627 1.00 1.34 H new ATOM 825 N SER A 54 32.050 -49.492 29.584 1.00 23.31 N ATOM 826 CA SER A 54 30.937 -49.543 30.528 1.00 3.33 C ATOM 827 C SER A 54 29.879 -48.488 30.188 1.00 74.53 C ATOM 828 O SER A 54 28.798 -48.840 29.719 1.00 23.42 O ATOM 829 CB SER A 54 31.469 -49.396 31.959 1.00 22.40 C ATOM 830 OG SER A 54 32.410 -50.413 32.229 1.00 12.31 O ATOM 0 H SER A 54 32.636 -48.665 29.696 1.00 23.31 H new ATOM 0 HA SER A 54 30.442 -50.511 30.452 1.00 3.33 H new ATOM 0 HB2 SER A 54 31.932 -48.417 32.085 1.00 22.40 H new ATOM 0 HB3 SER A 54 30.645 -49.453 32.670 1.00 22.40 H new ATOM 0 HG SER A 54 32.747 -50.312 33.144 1.00 12.31 H new ATOM 836 N HIS A 55 30.175 -47.204 30.445 1.00 32.43 N ATOM 837 CA HIS A 55 29.227 -46.102 30.285 1.00 10.23 C ATOM 838 C HIS A 55 29.942 -44.757 30.106 1.00 75.42 C ATOM 839 O HIS A 55 29.523 -43.937 29.289 1.00 54.25 O ATOM 840 CB HIS A 55 28.239 -46.061 31.460 1.00 14.14 C ATOM 841 CG HIS A 55 28.886 -45.912 32.812 1.00 54.34 C ATOM 842 ND1 HIS A 55 29.181 -44.677 33.370 1.00 15.13 N ATOM 843 CD2 HIS A 55 29.294 -46.835 33.744 1.00 64.31 C ATOM 844 CE1 HIS A 55 29.771 -44.905 34.556 1.00 72.21 C ATOM 845 NE2 HIS A 55 29.870 -46.205 34.842 1.00 24.53 N ATOM 0 H HIS A 55 31.093 -46.904 30.774 1.00 32.43 H new ATOM 0 HA HIS A 55 28.660 -46.283 29.372 1.00 10.23 H new ATOM 0 HB2 HIS A 55 27.547 -45.232 31.308 1.00 14.14 H new ATOM 0 HB3 HIS A 55 27.647 -46.976 31.453 1.00 14.14 H new ATOM 0 HD2 HIS A 55 29.183 -47.904 33.638 1.00 64.31 H new ATOM 0 HE1 HIS A 55 30.127 -44.121 35.208 1.00 72.21 H new ATOM 0 HE2 HIS A 55 30.274 -46.636 35.673 1.00 24.53 H new ATOM 853 N GLY A 56 31.019 -44.518 30.866 1.00 73.43 N ATOM 854 CA GLY A 56 31.780 -43.275 30.814 1.00 74.00 C ATOM 855 C GLY A 56 32.298 -42.989 29.405 1.00 22.22 C ATOM 856 O GLY A 56 32.171 -41.872 28.908 1.00 31.23 O ATOM 0 H GLY A 56 31.385 -45.192 31.538 1.00 73.43 H new ATOM 0 HA2 GLY A 56 31.151 -42.449 31.145 1.00 74.00 H new ATOM 0 HA3 GLY A 56 32.620 -43.333 31.506 1.00 74.00 H new ATOM 860 N CYS A 57 32.866 -44.012 28.758 1.00 23.34 N ATOM 861 CA CYS A 57 33.364 -43.920 27.394 1.00 44.41 C ATOM 862 C CYS A 57 32.204 -43.907 26.397 1.00 21.22 C ATOM 863 O CYS A 57 32.288 -43.221 25.381 1.00 5.12 O ATOM 864 CB CYS A 57 34.308 -45.087 27.101 1.00 63.22 C ATOM 865 SG CYS A 57 35.684 -45.111 28.284 1.00 22.10 S ATOM 0 H CYS A 57 32.991 -44.934 29.176 1.00 23.34 H new ATOM 0 HA CYS A 57 33.916 -42.986 27.287 1.00 44.41 H new ATOM 0 HB2 CYS A 57 33.759 -46.027 27.154 1.00 63.22 H new ATOM 0 HB3 CYS A 57 34.696 -45.002 26.086 1.00 63.22 H new ATOM 0 HG CYS A 57 36.470 -46.112 28.016 1.00 22.10 H new ATOM 871 N VAL A 58 31.127 -44.654 26.687 1.00 75.41 N ATOM 872 CA VAL A 58 29.940 -44.727 25.840 1.00 41.34 C ATOM 873 C VAL A 58 29.423 -43.318 25.544 1.00 3.42 C ATOM 874 O VAL A 58 29.103 -43.025 24.398 1.00 75.44 O ATOM 875 CB VAL A 58 28.851 -45.613 26.470 1.00 40.32 C ATOM 876 CG1 VAL A 58 27.630 -45.743 25.548 1.00 42.34 C ATOM 877 CG2 VAL A 58 29.375 -47.026 26.753 1.00 41.54 C ATOM 0 H VAL A 58 31.062 -45.228 27.527 1.00 75.41 H new ATOM 0 HA VAL A 58 30.216 -45.196 24.896 1.00 41.34 H new ATOM 0 HB VAL A 58 28.564 -45.127 27.402 1.00 40.32 H new ATOM 0 HG11 VAL A 58 26.880 -46.375 26.024 1.00 42.34 H new ATOM 0 HG12 VAL A 58 27.207 -44.756 25.363 1.00 42.34 H new ATOM 0 HG13 VAL A 58 27.934 -46.191 24.602 1.00 42.34 H new ATOM 0 HG21 VAL A 58 28.581 -47.626 27.198 1.00 41.54 H new ATOM 0 HG22 VAL A 58 29.700 -47.487 25.820 1.00 41.54 H new ATOM 0 HG23 VAL A 58 30.217 -46.970 27.443 1.00 41.54 H new ATOM 887 N SER A 59 29.387 -42.441 26.556 1.00 21.42 N ATOM 888 CA SER A 59 29.004 -41.042 26.409 1.00 13.31 C ATOM 889 C SER A 59 29.686 -40.396 25.193 1.00 64.32 C ATOM 890 O SER A 59 29.010 -39.961 24.261 1.00 10.12 O ATOM 891 CB SER A 59 29.328 -40.293 27.710 1.00 41.31 C ATOM 892 OG SER A 59 28.876 -38.956 27.659 1.00 74.21 O ATOM 0 H SER A 59 29.629 -42.694 27.514 1.00 21.42 H new ATOM 0 HA SER A 59 27.931 -40.982 26.226 1.00 13.31 H new ATOM 0 HB2 SER A 59 28.862 -40.805 28.552 1.00 41.31 H new ATOM 0 HB3 SER A 59 30.404 -40.309 27.883 1.00 41.31 H new ATOM 0 HG SER A 59 29.094 -38.505 28.501 1.00 74.21 H new ATOM 898 N LYS A 60 31.023 -40.349 25.187 1.00 44.31 N ATOM 899 CA LYS A 60 31.777 -39.713 24.113 1.00 33.23 C ATOM 900 C LYS A 60 31.719 -40.498 22.798 1.00 73.31 C ATOM 901 O LYS A 60 31.749 -39.887 21.731 1.00 64.22 O ATOM 902 CB LYS A 60 33.209 -39.392 24.555 1.00 5.10 C ATOM 903 CG LYS A 60 34.033 -40.611 24.981 1.00 33.10 C ATOM 904 CD LYS A 60 35.497 -40.212 25.201 1.00 64.04 C ATOM 905 CE LYS A 60 36.341 -41.436 25.578 1.00 54.43 C ATOM 906 NZ LYS A 60 37.767 -41.090 25.720 1.00 4.31 N ATOM 0 H LYS A 60 31.605 -40.749 25.923 1.00 44.31 H new ATOM 0 HA LYS A 60 31.289 -38.762 23.898 1.00 33.23 H new ATOM 0 HB2 LYS A 60 33.724 -38.890 23.736 1.00 5.10 H new ATOM 0 HB3 LYS A 60 33.170 -38.688 25.386 1.00 5.10 H new ATOM 0 HG2 LYS A 60 33.622 -41.034 25.898 1.00 33.10 H new ATOM 0 HG3 LYS A 60 33.971 -41.386 24.217 1.00 33.10 H new ATOM 0 HD2 LYS A 60 35.895 -39.755 24.295 1.00 64.04 H new ATOM 0 HD3 LYS A 60 35.560 -39.463 25.990 1.00 64.04 H new ATOM 0 HE2 LYS A 60 35.974 -41.858 26.514 1.00 54.43 H new ATOM 0 HE3 LYS A 60 36.227 -42.206 24.815 1.00 54.43 H new ATOM 0 HZ1 LYS A 60 38.307 -41.941 25.975 1.00 4.31 H new ATOM 0 HZ2 LYS A 60 38.124 -40.711 24.820 1.00 4.31 H new ATOM 0 HZ3 LYS A 60 37.878 -40.373 26.466 1.00 4.31 H new ATOM 920 N ILE A 61 31.601 -41.831 22.860 1.00 62.22 N ATOM 921 CA ILE A 61 31.429 -42.674 21.680 1.00 63.22 C ATOM 922 C ILE A 61 30.114 -42.332 20.966 1.00 73.21 C ATOM 923 O ILE A 61 30.084 -42.301 19.738 1.00 74.44 O ATOM 924 CB ILE A 61 31.538 -44.160 22.074 1.00 32.52 C ATOM 925 CG1 ILE A 61 32.999 -44.480 22.447 1.00 50.52 C ATOM 926 CG2 ILE A 61 31.066 -45.082 20.938 1.00 72.31 C ATOM 927 CD1 ILE A 61 33.149 -45.784 23.236 1.00 41.54 C ATOM 0 H ILE A 61 31.623 -42.353 23.736 1.00 62.22 H new ATOM 0 HA ILE A 61 32.228 -42.478 20.965 1.00 63.22 H new ATOM 0 HB ILE A 61 30.889 -44.339 22.931 1.00 32.52 H new ATOM 0 HG12 ILE A 61 33.594 -44.544 21.536 1.00 50.52 H new ATOM 0 HG13 ILE A 61 33.405 -43.658 23.036 1.00 50.52 H new ATOM 0 HG21 ILE A 61 31.157 -46.122 21.252 1.00 72.31 H new ATOM 0 HG22 ILE A 61 30.024 -44.864 20.702 1.00 72.31 H new ATOM 0 HG23 ILE A 61 31.681 -44.914 20.054 1.00 72.31 H new ATOM 0 HD11 ILE A 61 34.201 -45.951 23.467 1.00 41.54 H new ATOM 0 HD12 ILE A 61 32.580 -45.716 24.163 1.00 41.54 H new ATOM 0 HD13 ILE A 61 32.772 -46.615 22.640 1.00 41.54 H new ATOM 939 N LEU A 62 29.047 -42.040 21.724 1.00 40.05 N ATOM 940 CA LEU