USER MOD reduce.3.24.130724 H: found=0, std=0, add=1288, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1287 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 80 THR OG1 : rot 170:sc= -0.19 USER MOD Set 1.2: A 81 THR OG1 : rot 141:sc= 0.00489 USER MOD Set 1.3: A 109 HIS : no HE2:sc= -1.26 K(o=-1.4,f=-2.2) USER MOD Single : A 1 THR N :NH3+ 173:sc= 1.66 (180deg=1.38) USER MOD Single : A 1 THR OG1 : rot 180:sc= 0.00391 USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ -164:sc= 0.106 (180deg=-0.222) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= -1.12 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 GLN : amide:sc= 0 K(o=0,f=-2.1!) USER MOD Single : A 45 THR OG1 : rot 180:sc= -0.197 USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 HIS : no HD1:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 56 THR OG1 : rot 180:sc= -0.136 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 TYR OH : rot -29:sc= 0.854 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 MET CE :methyl -165:sc= -0.137 (180deg=-0.502) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 THR OG1 : rot 84:sc= 0.474 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 87 HIS : no HE2:sc= 0.175 K(o=0.18,f=-2.9) USER MOD Single : A 98 HIS : no HD1:sc= -0.328 X(o=-0.33,f=-0.18) USER MOD Single : A 108 THR OG1 : rot 120:sc= -0.257 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 ASN : amide:sc= 0.138 X(o=0.14,f=0) USER MOD Single : A 121 THR OG1 : rot 2:sc= 0.444 USER MOD Single : A 123 MET CE :methyl 138:sc= -0.257 (180deg=-1.16) USER MOD Single : A 124 THR OG1 : rot 101:sc= 0.0874 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 128 THR OG1 : rot 31:sc= -0.613 USER MOD Single : A 131 SER OG : rot 172:sc= -0.709 USER MOD Single : A 134 GLN : amide:sc= 0.307 K(o=0.31,f=-2.3) USER MOD Single : A 135 MET CE :methyl 136:sc= -0.482 (180deg=-1.99!) USER MOD Single : A 136 GLN : amide:sc= 0.603 K(o=0.6,f=-0.028) USER MOD Single : A 137 LYS NZ :NH3+ 177:sc= 0.528 (180deg=0.34) USER MOD Single : A 138 MET CE :methyl 162:sc= -1.33 (180deg=-1.84!) USER MOD Single : A 141 MET CE :methyl -167:sc= -0.0239 (180deg=-0.274) USER MOD Single : A 143 MET CE :methyl 171:sc= 0 (180deg=-0.0697) USER MOD Single : A 147 MET CE :methyl -125:sc= -0.965 (180deg=-1.5) USER MOD Single : A 153 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 159 SER OG : rot 180:sc= 0 USER MOD Single : A 163 ASN : amide:sc= -0.177 X(o=-0.18,f=-0.62) USER MOD Single : A 167 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 168 HIS : no HE2:sc= 0.453 K(o=0.45,f=-1.5!) USER MOD Single : A 169 HIS : no HE2:sc= 0.128 K(o=0.13,f=-1.5!) USER MOD Single : A 170 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 171 HIS : no HD1:sc= 0 X(o=0,f=-0.007) USER MOD Single : A 172 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -11.293 3.575 -8.236 1.00 75.23 N ATOM 2 CA THR A 1 -11.511 2.242 -8.855 1.00 1.13 C ATOM 3 C THR A 1 -10.180 1.665 -9.312 1.00 20.01 C ATOM 4 O THR A 1 -9.399 2.382 -9.931 1.00 21.45 O ATOM 5 CB THR A 1 -12.446 2.350 -10.099 1.00 0.32 C ATOM 6 OG1 THR A 1 -13.564 3.189 -9.790 1.00 74.42 O ATOM 7 CG2 THR A 1 -12.950 0.975 -10.585 1.00 14.21 C ATOM 0 H1 THR A 1 -12.212 4.018 -8.033 1.00 75.23 H new ATOM 0 H2 THR A 1 -10.759 3.463 -7.351 1.00 75.23 H new ATOM 0 H3 THR A 1 -10.755 4.178 -8.891 1.00 75.23 H new ATOM 0 HA THR A 1 -11.974 1.598 -8.108 1.00 1.13 H new ATOM 0 HB THR A 1 -11.857 2.783 -10.908 1.00 0.32 H new ATOM 0 HG1 THR A 1 -14.149 3.257 -10.574 1.00 74.42 H new ATOM 0 HG21 THR A 1 -13.596 1.110 -11.452 1.00 14.21 H new ATOM 0 HG22 THR A 1 -12.099 0.352 -10.860 1.00 14.21 H new ATOM 0 HG23 THR A 1 -13.511 0.490 -9.786 1.00 14.21 H new ATOM 17 N VAL A 2 -9.930 0.379 -9.054 1.00 52.43 N ATOM 18 CA VAL A 2 -8.730 -0.299 -9.575 1.00 5.23 C ATOM 19 C VAL A 2 -8.968 -0.675 -11.057 1.00 5.25 C ATOM 20 O VAL A 2 -9.533 -1.726 -11.374 1.00 25.14 O ATOM 21 CB VAL A 2 -8.357 -1.546 -8.715 1.00 4.40 C ATOM 22 CG1 VAL A 2 -7.095 -2.259 -9.266 1.00 33.42 C ATOM 23 CG2 VAL A 2 -8.152 -1.137 -7.238 1.00 32.10 C ATOM 0 H VAL A 2 -10.537 -0.216 -8.490 1.00 52.43 H new ATOM 0 HA VAL A 2 -7.880 0.380 -9.513 1.00 5.23 H new ATOM 0 HB VAL A 2 -9.185 -2.253 -8.772 1.00 4.40 H new ATOM 0 HG11 VAL A 2 -6.864 -3.123 -8.643 1.00 33.42 H new ATOM 0 HG12 VAL A 2 -7.280 -2.588 -10.288 1.00 33.42 H new ATOM 0 HG13 VAL A 2 -6.252 -1.568 -9.255 1.00 33.42 H new ATOM 0 HG21 VAL A 2 -7.892 -2.017 -6.649 1.00 32.10 H new ATOM 0 HG22 VAL A 2 -7.347 -0.405 -7.171 1.00 32.10 H new ATOM 0 HG23 VAL A 2 -9.072 -0.700 -6.850 1.00 32.10 H new ATOM 33 N VAL A 3 -8.581 0.247 -11.950 1.00 65.23 N ATOM 34 CA VAL A 3 -8.862 0.158 -13.400 1.00 44.51 C ATOM 35 C VAL A 3 -7.963 -0.860 -14.138 1.00 11.55 C ATOM 36 O VAL A 3 -8.311 -1.303 -15.241 1.00 51.10 O ATOM 37 CB VAL A 3 -8.775 1.588 -14.065 1.00 54.02 C ATOM 38 CG1 VAL A 3 -9.925 2.504 -13.561 1.00 3.24 C ATOM 39 CG2 VAL A 3 -7.400 2.244 -13.788 1.00 61.34 C ATOM 0 H VAL A 3 -8.060 1.084 -11.690 1.00 65.23 H new ATOM 0 HA VAL A 3 -9.880 -0.220 -13.500 1.00 44.51 H new ATOM 0 HB VAL A 3 -8.883 1.463 -15.142 1.00 54.02 H new ATOM 0 HG11 VAL A 3 -9.844 3.483 -14.033 1.00 3.24 H new ATOM 0 HG12 VAL A 3 -10.885 2.056 -13.817 1.00 3.24 H new ATOM 0 HG13 VAL A 3 -9.854 2.616 -12.479 1.00 3.24 H new ATOM 0 HG21 VAL A 3 -7.365 3.228 -14.256 1.00 61.34 H new ATOM 0 HG22 VAL A 3 -7.257 2.349 -12.713 1.00 61.34 H new ATOM 0 HG23 VAL A 3 -6.609 1.618 -14.200 1.00 61.34 H new ATOM 49 N SER A 4 -6.825 -1.233 -13.531 1.00 15.34 N ATOM 50 CA SER A 4 -5.918 -2.263 -14.090 1.00 24.22 C ATOM 51 C SER A 4 -5.102 -2.944 -12.963 1.00 74.15 C ATOM 52 O SER A 4 -4.686 -2.287 -12.005 1.00 61.14 O ATOM 53 CB SER A 4 -4.947 -1.637 -15.125 1.00 11.24 C ATOM 54 OG SER A 4 -5.628 -1.000 -16.198 1.00 21.41 O ATOM 0 H SER A 4 -6.505 -0.837 -12.647 1.00 15.34 H new ATOM 0 HA SER A 4 -6.533 -3.013 -14.588 1.00 24.22 H new ATOM 0 HB2 SER A 4 -4.307 -0.911 -14.624 1.00 11.24 H new ATOM 0 HB3 SER A 4 -4.296 -2.415 -15.524 1.00 11.24 H new ATOM 0 HG SER A 4 -4.974 -0.621 -16.821 1.00 21.41 H new ATOM 60 N VAL A 5 -4.891 -4.272 -13.083 1.00 65.23 N ATOM 61 CA VAL A 5 -4.007 -5.050 -12.168 1.00 3.14 C ATOM 62 C VAL A 5 -2.958 -5.821 -13.000 1.00 14.43 C ATOM 63 O VAL A 5 -3.314 -6.652 -13.841 1.00 3.15 O ATOM 64 CB VAL A 5 -4.810 -6.081 -11.276 1.00 44.12 C ATOM 65 CG1 VAL A 5 -3.867 -6.847 -10.302 1.00 54.24 C ATOM 66 CG2 VAL A 5 -5.947 -5.388 -10.497 1.00 11.34 C ATOM 0 H VAL A 5 -5.324 -4.840 -13.812 1.00 65.23 H new ATOM 0 HA VAL A 5 -3.528 -4.335 -11.499 1.00 3.14 H new ATOM 0 HB VAL A 5 -5.259 -6.808 -11.953 1.00 44.12 H new ATOM 0 HG11 VAL A 5 -4.452 -7.547 -9.705 1.00 54.24 H new ATOM 0 HG12 VAL A 5 -3.120 -7.396 -10.875 1.00 54.24 H new ATOM 0 HG13 VAL A 5 -3.369 -6.136 -9.643 1.00 54.24 H new ATOM 0 HG21 VAL A 5 -6.478 -6.126 -9.895 1.00 11.34 H new ATOM 0 HG22 VAL A 5 -5.527 -4.622 -9.845 1.00 11.34 H new ATOM 0 HG23 VAL A 5 -6.641 -4.926 -11.200 1.00 11.34 H new ATOM 76 N ASP A 6 -1.673 -5.535 -12.760 1.00 50.12 N ATOM 77 CA ASP A 6 -0.546 -6.205 -13.442 1.00 65.51 C ATOM 78 C ASP A 6 0.375 -6.894 -12.413 1.00 71.21 C ATOM 79 O ASP A 6 0.852 -6.254 -11.476 1.00 40.32 O ATOM 80 CB ASP A 6 0.248 -5.175 -14.281 1.00 34.01 C ATOM 81 CG ASP A 6 -0.573 -4.630 -15.461 1.00 31.54 C ATOM 82 OD1 ASP A 6 -1.283 -3.610 -15.291 1.00 10.45 O ATOM 83 OD2 ASP A 6 -0.524 -5.224 -16.559 1.00 43.11 O ATOM 0 H ASP A 6 -1.378 -4.830 -12.085 1.00 50.12 H new ATOM 0 HA ASP A 6 -0.941 -6.971 -14.109 1.00 65.51 H new ATOM 0 HB2 ASP A 6 0.555 -4.347 -13.641 1.00 34.01 H new ATOM 0 HB3 ASP A 6 1.158 -5.641 -14.658 1.00 34.01 H new ATOM 88 N LYS A 7 0.605 -8.204 -12.598 1.00 34.23 N ATOM 89 CA LYS A 7 1.477 -9.017 -11.725 1.00 72.21 C ATOM 90 C LYS A 7 2.557 -9.725 -12.571 1.00 51.04 C ATOM 91 O LYS A 7 2.249 -10.634 -13.345 1.00 22.02 O ATOM 92 CB LYS A 7 0.630 -10.064 -10.943 1.00 33.23 C ATOM 93 CG LYS A 7 1.464 -11.040 -10.074 1.00 23.33 C ATOM 94 CD LYS A 7 0.594 -12.050 -9.290 1.00 72.14 C ATOM 95 CE LYS A 7 1.446 -13.065 -8.503 1.00 43.50 C ATOM 96 NZ LYS A 7 0.622 -13.943 -7.640 1.00 12.33 N ATOM 0 H LYS A 7 0.189 -8.736 -13.363 1.00 34.23 H new ATOM 0 HA LYS A 7 1.968 -8.361 -11.006 1.00 72.21 H new ATOM 0 HB2 LYS A 7 -0.075 -9.537 -10.301 1.00 33.23 H new ATOM 0 HB3 LYS A 7 0.042 -10.643 -11.655 1.00 33.23 H new ATOM 0 HG2 LYS A 7 2.156 -11.586 -10.715 1.00 23.33 H new ATOM 0 HG3 LYS A 7 2.067 -10.466 -9.370 1.00 23.33 H new ATOM 0 HD2 LYS A 7 -0.054 -11.510 -8.600 1.00 72.14 H new ATOM 0 HD3 LYS A 7 -0.055 -12.584 -9.984 1.00 72.14 H new ATOM 0 HE2 LYS A 7 2.015 -13.678 -9.202 1.00 43.50 H new ATOM 0 HE3 LYS A 7 2.169 -12.529 -7.887 1.00 43.50 H new ATOM 0 HZ1 LYS A 7 1.231 -14.413 -6.940 1.00 12.33 H new ATOM 0 HZ2 LYS A 7 -0.094 -13.372 -7.147 1.00 12.33 H new ATOM 0 HZ3 LYS A 7 0.150 -14.661 -8.226 1.00 12.33 H new ATOM 110 N ASP A 8 3.811 -9.270 -12.441 1.00 60.01 N ATOM 111 CA ASP A 8 4.978 -9.890 -13.099 1.00 1.34 C ATOM 112 C ASP A 8 5.725 -10.796 -12.102 1.00 31.23 C ATOM 113 O ASP A 8 6.477 -10.312 -11.246 1.00 4.03 O ATOM 114 CB ASP A 8 5.925 -8.795 -13.651 1.00 50.31 C ATOM 115 CG ASP A 8 5.241 -7.891 -14.684 1.00 10.23 C ATOM 116 OD1 ASP A 8 4.497 -6.971 -14.280 1.00 52.32 O ATOM 117 OD2 ASP A 8 5.417 -8.115 -15.900 1.00 42.12 O ATOM 0 H ASP A 8 4.049 -8.457 -11.874 1.00 60.01 H new ATOM 0 HA ASP A 8 4.632 -10.500 -13.933 1.00 1.34 H new ATOM 0 HB2 ASP A 8 6.290 -8.185 -12.825 1.00 50.31 H new ATOM 0 HB3 ASP A 8 6.795 -9.268 -14.107 1.00 50.31 H new ATOM 122 N VAL A 9 5.484 -12.110 -12.207 1.00 34.14 N ATOM 123 CA VAL A 9 6.186 -13.131 -11.392 1.00 5.24 C ATOM 124 C VAL A 9 7.667 -13.240 -11.840 1.00 3.15 C ATOM 125 O VAL A 9 8.547 -13.594 -11.055 1.00 14.43 O ATOM 126 CB VAL A 9 5.487 -14.544 -11.503 1.00 14.11 C ATOM 127 CG1 VAL A 9 6.065 -15.560 -10.482 1.00 35.11 C ATOM 128 CG2 VAL A 9 3.950 -14.423 -11.367 1.00 32.24 C ATOM 0 H VAL A 9 4.801 -12.502 -12.855 1.00 34.14 H new ATOM 0 HA VAL A 9 6.141 -12.815 -10.350 1.00 5.24 H new ATOM 0 HB VAL A 9 5.705 -14.931 -12.498 1.00 14.11 H new ATOM 0 HG11 VAL A 9 5.556 -16.517 -10.593 1.00 35.11 H new ATOM 0 HG12 VAL A 9 7.131 -15.693 -10.665 1.00 35.11 H new ATOM 0 HG13 VAL A 9 5.914 -15.184 -9.470 1.00 35.11 H new ATOM 0 HG21 VAL A 9 3.499 -15.412 -11.448 1.00 32.24 H new ATOM 0 HG22 VAL A 9 3.703 -13.990 -10.398 1.00 32.24 H new ATOM 0 HG23 VAL A 9 3.564 -13.782 -12.160 1.00 32.24 H new ATOM 138 N GLU A 10 7.908 -12.909 -13.120 1.00 51.41 N ATOM 139 CA GLU A 10 9.250 -12.921 -13.743 1.00 45.41 C ATOM 140 C GLU A 10 10.106 -11.747 -13.215 1.00 52.04 C ATOM 141 O GLU A 10 11.251 -11.933 -12.793 1.00 4.33 O ATOM 142 CB GLU A 10 9.127 -12.833 -15.294 1.00 53.41 C ATOM 143 CG GLU A 10 8.307 -13.965 -15.966 1.00 45.41 C ATOM 144 CD GLU A 10 6.790 -13.911 -15.691 1.00 43.15 C ATOM 145 OE1 GLU A 10 6.129 -12.946 -16.134 1.00 61.22 O ATOM 146 OE2 GLU A 10 6.254 -14.808 -15.006 1.00 51.52 O ATOM 0 H GLU A 10 7.170 -12.621 -13.762 1.00 51.41 H new ATOM 0 HA GLU A 10 9.741 -13.857 -13.479 1.00 45.41 H new ATOM 0 HB2 GLU A 10 8.671 -11.877 -15.551 1.00 53.41 H new ATOM 0 HB3 GLU A 10 10.130 -12.833 -15.721 1.00 53.41 H new ATOM 0 HG2 GLU A 10 8.469 -13.923 -17.043 1.00 45.41 H new ATOM 0 HG3 GLU A 10 8.691 -14.926 -15.623 1.00 45.41 H new ATOM 153 N ALA A 11 9.518 -10.538 -13.235 1.00 3.04 N ATOM 154 CA ALA A 11 10.177 -9.296 -12.753 1.00 24.03 C ATOM 155 C ALA A 11 10.012 -9.090 -11.221 1.00 75.24 C ATOM 156 O ALA A 11 10.466 -8.071 -10.682 1.00 4.43 O ATOM 157 CB ALA A 11 9.618 -8.087 -13.526 1.00 33.30 C ATOM 0 H ALA A 11 8.572 -10.387 -13.585 1.00 3.04 H new ATOM 0 HA ALA A 11 11.247 -9.392 -12.940 1.00 24.03 H new ATOM 0 HB1 ALA A 11 10.100 -7.175 -13.174 1.00 33.30 H new ATOM 0 HB2 ALA A 11 9.815 -8.213 -14.591 1.00 33.30 H new ATOM 0 HB3 ALA A 11 8.543 -8.016 -13.362 1.00 33.30 H new ATOM 163 N LEU A 12 9.350 -10.064 -10.544 1.00 32.53 N ATOM 164 CA LEU A 12 9.112 -10.068 -9.070 1.00 51.33 C ATOM 165 C LEU A 12 8.410 -8.782 -8.564 1.00 61.33 C ATOM 166 O LEU A 12 8.577 -8.387 -7.414 1.00 62.35 O ATOM 167 CB LEU A 12 10.445 -10.324 -8.298 1.00 22.31 C ATOM 168 CG LEU A 12 11.202 -11.642 -8.655 1.00 75.01 C ATOM 169 CD1 LEU A 12 12.484 -11.802 -7.811 1.00 14.04 C ATOM 170 CD2 LEU A 12 10.283 -12.867 -8.496 1.00 72.01 C ATOM 0 H LEU A 12 8.959 -10.882 -11.011 1.00 32.53 H new ATOM 0 HA LEU A 12 8.424 -10.889 -8.866 1.00 51.33 H new ATOM 0 HB2 LEU A 12 11.114 -9.483 -8.481 1.00 22.31 H new ATOM 0 HB3 LEU A 12 10.227 -10.332 -7.230 1.00 22.31 H new ATOM 0 HG LEU A 12 11.501 -11.576 -9.701 1.00 75.01 H new ATOM 0 HD11 LEU A 12 12.986 -12.730 -8.085 1.00 14.04 H new ATOM 0 HD12 LEU A 12 13.150 -10.960 -7.998 1.00 14.04 H new ATOM 0 HD13 LEU A 12 12.222 -11.830 -6.753 1.00 14.04 H new ATOM 0 HD21 LEU A 12 10.835 -13.772 -8.751 1.00 72.01 H new ATOM 0 HD22 LEU A 12 9.938 -12.931 -7.464 1.00 72.01 H new ATOM 0 HD23 LEU A 12 9.425 -12.767 -9.160 1.00 72.01 H new ATOM 182 N SER A 13 7.593 -8.161 -9.422 1.00 72.10 N ATOM 183 CA SER A 13 6.925 -6.876 -9.128 1.00 15.04 C ATOM 184 C SER A 13 5.409 -6.977 -9.344 1.00 1.53 C ATOM 185 O SER A 13 4.950 -7.525 -10.348 1.00 72.41 O ATOM 186 CB SER A 13 7.510 -5.755 -10.018 1.00 63.13 C ATOM 187 OG SER A 13 7.461 -6.092 -11.407 1.00 13.14 O ATOM 0 H SER A 13 7.372 -8.533 -10.346 1.00 72.10 H new ATOM 0 HA SER A 13 7.105 -6.635 -8.080 1.00 15.04 H new ATOM 0 HB2 SER A 13 6.955 -4.832 -9.849 1.00 63.13 H new ATOM 0 HB3 SER A 13 8.543 -5.564 -9.728 1.00 63.13 H new ATOM 0 HG SER A 13 7.838 -5.358 -11.935 1.00 13.14 H new ATOM 193 N PHE A 14 4.646 -6.415 -8.401 1.00 30.01 N ATOM 194 CA PHE A 14 3.175 -6.364 -8.455 1.00 74.41 C ATOM 195 C PHE A 14 2.704 -4.885 -8.494 1.00 63.43 C ATOM 196 O PHE A 14 2.815 -4.159 -7.504 1.00 13.03 O ATOM 197 CB PHE A 14 2.590 -7.129 -7.239 1.00 21.25 C ATOM 198 CG PHE A 14 1.072 -7.077 -7.136 1.00 73.35 C ATOM 199 CD1 PHE A 14 0.272 -7.642 -8.129 1.00 53.34 C ATOM 200 CD2 PHE A 14 0.447 -6.457 -6.059 1.00 10.44 C ATOM 201 CE1 PHE A 14 -1.102 -7.583 -8.046 1.00 61.34 C ATOM 202 CE2 PHE A 14 -0.923 -6.404 -5.978 1.00 75.41 C ATOM 203 CZ PHE A 14 -1.702 -6.961 -6.971 1.00 4.20 C ATOM 0 H PHE A 14 5.034 -5.976 -7.566 1.00 30.01 H new ATOM 0 HA PHE A 14 2.812 -6.848 -9.362 1.00 74.41 H new ATOM 0 HB2 PHE A 14 2.903 -8.172 -7.296 1.00 21.25 H new ATOM 0 HB3 PHE A 14 3.019 -6.717 -6.325 1.00 21.25 H new ATOM 0 HD1 PHE A 14 0.735 -8.132 -8.973 1.00 53.34 H new ATOM 0 HD2 PHE A 14 1.046 -6.012 -5.278 1.00 10.44 H new ATOM 0 HE1 PHE A 14 -1.709 -8.024 -8.823 1.00 61.34 H new ATOM 0 HE2 PHE A 14 -1.393 -5.924 -5.132 1.00 75.41 H new ATOM 0 HZ PHE A 14 -2.779 -6.910 -6.907 1.00 4.20 H new ATOM 213 N SER A 15 2.203 -4.451 -9.664 1.00 61.33 N ATOM 214 CA SER A 15 1.770 -3.053 -9.913 1.00 52.50 C ATOM 215 C SER A 15 0.225 -2.930 -9.945 1.00 43.42 C ATOM 216 O SER A 15 -0.443 -3.591 -10.746 1.00 70.34 O ATOM 217 CB SER A 15 2.387 -2.538 -11.242 1.00 52.54 C ATOM 218 OG SER A 15 2.053 -3.366 -12.341 1.00 3.34 O ATOM 0 H SER A 15 2.084 -5.060 -10.473 1.00 61.33 H new ATOM 0 HA SER A 15 2.128 -2.436 -9.089 1.00 52.50 H new ATOM 0 HB2 SER A 15 2.038 -1.523 -11.434 1.00 52.54 H new ATOM 0 HB3 SER A 15 3.471 -2.488 -11.142 1.00 52.54 H new ATOM 0 HG SER A 15 2.459 -3.006 -13.157 1.00 3.34 H new ATOM 224 N ILE A 16 -0.334 -2.078 -9.061 1.00 22.12 N ATOM 225 CA ILE A 16 -1.782 -1.767 -9.018 1.00 13.11 C ATOM 226 C ILE A 16 -2.036 -0.374 -9.628 1.00 12.34 C ATOM 227 O ILE A 16 -1.488 0.624 -9.157 1.00 24.35 O ATOM 228 CB ILE A 16 -2.338 -1.801 -7.543 1.00 24.52 C ATOM 229 CG1 ILE A 16 -2.101 -3.204 -6.911 1.00 25.22 C ATOM 230 CG2 ILE A 16 -3.843 -1.405 -7.482 1.00 62.31 C ATOM 231 CD1 ILE A 16 -2.545 -3.338 -5.467 1.00 24.13 C ATOM 0 H ILE A 16 0.207 -1.583 -8.352 1.00 22.12 H new ATOM 0 HA ILE A 16 -2.303 -2.529 -9.597 1.00 13.11 H new ATOM 0 HB ILE A 16 -1.791 -1.059 -6.961 1.00 24.52 H new ATOM 0 HG12 ILE A 16 -2.627 -3.949 -7.508 1.00 25.22 H new ATOM 0 HG13 ILE A 16 -1.038 -3.439 -6.972 1.00 25.22 H new ATOM 0 HG21 ILE A 16 -4.187 -1.441 -6.448 1.00 62.31 H new ATOM 0 HG22 ILE A 16 -3.970 -0.395 -7.872 1.00 62.31 H new ATOM 0 HG23 ILE A 16 -4.427 -2.102 -8.083 1.00 62.31 H new ATOM 0 HD11 ILE A 16 -2.339 -4.349 -5.115 1.00 24.13 H new ATOM 0 HD12 ILE A 16 -2.001 -2.622 -4.851 1.00 24.13 H new ATOM 0 HD13 ILE A 16 -3.614 -3.140 -5.395 1.00 24.13 H new ATOM 243 N VAL A 17 -2.870 -0.330 -10.669 1.00 64.15 N ATOM 244 CA VAL A 17 -3.228 0.899 -11.402 1.00 14.45 C ATOM 245 C VAL A 17 -4.707 1.266 -11.096 1.00 70.10 C ATOM 246 O VAL A 17 -5.620 0.490 -11.392 1.00 61.31 O ATOM 247 CB VAL A 17 -2.991 0.674 -12.944 1.00 4.13 C ATOM 248 CG1 VAL A 17 -3.530 1.835 -13.804 1.00 4.54 C ATOM 249 CG2 VAL A 17 -1.489 0.420 -13.233 1.00 31.31 C ATOM 0 H VAL A 17 -3.328 -1.163 -11.039 1.00 64.15 H new ATOM 0 HA VAL A 17 -2.600 1.731 -11.082 1.00 14.45 H new ATOM 0 HB VAL A 17 -3.559 -0.212 -13.228 1.00 4.13 H new ATOM 0 HG11 VAL A 17 -3.340 1.627 -14.857 1.00 4.54 H new ATOM 0 HG12 VAL A 17 -4.603 1.939 -13.643 1.00 4.54 H new ATOM 0 HG13 VAL A 17 -3.029 2.761 -13.521 1.00 4.54 H new ATOM 0 HG21 VAL A 17 -1.345 0.267 -14.303 1.00 31.31 H new ATOM 0 HG22 VAL A 17 -0.905 1.281 -12.908 1.00 31.31 H new ATOM 0 HG23 VAL A 17 -1.159 -0.467 -12.692 1.00 31.31 H new ATOM 259 N ALA A 18 -4.932 2.448 -10.495 1.00 13.23 N ATOM 260 CA ALA A 18 -6.273 2.876 -10.023 1.00 70.51 C ATOM 261 C ALA A 18 -6.555 4.368 -10.329 1.00 2.24 C ATOM 262 O ALA A 18 -5.648 5.176 -10.320 1.00 32.11 O ATOM 263 CB ALA A 18 -6.390 2.598 -8.514 1.00 34.33 C ATOM 0 H ALA A 18 -4.198 3.134 -10.321 1.00 13.23 H new ATOM 0 HA ALA A 18 -7.024 2.301 -10.564 1.00 70.51 H new ATOM 0 HB1 ALA A 18 -7.373 2.910 -8.162 1.00 34.33 H new ATOM 0 HB2 ALA A 18 -6.260 1.532 -8.329 1.00 34.33 H new ATOM 0 HB3 ALA A 18 -5.620 3.155 -7.981 1.00 34.33 H new ATOM 269 N GLU A 19 -7.828 4.720 -10.612 1.00 5.54 N ATOM 270 CA GLU A 19 -8.262 6.126 -10.867 1.00 71.15 C ATOM 271 C GLU A 19 -9.395 6.545 -9.908 1.00 41.41 C ATOM 272 O GLU A 19 -10.365 5.801 -9.719 1.00 13.00 O ATOM 273 CB GLU A 19 -8.734 6.289 -12.334 1.00 43.21 C ATOM 274 CG GLU A 19 -7.621 6.079 -13.373 1.00 71.13 C ATOM 275 CD GLU A 19 -8.076 6.222 -14.833 1.00 73.44 C ATOM 276 OE1 GLU A 19 -8.873 7.132 -15.129 1.00 3.24 O ATOM 277 OE2 GLU A 19 -7.611 5.449 -15.691 1.00 62.03 O ATOM 0 H GLU A 19 -8.589 4.044 -10.672 1.00 5.54 H new ATOM 0 HA GLU A 19 -7.403 6.774 -10.690 1.00 71.15 H new ATOM 0 HB2 GLU A 19 -9.537 5.578 -12.528 1.00 43.21 H new ATOM 0 HB3 GLU A 19 -9.153 7.287 -12.462 1.00 43.21 H new ATOM 0 HG2 GLU A 19 -6.824 6.797 -13.182 1.00 71.13 H new ATOM 0 HG3 GLU A 19 -7.195 5.085 -13.234 1.00 71.13 H new ATOM 284 N PHE A 20 -9.269 7.751 -9.320 1.00 21.45 N ATOM 285 CA PHE A 20 -10.241 8.302 -8.333 1.00 65.31 C ATOM 286 C PHE A 20 -10.667 9.727 -8.749 1.00 44.14 C ATOM 287 O PHE A 20 -9.829 10.496 -9.229 1.00 51.32 O ATOM 288 CB PHE A 20 -9.603 8.342 -6.915 1.00 70.41 C ATOM 289 CG PHE A 20 -8.889 7.054 -6.528 1.00 45.34 C ATOM 290 CD1 PHE A 20 -9.609 5.882 -6.315 1.00 42.12 C ATOM 291 CD2 PHE A 20 -7.497 7.008 -6.411 1.00 73.04 C ATOM 292 CE1 PHE A 20 -8.964 4.710 -5.993 1.00 34.15 C ATOM 293 CE2 PHE A 20 -6.856 5.834 -6.082 1.00 0.32 C ATOM 294 CZ PHE A 20 -7.589 4.685 -5.878 1.00 62.23 C ATOM 0 H PHE A 20 -8.489 8.380 -9.512 1.00 21.45 H new ATOM 0 HA PHE A 20 -11.119 7.656 -8.311 1.00 65.31 H new ATOM 0 HB2 PHE A 20 -8.894 9.168 -6.869 1.00 70.41 H new ATOM 0 HB3 PHE A 20 -10.382 8.549 -6.182 1.00 70.41 H new ATOM 0 HD1 PHE A 20 -10.685 5.893 -6.403 1.00 42.12 H new ATOM 0 HD2 PHE A 20 -6.917 7.903 -6.581 1.00 73.04 H new ATOM 0 HE1 PHE A 20 -9.535 3.808 -5.830 1.00 34.15 H new ATOM 0 HE2 PHE A 20 -5.781 5.814 -5.984 1.00 0.32 H new ATOM 0 HZ PHE A 20 -7.086 3.763 -5.627 1.00 62.23 H new ATOM 304 N ASP A 21 -11.955 10.080 -8.551 1.00 12.41 N ATOM 305 CA ASP A 21 -12.477 11.428 -8.881 1.00 34.44 C ATOM 306 C ASP A 21 -12.003 12.462 -7.814 1.00 63.35 C ATOM 307 O ASP A 21 -12.695 12.715 -6.816 1.00 41.50 O ATOM 308 CB ASP A 21 -14.028 11.374 -8.993 1.00 43.51 C ATOM 309 CG ASP A 21 -14.653 12.678 -9.528 1.00 74.21 C ATOM 310 OD1 ASP A 21 -14.699 12.866 -10.764 1.00 14.21 O ATOM 311 OD2 ASP A 21 -15.096 13.528 -8.723 1.00 22.12 O ATOM 0 H ASP A 21 -12.656 9.449 -8.163 1.00 12.41 H new ATOM 0 HA ASP A 21 -12.084 11.752 -9.844 1.00 34.44 H new ATOM 0 HB2 ASP A 21 -14.308 10.550 -9.650 1.00 43.51 H new ATOM 0 HB3 ASP A 21 -14.448 11.156 -8.011 1.00 43.51 H new ATOM 316 N ALA A 22 -10.790 13.013 -8.030 1.00 31.02 N ATOM 317 CA ALA A 22 -10.105 13.919 -7.073 1.00 45.01 C ATOM 318 C ALA A 22 -8.862 14.571 -7.721 1.00 52.31 C ATOM 319 O ALA A 22 -8.591 14.366 -8.904 1.00 23.13 O ATOM 320 CB ALA A 22 -9.689 13.124 -5.819 1.00 4.03 C ATOM 0 H ALA A 22 -10.251 12.843 -8.879 1.00 31.02 H new ATOM 0 HA ALA A 22 -10.796 14.713 -6.791 1.00 45.01 H new ATOM 0 HB1 ALA A 22 -9.186 13.789 -5.117 1.00 4.03 H new ATOM 0 HB2 ALA A 22 -10.575 12.700 -5.346 1.00 4.03 H new ATOM 0 HB3 ALA A 22 -9.011 12.320 -6.106 1.00 4.03 H new ATOM 326 N ASP A 23 -8.111 15.372 -6.939 1.00 74.41 N ATOM 327 CA ASP A 23 -6.785 15.896 -7.363 1.00 32.30 C ATOM 328 C ASP A 23 -5.641 15.082 -6.712 1.00 1.11 C ATOM 329 O ASP A 23 -5.879 14.239 -5.835 1.00 31.10 O ATOM 330 CB ASP A 23 -6.643 17.399 -7.028 1.00 14.12 C ATOM 331 CG ASP A 23 -6.788 17.700 -5.530 1.00 54.30 C ATOM 332 OD1 ASP A 23 -7.931 17.860 -5.060 1.00 34.11 O ATOM 333 OD2 ASP A 23 -5.757 17.761 -4.815 1.00 13.32 O ATOM 0 H ASP A 23 -8.396 15.674 -6.007 1.00 74.41 H new ATOM 0 HA ASP A 23 -6.714 15.786 -8.445 1.00 32.30 H new ATOM 0 HB2 ASP A 23 -5.670 17.751 -7.370 1.00 14.12 H new ATOM 0 HB3 ASP A 23 -7.397 17.961 -7.580 1.00 14.12 H new ATOM 338 N VAL A 24 -4.403 15.366 -7.152 1.00 63.34 N ATOM 339 CA VAL A 24 -3.184 14.638 -6.733 1.00 74.44 C ATOM 340 C VAL A 24 -2.941 14.711 -5.207 1.00 31.40 C ATOM 341 O VAL A 24 -2.685 13.690 -4.567 1.00 60.14 O ATOM 342 CB VAL A 24 -1.930 15.185 -7.516 1.00 54.44 C ATOM 343 CG1 VAL A 24 -0.609 14.503 -7.084 1.00 53.42 C ATOM 344 CG2 VAL A 24 -2.133 15.032 -9.038 1.00 54.24 C ATOM 0 H VAL A 24 -4.214 16.116 -7.817 1.00 63.34 H new ATOM 0 HA VAL A 24 -3.337 13.587 -6.978 1.00 74.44 H new ATOM 0 HB VAL A 24 -1.842 16.242 -7.265 1.00 54.44 H new ATOM 0 HG11 VAL A 24 0.220 14.920 -7.657 1.00 53.42 H new ATOM 0 HG12 VAL A 24 -0.440 14.678 -6.021 1.00 53.42 H new ATOM 0 HG13 VAL A 24 -0.675 13.431 -7.269 1.00 53.42 H new ATOM 0 HG21 VAL A 24 -1.257 15.415 -9.562 1.00 54.24 H new ATOM 0 HG22 VAL A 24 -2.271 13.979 -9.283 1.00 54.24 H new ATOM 0 HG23 VAL A 24 -3.015 15.594 -9.346 1.00 54.24 H new ATOM 354 N LYS A 25 -3.073 15.919 -4.634 1.00 51.53 N ATOM 355 CA LYS A 25 -2.814 16.154 -3.191 1.00 62.33 C ATOM 356 C LYS A 25 -3.931 15.561 -2.305 1.00 21.41 C ATOM 357 O LYS A 25 -3.687 15.197 -1.151 1.00 1.10 O ATOM 358 CB LYS A 25 -2.618 17.663 -2.899 1.00 23.13 C ATOM 359 CG LYS A 25 -1.501 18.324 -3.744 1.00 44.42 C ATOM 360 CD LYS A 25 -1.007 19.678 -3.177 1.00 51.10 C ATOM 361 CE LYS A 25 -0.288 19.529 -1.821 1.00 72.54 C ATOM 362 NZ LYS A 25 0.351 20.797 -1.393 1.00 53.11 N ATOM 0 H LYS A 25 -3.358 16.755 -5.144 1.00 51.53 H new ATOM 0 HA LYS A 25 -1.888 15.636 -2.939 1.00 62.33 H new ATOM 0 HB2 LYS A 25 -3.557 18.184 -3.084 1.00 23.13 H new ATOM 0 HB3 LYS A 25 -2.385 17.792 -1.842 1.00 23.13 H new ATOM 0 HG2 LYS A 25 -0.656 17.639 -3.812 1.00 44.42 H new ATOM 0 HG3 LYS A 25 -1.869 18.478 -4.759 1.00 44.42 H new ATOM 0 HD2 LYS A 25 -0.329 20.142 -3.894 1.00 51.10 H new ATOM 0 HD3 LYS A 25 -1.857 20.350 -3.061 1.00 51.10 H new ATOM 0 HE2 LYS A 25 -1.004 19.209 -1.064 1.00 72.54 H new ATOM 0 HE3 LYS A 25 0.469 18.748 -1.895 1.00 72.54 H new ATOM 0 HZ1 LYS A 25 0.824 20.656 -0.477 1.00 53.11 H new ATOM 0 HZ2 LYS A 25 1.052 21.089 -2.103 1.00 53.11 H new ATOM 0 HZ3 LYS A 25 -0.374 21.536 -1.298 1.00 53.11 H new ATOM 376 N ARG A 26 -5.150 15.478 -2.863 1.00 32.53 N ATOM 377 CA ARG A 26 -6.305 14.814 -2.217 1.00 75.24 C ATOM 378 C ARG A 26 -6.016 13.298 -2.010 1.00 54.43 C ATOM 379 O ARG A 26 -6.326 12.739 -0.949 1.00 14.31 O ATOM 380 CB ARG A 26 -7.571 15.037 -3.090 1.00 22.44 C ATOM 381 CG ARG A 26 -8.895 14.448 -2.548 1.00 21.32 C ATOM 382 CD ARG A 26 -9.348 15.053 -1.207 1.00 25.14 C ATOM 383 NE ARG A 26 -10.687 14.558 -0.811 1.00 2.45 N ATOM 384 CZ ARG A 26 -11.107 14.380 0.430 1.00 4.22 C ATOM 385 NH1 ARG A 26 -10.322 14.591 1.447 1.00 41.53 N ATOM 386 NH2 ARG A 26 -12.324 13.979 0.641 1.00 65.34 N ATOM 0 H ARG A 26 -5.368 15.870 -3.779 1.00 32.53 H new ATOM 0 HA ARG A 26 -6.477 15.248 -1.232 1.00 