A 62 27.762 -41.575 21.207 1.00 4.14 C ATOM 941 C LEU A 62 27.805 -40.101 20.767 1.00 35.43 C ATOM 942 O LEU A 62 26.799 -39.587 20.280 1.00 11.10 O ATOM 943 CB LEU A 62 26.665 -41.802 22.265 1.00 44.52 C ATOM 944 CG LEU A 62 25.958 -43.167 22.177 1.00 71.14 C ATOM 945 CD1 LEU A 62 24.982 -43.227 20.994 1.00 14.25 C ATOM 946 CD2 LEU A 62 26.925 -44.353 22.107 1.00 11.11 C ATOM 0 H LEU A 62 29.060 -42.125 22.740 1.00 40.05 H new ATOM 0 HA LEU A 62 27.531 -42.157 20.315 1.00 4.14 H new ATOM 0 HB2 LEU A 62 27.108 -41.701 23.256 1.00 44.52 H new ATOM 0 HB3 LEU A 62 25.918 -41.014 22.168 1.00 44.52 H new ATOM 0 HG LEU A 62 25.400 -43.257 23.109 1.00 71.14 H new ATOM 0 HD11 LEU A 62 24.503 -44.206 20.966 1.00 14.25 H new ATOM 0 HD12 LEU A 62 24.222 -42.455 21.110 1.00 14.25 H new ATOM 0 HD13 LEU A 62 25.527 -43.063 20.064 1.00 14.25 H new ATOM 0 HD21 LEU A 62 26.358 -45.282 22.047 1.00 11.11 H new ATOM 0 HD22 LEU A 62 27.557 -44.256 21.224 1.00 11.11 H new ATOM 0 HD23 LEU A 62 27.549 -44.366 23.000 1.00 11.11 H new ATOM 958 N GLY A 63 28.950 -39.418 20.907 1.00 24.41 N ATOM 959 CA GLY A 63 29.119 -38.041 20.468 1.00 31.44 C ATOM 960 C GLY A 63 28.365 -37.065 21.369 1.00 12.35 C ATOM 961 O GLY A 63 27.674 -36.177 20.873 1.00 52.44 O ATOM 0 H GLY A 63 29.787 -39.816 21.333 1.00 24.41 H new ATOM 0 HA2 GLY A 63 30.179 -37.788 20.464 1.00 31.44 H new ATOM 0 HA3 GLY A 63 28.763 -37.939 19.443 1.00 31.44 H new ATOM 1314 N LYS A 87 -1.152 -1.114 5.316 1.00 21.20 N ATOM 1315 CA LYS A 87 -1.204 -1.835 4.050 1.00 22.43 C ATOM 1316 C LYS A 87 -2.376 -2.829 3.983 1.00 64.53 C ATOM 1317 O LYS A 87 -2.724 -3.295 2.900 1.00 42.05 O ATOM 1318 CB LYS A 87 0.140 -2.530 3.801 1.00 61.25 C ATOM 1319 CG LYS A 87 0.335 -2.841 2.308 1.00 13.45 C ATOM 1320 CD LYS A 87 0.536 -4.336 2.029 1.00 54.33 C ATOM 1321 CE LYS A 87 0.324 -4.669 0.544 1.00 54.22 C ATOM 1322 NZ LYS A 87 1.078 -3.778 -0.358 1.00 74.33 N ATOM 0 HA LYS A 87 -1.384 -1.110 3.256 1.00 22.43 H new ATOM 0 HB2 LYS A 87 0.952 -1.894 4.152 1.00 61.25 H new ATOM 0 HB3 LYS A 87 0.187 -3.454 4.377 1.00 61.25 H new ATOM 0 HG2 LYS A 87 -0.533 -2.487 1.752 1.00 13.45 H new ATOM 0 HG3 LYS A 87 1.198 -2.288 1.937 1.00 13.45 H new ATOM 0 HD2 LYS A 87 1.542 -4.630 2.328 1.00 54.33 H new ATOM 0 HD3 LYS A 87 -0.159 -4.916 2.635 1.00 54.33 H new ATOM 0 HE2 LYS A 87 0.625 -5.701 0.362 1.00 54.22 H new ATOM 0 HE3 LYS A 87 -0.738 -4.600 0.310 1.00 54.22 H new ATOM 0 HZ1 LYS A 87 1.194 -4.238 -1.283 1.00 74.33 H new ATOM 0 HZ2 LYS A 87 0.559 -2.885 -0.478 1.00 74.33 H new ATOM 0 HZ3 LYS A 87 2.014 -3.582 0.051 1.00 74.33 H new ATOM 1336 N VAL A 88 -3.015 -3.127 5.122 1.00 25.22 N ATOM 1337 CA VAL A 88 -4.307 -3.800 5.173 1.00 13.50 C ATOM 1338 C VAL A 88 -5.303 -3.147 4.206 1.00 2.42 C ATOM 1339 O VAL A 88 -6.034 -3.858 3.525 1.00 0.41 O ATOM 1340 CB VAL A 88 -4.838 -3.806 6.619 1.00 63.33 C ATOM 1341 CG1 VAL A 88 -6.334 -4.142 6.674 1.00 64.41 C ATOM 1342 CG2 VAL A 88 -4.073 -4.836 7.458 1.00 3.52 C ATOM 0 H VAL A 88 -2.639 -2.902 6.043 1.00 25.22 H new ATOM 0 HA VAL A 88 -4.181 -4.834 4.853 1.00 13.50 H new ATOM 0 HB VAL A 88 -4.690 -2.804 7.021 1.00 63.33 H new ATOM 0 HG11 VAL A 88 -6.670 -4.136 7.711 1.00 64.41 H new ATOM 0 HG12 VAL A 88 -6.895 -3.399 6.106 1.00 64.41 H new ATOM 0 HG13 VAL A 88 -6.501 -5.129 6.244 1.00 64.41 H new ATOM 0 HG21 VAL A 88 -4.457 -4.831 8.478 1.00 3.52 H new ATOM 0 HG22 VAL A 88 -4.204 -5.828 7.025 1.00 3.52 H new ATOM 0 HG23 VAL A 88 -3.013 -4.582 7.468 1.00 3.52 H new ATOM 1352 N VAL A 89 -5.336 -1.809 4.133 1.00 52.51 N ATOM 1353 CA VAL A 89 -6.246 -1.080 3.253 1.00 32.43 C ATOM 1354 C VAL A 89 -6.021 -1.472 1.787 1.00 20.43 C ATOM 1355 O VAL A 89 -6.985 -1.694 1.055 1.00 52.32 O ATOM 1356 CB VAL A 89 -6.105 0.436 3.484 1.00 70.13 C ATOM 1357 CG1 VAL A 89 -7.028 1.227 2.548 1.00 12.20 C ATOM 1358 CG2 VAL A 89 -6.461 0.802 4.933 1.00 14.34 C ATOM 0 H VAL A 89 -4.729 -1.205 4.686 1.00 52.51 H new ATOM 0 HA VAL A 89 -7.273 -1.354 3.495 1.00 32.43 H new ATOM 0 HB VAL A 89 -5.066 0.695 3.278 1.00 70.13 H new ATOM 0 HG11 VAL A 89 -6.907 2.294 2.734 1.00 12.20 H new ATOM 0 HG12 VAL A 89 -6.770 1.008 1.512 1.00 12.20 H new ATOM 0 HG13 VAL A 89 -8.064 0.942 2.732 1.00 12.20 H new ATOM 0 HG21 VAL A 89 -6.354 1.878 5.073 1.00 14.34 H new ATOM 0 HG22 VAL A 89 -7.490 0.509 5.140 1.00 14.34 H new ATOM 0 HG23 VAL A 89 -5.791 0.279 5.615 1.00 14.34 H new ATOM 1368 N GLU A 90 -4.755 -1.588 1.364 1.00 71.23 N ATOM 1369 CA GLU A 90 -4.408 -2.060 0.028 1.00 21.23 C ATOM 1370 C GLU A 90 -4.922 -3.487 -0.169 1.00 32.45 C ATOM 1371 O GLU A 90 -5.490 -3.795 -1.216 1.00 11.34 O ATOM 1372 CB GLU A 90 -2.893 -2.008 -0.195 1.00 40.21 C ATOM 1373 CG GLU A 90 -2.328 -0.588 -0.063 1.00 72.44 C ATOM 1374 CD GLU A 90 -0.802 -0.579 -0.087 1.00 42.35 C ATOM 1375 OE1 GLU A 90 -0.232 -1.377 -0.868 1.00 43.25 O ATOM 1376 OE2 GLU A 90 -0.223 0.198 0.698 1.00 21.43 O ATOM 0 H GLU A 90 -3.947 -1.356 1.942 1.00 71.23 H new ATOM 0 HA GLU A 90 -4.881 -1.404 -0.703 1.00 21.23 H new ATOM 0 HB2 GLU A 90 -2.400 -2.660 0.526 1.00 40.21 H new ATOM 0 HB3 GLU A 90 -2.661 -2.397 -1.187 1.00 40.21 H new ATOM 0 HG2 GLU A 90 -2.708 0.031 -0.876 1.00 72.44 H new ATOM 0 HG3 GLU A 90 -2.679 -0.142 0.868 1.00 72.44 H new ATOM 1383 N LYS A 91 -4.748 -4.345 0.846 1.00 54.03 N ATOM 1384 CA LYS A 91 -5.254 -5.708 0.820 1.00 41.53 C ATOM 1385 C LYS A 91 -6.776 -5.756 0.693 1.00 50.40 C ATOM 1386 O LYS A 91 -7.260 -6.626 -0.022 1.00 72.35 O ATOM 1387 CB LYS A 91 -4.758 -6.525 2.019 1.00 41.02 C ATOM 1388 CG LYS A 91 -3.255 -6.826 1.970 1.00 5.31 C ATOM 1389 CD LYS A 91 -2.906 -7.757 0.794 1.00 54.22 C ATOM 1390 CE LYS A 91 -1.507 -8.372 0.900 1.00 61.44 C ATOM 1391 NZ LYS A 91 -1.420 -9.349 1.996 1.00 34.44 N ATOM 0 H LYS A 91 -4.251 -4.105 1.704 1.00 54.03 H new ATOM 0 HA LYS A 91 -4.848 -6.175 -0.077 1.00 41.53 H new ATOM 0 HB2 LYS A 91 -4.983 -5.982 2.937 1.00 41.02 H new ATOM 0 HB3 LYS A 91 -5.308 -7.465 2.062 1.00 41.02 H new ATOM 0 HG2 LYS A 91 -2.699 -5.893 1.875 1.00 5.31 H new ATOM 0 HG3 LYS A 91 -2.944 -7.289 2.907 1.00 5.31 H new ATOM 0 HD2 LYS A 91 -3.644 -8.558 0.743 1.00 54.22 H new ATOM 0 HD3 LYS A 91 -2.979 -7.196 -0.138 1.00 54.22 H new ATOM 0 HE2 LYS A 91 -1.252 -8.859 -0.041 1.00 61.44 H new ATOM 0 HE3 LYS A 91 -0.774 -7.581 1.059 1.00 61.44 H new ATOM 0 HZ1 LYS A 91 -0.743 -10.096 1.742 1.00 34.44 H new ATOM 0 HZ2 LYS A 91 -1.099 -8.871 2.862 1.00 34.44 H new ATOM 0 HZ3 LYS A 91 -2.356 -9.771 2.160 1.00 34.44 H new ATOM 1405 N ILE A 92 -7.542 -4.844 1.313 1.00 11.13 N ATOM 1406 CA ILE A 92 -8.971 -4.752 1.014 1.00 33.00 C ATOM 1407 C ILE A 92 -9.173 -4.525 -0.486 1.00 11.32 C ATOM 