75.24 H new ATOM 0 HB2 ARG A 26 -7.706 16.110 -3.228 1.00 22.44 H new ATOM 0 HB3 ARG A 26 -7.386 14.610 -4.076 1.00 22.44 H new ATOM 0 HG2 ARG A 26 -9.680 14.604 -3.288 1.00 21.32 H new ATOM 0 HG3 ARG A 26 -8.779 13.371 -2.428 1.00 21.32 H new ATOM 0 HD2 ARG A 26 -8.623 14.804 -0.432 1.00 25.14 H new ATOM 0 HD3 ARG A 26 -9.370 16.140 -1.286 1.00 25.14 H new ATOM 0 HE ARG A 26 -11.342 14.335 -1.561 1.00 2.45 H new ATOM 0 HH11 ARG A 26 -9.362 14.900 1.295 1.00 41.53 H new ATOM 0 HH12 ARG A 26 -10.667 14.447 2.396 1.00 41.53 H new ATOM 0 HH21 ARG A 26 -12.947 13.804 -0.147 1.00 65.34 H new ATOM 0 HH22 ARG A 26 -12.657 13.839 1.595 1.00 65.34 H new ATOM 400 N VAL A 27 -5.396 12.658 -3.029 1.00 31.11 N ATOM 401 CA VAL A 27 -4.982 11.232 -2.956 1.00 65.05 C ATOM 402 C VAL A 27 -3.683 11.070 -2.110 1.00 74.14 C ATOM 403 O VAL A 27 -3.495 10.067 -1.442 1.00 44.21 O ATOM 404 CB VAL A 27 -4.751 10.603 -4.391 1.00 63.21 C ATOM 405 CG1 VAL A 27 -4.584 9.059 -4.316 1.00 2.11 C ATOM 406 CG2 VAL A 27 -5.882 10.987 -5.380 1.00 63.14 C ATOM 0 H VAL A 27 -5.170 13.107 -3.916 1.00 31.11 H new ATOM 0 HA VAL A 27 -5.800 10.697 -2.474 1.00 65.05 H new ATOM 0 HB VAL A 27 -3.822 11.025 -4.774 1.00 63.21 H new ATOM 0 HG11 VAL A 27 -4.427 8.661 -5.319 1.00 2.11 H new ATOM 0 HG12 VAL A 27 -3.725 8.816 -3.691 1.00 2.11 H new ATOM 0 HG13 VAL A 27 -5.483 8.616 -3.886 1.00 2.11 H new ATOM 0 HG21 VAL A 27 -5.684 10.535 -6.352 1.00 63.14 H new ATOM 0 HG22 VAL A 27 -6.837 10.625 -4.999 1.00 63.14 H new ATOM 0 HG23 VAL A 27 -5.921 12.071 -5.485 1.00 63.14 H new ATOM 416 N TRP A 28 -2.788 12.073 -2.154 1.00 32.32 N ATOM 417 CA TRP A 28 -1.523 12.070 -1.368 1.00 45.21 C ATOM 418 C TRP A 28 -1.792 12.154 0.152 1.00 35.40 C ATOM 419 O TRP A 28 -1.058 11.563 0.953 1.00 51.41 O ATOM 420 CB TRP A 28 -0.613 13.236 -1.825 1.00 33.43 C ATOM 421 CG TRP A 28 0.741 13.291 -1.142 1.00 42.52 C ATOM 422 CD1 TRP A 28 1.123 14.114 -0.116 1.00 33.14 C ATOM 423 CD2 TRP A 28 1.887 12.477 -1.440 1.00 50.41 C ATOM 424 NE1 TRP A 28 2.424 13.865 0.228 1.00 0.21 N ATOM 425 CE2 TRP A 28 2.914 12.869 -0.570 1.00 53.24 C ATOM 426 CE3 TRP A 28 2.139 11.458 -2.363 1.00 53.41 C ATOM 427 CZ2 TRP A 28 4.175 12.283 -0.595 1.00 63.20 C ATOM 428 CZ3 TRP A 28 3.388 10.881 -2.387 1.00 0.22 C ATOM 429 CH2 TRP A 28 4.394 11.295 -1.507 1.00 62.02 C ATOM 0 H TRP A 28 -2.912 12.907 -2.728 1.00 32.32 H new ATOM 0 HA TRP A 28 -1.014 11.124 -1.555 1.00 45.21 H new ATOM 0 HB2 TRP A 28 -0.459 13.158 -2.901 1.00 33.43 H new ATOM 0 HB3 TRP A 28 -1.134 14.177 -1.645 1.00 33.43 H new ATOM 0 HD1 TRP A 28 0.490 14.852 0.353 1.00 33.14 H new ATOM 0 HE1 TRP A 28 2.944 14.345 0.962 1.00 0.21 H new ATOM 0 HE3 TRP A 28 1.368 11.130 -3.044 1.00 53.41 H new ATOM 0 HZ2 TRP A 28 4.953 12.600 0.084 1.00 63.20 H new ATOM 0 HZ3 TRP A 28 3.595 10.095 -3.098 1.00 0.22 H new ATOM 0 HH2 TRP A 28 5.364 10.822 -1.552 1.00 62.02 H new ATOM 440 N ALA A 29 -2.845 12.898 0.525 1.00 35.03 N ATOM 441 CA ALA A 29 -3.264 13.091 1.931 1.00 51.35 C ATOM 442 C ALA A 29 -3.528 11.756 2.677 1.00 23.02 C ATOM 443 O ALA A 29 -3.282 11.652 3.884 1.00 54.35 O ATOM 444 CB ALA A 29 -4.519 13.973 1.967 1.00 43.04 C ATOM 0 H ALA A 29 -3.438 13.389 -0.144 1.00 35.03 H new ATOM 0 HA ALA A 29 -2.440 13.577 2.453 1.00 51.35 H new ATOM 0 HB1 ALA A 29 -4.832 14.118 3.001 1.00 43.04 H new ATOM 0 HB2 ALA A 29 -4.297 14.940 1.516 1.00 43.04 H new ATOM 0 HB3 ALA A 29 -5.321 13.488 1.410 1.00 43.04 H new ATOM 450 N ILE A 30 -4.015 10.736 1.939 1.00 13.54 N ATOM 451 CA ILE A 30 -4.346 9.407 2.517 1.00 74.44 C ATOM 452 C ILE A 30 -3.069 8.569 2.793 1.00 31.51 C ATOM 453 O ILE A 30 -3.115 7.604 3.534 1.00 45.23 O ATOM 454 CB ILE A 30 -5.343 8.603 1.595 1.00 12.02 C ATOM 455 CG1 ILE A 30 -4.594 7.927 0.402 1.00 20.13 C ATOM 456 CG2 ILE A 30 -6.486 9.518 1.098 1.00 11.34 C ATOM 457 CD1 ILE A 30 -5.465 7.317 -0.668 1.00 43.03 C ATOM 0 H ILE A 30 -4.190 10.804 0.936 1.00 13.54 H new ATOM 0 HA ILE A 30 -4.842 9.593 3.470 1.00 74.44 H new ATOM 0 HB ILE A 30 -5.786 7.806 2.192 1.00 12.02 H new ATOM 0 HG12 ILE A 30 -3.949 8.672 -0.064 1.00 20.13 H new ATOM 0 HG13 ILE A 30 -3.945 7.148 0.802 1.00 20.13 H new ATOM 0 HG21 ILE A 30 -7.162 8.944 0.464 1.00 11.34 H new ATOM 0 HG22 ILE A 30 -7.036 9.910 1.953 1.00 11.34 H new ATOM 0 HG23 ILE A 30 -6.067 10.346 0.526 1.00 11.34 H new ATOM 0 HD11 ILE A 30 -4.836 6.878 -1.443 1.00 43.03 H new ATOM 0 HD12 ILE A 30 -6.093 6.542 -0.228 1.00 43.03 H new ATOM 0 HD13 ILE A 30 -6.096 8.089 -1.107 1.00 43.03 H new ATOM 469 N TRP A 31 -1.947 8.930 2.142 1.00 70.43 N ATOM 470 CA TRP A 31 -0.628 8.286 2.368 1.00 62.44 C ATOM 471 C TRP A 31 0.193 9.045 3.424 1.00 32.11 C ATOM 472 O TRP A 31 0.935 8.437 4.200 1.00 53.45 O ATOM 473 CB TRP A 31 0.165 8.216 1.034 1.00 14.45 C ATOM 474 CG TRP A 31 -0.455 7.279 0.027 1.00 73.24 C ATOM 475 CD1 TRP A 31 -1.240 7.600 -1.049 1.00 33.23 C ATOM 476 CD2 TRP A 31 -0.347 5.849 0.034 1.00 34.43 C ATOM 477 NE1 TRP A 31 -1.626 6.457 -1.700 1.00 50.30 N ATOM 478 CE2 TRP A 31 -1.083 5.372 -1.058 1.00 51.52 C ATOM 479 CE3 TRP A 31 0.316 4.932 0.860 1.00 12.23 C ATOM 480 CZ2 TRP A 31 -1.187 4.015 -1.343 1.00 32.21 C ATOM 481 CZ3 TRP A 31 0.212 3.586 0.577 1.00 21.45 C ATOM 482 CH2 TRP A 31 -0.531 3.137 -0.521 1.00 3.42 C ATOM 0 H TRP A 31 -1.923 9.674 1.445 1.00 70.43 H new ATOM 0 HA TRP A 31 -0.807 7.277 2.739 1.00 62.44 H new ATOM 0 HB2 TRP A 31 0.227 9.215 0.602 1.00 14.45 H new ATOM 0 HB3 TRP A 31 1.186 7.894 1.241 1.00 14.45 H new ATOM 0 HD1 TRP A 31 -1.514 8.603 -1.341 1.00 33.23 H new ATOM 0 HE1 TRP A 31 -2.221 6.419 -2.528 1.00 50.30 H new ATOM 0 HE3 TRP A 31 0.898 5.273 1.703 1.00 12.23 H new ATOM 0 HZ2 TRP A 31 -1.766 3.665 -2.185 1.00 32.21 H new ATOM 0 HZ3 TRP A 31 0.711 2.868 1.212 1.00 21.45 H new ATOM 0 HH2 TRP A 31 -0.588 2.078 -0.724 1.00 3.42 H new ATOM 493 N GLU A 32 0.050 10.379 3.425 1.00 65.44 N ATOM 494 CA GLU A 32 0.833 11.279 4.289 1.00 33.21 C ATOM 495 C GLU A 32 0.317 11.265 5.751 1.00 33.12 C ATOM 496 O GLU A 32 1.112 11.297 6.697 1.00 34.43 O ATOM 497 CB GLU A 32 0.810 12.716 3.698 1.00 63.12 C ATOM 498 CG GLU A 32 1.726 13.720 4.422 1.00 73.13 C ATOM 499 CD GLU A 32 1.778 15.097 3.741 1.00 34.31 C ATOM 500 OE1 GLU A 32 2.602 15.295 2.820 1.00 53.23 O ATOM 501 OE2 GLU A 32 0.995 15.992 4.128 1.00 71.51 O ATOM 0 H GLU A 32 -0.615 10.867 2.824 1.00 65.44 H new ATOM 0 HA GLU A 32 1.863 10.922 4.317 1.00 33.21 H new ATOM 0 HB2 GLU A 32 1.102 12.668 2.649 1.00 63.12 H new ATOM 0 HB3 GLU A 32 -0.213 13.091 3.727 1.00 63.12 H new ATOM 0 HG2 GLU A 32 1.379 13.843 5.448 1.00 73.13 H new ATOM 0 HG3 GLU A 32 2.734 13.310 4.473 1.00 73.13 H new ATOM 508 N ASP A 33 -1.018 11.218 5.923 1.00 1.52 N ATOM 509 CA ASP A 33 -1.657 11.203 7.257 1.00 35.40 C ATOM 510 C ASP A 33 -2.089 9.753 7.651 1.00 23.12 C ATOM 511 O ASP A 33 -2.840 9.113 6.903 1.00 21.40 O ATOM 512 CB ASP A 33 -2.883 12.149 7.258 1.00 22.05 C ATOM 513 CG ASP A 33 -3.442 12.395 8.666 1.00 12.13 C ATOM 514 OD1 ASP A 33 -4.290 11.605 9.135 1.00 13.11 O ATOM 515 OD2 ASP A 33 -3.025 13.375 9.321 1.00 34.55 O ATOM 0 H ASP A 33 -1.681 11.189 5.149 1.00 1.52 H new ATOM 0 HA ASP A 33 -0.934 11.551 7.995 1.00 35.40 H new ATOM 0 HB2 ASP A 33 -2.601 13.103 6.812 1.00 22.05 H new ATOM 0 HB3 ASP A 33 -3.666 11.723 6.630 1.00 22.05 H new ATOM 520 N PRO A 34 -1.638 9.220 8.842 1.00 74.14 N ATOM 521 CA PRO A 34 -1.980 7.833 9.288 1.00 42.30 C ATOM 522 C PRO A 34 -3.490 7.599 9.591 1.00 1.22 C ATOM 523 O PRO A 34 -3.985 6.485 9.410 1.00 63.24 O ATOM 524 CB PRO A 34 -1.119 7.642 10.564 1.00 53.45 C ATOM 525 CG PRO A 34 -0.856 9.036 11.059 1.00 63.14 C ATOM 526 CD PRO A 34 -0.735 9.894 9.817 1.00 42.35 C ATOM 0 HA PRO A 34 -1.775 7.113 8.496 1.00 42.30 H new ATOM 0 HB2 PRO A 34 -1.646 7.049 11.312 1.00 53.45 H new ATOM 0 HB3 PRO A 34 -0.189 7.119 10.340 1.00 53.45 H new ATOM 0 HG2 PRO A 34 -1.667 9.384 11.698 1.00 63.14 H new ATOM 0 HG3 PRO A 34 0.057 9.075 11.653 1.00 63.14 H new ATOM 0 HD2 PRO A 34 -1.044 10.922 10.007 1.00 42.35 H new ATOM 0 HD3 PRO A 34 0.292 9.932 9.454 1.00 42.35 H new ATOM 534 N ARG A 35 -4.206 8.647 10.056 1.00 53.31 N ATOM 535 CA ARG A 35 -5.669 8.559 10.349 1.00 30.53 C ATOM 536 C ARG A 35 -6.484 8.448 9.032 1.00 63.23 C ATOM 537 O ARG A 35 -7.482 7.719 8.970 1.00 42.51 O ATOM 538 CB ARG A 35 -6.157 9.780 11.191 1.00 14.14 C ATOM 539 CG ARG A 35 -5.891 9.732 12.724 1.00 61.14 C ATOM 540 CD ARG A 35 -4.412 9.511 13.127 1.00 55.15 C ATOM 541 NE ARG A 35 -4.031 8.082 13.127 1.00 32.42 N ATOM 542 CZ ARG A 35 -2.971 7.578 13.718 1.00 15.41 C ATOM 543 NH1 ARG A 35 -2.090 8.332 14.288 1.00 75.02 N ATOM 544 NH2 ARG A 35 -2.788 6.305 13.707 1.00 13.34 N ATOM 0 H ARG A 35 -3.802 9.566 10.239 1.00 53.31 H new ATOM 0 HA ARG A 35 -5.835 7.658 10.940 1.00 30.53 H new ATOM 0 HB2 ARG A 35 -5.683 10.677 10.793 1.00 14.14 H new ATOM 0 HB3 ARG A 35 -7.230 9.891 11.037 1.00 14.14 H new ATOM 0 HG2 ARG A 35 -6.236 10.666 13.167 1.00 61.14 H new ATOM 0 HG3 ARG A 35 -6.493 8.933 13.157 1.00 61.14 H new ATOM 0 HD2 ARG A 35 -3.766 10.056 12.438 1.00 55.15 H new ATOM 0 HD3 ARG A 35 -4.243 9.928 14.120 1.00 55.15 H new ATOM 0 HE ARG A 35 -4.641 7.435 12.627 1.00 32.42 H new ATOM 0 HH11 ARG A 35 -2.208 9.345 14.286 1.00 75.02 H new ATOM 0 HH12 ARG A 35 -1.276 7.914 14.740 1.00 75.02 H new ATOM 0 HH21 ARG A 35 -3.462 5.697 13.242 1.00 13.34 H new ATOM 0 HH22 ARG A 35 -1.969 5.904 14.163 1.00 13.34 H new ATOM 558 N GLN A 36 -6.040 9.173 7.987 1.00 24.45 N ATOM 559 CA GLN A 36 -6.620 9.066 6.623 1.00 51.52 C ATOM 560 C GLN A 36 -6.312 7.681 6.009 1.00 41.33 C ATOM 561 O GLN A 36 -7.159 7.088 5.349 1.00 31.32 O ATOM 562 CB GLN A 36 -6.047 10.179 5.702 1.00 12.05 C ATOM 563 CG GLN A 36 -6.256 11.625 6.197 1.00 31.31 C ATOM 564 CD GLN A 36 -7.668 12.189 6.035 1.00 74.11 C ATOM 565 OE1 GLN A 36 -8.666 11.472 6.033 1.00 64.21 O ATOM 566 NE2 GLN A 36 -7.754 13.500 5.943 1.00 71.51 N ATOM 0 H GLN A 36 -5.276 9.845 8.057 1.00 24.45 H new ATOM 0 HA GLN A 36 -7.700 9.187 6.704 1.00 51.52 H new ATOM 0 HB2 GLN A 36 -4.978 10.008 5.577 1.00 12.05 H new ATOM 0 HB3 GLN A 36 -6.503 10.081 4.717 1.00 12.05 H new ATOM 0 HG2 GLN A 36 -5.987 11.670 7.252 1.00 31.31 H new ATOM 0 HG3 GLN A 36 -5.563 12.275 5.663 1.00 31.31 H new ATOM 0 HE21 GLN A 36 -6.907 14.068 5.947 1.00 71.51 H new ATOM 0 HE22 GLN A 36 -8.668 13.947 5.867 1.00 71.51 H new ATOM 575 N LEU A 37 -5.081 7.195 6.260 1.00 41.24 N ATOM 576 CA LEU A 37 -4.568 5.905 5.737 1.00 12.10 C ATOM 577 C LEU A 37 -5.347 4.695 6.299 1.00 45.14 C ATOM 578 O LEU A 37 -5.846 3.874 5.536 1.00 62.31 O ATOM 579 CB LEU A 37 -3.049 5.813 6.075 1.00 11.12 C ATOM 580 CG LEU A 37 -2.263 4.520 5.661 1.00 72.43 C ATOM 581 CD1 LEU A 37 -2.375 4.191 4.157 1.00 73.05 C ATOM 582 CD2 LEU A 37 -0.784 4.656 6.060 1.00 15.14 C ATOM 0 H LEU A 37 -4.403 7.691 6.839 1.00 41.24 H new ATOM 0 HA LEU A 37 -4.712 5.873 4.657 1.00 12.10 H new ATOM 0 HB2 LEU A 37 -2.554 6.665 5.608 1.00 11.12 H new ATOM 0 HB3 LEU A 37 -2.942 5.934 7.153 1.00 11.12 H new ATOM 0 HG LEU A 37 -2.724 3.690 6.196 1.00 72.43 H new ATOM 0 HD11 LEU A 37 -1.808 3.286 3.939 1.00 73.05 H new ATOM 0 HD12 LEU A 37 -3.422 4.036 3.895 1.00 73.05 H new ATOM 0 HD13 LEU A 37 -1.974 5.019 3.573 1.00 73.05 H new ATOM 0 HD21 LEU A 37 -0.244 3.755 5.770 1.00 15.14 H new ATOM 0 HD22 LEU A 37 -0.349 5.518 5.555 1.00 15.14 H new ATOM 0 HD23 LEU A 37 -0.709 4.792 7.139 1.00 15.14 H new ATOM 594 N GLU A 38 -5.503 4.641 7.630 1.00 54.44 N ATOM 595 CA GLU A 38 -6.067 3.460 8.337 1.00 50.21 C ATOM 596 C GLU A 38 -7.565 3.206 8.039 1.00 5.12 C ATOM 597 O GLU A 38 -8.039 2.074 8.201 1.00 33.43 O ATOM 598 CB GLU A 38 -5.853 3.618 9.858 1.00 52.12 C ATOM 599 CG GLU A 38 -6.605 4.796 10.503 1.00 1.00 C ATOM 600 CD GLU A 38 -6.230 4.993 11.975 1.00 23.10 C ATOM 601 OE1 GLU A 38 -5.083 5.401 12.239 1.00 25.15 O ATOM 602 OE2 GLU A 38 -7.063 4.741 12.869 1.00 33.21 O ATOM 0 H GLU A 38 -5.246 5.407 8.253 1.00 54.44 H new ATOM 0 HA GLU A 38 -5.532 2.589 7.959 1.00 50.21 H new ATOM 0 HB2 GLU A 38 -6.162 2.696 10.351 1.00 52.12 H new ATOM 0 HB3 GLU A 38 -4.787 3.739 10.049 1.00 52.12 H new ATOM 0 HG2 GLU A 38 -6.386 5.709 9.950 1.00 1.00 H new ATOM 0 HG3 GLU A 38 -7.679 4.625 10.424 1.00 1.00 H new ATOM 609 N ARG A 39 -8.306 4.255 7.601 1.00 64.34 N ATOM 610 CA ARG A 39 -9.764 4.139 7.339 1.00 10.02 C ATOM 611 C ARG A 39 -10.056 3.329 6.057 1.00 14.40 C ATOM 612 O ARG A 39 -11.155 2.785 5.899 1.00 1.34 O ATOM 613 CB ARG A 39 -10.455 5.536 7.267 1.00 12.10 C ATOM 614 CG ARG A 39 -10.290 6.325 5.945 1.00 71.13 C ATOM 615 CD ARG A 39 -11.219 7.562 5.877 1.00 22.22 C ATOM 616 NE ARG A 39 -12.642 7.206 6.092 1.00 2.13 N ATOM 617 CZ ARG A 39 -13.670 7.588 5.355 1.00 50.50 C ATOM 618 NH1 ARG A 39 -13.526 8.373 4.334 1.00 51.25 N ATOM 619 NH2 ARG A 39 -14.856 7.187 5.672 1.00 31.04 N ATOM 0 H ARG A 39 -7.922 5.183 7.423 1.00 64.34 H new ATOM 0 HA ARG A 39 -10.186 3.596 8.185 1.00 10.02 H new ATOM 0 HB2 ARG A 39 -11.521 5.399 7.451 1.00 12.10 H new ATOM 0 HB3 ARG A 39 -10.068 6.150 8.080 1.00 12.10 H new ATOM 0 HG2 ARG A 39 -9.253 6.646 5.844 1.00 71.13 H new ATOM 0 HG3 ARG A 39 -10.504 5.667 5.103 1.00 71.13 H new ATOM 0 HD2 ARG A 39 -10.910 8.288 6.629 1.00 22.22 H new ATOM 0 HD3 ARG A 39 -11.109 8.044 4.905 1.00 22.22 H new ATOM 0 HE ARG A 39 -12.848 6.605 6.890 1.00 2.13 H new ATOM 0 HH11 ARG A 39 -12.599 8.714 4.080 1.00 51.25 H new ATOM 0 HH12 ARG A 39 -14.340 8.650 3.785 1.00 51.25 H new ATOM 0 HH21 ARG A 39 -14.990 6.583 6.483 1.00 31.04 H new ATOM 0 HH22 ARG A 39 -15.658 7.474 5.112 1.00 31.04 H new ATOM 633 N TRP A 40 -9.067 3.265 5.137 1.00 32.21 N ATOM 634 CA TRP A 40 -9.192 2.493 3.882 1.00 52.42 C ATOM 635 C TRP A 40 -8.201 1.315 3.831 1.00 73.22 C ATOM 636 O TRP A 40 -8.513 0.305 3.223 1.00 21.43 O ATOM 637 CB TRP A 40 -9.008 3.408 2.638 1.00 71.53 C ATOM 638 CG TRP A 40 -7.638 4.039 2.468 1.00 40.23 C ATOM 639 CD1 TRP A 40 -7.216 5.238 2.964 1.00 21.41 C ATOM 640 CD2 TRP A 40 -6.523 3.508 1.722 1.00 21.12 C ATOM 641 NE1 TRP A 40 -5.916 5.469 2.593 1.00 41.21 N ATOM 642 CE2 TRP A 40 -5.477 4.431 1.822 1.00 64.41 C ATOM 643 CE3 TRP A 40 -6.316 2.338 0.985 1.00 50.11 C ATOM 644 CZ2 TRP A 40 -4.244 4.228 1.209 1.00 32.12 C ATOM 645 CZ3 TRP A 40 -5.098 2.136 0.375 1.00 64.21 C ATOM 646 CH2 TRP A 40 -4.076 3.079 0.490 1.00 5.15 C ATOM 0 H TRP A 40 -8.171 3.741 5.242 1.00 32.21 H new ATOM 0 HA TRP A 40 -10.201 2.081 3.863 1.00 52.42 H new ATOM 0 HB2 TRP A 40 -9.229 2.822 1.746 1.00 71.53 H new ATOM 0 HB3 TRP A 40 -9.749 4.206 2.687 1.00 71.53 H new ATOM 0 HD1 TRP A 40 -7.818 5.907 3.561 1.00 21.41 H new ATOM 0 HE1 TRP A 40 -5.364 6.287 2.852 1.00 41.21 H new ATOM 0 HE3 TRP A 40 -7.101 1.602 0.895 1.00 50.11 H new ATOM 0 HZ2 TRP A 40 -3.449 4.953 1.299 1.00 32.12 H new ATOM 0 HZ3 TRP A 40 -4.932 1.237 -0.199 1.00 64.21 H new ATOM 0 HH2 TRP A 40 -3.131 2.896 -0.000 1.00 5.15 H new ATOM 657 N TRP A 41 -7.029 1.459 4.511 1.00 54.54 N ATOM 658 CA TRP A 41 -5.837 0.560 4.355 1.00 34.23 C ATOM 659 C TRP A 41 -6.162 -0.941 4.518 1.00 5.14 C ATOM 660 O TRP A 41 -5.572 -1.798 3.847 1.00 60.22 O ATOM 661 CB TRP A 41 -4.718 0.964 5.357 1.00 22.54 C ATOM 662 CG TRP A 41 -3.419 0.204 5.180 1.00 31.42 C ATOM 663 CD1 TRP A 41 -2.786 -0.603 6.090 1.00 52.54 C ATOM 664 CD2 TRP A 41 -2.618 0.159 3.988 1.00 54.02 C ATOM 665 NE1 TRP A 41 -1.634 -1.106 5.549 1.00 34.43 N ATOM 666 CE2 TRP A 41 -1.516 -0.658 4.258 1.00 2.12 C ATOM 667 CE3 TRP A 41 -2.728 0.745 2.726 1.00 31.34 C ATOM 668 CZ2 TRP A 41 -0.535 -0.907 3.311 1.00 63.41 C ATOM 669 CZ3 TRP A 41 -1.759 0.494 1.783 1.00 1.11 C ATOM 670 CH2 TRP A 41 -0.670 -0.322 2.078 1.00 41.14 C ATOM 0 H TRP A 41 -6.879 2.206 5.189 1.00 54.54 H new ATOM 0 HA TRP A 41 -5.494 0.696 3.329 1.00 34.23 H new ATOM 0 HB2 TRP A 41 -4.519 2.030 5.251 1.00 22.54 H new ATOM 0 HB3 TRP A 41 -5.082 0.807 6.372 1.00 22.54 H new ATOM 0 HD1 TRP A 41 -3.144 -0.811 7.087 1.00 52.54 H new ATOM 0 HE1 TRP A 41 -0.971 -1.715 6.028 1.00 34.43 H new ATOM 0 HE3 TRP A 41 -3.564 1.388 2.493 1.00 31.34 H new ATOM 0 HZ2 TRP A 41 0.309 -1.542 3.537 1.00 63.41 H new ATOM 0 HZ3 TRP A 41 -1.844 0.935 0.801 1.00 1.11 H new ATOM 0 HH2 TRP A 41 0.082 -0.497 1.322 1.00 41.14 H new ATOM 681 N GLY A 42 -7.079 -1.240 5.436 1.00 53.23 N ATOM 682 CA GLY A 42 -7.611 -2.591 5.595 1.00 32.23 C ATOM 683 C GLY A 42 -8.971 -2.764 4.901 1.00 73.23 C ATOM 684 O GLY A 42 -9.763 -1.809 4.871 1.00 44.23 O ATOM 0 H GLY A 42 -7.471 -0.558 6.086 1.00 53.23 H new ATOM 0 HA2 GLY A 42 -6.902 -3.310 5.185 1.00 32.23 H new ATOM 0 HA3 GLY A 42 -7.715 -2.816 6.656 1.00 32.23 H new ATOM 688 N PRO A 43 -9.289 -3.978 4.336 1.00 12.34 N ATOM 689 CA PRO A 43 -10.631 -4.259 3.748 1.00 14.42 C ATOM 690 C PRO A 43 -11.768 -4.157 4.822 1.00 65.54 C ATOM 691 O PRO A 43 -11.472 -4.206 6.018 1.00 72.44 O ATOM 692 CB PRO A 43 -10.473 -5.704 3.176 1.00 54.32 C ATOM 693 CG PRO A 43 -9.334 -6.300 3.952 1.00 51.32 C ATOM 694 CD PRO A 43 -8.380 -5.152 4.224 1.00 61.13 C ATOM 0 HA PRO A 43 -10.926 -3.540 2.984 1.00 14.42 H new ATOM 0 HB2 PRO A 43 -11.387 -6.283 3.307 1.00 54.32 H new ATOM 0 HB3 PRO A 43 -10.257 -5.685 2.108 1.00 54.32 H new ATOM 0 HG2 PRO A 43 -9.685 -6.747 4.882 1.00 51.32 H new ATOM 0 HG3 PRO A 43 -8.844 -7.091 3.384 1.00 51.32 H new ATOM 0 HD2 PRO A 43 -7.810 -5.310 5.140 1.00 61.13 H new ATOM 0 HD3 PRO A 43 -7.658 -5.028 3.417 1.00 61.13 H new ATOM 702 N PRO A 44 -13.078 -3.988 4.415 1.00 41.24 N ATOM 703 CA PRO A 44 -14.230 -3.766 5.367 1.00 61.45 C ATOM 704 C PRO A 44 -14.294 -4.685 6.636 1.00 24.04 C ATOM 705 O PRO A 44 -14.818 -4.268 7.678 1.00 53.05 O ATOM 706 CB PRO A 44 -15.455 -3.999 4.457 1.00 44.44 C ATOM 707 CG PRO A 44 -15.003 -3.525 3.107 1.00 53.02 C ATOM 708 CD PRO A 44 -13.549 -3.946 2.994 1.00 60.11 C ATOM 0 HA PRO A 44 -14.150 -2.780 5.825 1.00 61.45 H new ATOM 0 HB2 PRO A 44 -15.741 -5.051 4.435 1.00 44.44 H new ATOM 0 HB3 PRO A 44 -16.323 -3.440 4.806 1.00 44.44 H new ATOM 0 HG2 PRO A 44 -15.603 -3.971 2.314 1.00 53.02 H new ATOM 0 HG3 PRO A 44 -15.107 -2.444 3.016 1.00 53.02 H new ATOM 0 HD2 PRO A 44 -13.450 -4.918 2.511 1.00 60.11 H new ATOM 0 HD3 PRO A 44 -12.972 -3.236 2.402 1.00 60.11 H new ATOM 716 N THR A 45 -13.768 -5.928 6.536 1.00 1.31 N ATOM 717 CA THR A 45 -13.738 -6.900 7.670 1.00 30.00 C ATOM 718 C THR A 45 -12.450 -6.791 8.540 1.00 74.03 C ATOM 719 O THR A 45 -12.451 -7.216 9.702 1.00 35.33 O ATOM 720 CB THR A 45 -13.889 -8.372 7.155 1.00 40.11 C ATOM 721 OG1 THR A 45 -12.841 -8.682 6.219 1.00 43.32 O ATOM 722 CG2 THR A 45 -15.252 -8.607 6.484 1.00 3.01 C ATOM 0 H THR A 45 -13.354 -6.290 5.677 1.00 1.31 H new ATOM 0 HA THR A 45 -14.586 -6.639 8.302 1.00 30.00 H new ATOM 0 HB THR A 45 -13.818 -9.026 8.024 1.00 40.11 H new ATOM 0 HG1 THR A 45 -12.945 -9.605 5.906 1.00 43.32 H new ATOM 0 HG21 THR A 45 -15.316 -9.640 6.141 1.00 3.01 H new ATOM 0 HG22 THR A 45 -16.049 -8.413 7.202 1.00 3.01 H new ATOM 0 HG23 THR A 45 -15.359 -7.935 5.633 1.00 3.01 H new ATOM 730 N TRP A 46 -11.355 -6.243 7.970 1.00 41.12 N ATOM 731 CA TRP A 46 -10.060 -6.024 8.687 1.00 13.51 C ATOM 732 C TRP A 46 -9.757 -4.501 8.881 1.00 61.33 C ATOM 733 O TRP A 46 -9.080 -3.901 8.044 1.00 51.21 O ATOM 734 CB TRP A 46 -8.884 -6.680 7.893 1.00 33.23 C ATOM 735 CG TRP A 46 -8.935 -8.190 7.793 1.00 21.20 C ATOM 736 CD1 TRP A 46 -9.817 -8.948 7.077 1.00 14.50 C ATOM 737 CD2 TRP A 46 -8.030 -9.120 8.409 1.00 3.41 C ATOM 738 NE1 TRP A 46 -9.548 -10.279 7.255 1.00 50.11 N ATOM 739 CE2 TRP A 46 -8.457 -10.412 8.059 1.00 1.24 C ATOM 740 CE3 TRP A 46 -6.919 -8.984 9.241 1.00 54.22 C ATOM 741 CZ2 TRP A 46 -7.806 -11.559 8.499 1.00 12.34 C ATOM 742 CZ3 TRP A 46 -6.271 -10.120 9.675 1.00 21.23 C ATOM 743 CH2 TRP A 46 -6.718 -11.395 9.310 1.00 35.55 C ATOM 0 H TRP A 46 -11.334 -5.936 6.997 1.00 41.12 H new ATOM 0 HA TRP A 46 -10.152 -6.487 9.669 1.00 13.51 H new ATOM 0 HB2 TRP A 46 -8.872 -6.266 6.885 1.00 33.23 H new ATOM 0 HB3 TRP A 46 -7.944 -6.395 8.366 1.00 33.23 H new ATOM 0 HD1 TRP A 46 -10.611 -8.555 6.460 1.00 14.50 H new ATOM 0 HE1 TRP A 46 -10.080 -11.049 6.850 1.00 50.11 H new ATOM 0 HE3 TRP A 46 -6.573 -8.006 9.540 1.00 54.22 H new ATOM 0 HZ2 TRP A 46 -8.147 -12.542 8.211 1.00 12.34 H new ATOM 0 HZ3 TRP A 46 -5.402 -10.025 10.309 1.00 21.23 H new ATOM 0 HH2 TRP A 46 -6.194 -12.265 9.676 1.00 35.55 H new ATOM 754 N PRO A 47 -10.282 -3.831 9.958 1.00 2.14 N ATOM 755 CA PRO A 47 -9.905 -2.422 10.286 1.00 12.24 C ATOM 756 C PRO A 47 -8.416 -2.276 10.738 1.00 14.23 C ATOM 757 O PRO A 47 -7.991 -2.876 11.734 1.00 20.02 O ATOM 758 CB PRO A 47 -10.890 -2.047 11.428 1.00 74.54 C ATOM 759 CG PRO A 47 -11.264 -3.364 12.048 1.00 4.42 C ATOM 760 CD PRO A 47 -11.312 -4.348 10.898 1.00 44.50 C ATOM 0 HA PRO A 47 -9.977 -1.766 9.418 1.00 12.24 H new ATOM 0 HB2 PRO A 47 -10.421 -1.385 12.155 1.00 74.54 H new ATOM 0 HB3 PRO A 47 -11.766 -1.527 11.042 1.00 74.54 H new ATOM 0 HG2 PRO A 47 -10.532 -3.669 12.796 1.00 4.42 H new ATOM 0 HG3 PRO A 47 -12.228 -3.301 12.553 1.00 4.42 H new ATOM 0 HD2 PRO A 47 -11.083 -5.362 11.227 1.00 44.50 H new ATOM 0 HD3 PRO A 47 -12.299 -4.378 10.436 1.00 44.50 H new ATOM 768 N ALA A 48 -7.635 -1.471 9.989 1.00 52.32 N ATOM 769 CA ALA A 48 -6.210 -1.208 10.300 1.00 65.15 C ATOM 770 C ALA A 48 -6.052 -0.148 11.428 1.00 31.10 C ATOM 771 O ALA A 48 -6.720 0.883 11.420 1.00 71.02 O ATOM 772 CB ALA A 48 -5.468 -0.765 9.024 1.00 73.35 C ATOM 0 H ALA A 48 -7.969 -0.986 9.156 1.00 52.32 H new ATOM 0 HA ALA A 48 -5.767 -2.134 10.666 1.00 65.15 H new ATOM 0 HB1 ALA A 48 -4.421 -0.573 9.260 1.00 73.35 H new ATOM 0 HB2 ALA A 48 -5.533 -1.553 8.274 1.00 73.35 H new ATOM 0 HB3 ALA A 48 -5.925 0.145 8.635 1.00 73.35 H new ATOM 778 N THR A 49 -5.175 -0.440 12.406 1.00 62.23 N ATOM 779 CA THR A 49 -4.823 0.480 13.520 1.00 31.40 C ATOM 780 C THR A 49 -3.320 0.843 13.443 1.00 72.20 C ATOM 781 O THR A 49 -2.467 -0.036 13.586 1.00 1.15 O ATOM 782 CB THR A 49 -5.128 -0.173 14.919 1.00 33.35 C ATOM 783 OG1 THR A 49 -6.497 -0.613 14.973 1.00 54.22 O ATOM 784 CG2 THR A 49 -4.862 0.796 16.093 1.00 4.21 C ATOM 0 H THR A 49 -4.681 -1.331 12.452 1.00 62.23 H new ATOM 0 HA THR A 49 -5.431 1.379 13.419 1.00 31.40 H new ATOM 0 HB THR A 49 -4.453 -1.022 15.025 1.00 33.35 H new ATOM 0 HG1 THR A 49 -6.676 -1.019 15.847 1.00 54.22 H new ATOM 0 HG21 THR A 49 -5.088 0.297 17.035 1.00 4.21 H new ATOM 0 HG22 THR A 49 -3.815 1.099 16.085 1.00 4.21 H new ATOM 0 HG23 THR A 49 -5.495 1.677 15.988 1.00 4.21 H new ATOM 792 N PHE A 50 -3.001 2.130 13.204 1.00 34.24 N ATOM 793 CA PHE A 50 -1.598 2.608 13.086 1.00 11.11 C ATOM 794 C PHE A 50 -1.055 3.155 14.429 1.00 62.35 C ATOM 795 O PHE A 50 -1.550 4.151 14.956 1.00 43.14 O ATOM 796 CB PHE A 50 -1.480 3.671 11.948 1.00 71.25 C ATOM 797 CG PHE A 50 -1.370 3.049 10.555 1.00 51.41 C ATOM 798 CD1 PHE A 50 -2.468 2.427 9.960 1.00 12.44 C ATOM 799 CD2 PHE A 50 -0.156 3.050 9.860 1.00 50.01 C ATOM 800 CE1 PHE A 50 -2.360 1.828 8.722 1.00 34.13 C ATOM 801 CE2 PHE A 50 -0.054 2.455 8.620 1.00 34.43 C ATOM 802 CZ PHE A 50 -1.155 1.839 8.052 1.00 12.11 C ATOM 0 H PHE A 50 -3.697 2.866 13.087 1.00 34.24 H new ATOM 0 HA PHE A 50 -0.976 1.752 12.824 1.00 11.11 H new ATOM 0 HB2 PHE A 50 -2.351 4.326 11.979 1.00 71.25 H new ATOM 0 HB3 PHE A 50 -0.605 4.295 12.131 1.00 71.25 H new ATOM 0 HD1 PHE A 50 -3.417 2.414 10.476 1.00 12.44 H new ATOM 0 HD2 PHE A 50 0.711 3.522 10.299 1.00 50.01 H new ATOM 0 HE1 PHE A 50 -3.220 1.350 8.277 1.00 34.13 H new ATOM 0 HE2 PHE A 50 0.888 2.470 8.091 1.00 34.43 H new ATOM 0 HZ PHE A 50 -1.071 1.367 7.084 1.00 12.11 H new ATOM 812 N GLU A 51 -0.030 2.471 14.967 1.00 13.45 N ATOM 813 CA GLU A 51 0.722 2.903 16.169 1.00 1.55 C ATOM 814 C GLU A 51 1.729 4.012 15.829 1.00 71.52 C ATOM 815 O GLU A 51 1.833 5.021 16.538 1.00 54.43 O ATOM 816 CB GLU A 51 1.459 1.679 16.786 1.00 53.15 C ATOM 817 CG GLU A 51 0.532 0.596 17.380 1.00 33.33 C ATOM 818 CD GLU A 51 -0.246 1.088 18.621 1.00 41.41 C ATOM 819 OE1 GLU A 51 0.305 1.012 19.746 1.00 61.24 O ATOM 820 OE2 GLU A 51 -1.392 1.566 18.477 1.00 72.40 O ATOM 0 H GLU A 51 0.307 1.591 14.578 1.00 13.45 H new ATOM 0 HA GLU A 51 0.014 3.308 16.893 1.00 1.55 H new ATOM 0 HB2 GLU A 51 2.082 1.222 16.017 1.00 53.15 H new ATOM 0 HB3 GLU A 51 2.129 2.033 17.569 1.00 53.15 H new ATOM 0 HG2 GLU A 51 -0.177 0.273 16.617 1.00 33.33 H new ATOM 0 HG3 GLU A 51 1.127 -0.276 17.652 1.00 33.33 H new ATOM 827 N THR A 52 2.472 3.811 14.742 1.00 54.34 N ATOM 828 CA THR A 52 3.532 4.735 14.309 1.00 33.02 C ATOM 829 C THR A 52 3.426 4.980 12.788 1.00 70.34 C ATOM 830 O THR A 52 2.990 4.088 12.049 1.00 64.24 O ATOM 831 CB THR A 52 4.940 4.146 14.670 1.00 61.23 C ATOM 832 OG1 THR A 52 4.940 3.682 