1408 O ILE A 92 -9.954 -5.242 -1.105 1.00 72.50 O ATOM 1409 CB ILE A 92 -9.681 -3.662 1.836 1.00 15.22 C ATOM 1410 CG1 ILE A 92 -9.469 -3.812 3.349 1.00 20.23 C ATOM 1411 CG2 ILE A 92 -11.187 -3.646 1.524 1.00 41.52 C ATOM 1412 CD1 ILE A 92 -9.796 -5.201 3.903 1.00 5.33 C ATOM 0 H ILE A 92 -7.203 -4.178 2.007 1.00 11.13 H new ATOM 0 HA ILE A 92 -9.428 -5.699 1.302 1.00 33.00 H new ATOM 0 HB ILE A 92 -9.229 -2.715 1.540 1.00 15.22 H new ATOM 0 HG12 ILE A 92 -8.430 -3.577 3.582 1.00 20.23 H new ATOM 0 HG13 ILE A 92 -10.086 -3.075 3.864 1.00 20.23 H new ATOM 0 HG21 ILE A 92 -11.673 -2.869 2.114 1.00 41.52 H new ATOM 0 HG22 ILE A 92 -11.337 -3.443 0.464 1.00 41.52 H new ATOM 0 HG23 ILE A 92 -11.620 -4.615 1.773 1.00 41.52 H new ATOM 0 HD11 ILE A 92 -9.617 -5.215 4.978 1.00 5.33 H new ATOM 0 HD12 ILE A 92 -10.842 -5.434 3.706 1.00 5.33 H new ATOM 0 HD13 ILE A 92 -9.161 -5.944 3.420 1.00 5.33 H new ATOM 1424 N GLY A 93 -8.452 -3.555 -1.064 1.00 25.51 N ATOM 1425 CA GLY A 93 -8.465 -3.277 -2.495 1.00 61.24 C ATOM 1426 C GLY A 93 -8.295 -4.551 -3.324 1.00 64.42 C ATOM 1427 O GLY A 93 -9.139 -4.861 -4.165 1.00 11.22 O ATOM 0 H GLY A 93 -7.836 -2.936 -0.537 1.00 25.51 H new ATOM 0 HA2 GLY A 93 -9.404 -2.792 -2.762 1.00 61.24 H new ATOM 0 HA3 GLY A 93 -7.665 -2.577 -2.736 1.00 61.24 H new ATOM 1431 N ASP A 94 -7.219 -5.302 -3.062 1.00 2.14 N ATOM 1432 CA ASP A 94 -6.934 -6.559 -3.737 1.00 75.53 C ATOM 1433 C ASP A 94 -8.060 -7.568 -3.529 1.00 25.10 C ATOM 1434 O ASP A 94 -8.496 -8.198 -4.484 1.00 52.11 O ATOM 1435 CB ASP A 94 -5.612 -7.149 -3.235 1.00 14.54 C ATOM 1436 CG ASP A 94 -4.419 -6.230 -3.488 1.00 33.43 C ATOM 1437 OD1 ASP A 94 -4.310 -5.738 -4.633 1.00 1.41 O ATOM 1438 OD2 ASP A 94 -3.632 -6.044 -2.534 1.00 74.25 O ATOM 0 H ASP A 94 -6.518 -5.045 -2.367 1.00 2.14 H new ATOM 0 HA ASP A 94 -6.853 -6.350 -4.804 1.00 75.53 H new ATOM 0 HB2 ASP A 94 -5.691 -7.348 -2.166 1.00 14.54 H new ATOM 0 HB3 ASP A 94 -5.437 -8.107 -3.726 1.00 14.54 H new ATOM 1443 N TYR A 95 -8.526 -7.737 -2.290 1.00 24.44 N ATOM 1444 CA TYR A 95 -9.542 -8.720 -1.955 1.00 13.41 C ATOM 1445 C TYR A 95 -10.923 -8.373 -2.509 1.00 3.22 C ATOM 1446 O TYR A 95 -11.723 -9.284 -2.678 1.00 11.23 O ATOM 1447 CB TYR A 95 -9.576 -8.990 -0.446 1.00 63.44 C ATOM 1448 CG TYR A 95 -8.519 -9.968 0.033 1.00 11.14 C ATOM 1449 CD1 TYR A 95 -8.513 -11.276 -0.486 1.00 63.31 C ATOM 1450 CD2 TYR A 95 -7.559 -9.597 0.995 1.00 71.34 C ATOM 1451 CE1 TYR A 95 -7.477 -12.163 -0.154 1.00 4.43 C ATOM 1452 CE2 TYR A 95 -6.512 -10.480 1.318 1.00 31.12 C ATOM 1453 CZ TYR A 95 -6.458 -11.752 0.718 1.00 62.22 C ATOM 1454 OH TYR A 95 -5.421 -12.597 0.969 1.00 1.52 O ATOM 0 H TYR A 95 -8.204 -7.190 -1.492 1.00 24.44 H new ATOM 0 HA TYR A 95 -9.253 -9.646 -2.453 1.00 13.41 H new ATOM 0 HB2 TYR A 95 -9.449 -8.046 0.084 1.00 63.44 H new ATOM 0 HB3 TYR A 95 -10.560 -9.376 -0.179 1.00 63.44 H new ATOM 0 HD1 TYR A 95 -9.308 -11.598 -1.142 1.00 63.31 H new ATOM 0 HD2 TYR A 95 -7.626 -8.636 1.484 1.00 71.34 H new ATOM 0 HE1 TYR A 95 -7.464 -13.160 -0.569 1.00 4.43 H new ATOM 0 HE2 TYR A 95 -5.752 -10.182 2.025 1.00 31.12 H new ATOM 0 HH TYR A 95 -4.659 -12.086 1.313 1.00 1.52 H new ATOM 1464 N LYS A 96 -11.217 -7.110 -2.842 1.00 41.13 N ATOM 1465 CA LYS A 96 -12.410 -6.809 -3.624 1.00 65.24 C ATOM 1466 C LYS A 96 -12.233 -7.307 -5.062 1.00 75.52 C ATOM 1467 O LYS A 96 -13.162 -7.884 -5.623 1.00 71.01 O ATOM 1468 CB LYS A 96 -12.753 -5.314 -3.583 1.00 40.23 C ATOM 1469 CG LYS A 96 -13.196 -4.808 -2.198 1.00 3.50 C ATOM 1470 CD LYS A 96 -14.358 -5.576 -1.545 1.00 64.02 C ATOM 1471 CE LYS A 96 -15.607 -5.722 -2.425 1.00 33.31 C ATOM 1472 NZ LYS A 96 -16.134 -4.419 -2.866 1.00 62.31 N ATOM 0 H LYS A 96 -10.655 -6.299 -2.586 1.00 41.13 H new ATOM 0 HA LYS A 96 -13.254 -7.335 -3.178 1.00 65.24 H new ATOM 0 HB2 LYS A 96 -11.882 -4.743 -3.905 1.00 40.23 H new ATOM 0 HB3 LYS A 96 -13.548 -5.115 -4.302 1.00 40.23 H new ATOM 0 HG2 LYS A 96 -12.338 -4.845 -1.527 1.00 3.50 H new ATOM 0 HG3 LYS A 96 -13.484 -3.761 -2.290 1.00 3.50 H new ATOM 0 HD2 LYS A 96 -14.008 -6.570 -1.268 1.00 64.02 H new ATOM 0 HD3 LYS A 96 -14.638 -5.068 -0.622 1.00 64.02 H new ATOM 0 HE2 LYS A 96 -15.365 -6.328 -3.298 1.00 33.31 H new ATOM 0 HE3 LYS A 96 -16.379 -6.255 -1.871 1.00 33.31 H new ATOM 0 HZ1 LYS A 96 -17.005 -4.565 -3.415 1.00 62.31 H new ATOM 0 HZ2 LYS A 96 -16.343 -3.830 -2.035 1.00 62.31 H new ATOM 0 HZ3 LYS A 96 -15.427 -3.942 -3.460 1.00 62.31 H new ATOM 1486 N ARG A 97 -11.049 -7.111 -5.655 1.00 3.31 N ATOM 1487 CA ARG A 97 -10.750 -7.581 -7.005 1.00 61.40 C ATOM 1488 C ARG A 97 -10.774 -9.114 -7.081 1.00 44.14 C ATOM 1489 O ARG A 97 -11.327 -9.670 -8.027 1.00 73.11 O ATOM 1490 CB ARG A 97 -9.394 -7.025 -7.467 1.00 4.43 C ATOM 1491 CG ARG A 97 -9.438 -5.503 -7.662 1.00 33.52 C ATOM 1492 CD ARG A 97 -8.033 -4.884 -7.665 1.00 61.41 C ATOM 1493 NE ARG A 97 -7.076 -5.634 -8.494 1.00 1.44 N ATOM 1494 CZ ARG A 97 -7.023 -5.633 -9.836 1.00 23.22 C ATOM 1495 NH1 ARG A 97 -7.882 -4.898 -10.558 1.00 5.42 N ATOM 1496 NH2 ARG A 97 -6.101 -6.378 -10.459 1.00 2.43 N ATOM 0 H ARG A 97 -10.274 -6.621 -5.209 1.00 3.31 H new ATOM 0 HA ARG A 97 -11.525 -7.212 -7.677 1.00 61.40 H new ATOM 0 HB2 ARG A 97 -8.629 -7.275 -6.732 1.00 4.43 H new ATOM 0 HB3 ARG A 97 -9.105 -7.503 -8.403 1.00 4.43 H new ATOM 0 HG2 ARG A 97 -9.938 -5.272 -8.603 1.00 33.52 H new ATOM 0 HG3 ARG A 97 -10.031 -5.052 -6.866 1.00 33.52 H new ATOM 0 HD2 ARG A 97 -8.095 -3.858 -8.029 1.00 61.41 H new ATOM 0 HD3 ARG A 97 -7.660 -4.837 -6.642 1.00 61.41 H new ATOM 0 HE ARG A 97 -6.389 -6.208 -8.004 1.00 1.44 H new ATOM 0 HH11 ARG A 97 -8.587 -4.330 -10.088 1.00 5.42 H new ATOM 0 HH12 ARG A 97 -7.830 -4.907 -11.577 1.00 5.42 H new ATOM 0 HH21 ARG A 97 -5.447 -6.940 -9.915 1.00 2.43 H new ATOM 0 HH22 ARG A 97 -6.053 -6.384 -11.478 1.00 2.43 H new ATOM 1510 N GLN A 98 -10.175 -9.792 -6.094 1.00 12.44 N ATOM 1511 CA GLN A 98 -10.061 -11.243 -6.046 1.00 15.43 C ATOM 1512 C GLN A 98 -11.384 -11.876 -5.606 1.00 35.53 C ATOM 1513 O GLN A 98 -11.874 -12.796 -6.257 1.00 25.03 O ATOM 1514 CB GLN A 98 -8.923 -11.654 -5.099 1.00 43.50 C ATOM 1515 CG GLN A 98 -7.536 -11.213 -5.593 1.00 50.32 C ATOM 1516 CD GLN A 98 -7.065 -11.953 -6.845 1.00 71.43 C ATOM 1517 OE1 GLN A 98 -7.616 -12.985 -7.220 1.00 3.12 O ATOM 1518 NE2 GLN A 98 -6.030 -11.424 -7.499 1.00 25.33 N ATOM 0 H GLN A 98 -9.748 -9.330 -5.291 1.00 12.44 H new ATOM 0 HA GLN A 98 -9.829 -11.606 -7.047 1.00 15.43 H new ATOM 0 HB2 GLN A 98 -9.105 -11.223 -4.114 1.00 43.50 H new ATOM 0 HB3 GLN A 98 -8.932 -12.737 -4.980 1.00 43.50 H new ATOM 0 HG2 GLN A 98 -7.557 -10.143 -5.801 1.00 50.32 H new ATOM 