16.034 1.00 1.23 O ATOM 833 CG2 THR A 52 6.062 5.177 14.513 1.00 22.23 C ATOM 0 H THR A 52 2.360 3.002 14.131 1.00 54.34 H new ATOM 0 HA THR A 52 3.410 5.686 14.827 1.00 33.02 H new ATOM 0 HB THR A 52 5.127 3.326 13.977 1.00 61.23 H new ATOM 0 HG1 THR A 52 5.821 3.313 16.254 1.00 1.23 H new ATOM 0 HG21 THR A 52 7.016 4.719 14.775 1.00 22.23 H new ATOM 0 HG22 THR A 52 6.097 5.522 13.480 1.00 22.23 H new ATOM 0 HG23 THR A 52 5.873 6.024 15.172 1.00 22.23 H new ATOM 841 N HIS A 53 3.783 6.197 12.338 1.00 71.44 N ATOM 842 CA HIS A 53 3.841 6.544 10.899 1.00 71.32 C ATOM 843 C HIS A 53 4.706 7.815 10.698 1.00 51.42 C ATOM 844 O HIS A 53 4.198 8.944 10.673 1.00 24.32 O ATOM 845 CB HIS A 53 2.399 6.719 10.341 1.00 1.45 C ATOM 846 CG HIS A 53 2.298 6.990 8.855 1.00 34.13 C ATOM 847 ND1 HIS A 53 2.357 8.269 8.364 1.00 31.42 N ATOM 848 CD2 HIS A 53 2.114 6.133 7.815 1.00 41.14 C ATOM 849 CE1 HIS A 53 2.210 8.169 7.063 1.00 4.13 C ATOM 850 NE2 HIS A 53 2.061 6.899 6.679 1.00 20.54 N ATOM 0 H HIS A 53 4.039 6.967 12.956 1.00 71.44 H new ATOM 0 HA HIS A 53 4.313 5.736 10.340 1.00 71.32 H new ATOM 0 HB2 HIS A 53 1.830 5.817 10.567 1.00 1.45 H new ATOM 0 HB3 HIS A 53 1.920 7.540 10.875 1.00 1.45 H new ATOM 0 HD2 HIS A 53 2.027 5.058 7.873 1.00 41.14 H new ATOM 0 HE1 HIS A 53 2.210 9.011 6.386 1.00 4.13 H new ATOM 0 HE2 HIS A 53 1.932 6.563 5.724 1.00 20.54 H new ATOM 858 N GLU A 54 6.034 7.615 10.619 1.00 74.53 N ATOM 859 CA GLU A 54 7.006 8.717 10.438 1.00 12.31 C ATOM 860 C GLU A 54 7.196 8.977 8.944 1.00 64.51 C ATOM 861 O GLU A 54 8.024 8.322 8.306 1.00 11.02 O ATOM 862 CB GLU A 54 8.375 8.380 11.097 1.00 73.30 C ATOM 863 CG GLU A 54 8.279 7.828 12.523 1.00 44.41 C ATOM 864 CD GLU A 54 7.479 8.736 13.478 1.00 44.32 C ATOM 865 OE1 GLU A 54 8.027 9.755 13.941 1.00 32.14 O ATOM 866 OE2 GLU A 54 6.298 8.437 13.769 1.00 74.53 O ATOM 0 H GLU A 54 6.465 6.692 10.678 1.00 74.53 H new ATOM 0 HA GLU A 54 6.614 9.610 10.925 1.00 12.31 H new ATOM 0 HB2 GLU A 54 8.894 7.651 10.474 1.00 73.30 H new ATOM 0 HB3 GLU A 54 8.988 9.281 11.111 1.00 73.30 H new ATOM 0 HG2 GLU A 54 7.812 6.844 12.493 1.00 44.41 H new ATOM 0 HG3 GLU A 54 9.285 7.692 12.920 1.00 44.41 H new ATOM 873 N PHE A 55 6.398 9.893 8.382 1.00 50.33 N ATOM 874 CA PHE A 55 6.420 10.201 6.947 1.00 23.53 C ATOM 875 C PHE A 55 7.630 11.125 6.599 1.00 75.21 C ATOM 876 O PHE A 55 7.471 12.309 6.276 1.00 33.22 O ATOM 877 CB PHE A 55 5.051 10.824 6.537 1.00 42.21 C ATOM 878 CG PHE A 55 4.710 10.673 5.055 1.00 52.21 C ATOM 879 CD1 PHE A 55 4.324 9.435 4.548 1.00 22.24 C ATOM 880 CD2 PHE A 55 4.766 11.749 4.179 1.00 25.15 C ATOM 881 CE1 PHE A 55 3.998 9.279 3.216 1.00 33.20 C ATOM 882 CE2 PHE A 55 4.439 11.591 2.845 1.00 50.32 C ATOM 883 CZ PHE A 55 4.058 10.354 2.364 1.00 21.43 C ATOM 0 H PHE A 55 5.719 10.442 8.909 1.00 50.33 H new ATOM 0 HA PHE A 55 6.559 9.286 6.371 1.00 23.53 H new ATOM 0 HB2 PHE A 55 4.262 10.360 7.128 1.00 42.21 H new ATOM 0 HB3 PHE A 55 5.057 11.884 6.790 1.00 42.21 H new ATOM 0 HD1 PHE A 55 4.279 8.582 5.209 1.00 22.24 H new ATOM 0 HD2 PHE A 55 5.068 12.720 4.544 1.00 25.15 H new ATOM 0 HE1 PHE A 55 3.696 8.311 2.844 1.00 33.20 H new ATOM 0 HE2 PHE A 55 4.482 12.438 2.177 1.00 50.32 H new ATOM 0 HZ PHE A 55 3.808 10.232 1.320 1.00 21.43 H new ATOM 893 N THR A 56 8.850 10.563 6.726 1.00 1.24 N ATOM 894 CA THR A 56 10.121 11.248 6.368 1.00 2.52 C ATOM 895 C THR A 56 11.106 10.267 5.681 1.00 54.43 C ATOM 896 O THR A 56 10.884 9.050 5.676 1.00 33.11 O ATOM 897 CB THR A 56 10.792 11.888 7.638 1.00 31.13 C ATOM 898 OG1 THR A 56 11.979 12.618 7.268 1.00 53.12 O ATOM 899 CG2 THR A 56 11.144 10.836 8.710 1.00 62.32 C ATOM 0 H THR A 56 8.988 9.617 7.081 1.00 1.24 H new ATOM 0 HA THR A 56 9.880 12.045 5.665 1.00 2.52 H new ATOM 0 HB THR A 56 10.060 12.570 8.071 1.00 31.13 H new ATOM 0 HG1 THR A 56 12.384 13.012 8.069 1.00 53.12 H new ATOM 0 HG21 THR A 56 11.605 11.329 9.566 1.00 62.32 H new ATOM 0 HG22 THR A 56 10.236 10.325 9.031 1.00 62.32 H new ATOM 0 HG23 THR A 56 11.841 10.109 8.292 1.00 62.32 H new ATOM 907 N VAL A 57 12.193 10.810 5.102 1.00 65.40 N ATOM 908 CA VAL A 57 13.255 10.014 4.443 1.00 3.04 C ATOM 909 C VAL A 57 14.042 9.185 5.507 1.00 13.13 C ATOM 910 O VAL A 57 14.869 9.723 6.250 1.00 10.52 O ATOM 911 CB VAL A 57 14.224 10.960 3.625 1.00 11.13 C ATOM 912 CG1 VAL A 57 15.406 10.184 2.987 1.00 3.45 C ATOM 913 CG2 VAL A 57 13.433 11.758 2.550 1.00 63.22 C ATOM 0 H VAL A 57 12.364 11.815 5.076 1.00 65.40 H new ATOM 0 HA VAL A 57 12.795 9.318 3.742 1.00 3.04 H new ATOM 0 HB VAL A 57 14.658 11.667 4.332 1.00 11.13 H new ATOM 0 HG11 VAL A 57 16.042 10.878 2.437 1.00 3.45 H new ATOM 0 HG12 VAL A 57 15.989 9.701 3.771 1.00 3.45 H new ATOM 0 HG13 VAL A 57 15.019 9.428 2.305 1.00 3.45 H new ATOM 0 HG21 VAL A 57 14.117 12.403 1.999 1.00 63.22 H new ATOM 0 HG22 VAL A 57 12.954 11.063 1.860 1.00 63.22 H new ATOM 0 HG23 VAL A 57 12.672 12.369 3.037 1.00 63.22 H new ATOM 923 N GLY A 58 13.737 7.875 5.581 1.00 1.43 N ATOM 924 CA GLY A 58 14.321 6.972 6.598 1.00 44.53 C ATOM 925 C GLY A 58 13.448 6.819 7.852 1.00 24.41 C ATOM 926 O GLY A 58 13.930 6.370 8.902 1.00 35.04 O ATOM 0 H GLY A 58 13.086 7.414 4.945 1.00 1.43 H new ATOM 0 HA2 GLY A 58 14.479 5.990 6.153 1.00 44.53 H new ATOM 0 HA3 GLY A 58 15.300 7.351 6.890 1.00 44.53 H new ATOM 930 N GLY A 59 12.166 7.222 7.750 1.00 72.11 N ATOM 931 CA GLY A 59 11.179 7.004 8.819 1.00 42.15 C ATOM 932 C GLY A 59 10.495 5.642 8.720 1.00 62.34 C ATOM 933 O GLY A 59 10.524 5.013 7.665 1.00 72.15 O ATOM 0 H GLY A 59 11.791 7.703 6.932 1.00 72.11 H new ATOM 0 HA2 GLY A 59 11.673 7.089 9.787 1.00 42.15 H new ATOM 0 HA3 GLY A 59 10.424 7.789 8.777 1.00 42.15 H new ATOM 937 N LYS A 60 9.881 5.169 9.821 1.00 75.45 N ATOM 938 CA LYS A 60 9.175 3.857 9.844 1.00 70.24 C ATOM 939 C LYS A 60 7.708 3.986 10.305 1.00 34.12 C ATOM 940 O LYS A 60 7.333 4.943 10.986 1.00 3.12 O ATOM 941 CB LYS A 60 9.931 2.838 10.746 1.00 13.31 C ATOM 942 CG LYS A 60 11.287 2.367 10.172 1.00 52.33 C ATOM 943 CD LYS A 60 11.962 1.288 11.049 1.00 3.42 C ATOM 944 CE LYS A 60 13.266 0.745 10.435 1.00 23.12 C ATOM 945 NZ LYS A 60 13.917 -0.257 11.315 1.00 71.44 N ATOM 0 H LYS A 60 9.855 5.669 10.710 1.00 75.45 H new ATOM 0 HA LYS A 60 9.165 3.489 8.818 1.00 70.24 H new ATOM 0 HB2 LYS A 60 10.100 3.291 11.723 1.00 13.31 H new ATOM 0 HB3 LYS A 60 9.294 1.968 10.904 1.00 13.31 H new ATOM 0 HG2 LYS A 60 11.134 1.971 9.168 1.00 52.33 H new ATOM 0 HG3 LYS A 60 11.955 3.223 10.078 1.00 52.33 H new ATOM 0 HD2 LYS A 60 12.177 1.708 12.032 1.00 3.42 H new ATOM 0 HD3 LYS A 60 11.266 0.463 11.200 1.00 3.42 H new ATOM 0 HE2 LYS A 60 13.051 0.292 9.467 1.00 23.12 H new ATOM 0 HE3 LYS A 60 13.954 1.571 10.255 1.00 23.12 H new ATOM 0 HZ1 LYS A 60 14.791 -0.598 10.866 1.00 71.44 H new ATOM 0 HZ2 LYS A 60 14.146 0.181 12.230 1.00 71.44 H new ATOM 0 HZ3 LYS A 60 13.271 -1.058 11.467 1.00 71.44 H new ATOM 959 N ALA A 61 6.891 2.981 9.939 1.00 34.13 N ATOM 960 CA ALA A 61 5.461 2.916 10.309 1.00 12.22 C ATOM 961 C ALA A 61 5.131 1.561 10.970 1.00 1.32 C ATOM 962 O ALA A 61 5.488 0.514 10.444 1.00 21.54 O ATOM 963 CB ALA A 61 4.568 3.154 9.073 1.00 34.33 C ATOM 0 H ALA A 61 7.203 2.189 9.377 1.00 34.13 H new ATOM 0 HA ALA A 61 5.258 3.706 11.032 1.00 12.22 H new ATOM 0 HB1 ALA A 61 3.519 3.102 9.366 1.00 34.33 H new ATOM 0 HB2 ALA A 61 4.780 4.138 8.655 1.00 34.33 H new ATOM 0 HB3 ALA A 61 4.773 2.390 8.323 1.00 34.33 H new ATOM 969 N ALA A 62 4.448 1.601 12.124 1.00 0.43 N ATOM 970 CA ALA A 62 3.978 0.394 12.843 1.00 1.24 C ATOM 971 C ALA A 62 2.441 0.344 12.810 1.00 63.32 C ATOM 972 O ALA A 62 1.784 1.350 13.096 1.00 4.43 O ATOM 973 CB ALA A 62 4.477 0.394 14.296 1.00 33.13 C ATOM 0 H ALA A 62 4.202 2.473 12.592 1.00 0.43 H new ATOM 0 HA ALA A 62 4.381 -0.489 12.347 1.00 1.24 H new ATOM 0 HB1 ALA A 62 4.119 -0.502 14.804 1.00 33.13 H new ATOM 0 HB2 ALA A 62 5.567 0.406 14.306 1.00 33.13 H new ATOM 0 HB3 ALA A 62 4.099 1.278 14.810 1.00 33.13 H new ATOM 979 N TYR A 63 1.876 -0.818 12.461 1.00 40.34 N ATOM 980 CA TYR A 63 0.414 -0.999 12.363 1.00 4.51 C ATOM 981 C TYR A 63 0.010 -2.468 12.538 1.00 31.25 C ATOM 982 O TYR A 63 0.863 -3.350 12.659 1.00 21.41 O ATOM 983 CB TYR A 63 -0.122 -0.449 11.011 1.00 24.21 C ATOM 984 CG TYR A 63 0.505 -1.062 9.742 1.00 1.43 C ATOM 985 CD1 TYR A 63 1.700 -0.559 9.210 1.00 43.41 C ATOM 986 CD2 TYR A 63 -0.111 -2.121 9.059 1.00 13.54 C ATOM 987 CE1 TYR A 63 2.255 -1.090 8.064 1.00 4.14 C ATOM 988 CE2 TYR A 63 0.446 -2.657 7.914 1.00 4.14 C ATOM 989 CZ TYR A 63 1.626 -2.134 7.416 1.00 60.52 C ATOM 990 OH TYR A 63 2.189 -2.669 6.274 1.00 41.43 O ATOM 0 H TYR A 63 2.411 -1.657 12.239 1.00 40.34 H new ATOM 0 HA TYR A 63 -0.037 -0.431 13.176 1.00 4.51 H new ATOM 0 HB2 TYR A 63 -1.199 -0.611 10.976 1.00 24.21 H new ATOM 0 HB3 TYR A 63 0.039 0.629 10.989 1.00 24.21 H new ATOM 0 HD1 TYR A 63 2.197 0.261 9.707 1.00 43.41 H new ATOM 0 HD2 TYR A 63 -1.039 -2.525 9.436 1.00 13.54 H new ATOM 0 HE1 TYR A 63 3.180 -0.690 7.675 1.00 4.14 H new ATOM 0 HE2 TYR A 63 -0.038 -3.481 7.410 1.00 4.14 H new ATOM 0 HH TYR A 63 2.705 -1.978 5.809 1.00 41.43 H new ATOM 1000 N TYR A 64 -1.310 -2.703 12.572 1.00 23.42 N ATOM 1001 CA TYR A 64 -1.888 -4.055 12.568 1.00 15.44 C ATOM 1002 C TYR A 64 -3.359 -4.022 12.105 1.00 15.12 C ATOM 1003 O TYR A 64 -4.123 -3.150 12.517 1.00 74.51 O ATOM 1004 CB TYR A 64 -1.748 -4.725 13.968 1.00 14.34 C ATOM 1005 CG TYR A 64 -2.334 -3.941 15.156 1.00 72.50 C ATOM 1006 CD1 TYR A 64 -3.663 -4.120 15.551 1.00 61.51 C ATOM 1007 CD2 TYR A 64 -1.547 -3.057 15.908 1.00 73.54 C ATOM 1008 CE1 TYR A 64 -4.184 -3.459 16.638 1.00 65.51 C ATOM 1009 CE2 TYR A 64 -2.071 -2.387 16.996 1.00 61.23 C ATOM 1010 CZ TYR A 64 -3.388 -2.595 17.357 1.00 52.31 C ATOM 1011 OH TYR A 64 -3.909 -1.940 18.448 1.00 42.24 O ATOM 0 H TYR A 64 -2.008 -1.960 12.603 1.00 23.42 H new ATOM 0 HA TYR A 64 -1.329 -4.661 11.855 1.00 15.44 H new ATOM 0 HB2 TYR A 64 -2.230 -5.702 13.930 1.00 14.34 H new ATOM 0 HB3 TYR A 64 -0.689 -4.899 14.161 1.00 14.34 H new ATOM 0 HD1 TYR A 64 -4.295 -4.793 14.990 1.00 61.51 H new ATOM 0 HD2 TYR A 64 -0.515 -2.898 15.632 1.00 73.54 H new ATOM 0 HE1 TYR A 64 -5.213 -3.616 16.927 1.00 65.51 H new ATOM 0 HE2 TYR A 64 -1.454 -1.704 17.562 1.00 61.23 H new ATOM 0 HH TYR A 64 -3.220 -1.369 18.846 1.00 42.24 H new ATOM 1021 N MET A 65 -3.746 -4.969 11.237 1.00 74.40 N ATOM 1022 CA MET A 65 -5.146 -5.132 10.797 1.00 44.11 C ATOM 1023 C MET A 65 -5.876 -6.083 11.769 1.00 43.21 C ATOM 1024 O MET A 65 -5.594 -7.287 11.789 1.00 45.42 O ATOM 1025 CB MET A 65 -5.209 -5.688 9.350 1.00 41.04 C ATOM 1026 CG MET A 65 -4.521 -4.818 8.286 1.00 3.33 C ATOM 1027 SD MET A 65 -4.670 -5.504 6.619 1.00 15.01 S ATOM 1028 CE MET A 65 -3.897 -7.120 6.798 1.00 3.23 C ATOM 0 H MET A 65 -3.103 -5.642 10.820 1.00 74.40 H new ATOM 0 HA MET A 65 -5.636 -4.158 10.803 1.00 44.11 H new ATOM 0 HB2 MET A 65 -4.753 -6.678 9.338 1.00 41.04 H new ATOM 0 HB3 MET A 65 -6.255 -5.815 9.072 1.00 41.04 H new ATOM 0 HG2 MET A 65 -4.956 -3.819 8.303 1.00 3.33 H new ATOM 0 HG3 MET A 65 -3.466 -4.711 8.537 1.00 3.33 H new ATOM 0 HE1 MET A 65 -3.682 -7.532 5.812 1.00 3.23 H new ATOM 0 HE2 MET A 65 -2.968 -7.019 7.359 1.00 3.23 H new ATOM 0 HE3 MET A 65 -4.572 -7.789 7.331 1.00 3.23 H new ATOM 1038 N THR A 66 -6.773 -5.532 12.597 1.00 41.22 N ATOM 1039 CA THR A 66 -7.562 -6.322 13.563 1.00 21.11 C ATOM 1040 C THR A 66 -8.664 -7.122 12.826 1.00 34.32 C ATOM 1041 O THR A 66 -9.669 -6.556 12.398 1.00 43.24 O ATOM 1042 CB THR A 66 -8.186 -5.399 14.663 1.00 54.10 C ATOM 1043 OG1 THR A 66 -7.137 -4.663 15.317 1.00 15.21 O ATOM 1044 CG2 THR A 66 -8.965 -6.196 15.724 1.00 12.42 C ATOM 0 H THR A 66 -6.975 -4.532 12.620 1.00 41.22 H new ATOM 0 HA THR A 66 -6.894 -7.027 14.059 1.00 21.11 H new ATOM 0 HB THR A 66 -8.886 -4.728 14.166 1.00 54.10 H new ATOM 0 HG1 THR A 66 -7.524 -4.083 16.005 1.00 15.21 H new ATOM 0 HG21 THR A 66 -9.378 -5.510 16.464 1.00 12.42 H new ATOM 0 HG22 THR A 66 -9.776 -6.744 15.245 1.00 12.42 H new ATOM 0 HG23 THR A 66 -8.293 -6.899 16.216 1.00 12.42 H new ATOM 1052 N GLY A 67 -8.444 -8.445 12.683 1.00 35.13 N ATOM 1053 CA GLY A 67 -9.328 -9.327 11.897 1.00 63.03 C ATOM 1054 C GLY A 67 -10.780 -9.417 12.393 1.00 11.34 C ATOM 1055 O GLY A 67 -11.048 -9.060 13.543 1.00 32.02 O ATOM 0 H