0 HG3 GLN A 98 -6.810 -11.368 -4.795 1.00 50.32 H new ATOM 0 HE21 GLN A 98 -5.597 -10.566 -7.159 1.00 25.33 H new ATOM 0 HE22 GLN A 98 -5.672 -11.878 -8.339 1.00 25.33 H new ATOM 1527 N ASN A 99 -11.944 -11.384 -4.494 1.00 45.13 N ATOM 1528 CA ASN A 99 -13.166 -11.873 -3.866 1.00 33.13 C ATOM 1529 C ASN A 99 -14.218 -10.752 -3.840 1.00 63.11 C ATOM 1530 O ASN A 99 -14.478 -10.176 -2.784 1.00 51.24 O ATOM 1531 CB ASN A 99 -12.818 -12.380 -2.456 1.00 42.13 C ATOM 1532 CG ASN A 99 -13.990 -13.047 -1.754 1.00 54.34 C ATOM 1533 OD1 ASN A 99 -14.313 -14.200 -2.033 1.00 44.31 O ATOM 1534 ND2 ASN A 99 -14.593 -12.353 -0.797 1.00 61.34 N ATOM 0 H ASN A 99 -11.535 -10.598 -3.989 1.00 45.13 H new ATOM 0 HA ASN A 99 -13.594 -12.700 -4.432 1.00 33.13 H new ATOM 0 HB2 ASN A 99 -11.993 -13.089 -2.525 1.00 42.13 H new ATOM 0 HB3 ASN A 99 -12.469 -11.543 -1.851 1.00 42.13 H new ATOM 0 HD21 ASN A 99 -15.353 -12.774 -0.263 1.00 61.34 H new ATOM 0 HD22 ASN A 99 -14.296 -11.398 -0.595 1.00 61.34 H new ATOM 1541 N PRO A 100 -14.854 -10.434 -4.983 1.00 55.03 N ATOM 1542 CA PRO A 100 -15.898 -9.417 -5.064 1.00 1.11 C ATOM 1543 C PRO A 100 -17.214 -9.855 -4.406 1.00 71.51 C ATOM 1544 O PRO A 100 -18.139 -9.050 -4.320 1.00 13.51 O ATOM 1545 CB PRO A 100 -16.101 -9.172 -6.564 1.00 1.10 C ATOM 1546 CG PRO A 100 -15.756 -10.526 -7.179 1.00 43.44 C ATOM 1547 CD PRO A 100 -14.606 -11.007 -6.297 1.00 24.24 C ATOM 0 HA PRO A 100 -15.598 -8.519 -4.524 1.00 1.11 H new ATOM 0 HB2 PRO A 100 -17.125 -8.874 -6.790 1.00 1.10 H new ATOM 0 HB3 PRO A 100 -15.450 -8.381 -6.936 1.00 1.10 H new ATOM 0 HG2 PRO A 100 -16.603 -11.212 -7.151 1.00 43.44 H new ATOM 0 HG3 PRO A 100 -15.455 -10.433 -8.223 1.00 43.44 H new ATOM 0 HD2 PRO A 100 -14.577 -12.096 -6.251 1.00 24.24 H new ATOM 0 HD3 PRO A 100 -13.645 -10.679 -6.693 1.00 24.24 H new ATOM 1555 N THR A 101 -17.311 -11.117 -3.965 1.00 13.32 N ATOM 1556 CA THR A 101 -18.529 -11.721 -3.446 1.00 22.04 C ATOM 1557 C THR A 101 -19.089 -10.944 -2.251 1.00 13.25 C ATOM 1558 O THR A 101 -20.234 -10.499 -2.299 1.00 44.21 O ATOM 1559 CB THR A 101 -18.259 -13.190 -3.086 1.00 41.23 C ATOM 1560 OG1 THR A 101 -17.188 -13.281 -2.168 1.00 14.35 O ATOM 1561 CG2 THR A 101 -17.916 -14.017 -4.330 1.00 15.22 C ATOM 0 H THR A 101 -16.517 -11.757 -3.963 1.00 13.32 H new ATOM 0 HA THR A 101 -19.293 -11.681 -4.223 1.00 22.04 H new ATOM 0 HB THR A 101 -19.169 -13.588 -2.638 1.00 41.23 H new ATOM 0 HG1 THR A 101 -16.440 -13.758 -2.584 1.00 14.35 H new ATOM 0 HG21 THR A 101 -17.731 -15.051 -4.040 1.00 15.22 H new ATOM 0 HG22 THR A 101 -18.749 -13.981 -5.032 1.00 15.22 H new ATOM 0 HG23 THR A 101 -17.024 -13.608 -4.804 1.00 15.22 H new ATOM 1569 N MET A 102 -18.296 -10.811 -1.180 1.00 53.53 N ATOM 1570 CA MET A 102 -18.742 -10.280 0.099 1.00 5.24 C ATOM 1571 C MET A 102 -18.047 -8.966 0.453 1.00 71.33 C ATOM 1572 O MET A 102 -17.087 -8.540 -0.187 1.00 14.14 O ATOM 1573 CB MET A 102 -18.529 -11.336 1.188 1.00 24.21 C ATOM 1574 CG MET A 102 -19.499 -12.503 0.995 1.00 4.21 C ATOM 1575 SD MET A 102 -19.398 -13.814 2.242 1.00 23.12 S ATOM 1576 CE MET A 102 -20.331 -13.046 3.594 1.00 42.20 C ATOM 0 H MET A 102 -17.311 -11.076 -1.186 1.00 53.53 H new ATOM 0 HA MET A 102 -19.805 -10.050 0.024 1.00 5.24 H new ATOM 0 HB2 MET A 102 -17.502 -11.699 1.156 1.00 24.21 H new ATOM 0 HB3 MET A 102 -18.678 -10.889 2.171 1.00 24.21 H new ATOM 0 HG2 MET A 102 -20.516 -12.110 0.987 1.00 4.21 H new ATOM 0 HG3 MET A 102 -19.320 -12.944 0.014 1.00 4.21 H new ATOM 0 HE1 MET A 102 -19.906 -13.352 4.550 1.00 42.20 H new ATOM 0 HE2 MET A 102 -20.276 -11.961 3.503 1.00 42.20 H new ATOM 0 HE3 MET A 102 -21.373 -13.362 3.543 1.00 42.20 H new ATOM 1586 N PHE A 103 -18.596 -8.330 1.491 1.00 55.04 N ATOM 1587 CA PHE A 103 -18.248 -7.001 1.973 1.00 3.44 C ATOM 1588 C PHE A 103 -17.179 -7.089 3.071 1.00 65.22 C ATOM 1589 O PHE A 103 -16.770 -8.184 3.453 1.00 1.44 O ATOM 1590 CB PHE A 103 -19.547 -6.352 2.473 1.00 5.10 C ATOM 1591 CG PHE A 103 -19.490 -4.862 2.743 1.00 20.21 C ATOM 1592 CD1 PHE A 103 -19.551 -3.948 1.675 1.00 63.50 C ATOM 1593 CD2 PHE A 103 -19.501 -4.387 4.067 1.00 72.14 C ATOM 1594 CE1 PHE A 103 -19.647 -2.570 1.931 1.00 1.33 C ATOM 1595 CE2 PHE A 103 -19.655 -3.016 4.324 1.00 70.23 C ATOM 1596 CZ PHE A 103 -19.714 -2.104 3.256 1.00 3.13 C ATOM 0 H PHE A 103 -19.337 -8.758 2.046 1.00 55.04 H new ATOM 0 HA PHE A 103 -17.815 -6.390 1.181 1.00 3.44 H new ATOM 0 HB2 PHE A 103 -20.328 -6.537 1.736 1.00 5.10 H new ATOM 0 HB3 PHE A 103 -19.850 -6.855 3.391 1.00 5.10 H new ATOM 0 HD1 PHE A 103 -19.524 -4.306 0.657 1.00 63.50 H new ATOM 0 HD2 PHE A 103 -19.391 -5.080 4.888 1.00 72.14 H new ATOM 0 HE1 PHE A 103 -19.669 -1.869 1.110 1.00 1.33 H new ATOM 0 HE2 PHE A 103 -19.728 -2.662 5.342 1.00 70.23 H new ATOM 0 HZ PHE A 103 -19.811 -1.047 3.453 1.00 3.13 H new ATOM 1606 N ALA A 104 -16.735 -5.926 3.572 1.00 31.41 N ATOM 1607 CA ALA A 104 -15.701 -5.746 4.591 1.00 63.22 C ATOM 1608 C ALA A 104 -15.778 -6.751 5.747 1.00 32.33 C ATOM 1609 O ALA A 104 -14.742 -7.221 6.214 1.00 53.22 O ATOM 1610 CB ALA A 104 -15.776 -4.314 5.130 1.00 34.43 C ATOM 0 H ALA A 104 -17.115 -5.034 3.254 1.00 31.41 H new ATOM 0 HA ALA A 104 -14.743 -5.932 4.105 1.00 63.22 H new ATOM 0 HB1 ALA A 104 -15.008 -4.171 5.891 1.00 34.43 H new ATOM 0 HB2 ALA A 104 -15.615 -3.609 4.314 1.00 34.43 H new ATOM 0 HB3 ALA A 104 -16.759 -4.142 5.569 1.00 34.43 H new ATOM 1616 N TRP A 105 -16.998 -7.082 6.195 1.00 12.43 N ATOM 1617 CA TRP A 105 -17.264 -8.053 7.253 1.00 2.14 C ATOM 1618 C TRP A 105 -16.532 -9.380 7.022 1.00 31.35 C ATOM 1619 O TRP A 105 -16.012 -9.962 7.970 1.00 3.10 O ATOM 1620 CB TRP A 105 -18.776 -8.298 7.367 1.00 70.51 C ATOM 1621 CG TRP A 105 -19.651 -7.082 7.437 1.00 72.55 C ATOM 1622 CD1 TRP A 105 -20.652 -6.790 6.576 1.00 64.31 C ATOM 1623 CD2 TRP A 105 -19.631 -5.984 8.400 1.00 1.25 C ATOM 1624 NE1 TRP A 105 -21.224 -5.579 6.906 1.00 60.22 N ATOM 1625 CE2 TRP A 105 -20.625 -5.034 8.022 1.00 31.13 C ATOM 1626 CE3 TRP A 105 -18.882 -5.697 9.563 1.00 22.21 C ATOM 1627 CZ2 TRP A 105 -20.842 -3.847 8.739 1.00 42.21 C ATOM 1628 CZ3 TRP A 105 -19.098 -4.513 10.294 1.00 62.40 C ATOM 1629 CH2 TRP A 105 -20.066 -3.583 9.877 1.00 11.42 C ATOM 0 H TRP A 105 -17.849 -6.666 5.816 1.00 12.43 H new ATOM 0 HA TRP A 105 -16.886 -7.634 8.185 1.00 2.14 H new ATOM 0 HB2 TRP A 105 -19.090 -8.894 6.510 1.00 70.51 H new ATOM 0 HB3 TRP A 105 -18.957 -8.900 8.258 1.00 70.51 H new ATOM 0 HD1 TRP A 105 -20.959 -7.414 5.750 1.00 64.31 H new ATOM 0 HE1 TRP A 105 -21.990 -5.144 6.392 1.00 60.22 H new ATOM 0 HE3 TRP A 105 -18.131 -6.398 9.897 1.00 22.21 H new ATOM 0 HZ2 TRP A 105 -21.598 -3.145 8.418 1.00 42.21 H new ATOM 0 HZ3 TRP A 105 -18.515 -4.318 11.182 1.00 62.40 H new ATOM 0 HH2 TRP A 105 -20.212 -2.668 10.431 1.00 11.42 H new ATOM 1640 N GLU A 106 -16.500 -9.845 5.767 1.00 42.12 N ATOM 1641 CA GLU A 106 -15.834 -11.070 5.346 1.00 52.13 C ATOM 1642 C GLU A 106 -14.360 -10.812 5.027 1.00 42.20 C ATOM 1643 O GLU A 106 -13.511 -11.634 5.363 1.00 13.41 O ATOM 1644 CB GLU A 106 -16.566 -11.637 4.122 1.00 51.41 C ATOM 1645 CG GLU A 106 -15.951 -12.939 3.593 1.00 71.02 C ATOM 1646 CD GLU A 106 -15.959 -14.048 4.640 1.00 32.21 C ATOM 1647 OE1 GLU A 106 -17.070 -14.523 4.955 1.00 13.25 O ATOM 1648 OE2 GLU A 106 -14.850 -14.409 5.094 1.00 62.43 O ATOM 0 H GLU A 106 -16.955 -9.357 4.995 1.00 42.12 H new ATOM 0 HA GLU A 106 -15.867 -11.796 6.159 1.00 52.13 H new ATOM 0 HB2 GLU A 106 -17.609 -11.816 4.383 1.00 51.41 H new ATOM 0 HB3 GLU A 106 -16.560 -10.892 3.327 1.00 51.41 H new ATOM 0 HG2 GLU A 106 -16.504 -13.269 2.713 1.00 71.02 H new ATOM 0 HG3 GLU A 106 -14.926 -12.751 3.273 1.00 71.02 H new ATOM 1655 N ILE A 107 -14.045 -9.694 4.357 1.00 31.43 N ATOM 1656 CA ILE A 107 -12.674 -9.403 3.939 1.00 63.44 C ATOM 1657 C ILE A 107 -11.735 -9.290 5.149 1.00 61.15 C ATOM 1658 O ILE A 107 -10.570 -9.674 5.064 1.00 75.34 O ATOM 1659 CB ILE A 107 -12.601 -8.165 3.030 1.00 1.32 C ATOM 1660 CG1 ILE A 107 -13.616 -8.177 1.870 1.00 51.53 C ATOM 1661 CG2 ILE A 107 -11.181 -8.049 2.464 1.00 31.03 C ATOM 1662 CD1 ILE A 107 -13.640 -9.464 1.036 1.00 1.32 C ATOM 0 H ILE A 107 -14.724 -8.979 4.095 1.00 31.43 H new ATOM 0 HA ILE A 107 -12.329 -10.246 3.341 1.00 63.44 H new ATOM 0 HB ILE A 107 -12.858 -7.305 3.649 1.00 1.32 H new ATOM 0 HG12 ILE A 107 -14.612 -8.009 2.279 1.00 51.53 H new ATOM 0 HG13 ILE A 107 -13.398 -7.339 1.209 1.00 51.53 H new ATOM 0 HG21 ILE A 107 -11.117 -7.174 1.817 1.00 31.03 H new ATOM 0 HG22 ILE A 107 -10.470 -7.947 3.284 1.00 31.03 H new ATOM 0 HG23 ILE A 107 -10.945 -8.944 1.888 1.00 31.03 H new ATOM 0 HD11 ILE A 107 -14.386 -9.372 0.247 1.00 1.32 H new ATOM 0 HD12 ILE A 107 -12.659 -9.627 0.591 1.00 1.32 H new ATOM 0 HD13 ILE A 107 -13.892 -10.308 1.677 1.00 1.32 H new ATOM 1674 N ARG A 108 -12.265 -8.822 6.286 1.00 42.31 N ATOM 1675 CA ARG A 108 -11.665 -8.937 7.610 1.00 65.45 C ATOM 1676 C ARG A 108 -10.964 -10.292 7.792 1.00 1.44 C ATOM 1677 O ARG A 108 -9.817 -10.340 8.229 1.00 42.35 O ATOM 1678 CB ARG A 108 -12.793 -8.773 8.634 1.00 42.12 C ATOM 1679 CG ARG A 108 -12.349 -8.932 10.097 1.00 23.42 C ATOM 1680 CD ARG A 108 -13.572 -9.105 11.006 1.00 62.15 C ATOM 1681 NE ARG A 108 -14.309 -10.329 10.661 1.00 10.23 N ATOM 1682 CZ ARG A 108 -15.503 -10.695 11.151 1.00 45.10 C ATOM 1683 NH1 ARG A 108 -16.093 -9.989 12.126 1.00 11.10 N ATOM 1684 NH2 ARG A 108 -16.103 -11.780 10.648 1.00 52.10 N ATOM 0 H ARG A 108 -13.160 -8.334 6.303 1.00 42.31 H new ATOM 0 HA ARG A 108 -10.903 -8.170 7.744 1.00 65.45 H new ATOM 0 HB2 ARG A 108 -13.241 -7.788 8.508 1.00 42.12 H new ATOM 0 HB3 ARG A 108 -13.570 -9.507 8.421 1.00 42.12 H new ATOM 0 HG2 ARG A 108 -11.690 -9.795 10.193 1.00 23.42 H new ATOM 0 HG3 ARG A 108 -11.776 -8.058 10.408 1.00 23.42 H new ATOM 0 HD2 ARG A 108 -13.254 -9.148 12.048 1.00 62.15 H new ATOM 0 HD3 ARG A 108 -14.228 -8.240 10.909 1.00 62.15 H new ATOM 0 HE ARG A 108 -13.872 -10.958 9.987 1.00 10.23 H new ATOM 0 HH11 ARG A 108 -15.634 -9.161 12.505 1.00 11.10 H new ATOM 0 HH12 ARG A 108 -17.001 -10.280 12.488 1.00 11.10 H new ATOM 0 HH21 ARG A 108 -15.652 -12.314 9.905 1.00 52.10 H new ATOM 0 HH22 ARG A 108 -17.011 -12.074 11.008 1.00 52.10 H new ATOM 1698 N ASP A 109 -11.663 -11.385 7.469 1.00 42.43 N ATOM 1699 CA ASP A 109 -11.208 -12.752 7.685 1.00 30.41 C ATOM 1700 C ASP A 109 -10.279 -13.244 6.571 1.00 14.31 C ATOM 1701 O ASP A 109 -9.453 -14.117 6.828 1.00 44.03 O ATOM 1702 CB ASP A 109 -12.412 -13.678 7.865 1.00 53.14 C ATOM 1703 CG ASP A 109 -13.344 -13.182 8.968 1.00 10.32 C ATOM 1704 OD1 ASP A 109 -13.111 -13.558 10.136 1.00 73.30 O ATOM 1705 OD2 ASP A 109 -14.265 -12.405 8.633 1.00 45.24 O ATOM 0 H ASP A 109 -12.586 -11.336 7.038 1.00 42.43 H new ATOM 0 HA ASP A 109 -10.614 -12.766 8.599 1.00 30.41 H new ATOM 0 HB2 ASP A 109 -12.962 -13.746 6.927 1.00 53.14 H new ATOM 0 HB3 ASP A 109 -12.066 -14.683 8.105 1.00 53.14 H new ATOM 1710 N ARG A 110 -10.369 -12.693 5.350 1.00 24.24 N ATOM 1711 CA ARG A 110 -9.414 -12.980 4.285 1.00 50.34 C ATOM 1712 C ARG A 110 -7.994 -12.588 4.714 1.00 22.41 C ATOM 1713 O ARG A 110 -7.038 -13.292 4.391 1.00 43.43 O ATOM 1714 CB ARG A 110 -9.809 -12.239 3.000 1.00 73.43 C ATOM 1715 CG ARG A 110 -10.675 -13.057 2.036 1.00 13.23 C ATOM 1716 CD ARG A 110 -12.059 -13.407 2.589 1.00 64.10 C ATOM 1717 NE ARG A 110 -12.875 -14.028 1.535 1.00 33.41 N ATOM 1718 CZ ARG A 110 -13.664 -15.111 1.653 1.00 42.02 C ATOM 1719 NH1 ARG A 110 -13.893 -15.690 2.839 1.00 72.41 N ATOM 1720 NH2 ARG A 110 -14.239 -15.623 0.556 1.00 64.43 N ATOM 0 H ARG A 110 -11.105 -12.040 5.081 1.00 24.24 H new ATOM 0 HA ARG A 110 -9.430 -14.052 4.087 1.00 50.34 H new ATOM 0 HB2 ARG A 110 -10.347 -11.330 3.270 1.00 73.43 H new ATOM 0 HB3 ARG A 110 -8.902 -11.930 2.480 1.00 73.43 H new ATOM 0 HG2 ARG A 110 -10.796 -12.498 1.108 1.00 13.23 H new ATOM 0 HG3 ARG A 110 -10.151 -13.979 1.786 1.00 13.23 H new ATOM 0 HD2 ARG A 110 -11.961 -14.088 3.434 1.00 64.10 H new ATOM 0 HD3 ARG A 110 -12.551 -12.508 2.960 1.00 64.10 H new ATOM 0 HE ARG A 110 -12.839 -13.590 0.615 1.00 33.41 H new ATOM 0 HH11 ARG A 110 -13.464 -15.310 3.683 1.00 72.41 H new ATOM 0 HH12 ARG A 110 -14.496 -16.511 2.898 1.00 72.41 H new ATOM 0 HH21 ARG A 110 -14.076 -15.192 -0.354 1.00 64.43 H new ATOM 0 HH22 ARG A 110 -14.840 -16.444 0.631 1.00 64.43 H new ATOM 1734 N LEU A 111 -7.858 -11.476 5.453 1.00 5.52 N ATOM 1735 CA LEU A 111 -6.577 -11.032 5.993 1.00 2.34 C ATOM 1736 C LEU A 111 -5.992 -12.114 6.902 1.00 14.55 C ATOM 1737 O LEU A 111 -4.818 -12.461 6.784 1.00 13.45 O ATOM 1738 CB LEU A 111 -6.736 -9.727 6.782 1.00 72.31 C ATOM 1739 CG LEU A 111 -7.229 -8.560 5.914 1.00 73.10 C ATOM 1740 CD1 LEU A 111 -7.806 -7.472 6.825 1.00 10.35 C ATOM 1741 CD2 LEU A 111 -6.108 -7.970 5.051 1.00 24.43 C ATOM 0 H LEU A 111 -8.638 -10.863 5.690 1.00 5.52 H new ATOM 0 HA LEU A 111 -5.900 -10.851 5.158 1.00 2.34 H new ATOM 0 HB2 LEU A 111 -7.438 -9.886 7.600 1.00 72.31 H new ATOM 0 HB3 LEU A 111 -5.779 -9.461 7.230 1.00 72.31 H new ATOM 0 HG LEU A 111 -7.995 -8.940 5.238 1.00 73.10 H new ATOM 0 HD11 LEU A 111 -8.159 -6.638 6.218 1.00 10.35 H new ATOM 0 HD12 LEU A 111 -8.638 -7.881 7.398 1.00 10.35 H new ATOM 0 HD13 LEU A 111 -7.032 -7.121 7.508 1.00 10.35 H new ATOM 0 HD21 LEU A 111 -6.503 -7.148 4.454 