GLY A 67 -7.653 -8.929 13.107 1.00 35.13 H new ATOM 0 HA2 GLY A 67 -9.336 -8.978 10.864 1.00 63.03 H new ATOM 0 HA3 GLY A 67 -8.901 -10.330 11.892 1.00 63.03 H new ATOM 1059 N PRO A 68 -11.741 -9.918 11.539 1.00 21.21 N ATOM 1060 CA PRO A 68 -13.203 -9.967 11.866 1.00 23.31 C ATOM 1061 C PRO A 68 -13.505 -10.673 13.214 1.00 53.31 C ATOM 1062 O PRO A 68 -14.277 -10.165 14.042 1.00 4.22 O ATOM 1063 CB PRO A 68 -13.825 -10.734 10.651 1.00 31.42 C ATOM 1064 CG PRO A 68 -12.657 -11.371 9.944 1.00 44.24 C ATOM 1065 CD PRO A 68 -11.482 -10.454 10.178 1.00 3.15 C ATOM 0 HA PRO A 68 -13.622 -8.970 12.003 1.00 23.31 H new ATOM 0 HB2 PRO A 68 -14.540 -11.486 10.985 1.00 31.42 H new ATOM 0 HB3 PRO A 68 -14.362 -10.054 9.990 1.00 31.42 H new ATOM 0 HG2 PRO A 68 -12.459 -12.368 10.337 1.00 44.24 H new ATOM 0 HG3 PRO A 68 -12.859 -11.483 8.879 1.00 44.24 H new ATOM 0 HD2 PRO A 68 -10.535 -10.991 10.130 1.00 3.15 H new ATOM 0 HD3 PRO A 68 -11.436 -9.659 9.433 1.00 3.15 H new ATOM 1073 N ASP A 69 -12.867 -11.833 13.423 1.00 35.11 N ATOM 1074 CA ASP A 69 -12.949 -12.597 14.687 1.00 63.14 C ATOM 1075 C ASP A 69 -12.072 -11.949 15.794 1.00 61.41 C ATOM 1076 O ASP A 69 -12.418 -11.985 16.981 1.00 43.21 O ATOM 1077 CB ASP A 69 -12.503 -14.061 14.434 1.00 55.15 C ATOM 1078 CG ASP A 69 -11.015 -14.176 14.038 1.00 4.31 C ATOM 1079 OD1 ASP A 69 -10.614 -13.596 13.002 1.00 63.44 O ATOM 1080 OD2 ASP A 69 -10.232 -14.815 14.772 1.00 72.41 O ATOM 0 H ASP A 69 -12.275 -12.275 12.719 1.00 35.11 H new ATOM 0 HA ASP A 69 -13.982 -12.585 15.034 1.00 63.14 H new ATOM 0 HB2 ASP A 69 -12.681 -14.650 15.334 1.00 55.15 H new ATOM 0 HB3 ASP A 69 -13.118 -14.492 13.644 1.00 55.15 H new ATOM 1085 N GLY A 70 -10.937 -11.359 15.369 1.00 11.03 N ATOM 1086 CA GLY A 70 -9.929 -10.801 16.281 1.00 11.54 C ATOM 1087 C GLY A 70 -8.495 -11.212 15.922 1.00 15.32 C ATOM 1088 O GLY A 70 -7.585 -11.034 16.740 1.00 50.34 O ATOM 0 H GLY A 70 -10.697 -11.258 14.383 1.00 11.03 H new ATOM 0 HA2 GLY A 70 -10.002 -9.713 16.271 1.00 11.54 H new ATOM 0 HA3 GLY A 70 -10.149 -11.126 17.298 1.00 11.54 H new ATOM 1092 N THR A 71 -8.279 -11.769 14.701 1.00 61.32 N ATOM 1093 CA THR A 71 -6.915 -12.125 14.219 1.00 12.41 C ATOM 1094 C THR A 71 -6.090 -10.850 13.930 1.00 15.41 C ATOM 1095 O THR A 71 -6.179 -10.261 12.851 1.00 22.03 O ATOM 1096 CB THR A 71 -6.941 -13.037 12.939 1.00 12.23 C ATOM 1097 OG1 THR A 71 -7.706 -14.222 13.203 1.00 50.25 O ATOM 1098 CG2 THR A 71 -5.526 -13.457 12.486 1.00 51.31 C ATOM 0 H THR A 71 -9.024 -11.980 14.037 1.00 61.32 H new ATOM 0 HA THR A 71 -6.444 -12.696 15.019 1.00 12.41 H new ATOM 0 HB THR A 71 -7.394 -12.450 12.140 1.00 12.23 H new ATOM 0 HG1 THR A 71 -8.658 -14.036 13.061 1.00 50.25 H new ATOM 0 HG21 THR A 71 -5.600 -14.086 11.599 1.00 51.31 H new ATOM 0 HG22 THR A 71 -4.940 -12.568 12.253 1.00 51.31 H new ATOM 0 HG23 THR A 71 -5.038 -14.014 13.286 1.00 51.31 H new ATOM 1106 N LYS A 72 -5.321 -10.416 14.933 1.00 11.12 N ATOM 1107 CA LYS A 72 -4.487 -9.211 14.851 1.00 70.34 C ATOM 1108 C LYS A 72 -3.235 -9.473 13.969 1.00 23.41 C ATOM 1109 O LYS A 72 -2.255 -10.075 14.423 1.00 2.13 O ATOM 1110 CB LYS A 72 -4.098 -8.780 16.292 1.00 73.44 C ATOM 1111 CG LYS A 72 -3.333 -7.450 16.379 1.00 13.21 C ATOM 1112 CD LYS A 72 -2.980 -7.051 17.831 1.00 41.44 C ATOM 1113 CE LYS A 72 -4.218 -6.694 18.677 1.00 43.35 C ATOM 1114 NZ LYS A 72 -3.857 -6.329 20.068 1.00 30.33 N ATOM 0 H LYS A 72 -5.259 -10.894 15.832 1.00 11.12 H new ATOM 0 HA LYS A 72 -5.042 -8.401 14.378 1.00 70.34 H new ATOM 0 HB2 LYS A 72 -5.005 -8.702 16.891 1.00 73.44 H new ATOM 0 HB3 LYS A 72 -3.488 -9.565 16.739 1.00 73.44 H new ATOM 0 HG2 LYS A 72 -2.416 -7.526 15.795 1.00 13.21 H new ATOM 0 HG3 LYS A 72 -3.934 -6.661 15.927 1.00 13.21 H new ATOM 0 HD2 LYS A 72 -2.446 -7.873 18.308 1.00 41.44 H new ATOM 0 HD3 LYS A 72 -2.301 -6.198 17.813 1.00 41.44 H new ATOM 0 HE2 LYS A 72 -4.748 -5.863 18.211 1.00 43.35 H new ATOM 0 HE3 LYS A 72 -4.903 -7.541 18.691 1.00 43.35 H new ATOM 0 HZ1 LYS A 72 -4.719 -6.096 20.601 1.00 30.33 H new ATOM 0 HZ2 LYS A 72 -3.374 -7.130 20.523 1.00 30.33 H new ATOM 0 HZ3 LYS A 72 -3.224 -5.504 20.057 1.00 30.33 H new ATOM 1128 N ALA A 73 -3.297 -9.041 12.694 1.00 11.41 N ATOM 1129 CA ALA A 73 -2.207 -9.254 11.713 1.00 32.50 C ATOM 1130 C ALA A 73 -1.288 -8.018 11.662 1.00 55.04 C ATOM 1131 O ALA A 73 -1.627 -7.005 11.040 1.00 41.34 O ATOM 1132 CB ALA A 73 -2.785 -9.573 10.325 1.00 12.10 C ATOM 0 H ALA A 73 -4.098 -8.537 12.314 1.00 11.41 H new ATOM 0 HA ALA A 73 -1.610 -10.109 12.031 1.00 32.50 H new ATOM 0 HB1 ALA A 73 -1.970 -9.726 9.618 1.00 12.10 H new ATOM 0 HB2 ALA A 73 -3.391 -10.477 10.382 1.00 12.10 H new ATOM 0 HB3 ALA A 73 -3.405 -8.742 9.989 1.00 12.10 H new ATOM 1138 N ARG A 74 -0.122 -8.117 12.313 1.00 23.21 N ATOM 1139 CA ARG A 74 0.801 -6.974 12.503 1.00 72.50 C ATOM 1140 C ARG A 74 1.673 -6.745 11.238 1.00 11.32 C ATOM 1141 O ARG A 74 2.019 -7.696 10.529 1.00 73.42 O ATOM 1142 CB ARG A 74 1.665 -7.224 13.778 1.00 11.10 C ATOM 1143 CG ARG A 74 2.245 -5.952 14.458 1.00 41.34 C ATOM 1144 CD ARG A 74 2.903 -6.256 15.818 1.00 63.21 C ATOM 1145 NE ARG A 74 3.303 -5.034 16.546 1.00 73.33 N ATOM 1146 CZ ARG A 74 3.117 -4.815 17.832 1.00 61.12 C ATOM 1147 NH1 ARG A 74 2.547 -5.703 18.593 1.00 23.32 N ATOM 1148 NH2 ARG A 74 3.513 -3.699 18.349 1.00 40.10 N ATOM 0 H ARG A 74 0.214 -8.987 12.725 1.00 23.21 H new ATOM 0 HA ARG A 74 0.227 -6.059 12.649 1.00 72.50 H new ATOM 0 HB2 ARG A 74 1.057 -7.759 14.508 1.00 11.10 H new ATOM 0 HB3 ARG A 74 2.493 -7.881 13.511 1.00 11.10 H new ATOM 0 HG2 ARG A 74 2.981 -5.494 13.797 1.00 41.34 H new ATOM 0 HG3 ARG A 74 1.446 -5.224 14.599 1.00 41.34 H new ATOM 0 HD2 ARG A 74 2.209 -6.829 16.433 1.00 63.21 H new ATOM 0 HD3 ARG A 74 3.780 -6.883 15.660 1.00 63.21 H new ATOM 0 HE ARG A 74 3.761 -4.298 16.008 1.00 73.33 H new ATOM 0 HH11 ARG A 74 2.234 -6.589 18.197 1.00 23.32 H new ATOM 0 HH12 ARG A 74 2.413 -5.513 19.586 1.00 23.32 H new ATOM 0 HH21 ARG A 74 3.965 -2.997 17.763 1.00 40.10 H new ATOM 0 HH22 ARG A 74 3.374 -3.520 19.343 1.00 40.10 H new ATOM 1162 N GLY A 75 1.988 -5.468 10.942 1.00 40.12 N ATOM 1163 CA GLY A 75 2.825 -5.101 9.784 1.00 73.10 C ATOM 1164 C GLY A 75 3.669 -3.844 10.026 1.00 75.34 C ATOM 1165 O GLY A 75 3.425 -3.091 10.977 1.00 11.42 O ATOM 0 H GLY A 75 1.673 -4.670 11.493 1.00 40.12 H new ATOM 0 HA2 GLY A 75 3.485 -5.934 9.542 1.00 73.10 H new ATOM 0 HA3 GLY A 75 2.185 -4.940 8.917 1.00 73.10 H new ATOM 1169 N TRP A 76 4.664 -3.617 9.147 1.00 23.43 N ATOM 1170 CA TRP A 76 5.608 -2.476 9.249 1.00 11.51 C ATOM 1171 C TRP A 76 5.931 -1.871 7.856 1.00 45.03 C ATOM 1172 O TRP A 76 5.783 -2.539 6.825 1.00 61.41 O ATOM 1173 CB TRP A 76 6.921 -2.943 9.945 1.00 65.23 C ATOM 1174 CG TRP A 76 7.643 -4.049 9.196 1.00 42.23 C ATOM 1175 CD1 TRP A 76 7.387 -5.388 9.266 1.00 20.22 C ATOM 1176 CD2 TRP A 76 8.720 -3.904 8.260 1.00 71.03 C ATOM 1177 NE1 TRP A 76 8.208 -6.075 8.419 1.00 33.43 N ATOM 1178 CE2 TRP A 76 9.042 -5.189 7.793 1.00 4.21 C ATOM 1179 CE3 TRP A 76 9.433 -2.806 7.764 1.00 41.54 C ATOM 1180 CZ2 TRP A 76 10.048 -5.410 6.864 1.00 1.41 C ATOM 1181 CZ3 TRP A 76 10.434 -3.025 6.842 1.00 31.41 C ATOM 1182 CH2 TRP A 76 10.731 -4.318 6.395 1.00 14.45 C ATOM 0 H TRP A 76 4.840 -4.219 8.342 1.00 23.43 H new ATOM 0 HA TRP A 76 5.132 -1.697 9.845 1.00 11.51 H new ATOM 0 HB2 TRP A 76 7.590 -2.089 10.050 1.00 65.23 H new ATOM 0 HB3 TRP A 76 6.686 -3.290 10.951 1.00 65.23 H new ATOM 0 HD1 TRP A 76 6.640 -5.840 9.902 1.00 20.22 H new ATOM 0 HE1 TRP A 76 8.201 -7.085 8.276 1.00 33.43 H new ATOM 0 HE3 TRP A 76 9.203 -1.805 8.098 1.00 41.54 H new ATOM 0 HZ2 TRP A 76 10.285 -6.407 6.522 1.00 1.41 H new ATOM 0 HZ3 TRP A 76 10.997 -2.187 6.459 1.00 31.41 H new ATOM 0 HH2 TRP A 76 11.515 -4.458 5.665 1.00 14.45 H new ATOM 1193 N TRP A 77 6.364 -0.595 7.855 1.00 15.43 N ATOM 1194 CA TRP A 77 6.933 0.108 6.671 1.00 73.42 C ATOM 1195 C TRP A 77 8.313 0.729 7.020 1.00 73.14 C ATOM 1196 O TRP A 77 8.645 0.900 8.196 1.00 31.12 O ATOM 1197 CB TRP A 77 6.008 1.265 6.191 1.00 71.21 C ATOM 1198 CG TRP A 77 4.711 0.892 5.504 1.00 20.33 C ATOM 1199 CD1 TRP A 77 4.253 -0.343 5.143 1.00 15.43 C ATOM 1200 CD2 TRP A 77 3.723 1.820 5.050 1.00 64.41 C ATOM 1201 NE1 TRP A 77 3.038 -0.232 4.515 1.00 74.32 N ATOM 1202 CE2 TRP A 77 2.698 1.093 4.442 1.00 42.31 C ATOM 1203 CE3 TRP A 77 3.620 3.206 5.106 1.00 21.14 C ATOM 1204 CZ2 TRP A 77 1.580 1.713 3.898 1.00 35.22 C ATOM 1205 CZ3 TRP A 77 2.513 3.820 4.564 1.00 4.03 C ATOM 1206 CH2 TRP A 77 1.507 3.072 3.961 1.00 4.25 C ATOM 0 H TRP A 77 6.331 -0.007 8.688 1.00 15.43 H new ATOM 0 HA TRP A 77 7.030 -0.637 5.881 1.00 73.42 H new ATOM 0 HB2 TRP A 77 5.764 1.880 7.057 1.00 71.21 H new ATOM 0 HB3 TRP A 77 6.581 1.891 5.507 1.00 71.21 H new ATOM 0 HD1 TRP A 77 4.772 -1.272 5.325 1.00 15.43 H new ATOM 0 HE1 TRP A 77 2.480 -1.009 4.161 1.00 74.32 H new ATOM 0 HE3 TRP A 77 4.399 3.794 5.569 1.00 21.14 H new ATOM 0 HZ2 TRP A 77 0.792 1.135 3.439 1.00 35.22 H new ATOM 0 HZ3 TRP A 77 2.425 4.896 4.608 1.00 4.03 H new ATOM 0 HH2 TRP A 77 0.653 3.578 3.535 1.00 4.25 H new ATOM 1217 N GLN A 78 9.093 1.083 5.977 1.00 41.22 N ATOM 1218 CA GLN A 78 10.278 1.962 6.118 1.00 24.12 C ATOM 1219 C GLN A 78 10.439 2.852 4.859 1.00 71.43 C ATOM 1220 O GLN A 78 10.860 2.375 3.802 1.00 20.04 O ATOM 1221 CB GLN A 78 11.579 1.150 6.377 1.00 73.30 C ATOM 1222 CG GLN A 78 12.839 2.042 6.526 1.00 33.03 C ATOM 1223 CD GLN A 78 14.143 1.274 6.739 1.00 3.24 C ATOM 1224 OE1 GLN A 78 14.295 0.135 6.303 1.00 33.12 O ATOM 1225 NE2 GLN A 78 15.105 1.912 7.376 1.00 24.23 N ATOM 0 H GLN A 78 8.923 0.772 5.021 1.00 41.22 H new ATOM 0 HA GLN A 78 10.113 2.597 6.988 1.00 24.12 H new ATOM 0 HB2 GLN A 78 11.454 0.556 7.282 1.00 73.30 H new ATOM 0 HB3 GLN A 78 11.732 0.451 5.555 1.00 73.30 H new ATOM 0 HG2 GLN A 78 12.938 2.659 5.633 1.00 33.03 H new ATOM 0 HG3 GLN A 78 12.691 2.720 7.367 1.00 33.03 H new ATOM 0 HE21 GLN A 78 14.946 2.857 7.725 1.00 24.23 H new ATOM 0 HE22 GLN A 78 16.008 1.461 7.519 1.00 24.23 H new ATOM 1234 N PHE A 79 10.117 4.150 5.003 1.00 52.42 N ATOM 1235 CA PHE A 79 10.148 5.136 3.903 1.00 1.14 C ATOM 1236 C PHE A 79 11.587 5.426 3.416 1.00 72.30 C ATOM 1237 O PHE A 79 12.499 5.614 4.224 1.00 41.22 O ATOM 1238 CB PHE A 79 9.474 6.449 4.355 1.00 0.55 C ATOM 1239 CG PHE A 79 8.019 6.295 4.792 1.00 12.20 C ATOM 1240 CD1 PHE A 79 6.987 6.284 3.855 1.00 54.32 C ATOM 1241 CD2 PHE A 79 7.683 6.177 6.142 1.00 52.43 C ATOM 1242 CE1 PHE A 79 5.672 6.163 4.253 1.00 51.21 C ATOM 1243 CE2 PHE A 79 6.366 6.059 6.540 1.00 44.04 C ATOM 1244 CZ PHE A 79 5.364 6.055 5.596 1.00 35.43 C ATOM 0 H PHE A 79 9.825 4.550 5.895 1.00 52.42 H new ATOM 0 HA PHE A 79 9.600 4.706 3.065 1.00 1.14 H new ATOM 0 HB2 PHE A 79 10.046 6.871 5.182 1.00 0.55 H new ATOM 0 HB3 PHE A 79 9.520 7.167 3.536 1.00 0.55 H new ATOM 0 HD1 PHE A 79 7.220 6.371 2.804 1.00 54.32 H new ATOM 0 HD2 PHE A 79 8.465 6.178 6.887 1.00 52.43 H new ATOM 0 HE1 PHE A 79 4.883 6.153 3.515 1.00 51.21 H new ATOM 0 HE2 PHE A 79 6.123 5.970 7.589 1.00 44.04 H new ATOM 0 HZ PHE A 79 4.333 5.967 5.906 1.00 35.43 H new ATOM 1254 N THR A 80 11.773 5.456 2.084 1.00 44.03 N ATOM 1255 CA THR A 80 13.077 5.769 1.448 1.00 23.43 C ATOM 1256 C THR A 80 13.043 7.145 0.736 1.00 22.22 C ATOM 1257 O THR A 80 13.744 8.076 1.145 1.00 54.02 O ATOM 1258 CB THR A 80 13.501 4.643 0.438 1.00 53.52 C ATOM 1259 OG1 THR A 80 12.570 4.558 -0.648 1.00 44.05 O ATOM 1260 CG2 THR A 80 13.577 3.271 1.115 1.00 51.32 C ATOM 0 H THR A 80 11.028 5.265 1.414 1.00 44.03 H new ATOM 0 HA THR A 80 13.821 5.816 2.243 1.00 23.43 H new ATOM 0 HB THR A 80 14.489 4.914 0.066 1.00 53.52 H new ATOM 0 HG1 THR A 80 12.931 3.970 -1.343 1.00 44.05 H new ATOM 0 HG21 THR A 80 13.873 2.520 0.383 1.00 51.32 H new ATOM 0 HG22 THR A 80 14.311 3.303 1.920 1.00 51.32 H new ATOM 0 HG23 THR A 80 12.600 3.013 1.525 1.00 51.32 H new ATOM 1268 N THR A 81 12.224 7.270 -0.328 1.00 23.22 N ATOM 1269 CA THR A 81 12.137 8.509 -1.147 1.00 33.21 C ATOM 1270 C THR A 81 10.738 9.153 -1.046 1.00 70.52 C ATOM 1271 O THR A 81 9.768 8.661 -1.633 1.00 60.23 O ATOM 1272 CB THR A 81 12.457 8.228 -2.658 1.00 0.52 C ATOM 1273 OG1 THR A 81 13.712 7.543 -2.784 1.00 70.11 O ATOM 1274 CG2 THR A 81 12.499 9.522 -3.495 1.00 53.31 C ATOM 0 H THR A 81 11.606 6.524 -0.647 1.00 23.22 H new ATOM 0 HA THR A 81 12.882 9.197 -0.746 1.00 33.21 H new ATOM 0 HB THR A 81 11.651 7.603 -3.041 1.00 0.52 H new ATOM 0 HG1 THR A 81 13.645 6.865 -3.488 1.00 70.11 H new ATOM 0 HG21 THR A 81 12.724 9.277 -4.533 1.00 53.31 H new ATOM 0 HG22 THR A 81 11.532 10.022 -3.441 1.00 53.31 H new ATOM 0 HG23 THR A 81 13.271 10.184 -3.103 1.00 53.31 H new ATOM 1282 N ILE A 82 10.644 10.256 -0.288 1.00 72.43 N ATOM 1283 CA ILE A 82 9.421 11.085 -0.205 1.00 11.11 C ATOM 1284 C ILE A 82 9.704 12.477 -0.805 1.00 74.10 C ATOM 1285 O ILE A 82 10.429 13.281 -0.208 1.00 55.24 O ATOM 1286 CB ILE A 82 8.915 11.234 1.279 1.00 35.32 C ATOM 1287 CG1 ILE A 82 8.683 9.828 1.915 1.00 62.51 C ATOM 1288 CG2 ILE A 82 7.631 12.105 1.348 1.00 61.12 C ATOM 1289 CD1 ILE A 82 8.119 9.842 3.323 1.00 63.43 C ATOM 0 H ILE A 82 11.412 10.603 0.287 1.00 72.43 H new ATOM 0 HA ILE A 82 8.635 10.586 -0.772 1.00 11.11 H new ATOM 0 HB ILE A 82 9.685 11.746 1.856 1.00 35.32 H new ATOM 0 HG12 ILE A 82 8.005 9.264 1.274 1.00 62.51 H new ATOM 0 HG13 ILE A 82 9.631 9.291 1.926 1.00 62.51 H new ATOM 0 HG21 ILE A 82 7.305 12.191 2.384 1.00 61.12 H new ATOM 0 HG22 ILE A 82 7.843 13.098 0.951 1.00 61.12 H new ATOM 0 HG23 ILE A 82 6.843 11.639 0.757 1.00 61.12 H new ATOM 0 HD11 ILE A 82 7.994 8.818 3.675 1.00 63.43 H new ATOM 0 HD12 ILE A 82 8.804 10.372 3.984 1.00 63.43 H new ATOM 0 HD13 ILE A 82 7.152 10.346 3.323 1.00 63.43 H new ATOM 1301 N GLU A 83 9.164 12.745 -2.007 1.00 45.41 N ATOM 1302 CA GLU A 83 9.334 14.055 -2.688 1.00 42.25 C ATOM 1303 C GLU A 83 8.058 14.924 -2.606 1.00 64.12 C ATOM 1304 O GLU A 83 8.151 16.145 -2.413 1.00 53.53 O ATOM 1305 CB GLU A 83 9.756 13.855 -4.166 1.00 34.23 C ATOM 1306 CG GLU A 83 11.102 13.129 -4.348 1.00 4.24 C ATOM 1307 CD GLU A 83 11.665 13.246 -5.774 1.00 5.22 C ATOM 1308 OE1 GLU A 83 11.121 12.608 -6.688 1.00 42.43 O ATOM 1309 OE2 GLU A 83 12.656 13.984 -5.981 1.00 32.30 O ATOM 0 H GLU A 83 8.604 12.075 -2.533 1.00 45.41 H new ATOM 0 HA GLU A 83 10.127 14.588 -2.163 1.00 42.25 H new ATOM 0 HB2 GLU A 83 8.979 13.289 -4.680 1.00 34.23 H new ATOM 0 HB3 GLU A 83 9.814 14.830 -4.650 1.00 34.23 H new ATOM 0 HG2 GLU A 83 11.826 13.538 -3.644 1.00 4.24 H new ATOM 0 HG3 GLU A 83 10.976 12.075 -4.099 1.00 4.24 H new ATOM 1316 N ALA A 84 6.882 14.275 -2.776 1.00 60.43 N ATOM 1317 CA ALA A 84 5.546 14.934 -2.777 1.00 61.10 C ATOM 1318 C ALA A 84 5.312 15.863 -4.020 1.00 32.01 C ATOM 1319 O ALA A 84 6.265 16.413 -4.583 1.00 21.21 O ATOM 1320 CB ALA A 84 5.296 15.689 -1.447 1.00 32.43 C ATOM 0 H ALA A 84 6.829 13.266 -2.918 1.00 60.43 H new ATOM 0 HA ALA A 84 4.810 14.135 -2.861 1.00 61.10 H new ATOM 0 HB1 ALA A 84 4.314 16.160 -1.475 1.00 32.43 H new ATOM 0 HB2 ALA A 84 5.337 14.985 -0.616 1.00 32.43 H new ATOM 0 HB3 ALA A 84 6.062 16.453 -1.313 1.00 32.43 H new ATOM 1326 N PRO A 85 4.028 16.046 -4.499 1.00 61.55 N ATOM 1327 CA PRO A 85 2.808 15.359 -3.980 1.00 4.35 C ATOM 1328 C PRO A 85 2.469 14.047 -4.737 1.00 55.23 C ATOM 1329 O PRO A 85 1.330 13.586 -4.690 1.00 72.41 O ATOM 1330 CB PRO A 85 1.740 16.440 -4.235 1.00 65.42 C ATOM 1331 CG PRO A 85 2.132 17.008 -5.574 1.00 50.13 C ATOM 1332 CD PRO A 85 3.661 16.995 -5.594 1.00 54.31 C ATOM 0 HA PRO A 85 2.906 15.032 -2.945 1.00 4.35 H new ATOM 0 HB2 PRO A 85 0.736 16.016 -4.257 1.00 65.42 H new ATOM 0 HB3 PRO A 85 1.747 17.203 -3.457 1.00 65.42 H new ATOM 0 HG2 PRO A 85 1.724 16.409 -6.388 1.00 50.13 H new ATOM 0 HG3 PRO A 85 1.747 18.020 -5.699 1.00 50.13 H new ATOM 0 HD2 PRO A 85 4.045 16.660 -6.558 1.00 54.31 H new ATOM 0 HD3 PRO A 85 4.071 17.989 -5.415 1.00 54.31 H new ATOM 1340 N ASP A 86 3.465 13.446 -5.408 1.00 23.52 N ATOM 1341 CA ASP A 86 3.254 12.289 -6.307 1.00 71.41 C ATOM 1342 C ASP A 86 4.204 11.102 -5.998 1.00 54.20 C ATOM 1343 O ASP A 86 3.755 9.959 -5.904 1.00 11.42 O ATOM 1344 CB ASP A 86 3.399 12.760 -7.781 1.00 71.32 C ATOM 1345 CG ASP A 86 4.784 13.343 -8.139 1.00 72.03 C ATOM 1346 OD1 ASP A 86 5.275 14.234 -7.407 1.00 25.10 O ATOM 1347 OD2 ASP A 86 5.372 12.935 -9.166 1.00 65.44 O ATOM 0 H ASP A 86 4.438 13.744 -5.346 1.00 23.52 H new ATOM 0 HA ASP A 86 2.246 11.909 -6.138 1.00 71.41 H new ATOM 0 HB2 ASP A 86 3.194 11.916 -8.440 1.00 71.32 H new ATOM 0 HB3 ASP A 86 2.639 13.515 -7.984 1.00 71.32 H new ATOM 1352 N HIS A 87 5.515 11.378 -5.852 1.00 25.40 N ATOM 1353 CA HIS A 87 6.540 10.323 -5.662 1.00 0.51 C ATOM 1354 C HIS A 87 6.666 9.914 -4.170 1.00 13.22 C ATOM 1355 O HIS A 87 7.123 10.695 -3.324 1.00 62.00 O ATOM 1356 CB HIS A 87 7.913 10.797 -6.216 1.00 11.31 C ATOM 1357 CG HIS A 87 8.985 9.724 -6.339 1.00 4.52 C ATOM 1358 ND1 HIS A 87 10.185 9.942 -6.984 1.00 61.41 N ATOM 1359 CD2 HIS A 87 9.049 8.432 -5.901 1.00 50.32 C ATOM 1360 CE1 HIS A 87 10.927 8.861 -6.938 1.00 41.31 C ATOM 1361 NE2 HIS A 87 10.264 7.933 -6.291 1.00 10.34 N ATOM 0 H HIS A 87 5.894 12.325 -5.862 1.00 25.40 H new ATOM 0 HA HIS A 87 6.220 9.443 -6.220 1.00 0.51 H new ATOM 0 HB2 HIS A 87 7.753 11.239 -7.200 1.00 11.31 H new ATOM 0 HB3 HIS A 87 8.291 11.588 -5.569 1.00 11.31 H new ATOM 0 HD1 HIS A 87 10.456 10.817 -7.432 1.00 61.41 H new ATOM 0 HD2 HIS A 87 8.285 7.903 -5.350 1.00 50.32 H new ATOM 0 HE1 HIS A 87 11.915 8.754 -7.361 1.00 41.31 H new ATOM 1370 N LEU A 88 6.266 8.667 -3.888 1.00 72.42 N ATOM 1371 CA LEU A 88 6.458 7.994 -2.589 1.00 53.52 C ATOM 1372 C LEU A 88 7.166 6.644 -2.816 1.00 70.24 C ATOM 1373 O LEU A 88 6.841 5.920 -3.760 1.00 54.31 O ATOM 1374 CB LEU A 88 5.089 7.772 -1.885 1.00 73.25 C ATOM 1375 CG LEU A 88 5.105 7.011 -0.519 1.00 12.01 C ATOM 1376 CD1 LEU A 88 6.029 7.696 0.506 1.00 24.42 C ATOM 1377 CD2 LEU A 88 3.675 6.855 0.041 1.00 40.42 C ATOM 0 H LEU A 88 5.788 8.080 -4.572 1.00 72.42 H new ATOM 0 HA LEU A 88 7.074 8.623 -1.946 1.00 53.52 H new ATOM 0 HB2 LEU A 88 4.630 8.747 -1.723 1.00 73.25 H new ATOM 0 HB3 LEU A 88 4.442 7.224 -2.570 1.00 73.25 H new ATOM 0 HG LEU A 88 5.509 6.016 -0.704 1.00 12.01 H new ATOM 0 HD11 LEU A 88 6.012 7.137 1.442 1.00 24.42 H new ATOM 0 HD12 LEU A 88 7.047 7.723 0.117 1.00 24.42 H new ATOM 0 HD13 LEU A 88 5.682 8.714 0.685 1.00 24.42 H new ATOM 0 HD21 LEU A 88 3.713 6.323 0.991 1.00 40.42 H new ATOM 0 HD22 LEU A 88 3.235 7.840 0.194 1.00 40.42 H new ATOM 0 HD23 LEU A 88 3.067 6.292 -0.667 1.00 40.42 H new ATOM 1389 N GLU A 89 8.170 6.340 -1.980 1.00 10.42 N ATOM 1390 CA GLU A 89 8.801 5.008 -1.916 1.00 64.34 C ATOM 1391 C GLU A 89 8.965 4.583 -0.451 1.00 0.45 C ATOM 1392 O GLU A 89 9.273 5.411 0.416 1.00 25.14 O ATOM 1393 CB GLU A 89 10.188 4.987 -2.615 1.00 11.13 C ATOM 1394 CG GLU A 89 10.153 5.210 -4.130 1.00 1.01 C ATOM 1395 CD GLU A 89 11.507 4.966 -4.806 1.00 31.24 C ATOM 1396 OE1 GLU A 89 11.862 3.785 -5.007 1.00 23.55 O ATOM 1397 OE2 GLU A 89 12.221 5.943 -5.126 1.00 21.55 O ATOM 0 H GLU A 89 8.571 7.012 -1.326 1.00 10.42 H new ATOM 0 HA GLU A 89 8.149 4.310 -2.442 1.00 64.34 H new ATOM 0 HB2 GLU A 89 10.817 5.755 -2.164 1.00 11.13 H new ATOM 0 HB3 GLU A 89 10.664 4.027 -2.415 1.00 11.13 H new ATOM 0 HG2 GLU A 89 9.409 4.547 -4.572 1.00 1.01 H new ATOM 0 HG3 GLU A 89 9.831 6.231 -4.333 1.00 1.01 H new ATOM 1404 N PHE A 90 8.747 3.289 -0.195 1.00 52.41 N ATOM 1405 CA PHE A 90 8.966 2.668 1.122 1.00 53.10 C ATOM 1406 C PHE A 90 9.189 1.154 0.981 1.00 12.11 C ATOM 1407 O PHE A 90 9.066 0.595 -0.111 1.00 64.02 O ATOM 1408 CB PHE A 90 7.785 2.971 2.103 1.00 23.24 C ATOM 1409 CG PHE A 90 6.392 2.574 1.611 1.00 14.12 C ATOM 1410 CD1 PHE A 90 5.885 1.292 1.826 1.00 20.01 C ATOM 1411 CD2 PHE A 90 5.576 3.499 0.954 1.00 43.11 C ATOM 1412 CE1 PHE A 90 4.619 0.951 1.387 1.00 34.12 C ATOM 1413 CE2 PHE A 90 4.312 3.152 0.520 1.00 72.13 C ATOM 1414 CZ PHE A 90 3.831 1.881 0.742 1.00 71.22 C ATOM 0 H PHE A 90 8.410 2.634 -0.901 1.00 52.41 H new ATOM 0 HA PHE A 90 9.867 3.108 1.549 1.00 53.10 H new ATOM 0 HB2 PHE A 90 7.978 2.456 3.044 1.00 23.24 H new ATOM 0 HB3 PHE A 90 7.782 4.039 2.319 1.00 23.24 H new ATOM 0 HD1 PHE A 90 6.488 0.558 2.341 1.00 20.01 H new ATOM 0 HD2 PHE A 90 5.940 4.501 0.783 1.00 43.11 H new ATOM 0 HE1 PHE A 90 4.245 -0.049 1.550 1.00 34.12 H new ATOM 0 HE2 PHE A 90 3.700 3.878 0.006 1.00 72.13 H new ATOM 0 HZ PHE A 90 2.838 1.613 0.412 1.00 71.22 H new ATOM 1424 N ASP A 91 9.523 0.509 2.101 1.00 61.04 N ATOM 1425 CA ASP A 91 9.651 -0.947 2.195 1.00 21.01 C ATOM 1426 C ASP A 91 8.538 -1.493 3.092 1.00 35.40 C ATOM 1427 O ASP A 91 8.616 -1.412 4.323 1.00 31.12 O ATOM 1428 CB ASP A 91 11.035 -1.344 2.740 1.00 11.14 C ATOM 1429 CG ASP A 91 12.164 -1.000 1.763 1.00 21.02 C ATOM 1430 OD1 ASP A 91 12.623 0.158 1.759 1.00 62.03 O ATOM 1431 OD2 ASP A 91 12.578 -1.872 0.970 1.00 33.41 O ATOM 0 H ASP A 91 9.715 0.990 2.980 1.00 61.04 H new ATOM 0 HA ASP A 91 9.555 -1.379 1.199 1.00 21.01 H new ATOM 0 HB2 ASP A 91 11.210 -0.835 3.688 1.00 11.14 H new ATOM 0 HB3 ASP A 91 11.049 -2.414 2.946 1.00 11.14 H new ATOM 1436 N ASP A 92 7.482 -1.994 2.455 1.00 45.35 N ATOM 1437 CA ASP A 92 6.353 -2.632 3.134 1.00 51.01 C ATOM 1438 C ASP A 92 6.682 -4.094 3.517 1.00 52.11 C ATOM 1439 O ASP A 92 7.551 -4.736 2.916 1.00 52.34 O ATOM 1440 CB ASP A 92 5.064 -2.537 2.261 1.00 31.11 C ATOM 1441 CG ASP A 92 5.184 -3.118 0.830 1.00 53.45 C ATOM 1442 OD1 ASP A 92 6.098 -2.714 0.075 1.00 44.15 O ATOM 1443 OD2 ASP A 92 4.351 -3.966 0.447 1.00 71.33 O ATOM 0 H ASP A 92 7.384 -1.969 1.440 1.00 45.35 H new ATOM 0 HA ASP A 92 6.164 -2.095 4.063 1.00 51.01 H new ATOM 0 HB2 ASP A 92 4.257 -3.055 2.778 1.00 31.11 H new ATOM 0 HB3 ASP A 92 4.773 -1.489 2.186 1.00 31.11 H new ATOM 1448 N GLY A 93 6.003 -4.590 4.555 1.00 42.04 N ATOM 1449 CA GLY A 93 6.192 -5.964 5.020 1.00 63.42 C ATOM 1450 C GLY A 93 5.291 -6.313 6.194 1.00 24.34 C ATOM 1451 O GLY A 93 4.585 -5.454 6.735 1.00 34.25 O ATOM 0 H GLY A 93 5.316 -4.058 5.089 1.00 42.04 H new ATOM 0 HA2 GLY A 93 5.995 -6.652 4.198 1.00 63.42 H new ATOM 0 HA3 GLY A 93 7.233 -6.105 5.311 1.00 63.42 H new ATOM 1455 N PHE A 94 5.320 -7.586 6.594 1.00 24.34 N ATOM 1456 CA PHE A 94 4.542 -8.091 7.740 1.00 22.05 C ATOM 1457 C PHE A 94 5.450 -8.265 8.964 1.00 13.02 C ATOM 1458 O PHE A 94 6.612 -8.665 8.842 1.00 2.31 O ATOM 1459 CB PHE A 94 3.842 -9.428 7.393 1.00 3.21 C ATOM 1460 CG PHE A 94 2.701 -9.279 6.393 1.00 20.45 C ATOM 1461 CD1 PHE A 94 2.946 -9.263 5.021 1.00 70.52 C ATOM 1462 CD2 PHE A 94 1.380 -9.151 6.829 1.00 4.13 C ATOM 1463 CE1 PHE A 94 1.913 -9.123 4.120 1.00 63.41 C ATOM 1464 CE2 PHE A 94 0.345 -9.014 5.923 1.00 22.13 C ATOM 1465 CZ PHE A 94 0.612 -8.998 4.568 1.00 54.03 C ATOM 0 H PHE A 94 5.883 -8.302 6.135 1.00 24.34 H new ATOM 0 HA PHE A 94 3.770 -7.358 7.975 1.00 22.05 H new ATOM 0 HB2 PHE A 94 4.580 -10.120 6.988 1.00 3.21 H new ATOM 0 HB3 PHE A 94 3.455 -9.874 8.309 1.00 3.21 H new ATOM 0 HD1 PHE A 94 3.959 -9.362 4.659 1.00 70.52 H new ATOM 0 HD2 PHE A 94 1.165 -9.159 7.887 1.00 4.13 H new ATOM 0 HE1 PHE A 94 2.121 -9.111 3.060 1.00 63.41 H new ATOM 0 HE2 PHE A 94 -0.672 -8.920 6.274 1.00 22.13 H new ATOM 0 HZ PHE A 94 -0.195 -8.888 3.859 1.00 54.03 H new ATOM 1475 N ALA A 95 4.905 -7.926 10.131 1.00 24.41 N ATOM 1476 CA ALA A 95 5.564 -8.102 11.433 1.00 1.34 C ATOM 1477 C ALA A 95 4.868 -9.220 12.231 1.00 24.35 C ATOM 1478 O ALA A 95 3.685 -9.513 12.025 1.00 14.24 O ATOM 1479 CB ALA A 95 5.534 -6.780 12.218 1.00 32.45 C ATOM 0 H ALA A 95 3.975 -7.513 10.204 1.00 24.41 H new ATOM 0 HA ALA A 95 6.603 -8.388 11.272 1.00 1.34 H new ATOM 0 HB1 ALA A 95 6.024 -6.918 13.182 1.00 32.45 H new ATOM 0 HB2 ALA A 95 6.057 -6.009 11.652 1.00 32.45 H new ATOM 0 HB3 ALA A 95 4.500 -6.475 12.377 1.00 32.45 H new ATOM 1485 N ASP A 96 5.624 -9.840 13.141 1.00 24.22 N ATOM 1486 CA ASP A 96 5.110 -10.858 14.071 1.00 13.12 C ATOM 1487 C ASP A 96 4.195 -10.182 15.123 1.00 40.54 C ATOM 1488 O ASP A 96 4.191 -8.960 15.224 1.00 5.44 O ATOM 1489 CB ASP A 96 6.323 -11.557 14.729 1.00 2.52 C ATOM 1490 CG ASP A 96 5.935 -12.618 15.759 1.00 64.30 C ATOM 1491 OD1 ASP A 96 5.524 -13.724 15.360 1.00 43.41 O ATOM 1492 OD2 ASP A 96 6.005 -12.336 16.974 1.00 53.11 O ATOM 0 H ASP A 96 6.619 -9.650 13.257 1.00 24.22 H new ATOM 0 HA ASP A 96 4.511 -11.604 13.550 1.00 13.12 H new ATOM 0 HB2 ASP A 96 6.929 -12.022 13.952 1.00 2.52 H new ATOM 0 HB3 ASP A 96 6.947 -10.805 15.212 1.00 2.52 H new ATOM 1497 N GLU A 97 3.448 -10.971 15.923 1.00 22.12 N ATOM 1498 CA GLU A 97 2.555 -10.433 16.984 