1.00 24.43 H new ATOM 0 HD22 LEU A 111 -5.310 -7.601 5.694 1.00 24.43 H new ATOM 0 HD23 LEU A 111 -5.713 -8.742 4.390 1.00 24.43 H new ATOM 1753 N LEU A 112 -6.827 -12.649 7.801 1.00 51.30 N ATOM 1754 CA LEU A 112 -6.452 -13.692 8.744 1.00 63.24 C ATOM 1755 C LEU A 112 -6.090 -14.986 8.009 1.00 11.11 C ATOM 1756 O LEU A 112 -5.125 -15.652 8.378 1.00 63.40 O ATOM 1757 CB LEU A 112 -7.585 -13.943 9.753 1.00 12.44 C ATOM 1758 CG LEU A 112 -8.082 -12.685 10.488 1.00 10.44 C ATOM 1759 CD1 LEU A 112 -9.160 -13.081 11.503 1.00 41.14 C ATOM 1760 CD2 LEU A 112 -6.947 -11.947 11.204 1.00 22.13 C ATOM 0 H LEU A 112 -7.801 -12.358 7.889 1.00 51.30 H new ATOM 0 HA LEU A 112 -5.572 -13.354 9.291 1.00 63.24 H new ATOM 0 HB2 LEU A 112 -8.426 -14.397 9.229 1.00 12.44 H new ATOM 0 HB3 LEU A 112 -7.241 -14.667 10.492 1.00 12.44 H new ATOM 0 HG LEU A 112 -8.494 -12.006 9.742 1.00 10.44 H new ATOM 0 HD11 LEU A 112 -9.513 -12.191 12.024 1.00 41.14 H new ATOM 0 HD12 LEU A 112 -9.994 -13.552 10.983 1.00 41.14 H new ATOM 0 HD13 LEU A 112 -8.740 -13.782 12.225 1.00 41.14 H new ATOM 0 HD21 LEU A 112 -7.346 -11.067 11.708 1.00 22.13 H new ATOM 0 HD22 LEU A 112 -6.489 -12.609 11.939 1.00 22.13 H new ATOM 0 HD23 LEU A 112 -6.197 -11.639 10.476 1.00 22.13 H new ATOM 1772 N ALA A 113 -6.864 -15.336 6.972 1.00 23.04 N ATOM 1773 CA ALA A 113 -6.678 -16.549 6.190 1.00 60.31 C ATOM 1774 C ALA A 113 -5.311 -16.564 5.505 1.00 41.41 C ATOM 1775 O ALA A 113 -4.605 -17.568 5.574 1.00 13.11 O ATOM 1776 CB ALA A 113 -7.808 -16.686 5.166 1.00 42.51 C ATOM 0 H ALA A 113 -7.649 -14.768 6.654 1.00 23.04 H new ATOM 0 HA ALA A 113 -6.711 -17.404 6.865 1.00 60.31 H new ATOM 0 HB1 ALA A 113 -7.663 -17.596 4.584 1.00 42.51 H new ATOM 0 HB2 ALA A 113 -8.765 -16.736 5.685 1.00 42.51 H new ATOM 0 HB3 ALA A 113 -7.801 -15.824 4.499 1.00 42.51 H new ATOM 1782 N GLU A 114 -4.931 -15.451 4.864 1.00 21.41 N ATOM 1783 CA GLU A 114 -3.610 -15.297 4.272 1.00 54.30 C ATOM 1784 C GLU A 114 -2.544 -15.285 5.373 1.00 22.13 C ATOM 1785 O GLU A 114 -1.490 -15.900 5.224 1.00 15.23 O ATOM 1786 CB GLU A 114 -3.588 -14.013 3.436 1.00 72.32 C ATOM 1787 CG GLU A 114 -2.228 -13.754 2.769 1.00 2.54 C ATOM 1788 CD GLU A 114 -2.146 -12.415 2.038 1.00 30.13 C ATOM 1789 OE1 GLU A 114 -3.126 -11.639 2.096 1.00 54.35 O ATOM 1790 OE2 GLU A 114 -1.073 -12.158 1.450 1.00 71.24 O ATOM 0 H GLU A 114 -5.535 -14.637 4.745 1.00 21.41 H new ATOM 0 HA GLU A 114 -3.386 -16.137 3.614 1.00 54.30 H new ATOM 0 HB2 GLU A 114 -4.358 -14.074 2.667 1.00 72.32 H new ATOM 0 HB3 GLU A 114 -3.841 -13.166 4.074 1.00 72.32 H new ATOM 0 HG2 GLU A 114 -1.448 -13.791 3.529 1.00 2.54 H new ATOM 0 HG3 GLU A 114 -2.022 -14.557 2.061 1.00 2.54 H new ATOM 1797 N GLY A 115 -2.830 -14.576 6.471 1.00 54.04 N ATOM 1798 CA GLY A 115 -1.916 -14.366 7.582 1.00 14.21 C ATOM 1799 C GLY A 115 -1.205 -13.021 7.444 1.00 2.31 C ATOM 1800 O GLY A 115 -0.019 -12.912 7.751 1.00 55.22 O ATOM 0 H GLY A 115 -3.733 -14.122 6.608 1.00 54.04 H new ATOM 0 HA2 GLY A 115 -2.465 -14.399 8.523 1.00 14.21 H new ATOM 0 HA3 GLY A 115 -1.181 -15.171 7.613 1.00 14.21 H new ATOM 1804 N VAL A 116 -1.944 -11.993 7.009 1.00 71.01 N ATOM 1805 CA VAL A 116 -1.493 -10.607 7.004 1.00 61.45 C ATOM 1806 C VAL A 116 -1.407 -10.126 8.450 1.00 11.43 C ATOM 1807 O VAL A 116 -0.437 -9.481 8.842 1.00 71.21 O ATOM 1808 CB VAL A 116 -2.479 -9.731 6.208 1.00 33.24 C ATOM 1809 CG1 VAL A 116 -1.950 -8.298 6.073 1.00 32.04 C ATOM 1810 CG2 VAL A 116 -2.727 -10.318 4.817 1.00 12.55 C ATOM 0 H VAL A 116 -2.890 -12.110 6.645 1.00 71.01 H new ATOM 0 HA VAL A 116 -0.515 -10.533 6.529 1.00 61.45 H new ATOM 0 HB VAL A 116 -3.420 -9.711 6.757 1.00 33.24 H new ATOM 0 HG11 VAL A 116 -2.663 -7.699 5.507 1.00 32.04 H new ATOM 0 HG12 VAL A 116 -1.817 -7.864 7.064 1.00 32.04 H new ATOM 0 HG13 VAL A 116 -0.993 -8.311 5.551 1.00 32.04 H new ATOM 0 HG21 VAL A 116 -3.426 -9.683 4.273 1.00 12.55 H new ATOM 0 HG22 VAL A 116 -1.785 -10.371 4.271 1.00 12.55 H new ATOM 0 HG23 VAL A 116 -3.147 -11.319 4.914 1.00 12.55 H new ATOM 1820 N CYS A 117 -2.445 -10.457 9.225 1.00 40.22 N ATOM 1821 CA CYS A 117 -2.590 -10.144 10.632 1.00 64.24 C ATOM 1822 C CYS A 117 -3.173 -11.356 11.356 1.00 33.03 C ATOM 1823 O CYS A 117 -3.765 -12.235 10.733 1.00 53.02 O ATOM 1824 CB CYS A 117 -3.521 -8.935 10.783 1.00 25.13 C ATOM 1825 SG CYS A 117 -2.584 -7.402 10.565 1.00 55.34 S ATOM 0 H CYS A 117 -3.243 -10.977 8.859 1.00 40.22 H new ATOM 0 HA CYS A 117 -1.620 -9.903 11.067 1.00 64.24 H new ATOM 0 HB2 CYS A 117 -4.323 -8.989 10.047 1.00 25.13 H new ATOM 0 HB3 CYS A 117 -3.990 -8.947 11.767 1.00 25.13 H new ATOM 0 HG CYS A 117 -1.507 -7.645 9.878 1.00 55.34 H new ATOM 1831 N ASP A 118 -3.017 -11.367 12.684 1.00 30.32 N ATOM 1832 CA ASP A 118 -3.762 -12.216 13.604 1.00 54.31 C ATOM 1833 C ASP A 118 -4.957 -11.431 14.150 1.00 13.15 C ATOM 1834 O ASP A 118 -5.074 -10.228 13.922 1.00 35.54 O ATOM 1835 CB ASP A 118 -2.855 -12.685 14.753 1.00 34.10 C ATOM 1836 CG ASP A 118 -1.701 -13.555 14.265 1.00 53.31 C ATOM 1837 OD1 ASP A 118 -1.970 -14.479 13.467 1.00 54.43 O ATOM 1838 OD2 ASP A 118 -0.554 -13.281 14.680 1.00 20.15 O ATOM 0 H ASP A 118 -2.345 -10.763 13.158 1.00 30.32 H new ATOM 0 HA ASP A 118 -4.120 -13.100 13.076 1.00 54.31 H new ATOM 0 HB2 ASP A 118 -2.455 -11.815 15.275 1.00 34.10 H new ATOM 0 HB3 ASP A 118 -3.449 -13.245 15.475 1.00 34.10 H new ATOM 1843 N ASN A 119 -5.830 -12.123 14.891 1.00 12.13 N ATOM 1844 CA ASN A 119 -7.051 -11.576 15.478 1.00 4.33 C ATOM 1845 C ASN A 119 -6.802 -10.399 16.426 1.00 25.54 C ATOM 1846 O ASN A 119 -7.718 -9.616 16.669 1.00 21.24 O ATOM 1847 CB ASN A 119 -7.812 -12.694 16.201 1.00 2.25 C ATOM 1848 CG ASN A 119 -6.993 -13.325 17.328 1.00 14.33 C ATOM 1849 OD1 ASN A 119 -6.275 -14.295 17.098 1.00 24.02 O ATOM 1850 ND2 ASN A 119 -7.096 -12.785 18.544 1.00 4.32 N ATOM 0 H ASN A 119 -5.698 -13.112 15.104 1.00 12.13 H new ATOM 0 HA ASN A 119 -7.649 -11.177 14.658 1.00 4.33 H new ATOM 0 HB2 ASN A 119 -8.739 -12.292 16.611 1.00 2.25 H new ATOM 0 HB3 ASN A 119 -8.089 -13.465 15.482 1.00 2.25 H new ATOM 0 HD21 ASN A 119 -6.567 -13.178 19.323 1.00 4.32 H new ATOM 0 HD22 ASN A 119 -7.703 -11.979 18.695 1.00 4.32 H new ATOM 1857 N ASP A 120 -5.585 -10.274 16.967 1.00 44.33 N ATOM 1858 CA ASP A 120 -5.194 -9.167 17.821 1.00 60.33 C ATOM 1859 C ASP A 120 -4.764 -7.990 16.947 1.00 12.42 C ATOM 1860 O ASP A 120 -5.241 -6.870 17.119 1.00 53.25 O ATOM 1861 CB ASP A 120 -4.055 -9.629 18.733 1.00 34.21 C ATOM 1862 CG ASP A 120 -3.525 -8.484 19.591 1.00 42.30 C ATOM 1863 OD1 ASP A 120 -4.107 -8.269 20.675 1.00 21.01 O ATOM 1864 OD2 ASP A 120 -2.550 -7.843 19.140 1.00 11.23 O ATOM 0 H ASP A 120 -4.839 -10.953 16.816 1.00 44.33 H new ATOM 0 HA ASP A 120 -6.028 -8.843 18.443 1.00 60.33 H new ATOM 0 HB2 ASP A 120 -4.407 -10.435 19.377 1.00 34.21 H new ATOM 0 HB3 ASP A 120 -3.245 -10.036 18.128 1.00 34.21 H new ATOM 1869 N THR A 121 -3.840 -8.262 16.022 1.00 21.50 N ATOM 1870 CA THR A 121 -3.137 -7.243 15.257 1.00 2.51 C ATOM 1871 C THR A 121 -4.015 -6.606 14.175 1.00 75.13 C ATOM 1872 O THR A 121 -3.783 -5.458 13.800 1.00 64.31 O ATOM 1873 CB THR A 121 -1.853 -7.832 14.655 1.00 73.33 C ATOM 1874 OG1 THR A 121 -2.162 -8.795 13.672 1.00 41.11 O ATOM 1875 CG2 THR A 121 -0.966 -8.478 15.724 1.00 34.35 C ATOM 0 H THR A 121 -3.559 -9.213 15.784 1.00 21.50 H new ATOM 0 HA THR A 121 -2.873 -6.440 15.945 1.00 2.51 H new ATOM 0 HB THR A 121 -1.306 -7.004 14.204 1.00 73.33 H new ATOM 0 HG1 THR A 121 -2.118 -8.382 12.784 1.00 41.11 H new ATOM 0 HG21 THR A 121 -0.068 -8.882 15.256 1.00 34.35 H new ATOM 0 HG22 THR A 121 -0.684 -7.729 16.464 1.00 34.35 H new ATOM 0 HG23 THR A 121 -1.514 -9.283 16.214 1.00 34.35 H new ATOM 1883 N VAL A 122 -5.007 -7.344 13.660 1.00 21.35 N ATOM 1884 CA VAL A 122 -5.912 -6.875 12.620 1.00 42.01 C ATOM 1885 C VAL A 122 -6.638 -5.606 13.092 1.00 12.35 C ATOM 1886 O VAL A 122 -7.141 -5.582 14.216 1.00 24.10 O ATOM 1887 CB VAL A 122 -6.883 -8.009 12.227 1.00 11.20 C ATOM 1888 CG1 VAL A 122 -7.859 -8.381 13.351 1.00 34.10 C ATOM 1889 CG2 VAL A 122 -7.664 -7.681 10.952 1.00 73.21 C ATOM 0 H VAL A 122 -5.201 -8.298 13.964 1.00 21.35 H new ATOM 0 HA VAL A 122 -5.352 -6.606 11.725 1.00 42.01 H new ATOM 0 HB VAL A 122 -6.249 -8.875 12.038 1.00 11.20 H new ATOM 0 HG11 VAL A 122 -8.515 -9.183 13.013 1.00 34.10 H new ATOM 0 HG12 VAL A 122 -7.298 -8.714 14.224 1.00 34.10 H new ATOM 0 HG13 VAL A 122 -8.458 -7.510 13.615 1.00 34.10 H new ATOM 0 HG21 VAL A 122 -8.334 -8.507 10.713 1.00 73.21 H new ATOM 0 HG22 VAL A 122 -8.247 -6.773 11.106 1.00 73.21 H new ATOM 0 HG23 VAL A 122 -6.967 -7.530 10.127 1.00 73.21 H new ATOM 1899 N PRO A 123 -6.685 -4.535 12.281 1.00 61.11 N ATOM 1900 CA PRO A 123 -7.351 -3.298 12.657 1.00 31.15 C ATOM 1901 C PRO A 123 -8.871 -3.477 12.658 1.00 71.14 C ATOM 1902 O PRO A 123 -9.393 -4.472 12.154 1.00 72.45 O ATOM 1903 CB PRO A 123 -6.897 -2.264 11.622 1.00 34.45 C ATOM 1904 CG PRO A 123 -6.628 -3.109 10.380 1.00 35.11 C ATOM 1905 CD PRO A 123 -6.074 -4.407 10.967 1.00 33.02 C ATOM 0 HA PRO A 123 -7.093 -2.981 13.667 1.00 31.15 H new ATOM 0 HB2 PRO A 123 -7.665 -1.513 11.439 1.00 34.45 H new ATOM 0 HB3 PRO A 123 -6.003 -1.733 11.949 1.00 34.45 H new ATOM 0 HG2 PRO A 123 -7.537 -3.281 9.803 1.00 35.11 H new ATOM 0 HG3 PRO A 123 -5.913 -2.630 9.712 1.00 35.11 H new ATOM 0 HD2 PRO A 123 -6.322 -5.260 10.335 1.00 33.02 H new ATOM 0 HD3 PRO A 123 -4.987 -4.371 11.042 1.00 33.02 H new ATOM 1913 N SER A 124 -9.575 -2.495 13.233 1.00 4.11 N ATOM 1914 CA SER A 124 -11.029 -2.466 13.309 1.00 22.44 C ATOM 1915 C SER A 124 -11.661 -2.681 11.935 1.00 12.21 C ATOM 1916 O SER A 124 -11.231 -2.077 10.954 1.00 24.21 O ATOM 1917 CB SER A 124 -11.478 -1.111 13.864 1.00 5.24 C ATOM 1918 OG SER A 124 -11.288 -1.064 15.262 1.00 20.24 O ATOM 0 H SER A 124 -9.134 -1.684 13.666 1.00 4.11 H new ATOM 0 HA SER A 124 -11.354 -3.273 13.966 1.00 22.44 H new ATOM 0 HB2 SER A 124 -10.913 -0.310 13.387 1.00 5.24 H new ATOM 0 HB3 SER A 124 -12.529 -0.944 13.628 1.00 5.24 H new ATOM 0 HG SER A 124 -11.578 -0.192 15.602 1.00 20.24 H new ATOM 1924 N VAL A 125 -12.719 -3.499 11.886 1.00 53.34 N ATOM 1925 CA VAL A 125 -13.535 -3.662 10.692 1.00 30.01 C ATOM 1926 C VAL A 125 -14.160 -2.322 10.283 1.00 33.41 C ATOM 1927 O VAL A 125 -14.338 -2.062 9.097 1.00 62.12 O ATOM 1928 CB VAL A 125 -14.564 -4.787 10.900 1.00 1.02 C ATOM 1929 CG1 VAL A 125 -15.637 -4.432 11.937 1.00 2.33 C ATOM 1930 CG2 VAL A 125 -15.225 -5.177 9.572 1.00 43.11 C ATOM 0 H VAL A 125 -13.028 -4.064 12.677 1.00 53.34 H new ATOM 0 HA VAL A 125 -12.909 -3.971 9.855 1.00 30.01 H new ATOM 0 HB VAL A 125 -14.008 -5.639 11.291 1.00 1.02 H new ATOM 0 HG11 VAL A 125 -16.333 -5.264 12.040 1.00 2.33 H new ATOM 0 HG12 VAL A 125 -15.163 -4.235 12.898 1.00 2.33 H new ATOM 0 HG13 VAL A 125 -16.179 -3.544 11.611 1.00 2.33 H new ATOM 0 HG21 VAL A 125 -15.948 -5.974 9.746 1.00 43.11 H new ATOM 0 HG22 VAL A 125 -15.734 -4.310 9.151 1.00 43.11 H new ATOM 0 HG23 VAL A 125 -14.463 -5.524 8.874 1.00 43.11 H new ATOM 1940 N SER A 126 -14.434 -1.444 11.256 1.00 31.43 N ATOM 1941 CA SER A 126 -14.851 -0.069 11.014 1.00 35.45 C ATOM 1942 C SER A 126 -13.793 0.712 10.222 1.00 51.21 C ATOM 1943 O SER A 126 -14.141 1.547 9.389 1.00 44.23 O ATOM 1944 CB SER A 126 -15.133 0.630 12.349 1.00 72.54 C ATOM 1945 OG SER A 126 -16.134 -0.058 13.068 1.00 53.42 O ATOM 0 H SER A 126 -14.369 -1.679 12.247 1.00 31.43 H new ATOM 0 HA SER A 126 -15.761 -0.093 10.415 1.00 35.45 H new ATOM 0 HB2 SER A 126 -14.219 0.677 12.941 1.00 72.54 H new ATOM 0 HB3 SER A 126 -15.449 1.658 12.168 1.00 72.54 H new ATOM 0 HG SER A 126 -16.300 0.401 13.918 1.00 53.42 H new ATOM 1951 N SER A 127 -12.505 0.455 10.492 1.00 51.41 N ATOM 1952 CA SER A 127 -11.399 1.236 9.951 1.00 13.20 C ATOM 1953 C SER A 127 -11.051 0.851 8.513 1.00 43.12 C ATOM 1954 O SER A 127 -10.369 1.628 7.848 1.00 10.54 O ATOM 1955 CB SER A 127 -10.172 1.147 10.863 1.00 0.04 C ATOM 1956 OG SER A 127 -10.457 1.772 12.096 1.00 74.31 O ATOM 0 H SER A 127 -12.206 -0.309 11.098 1.00 51.41 H new ATOM 0 HA SER A 127 -11.731 2.274 9.919 1.00 13.20 H new ATOM 0 HB2 SER A 127 -9.901 0.104 11.026 1.00 0.04 H new ATOM 0 HB3 SER A 127 -9.317 1.628 10.388 1.00 0.04 H new ATOM 0 HG SER A 127 -9.673 1.714 12.681 1.00 74.31 H new ATOM 1962 N ILE A 128 -11.524 -0.307 8.033 1.00 3.43 N ATOM 1963 CA ILE A 128 -11.510 -0.680 6.620 1.00 55.23 C ATOM 1964 C ILE A 128 -12.847 -0.321 5.955 1.00 12.32 C ATOM 1965 O ILE A 128 -12.855 0.161 4.823 1.00 72.32 O ATOM 1966 CB ILE A 128 -11.123 -2.160 6.418 1.00 23.35 C ATOM 1967 CG1 ILE A 128 -11.801 -3.095 7.432 1.00 4.53 C ATOM 1968 CG2 ILE A 128 -9.591 -2.299 6.437 1.00 51.35 C ATOM 1969 CD1 ILE A 128 -11.532 -4.581 7.192 1.00 10.51 C ATOM 0 H ILE A 128 -11.935 -1.023 8.632 1.00 3.43 H new ATOM 0 HA ILE A 128 -10.733 -0.100 6.123 1.00 55.23 H new ATOM 0 HB ILE A 128 -11.492 -2.476 5.442 1.00 23.35 H new ATOM 0 HG12 ILE A 128 -11.462 -2.833 8.434 1.00 4.53 H new ATOM 0 HG13 ILE A 128 -12.877 -2.923 7.405 1.00 4.53 H new ATOM 0 HG21 ILE A 128 -9.319 -3.345 6.294 1.00 51.35 H new ATOM 0 HG22 ILE A 128 -9.161 -1.699 5.635 1.00 51.35 H new ATOM 0 HG23 ILE A 128 -9.206 -1.951 7.396 1.00 51.35 H new ATOM 0 HD11 ILE A 128 -12.046 -5.171 7.951 1.00 10.51 H new ATOM 0 HD12 ILE A 128 -11.898 -4.862 6.204 1.00 10.51 H new ATOM 0 HD13 ILE A 128 -10.460 -4.771 7.250 1.00 10.51 H new ATOM 1981 N ASN A 129 -13.971 -0.528 6.655 1.00 3.14 N ATOM 1982 CA ASN A 129 -15.313 -0.209 6.182 1.00 54.31 C ATOM 1983 C ASN A 129 -15.424 1.242 5.712 1.00 21.01 C ATOM 1984 O ASN A 129 -15.925 1.489 4.619 1.00 22.32 O ATOM 1985 CB ASN A 129 -16.323 -0.486 7.302 1.00 20.22 C ATOM 1986 CG ASN A 129 -17.724 0.001 6.951 1.00 44.32 C ATOM 1987 OD1 ASN A 129 -18.259 0.893 7.604 1.00 71.04 O ATOM 1988 ND2 ASN A 129 -18.319 -0.576 5.909 1.00 73.54 N ATOM 0 H ASN A 129 -13.965 -0.933 7.591 1.00 3.14 H new ATOM 0 HA ASN A 129 -15.531 -0.842 5.321 1.00 54.31 H new ATOM 0 HB2 ASN A 129 -16.353 -1.557 7.505 1.00 20.22 H new ATOM 0 HB3 ASN A 129 -15.990 0.002 8.218 1.00 20.22 H new ATOM 0 HD21 ASN A 129 -19.254 -0.280 5.627 1.00 73.54 H new ATOM 0 HD22 ASN A 129 -17.840 -1.314 5.393 1.00 73.54 H new ATOM 1995 N ARG A 130 -14.975 2.190 6.544 1.00 62.52 N ATOM 1996 CA ARG A 130 -15.068 3.627 6.288 1.00 61.22 C ATOM 1997 C ARG A 130 -14.602 4.021 4.879 1.00 64.12 C ATOM 1998 O ARG A 130 -15.235 4.859 4.239 1.00 41.22 O ATOM 1999 CB ARG A 130 -14.324 4.410 7.382 1.00 0.35 C ATOM 2000 CG ARG A 130 -12.820 4.112 7.419 1.00 45.12 C ATOM 2001 CD ARG A 130 -12.136 4.815 8.594 1.00 22.31 C ATOM 2002 NE ARG A 130 -10.725 4.413 8.676 1.00 32.34 N ATOM 2003 CZ ARG A 130 -9.847 4.849 9.594 1.00 54.34 C ATOM 2004 NH1 ARG A 130 -10.208 5.760 10.509 1.00 65.33 N ATOM 2005 NH2 ARG A 130 -8.599 4.363 9.593 1.00 33.22 N ATOM 0 H ARG A 130 -14.527 1.971 7.434 1.00 62.52 H new ATOM 0 HA ARG A 130 -16.124 3.896 6.326 1.00 61.22 H new ATOM 0 HB2 ARG A 130 -14.473 5.478 7.221 1.00 0.35 H new ATOM 0 HB3 ARG A 130 -14.760 4.170 8.352 1.00 0.35 H new ATOM 0 HG2 ARG A 130 -12.663 3.036 7.497 1.00 45.12 H new ATOM 0 HG3 ARG A 130 -12.361 4.434 6.484 1.00 45.12 H new ATOM 0 HD2 ARG A 130 -12.207 5.896 8.471 1.00 22.31 H new ATOM 0 HD3 ARG A 130 -12.647 4.565 9.524 1.00 22.31 H new ATOM 0 HE ARG A 130 -10.385 3.750 7.980 1.00 32.34 H new ATOM 0 HH11 ARG A 130 -11.159 6.130 10.513 1.00 65.33 H new ATOM 0 HH12 ARG A 130 -9.532 6.083 11.201 1.00 65.33 H new ATOM 0 HH21 ARG A 130 -8.323 3.668 8.899 1.00 33.22 H new ATOM 0 HH22 ARG A 130 -7.925 4.688 10.286 1.00 33.22 H new ATOM 2019 N ILE A 131 -13.518 3.408 4.385 1.00 35.51 N ATOM 2020 CA ILE A 131 -12.992 3.651 3.052 1.00 55.21 C ATOM 2021 C ILE A 131 -14.052 3.258 2.019 1.00 23.14 C ATOM 2022 O ILE A 131 -14.525 4.105 1.266 1.00 62.30 O ATOM 2023 CB ILE A 131 -11.655 2.901 2.875 1.00 74.23 C ATOM 2024 CG1 ILE A 131 -10.596 3.439 3.858 1.00 51.45 C ATOM 2025 CG2 ILE A 131 -11.121 3.045 1.445 1.00 11.31 C ATOM 2026 CD1 ILE A 131 -10.367 2.503 5.045 1.00 2.52 C ATOM 0 H ILE A 131 -12.981 2.721 4.914 1.00 35.51 H new ATOM 0 HA ILE A 131 -12.774 4.709 2.903 1.00 55.21 H new ATOM 0 HB ILE A 131 -11.846 1.848 3.080 1.00 74.23 H new ATOM 0 HG12 ILE A 131 -9.655 3.585 3.328 1.00 51.45 H new ATOM 0 HG13 ILE A 131 -10.910 4.416 4.226 1.00 51.45 H new ATOM 0 HG21 ILE A 131 -10.178 2.506 1.353 1.00 11.31 H new ATOM 0 HG22 ILE A 131 -11.845 2.632 0.743 1.00 11.31 H new ATOM 0 HG23 ILE A 131 -10.959 4.099 1.222 1.00 11.31 H new ATOM 0 HD11 ILE A 131 -9.612 2.930 5.705 1.00 2.52 H new ATOM 0 HD12 ILE A 131 -11.300 2.377 5.594 1.00 2.52 H new ATOM 0 HD13 ILE A 131 -10.025 1.533 4.683 1.00 2.52 H new ATOM 2038 N ILE A 132 -14.449 1.982 2.014 1.00 53.41 N ATOM 2039 CA ILE A 132 -15.469 1.437 1.125 1.00 52.12 C ATOM 2040 C ILE A 132 -16.736 2.299 1.134 1.00 42.55 C ATOM 2041 O ILE A 132 -17.260 2.607 0.068 1.00 54.12 O ATOM 2042 CB ILE A 132 -15.771 -0.033 1.486 1.00 71.22 C ATOM 2043 CG1 ILE A 132 -14.514 -0.927 1.493 1.00 61.34 C ATOM 2044 CG2 ILE A 132 -16.832 -0.621 0.543 1.00 34.15 C ATOM 2045 CD1 ILE A 132 -13.740 -0.939 0.169 1.00 31.53 C ATOM 0 H ILE A 132 -14.057 1.284 2.646 1.00 53.41 H new ATOM 0 HA ILE A 132 -15.081 1.456 0.106 1.00 52.12 H new ATOM 0 HB ILE A 132 -16.158 -0.021 2.505 1.00 71.22 H new ATOM 0 HG12 ILE A 132 -13.847 -0.590 2.287 1.00 61.34 H new ATOM 0 HG13 ILE A 132 -14.810 -1.947 1.737 1.00 61.34 H new ATOM 0 HG21 ILE A 132 -17.028 -1.658 0.817 1.00 34.15 H new ATOM 0 HG22 ILE A 132 -17.753 -0.043 0.626 1.00 34.15 H new ATOM 0 HG23 ILE A 132 -16.469 -0.580 -0.484 1.00 34.15 H new ATOM 0 HD11 ILE A 132 -12.872 -1.592 0.261 1.00 31.53 H new ATOM 0 HD12 ILE A 132 -14.387 -1.306 -0.628 1.00 31.53 H new ATOM 0 HD13 ILE A 132 -13.410 0.072 -0.069 1.00 31.53 H new ATOM 2057 N ARG A 133 -17.217 2.707 2.317 1.00 13.20 N ATOM 2058 CA ARG A 133 -18.396 3.544 2.448 1.00 0.10 C ATOM 2059 C ARG A 133 -18.206 4.894 1.748 1.00 1.50 C ATOM 2060 O ARG A 133 -19.034 5.281 0.926 1.00 53.22 O ATOM 2061 CB ARG A 133 -18.742 3.767 3.928 1.00 1.34 C ATOM 2062 CG ARG A 133 -19.237 2.507 4.655 1.00 61.14 C ATOM 2063 CD ARG A 133 -20.659 2.073 4.279 1.00 24.43 C ATOM 2064 NE ARG A 133 -21.654 3.112 4.593 1.00 43.43 N ATOM 2065 CZ ARG A 133 -22.987 2.948 4.524 1.00 22.14 C ATOM 2066 NH1 ARG A 133 -23.515 1.756 4.212 1.00 20.44 N ATOM 2067 NH2 ARG A 133 -23.795 3.992 4.752 1.00 35.14 N ATOM 0 H ARG A 133 -16.789 2.459 3.209 1.00 13.20 H new ATOM 0 HA ARG A 133 -19.222 3.022 1.964 1.00 0.10 H new ATOM 0 HB2 ARG A 133 -17.860 4.147 4.443 1.00 1.34 H new ATOM 0 HB3 ARG A 133 -19.509 4.538 3.998 1.00 1.34 H new ATOM 0 HG2 ARG A 133 -18.552 1.687 4.441 1.00 61.14 H new ATOM 0 HG3 ARG A 133 -19.197 2.684 5.730 1.00 61.14 H new ATOM 0 HD2 ARG A 133 -20.698 1.843 3.214 1.00 24.43 H new ATOM 0 HD3 ARG A 133 -20.911 1.156 4.812 1.00 24.43 H new ATOM 0 HE ARG A 133 -21.306 4.025 4.885 1.00 43.43 H new ATOM 0 HH11 ARG A 133 -22.904 0.961 4.024 1.00 20.44 H new ATOM 0 HH12 ARG A 133 -24.528 1.644 4.163 1.00 20.44 H new ATOM 0 HH21 ARG A 133 -23.398 4.905 4.976 1.00 35.14 H new ATOM 0 HH22 ARG A 133 -24.807 3.874 4.701 1.00 35.14 H new ATOM 2081 N THR A 134 -17.137 5.627 2.082 1.00 22.03 N ATOM 2082 CA THR A 134 -16.885 6.946 1.510 1.00 24.44 C ATOM 2083 C THR A 134 -16.752 6.885 -0.017 1.00 62.54 C ATOM 2084 O THR A 134 -17.209 7.801 -0.698 1.00 1.02 O ATOM 2085 CB THR A 134 -15.671 7.620 2.169 1.00 73.22 C ATOM 2086 OG1 THR A 134 -14.547 6.765 2.169 1.00 15.45 O ATOM 2087 CG2 THR A 134 -15.993 8.052 3.602 1.00 62.43 C ATOM 0 H THR A 134 -16.430 5.322 2.751 1.00 22.03 H new ATOM 0 HA THR A 134 -17.753 7.569 1.726 1.00 24.44 H new ATOM 0 HB THR A 134 -15.434 8.505 1.579 1.00 73.22 H new ATOM 0 HG1 THR A 134 -14.765 5.938 1.691 1.00 15.45 H new ATOM 0 HG21 THR A 134 -15.117 8.526 4.045 1.00 62.43 H new ATOM 0 HG22 THR A 134 -16.822 8.760 3.591 1.00 62.43 H new ATOM 0 HG23 THR A 134 -16.270 7.178 4.192 1.00 62.43 H new