1.00 42.32 C ATOM 1499 C GLU A 97 3.286 -9.481 17.972 1.00 53.13 C ATOM 1500 O GLU A 97 2.651 -8.628 18.603 1.00 64.10 O ATOM 1501 CB GLU A 97 1.869 -11.588 17.762 1.00 55.24 C ATOM 1502 CG GLU A 97 2.833 -12.526 18.519 1.00 61.43 C ATOM 1503 CD GLU A 97 2.112 -13.572 19.382 1.00 41.14 C ATOM 1504 OE1 GLU A 97 1.486 -14.494 18.819 1.00 32.55 O ATOM 1505 OE2 GLU A 97 2.150 -13.466 20.628 1.00 23.43 O ATOM 0 H GLU A 97 3.442 -11.989 15.858 1.00 22.12 H new ATOM 0 HA GLU A 97 1.797 -9.838 16.474 1.00 42.32 H new ATOM 0 HB2 GLU A 97 1.168 -11.158 18.477 1.00 55.24 H new ATOM 0 HB3 GLU A 97 1.284 -12.182 17.060 1.00 55.24 H new ATOM 0 HG2 GLU A 97 3.471 -13.037 17.799 1.00 61.43 H new ATOM 0 HG3 GLU A 97 3.486 -11.928 19.155 1.00 61.43 H new ATOM 1512 N HIS A 98 4.621 -9.628 18.084 1.00 71.41 N ATOM 1513 CA HIS A 98 5.466 -8.774 18.952 1.00 63.11 C ATOM 1514 C HIS A 98 6.177 -7.640 18.164 1.00 21.31 C ATOM 1515 O HIS A 98 6.611 -6.649 18.766 1.00 2.44 O ATOM 1516 CB HIS A 98 6.506 -9.655 19.685 1.00 62.40 C ATOM 1517 CG HIS A 98 5.911 -10.821 20.420 1.00 32.24 C ATOM 1518 ND1 HIS A 98 5.113 -10.684 21.532 1.00 51.52 N ATOM 1519 CD2 HIS A 98 5.963 -12.150 20.166 1.00 11.42 C ATOM 1520 CE1 HIS A 98 4.701 -11.871 21.925 1.00 75.33 C ATOM 1521 NE2 HIS A 98 5.202 -12.778 21.118 1.00 31.51 N ATOM 0 H HIS A 98 5.146 -10.340 17.577 1.00 71.41 H new ATOM 0 HA HIS A 98 4.812 -8.288 19.676 1.00 63.11 H new ATOM 0 HB2 HIS A 98 7.228 -10.027 18.958 1.00 62.40 H new ATOM 0 HB3 HIS A 98 7.057 -9.036 20.393 1.00 62.40 H new ATOM 0 HD2 HIS A 98 6.504 -12.627 19.362 1.00 11.42 H new ATOM 0 HE1 HIS A 98 4.058 -12.066 22.770 1.00 75.33 H new ATOM 0 HE2 HIS A 98 5.050 -13.784 21.188 1.00 31.51 H new ATOM 1530 N GLY A 99 6.280 -7.785 16.821 1.00 51.44 N ATOM 1531 CA GLY A 99 6.903 -6.752 15.958 1.00 13.11 C ATOM 1532 C GLY A 99 8.082 -7.241 15.098 1.00 75.23 C ATOM 1533 O GLY A 99 8.638 -6.452 14.324 1.00 10.01 O ATOM 0 H GLY A 99 5.942 -8.603 16.314 1.00 51.44 H new ATOM 0 HA2 GLY A 99 6.138 -6.343 15.298 1.00 13.11 H new ATOM 0 HA3 GLY A 99 7.250 -5.934 16.590 1.00 13.11 H new ATOM 1537 N ALA A 100 8.465 -8.528 15.219 1.00 51.35 N ATOM 1538 CA ALA A 100 9.614 -9.104 14.462 1.00 12.22 C ATOM 1539 C ALA A 100 9.280 -9.295 12.954 1.00 25.11 C ATOM 1540 O ALA A 100 8.362 -10.045 12.635 1.00 42.15 O ATOM 1541 CB ALA A 100 10.041 -10.442 15.087 1.00 71.52 C ATOM 0 H ALA A 100 7.999 -9.196 15.833 1.00 51.35 H new ATOM 0 HA ALA A 100 10.440 -8.395 14.526 1.00 12.22 H new ATOM 0 HB1 ALA A 100 10.880 -10.854 14.527 1.00 71.52 H new ATOM 0 HB2 ALA A 100 10.340 -10.281 16.123 1.00 71.52 H new ATOM 0 HB3 ALA A 100 9.206 -11.141 15.055 1.00 71.52 H new ATOM 1547 N PRO A 101 10.039 -8.651 12.001 1.00 63.41 N ATOM 1548 CA PRO A 101 9.758 -8.756 10.537 1.00 31.01 C ATOM 1549 C PRO A 101 9.738 -10.235 10.033 1.00 1.21 C ATOM 1550 O PRO A 101 10.776 -10.912 10.013 1.00 32.53 O ATOM 1551 CB PRO A 101 10.895 -7.921 9.876 1.00 12.23 C ATOM 1552 CG PRO A 101 11.958 -7.801 10.937 1.00 5.33 C ATOM 1553 CD PRO A 101 11.223 -7.787 12.262 1.00 1.42 C ATOM 0 HA PRO A 101 8.766 -8.383 10.282 1.00 31.01 H new ATOM 0 HB2 PRO A 101 11.281 -8.416 8.985 1.00 12.23 H new ATOM 0 HB3 PRO A 101 10.535 -6.940 9.565 1.00 12.23 H new ATOM 0 HG2 PRO A 101 12.656 -8.636 10.887 1.00 5.33 H new ATOM 0 HG3 PRO A 101 12.541 -6.890 10.804 1.00 5.33 H new ATOM 0 HD2 PRO A 101 11.840 -8.182 13.069 1.00 1.42 H new ATOM 0 HD3 PRO A 101 10.930 -6.777 12.550 1.00 1.42 H new ATOM 1561 N VAL A 102 8.528 -10.714 9.675 1.00 34.50 N ATOM 1562 CA VAL A 102 8.269 -12.115 9.266 1.00 1.04 C ATOM 1563 C VAL A 102 9.140 -12.535 8.050 1.00 13.31 C ATOM 1564 O VAL A 102 8.946 -12.050 6.932 1.00 44.12 O ATOM 1565 CB VAL A 102 6.736 -12.330 8.951 1.00 43.33 C ATOM 1566 CG1 VAL A 102 6.426 -13.778 8.492 1.00 62.30 C ATOM 1567 CG2 VAL A 102 5.865 -11.958 10.175 1.00 50.22 C ATOM 0 H VAL A 102 7.690 -10.132 9.661 1.00 34.50 H new ATOM 0 HA VAL A 102 8.548 -12.754 10.104 1.00 1.04 H new ATOM 0 HB VAL A 102 6.488 -11.665 8.123 1.00 43.33 H new ATOM 0 HG11 VAL A 102 5.360 -13.875 8.288 1.00 62.30 H new ATOM 0 HG12 VAL A 102 6.990 -14.001 7.587 1.00 62.30 H new ATOM 0 HG13 VAL A 102 6.710 -14.478 9.278 1.00 62.30 H new ATOM 0 HG21 VAL A 102 4.813 -12.114 9.934 1.00 50.22 H new ATOM 0 HG22 VAL A 102 6.140 -12.586 11.022 1.00 50.22 H new ATOM 0 HG23 VAL A 102 6.027 -10.911 10.432 1.00 50.22 H new ATOM 1577 N ASP A 103 10.112 -13.429 8.314 1.00 21.54 N ATOM 1578 CA ASP A 103 11.075 -13.942 7.307 1.00 11.25 C ATOM 1579 C ASP A 103 10.367 -14.821 6.243 1.00 52.34 C ATOM 1580 O ASP A 103 10.779 -14.872 5.079 1.00 71.10 O ATOM 1581 CB ASP A 103 12.183 -14.741 8.044 1.00 1.24 C ATOM 1582 CG ASP A 103 13.275 -15.293 7.108 1.00 21.12 C ATOM 1583 OD1 ASP A 103 14.131 -14.510 6.650 1.00 31.44 O ATOM 1584 OD2 ASP A 103 13.279 -16.510 6.829 1.00 35.45 O ATOM 0 H ASP A 103 10.257 -13.824 9.243 1.00 21.54 H new ATOM 0 HA ASP A 103 11.521 -13.102 6.774 1.00 11.25 H new ATOM 0 HB2 ASP A 103 12.648 -14.097 8.790 1.00 1.24 H new ATOM 0 HB3 ASP A 103 11.724 -15.571 8.581 1.00 1.24 H new ATOM 1589 N GLU A 104 9.301 -15.511 6.685 1.00 65.11 N ATOM 1590 CA GLU A 104 8.409 -16.317 5.822 1.00 51.14 C ATOM 1591 C GLU A 104 7.778 -15.472 4.679 1.00 5.55 C ATOM 1592 O GLU A 104 7.674 -15.926 3.534 1.00 23.45 O ATOM 1593 CB GLU A 104 7.300 -16.943 6.711 1.00 13.30 C ATOM 1594 CG GLU A 104 6.267 -17.815 5.977 1.00 62.41 C ATOM 1595 CD GLU A 104 6.882 -19.045 5.288 1.00 43.24 C ATOM 1596 OE1 GLU A 104 7.252 -20.005 5.993 1.00 54.02 O ATOM 1597 OE2 GLU A 104 6.981 -19.063 4.043 1.00 41.42 O ATOM 0 H GLU A 104 9.028 -15.527 7.668 1.00 65.11 H new ATOM 0 HA GLU A 104 8.999 -17.098 5.342 1.00 51.14 H new ATOM 0 HB2 GLU A 104 7.777 -17.549 7.482 1.00 13.30 H new ATOM 0 HB3 GLU A 104 6.771 -16.138 7.221 1.00 13.30 H new ATOM 0 HG2 GLU A 104 5.512 -18.147 6.689 1.00 62.41 H new ATOM 0 HG3 GLU A 104 5.756 -17.208 5.230 1.00 62.41 H new ATOM 1604 N LEU A 105 7.354 -14.242 5.014 1.00 52.11 N ATOM 1605 CA LEU A 105 6.703 -13.319 4.052 1.00 73.20 C ATOM 1606 C LEU A 105 7.693 -12.274 3.480 1.00 22.42 C ATOM 1607 O LEU A 105 7.351 -11.539 2.547 1.00 3.13 O ATOM 1608 CB LEU A 105 5.488 -12.646 4.744 1.00 73.35 C ATOM 1609 CG LEU A 105 4.371 -13.635 5.223 1.00 71.32 C ATOM 1610 CD1 LEU A 105 3.195 -12.893 5.886 1.00 12.24 C ATOM 1611 CD2 LEU A 105 3.887 -14.527 4.059 1.00 21.53 C ATOM 0 H LEU A 105 7.449 -13.855 5.953 1.00 52.11 H new ATOM 0 HA LEU A 105 6.354 -13.894 3.194 1.00 73.20 H new ATOM 0 HB2 LEU A 105 5.846 -12.080 5.604 1.00 73.35 H new ATOM 0 HB3 LEU A 105 5.046 -11.929 4.053 1.00 73.35 H new ATOM 0 HG LEU A 105 4.811 -14.281 5.983 1.00 71.32 H new ATOM 0 HD11 LEU A 105 2.442 -13.615 6.204 1.00 12.24 H new ATOM 0 HD12 LEU A 105 3.556 -12.340 6.753 1.00 12.24 H new ATOM 0 HD13 LEU A 105 2.753 -12.199 5.171 1.00 12.24 H new ATOM 0 HD21 LEU A 105 3.112 -15.204 4.418 1.00 21.53 H new ATOM 0 HD22 LEU A 105 3.482 -13.900 3.264 1.00 21.53 H new ATOM 0 HD23 LEU A 105 4.725 -15.107 3.672 1.00 21.53 H new ATOM 1623 N GLY A 106 8.908 -12.220 4.062 1.00 2.24 N ATOM 1624 CA GLY A 106 10.023 -11.426 3.524 1.00 55.15 C ATOM 1625 C GLY A 106 9.828 -9.901 3.587 1.00 33.13 C ATOM 1626 O GLY A 106 9.001 -9.393 4.353 1.00 41.25 O ATOM 0 H GLY A 106 9.140 -12.726 4.917 1.00 2.24 H new ATOM 0 HA2 GLY A 106 10.930 -11.684 4.071 1.00 55.15 H new ATOM 0 HA3 GLY A 106 10.185 -11.713 2.485 1.00 55.15 H new ATOM 1630 N VAL A 107 10.636 -9.175 2.788 1.00 13.22 N ATOM 1631 CA VAL A 107 10.557 -7.698 2.653 1.00 40.05 C ATOM 1632 C VAL A 107 10.268 -7.323 1.176 1.00 55.23 C ATOM 1633 O VAL A 107 10.807 -7.939 0.255 1.00 30.33 O ATOM 1634 CB VAL A 107 11.896 -6.997 3.120 1.00 14.25 C ATOM 1635 CG1 VAL A 107 11.787 -5.444 3.051 1.00 1.32 C ATOM 1636 CG2 VAL A 107 12.309 -7.459 4.543 1.00 3.23 C ATOM 0 H VAL A 107 11.367 -9.595 2.213 1.00 13.22 H new ATOM 0 HA VAL A 107 9.749 -7.347 3.295 1.00 40.05 H new ATOM 0 HB VAL A 107 12.678 -7.305 2.426 1.00 14.25 H new ATOM 0 HG11 VAL A 107 12.726 -4.998 3.379 1.00 1.32 H new ATOM 0 HG12 VAL A 107 11.580 -5.139 2.025 1.00 1.32 H new ATOM 0 HG13 VAL A 107 10.979 -5.107 3.700 1.00 1.32 H new ATOM 0 HG21 VAL A 107 13.233 -6.959 4.834 1.00 3.23 H new ATOM 0 HG22 VAL A 107 11.520 -7.205 5.251 1.00 3.23 H new ATOM 0 HG23 VAL A 107 12.464 -8.538 4.544 1.00 3.23 H new ATOM 1646 N THR A 108 9.408 -6.317 0.970 1.00 34.00 N ATOM 1647 CA THR A 108 9.045 -5.797 -0.373 1.00 21.04 C ATOM 1648 C THR A 108 9.114 -4.256 -0.390 1.00 21.23 C ATOM 1649 O THR A 108 8.981 -3.620 0.647 1.00 62.55 O ATOM 1650 CB THR A 108 7.630 -6.309 -0.840 1.00 43.05 C ATOM 1651 OG1 THR A 108 7.094 -5.483 -1.891 1.00 55.11 O ATOM 1652 CG2 THR A 108 6.617 -6.413 0.314 1.00 41.02 C ATOM 0 H THR A 108 8.935 -5.831 1.732 1.00 34.00 H new ATOM 0 HA THR A 108 9.773 -6.184 -1.086 1.00 21.04 H new ATOM 0 HB THR A 108 7.790 -7.317 -1.224 1.00 43.05 H new ATOM 0 HG1 THR A 108 6.945 -6.028 -2.692 1.00 55.11 H new ATOM 0 HG21 THR A 108 5.662 -6.771 -0.071 1.00 41.02 H new ATOM 0 HG22 THR A 108 6.990 -7.110 1.064 1.00 41.02 H new ATOM 0 HG23 THR A 108 6.480 -5.431 0.768 1.00 41.02 H new ATOM 1660 N HIS A 109 9.351 -3.670 -1.578 1.00 63.23 N ATOM 1661 CA HIS A 109 9.536 -2.208 -1.739 1.00 62.42 C ATOM 1662 C HIS A 109 8.442 -1.632 -2.668 1.00 2.12 C ATOM 1663 O HIS A 109 8.491 -1.821 -3.885 1.00 20.20 O ATOM 1664 CB HIS A 109 10.956 -1.925 -2.306 1.00 35.31 C ATOM 1665 CG HIS A 109 11.386 -0.471 -2.291 1.00 61.23 C ATOM 1666 ND1 HIS A 109 12.337 0.018 -1.426 1.00 25.33 N ATOM 1667 CD2 HIS A 109 11.027 0.586 -3.070 1.00 53.03 C ATOM 1668 CE1 HIS A 109 12.543 1.291 -1.671 1.00 75.33 C ATOM 1669 NE2 HIS A 109 11.766 1.667 -2.663 1.00 51.24 N ATOM 0 H HIS A 109 9.420 -4.190 -2.453 1.00 63.23 H new ATOM 0 HA HIS A 109 9.444 -1.719 -0.769 1.00 62.42 H new ATOM 0 HB2 HIS A 109 11.679 -2.506 -1.734 1.00 35.31 H new ATOM 0 HB3 HIS A 109 10.997 -2.288 -3.333 1.00 35.31 H new ATOM 0 HD1 HIS A 109 12.810 -0.526 -0.704 1.00 25.33 H new ATOM 0 HD2 HIS A 109 10.294 0.575 -3.863 1.00 53.03 H new ATOM 0 HE1 HIS A 109 13.238 1.927 -1.143 1.00 75.33 H new ATOM 1678 N ALA A 110 7.471 -0.913 -2.083 1.00 1.52 N ATOM 1679 CA ALA A 110 6.349 -0.310 -2.832 1.00 71.31 C ATOM 1680 C ALA A 110 6.677 1.133 -3.279 1.00 21.31 C ATOM 1681 O ALA A 110 7.120 1.961 -2.471 1.00 10.54 O ATOM 1682 CB ALA A 110 5.073 -0.337 -1.983 1.00 35.21 C ATOM 0 H ALA A 110 7.438 -0.732 -1.080 1.00 1.52 H new ATOM 0 HA ALA A 110 6.187 -0.903 -3.732 1.00 71.31 H new ATOM 0 HB1 ALA A 110 4.253 0.110 -2.545 1.00 35.21 H new ATOM 0 HB2 ALA A 110 4.823 -1.368 -1.734 1.00 35.21 H new ATOM 0 HB3 ALA A 110 5.235 0.228 -1.065 1.00 35.21 H new ATOM 1688 N THR A 111 6.445 1.431 -4.573 1.00 61.42 N ATOM 1689 CA THR A 111 6.593 2.798 -5.131 1.00 74.34 C ATOM 1690 C THR A 111 5.193 3.340 -5.479 1.00 73.43 C ATOM 1691 O THR A 111 4.566 2.862 -6.423 1.00 12.32 O ATOM 1692 CB THR A 111 7.503 2.830 -6.422 1.00 52.52 C ATOM 1693 OG1 THR A 111 8.715 2.092 -6.182 1.00 61.13 O ATOM 1694 CG2 THR A 111 7.876 4.269 -6.825 1.00 4.34 C ATOM 0 H THR A 111 6.151 0.738 -5.261 1.00 61.42 H new ATOM 0 HA THR A 111 7.081 3.418 -4.378 1.00 74.34 H new ATOM 0 HB THR A 111 6.932 2.379 -7.234 1.00 52.52 H new ATOM 0 HG1 THR A 111 9.275 2.113 -6.986 1.00 61.13 H new ATOM 0 HG21 THR A 111 8.502 4.246 -7.717 1.00 4.34 H new ATOM 0 HG22 THR A 111 6.968 4.835 -7.033 1.00 4.34 H new ATOM 0 HG23 THR A 111 8.422 4.745 -6.011 1.00 4.34 H new ATOM 1702 N VAL A 112 4.701 4.315 -4.697 1.00 52.33 N ATOM 1703 CA VAL A 112 3.377 4.945 -4.914 1.00 21.44 C ATOM 1704 C VAL A 112 3.558 6.230 -5.750 1.00 21.52 C ATOM 1705 O VAL A 112 4.214 7.173 -5.312 1.00 24.24 O ATOM 1706 CB VAL A 112 2.677 5.287 -3.550 1.00 0.23 C ATOM 1707 CG1 VAL A 112 1.303 5.977 -3.774 1.00 13.43 C ATOM 1708 CG2 VAL A 112 2.535 4.018 -2.668 1.00 74.23 C ATOM 0 H VAL A 112 5.206 4.693 -3.895 1.00 52.33 H new ATOM 0 HA VAL A 112 2.740 4.240 -5.448 1.00 21.44 H new ATOM 0 HB VAL A 112 3.312 5.995 -3.018 1.00 0.23 H new ATOM 0 HG11 VAL A 112 0.846 6.200 -2.810 1.00 13.43 H new ATOM 0 HG12 VAL A 112 1.447 6.904 -4.330 1.00 13.43 H new ATOM 0 HG13 VAL A 112 0.650 5.313 -4.340 1.00 13.43 H new ATOM 0 HG21 VAL A 112 2.048 4.280 -1.729 1.00 74.23 H new ATOM 0 HG22 VAL A 112 1.935 3.275 -3.193 1.00 74.23 H new ATOM 0 HG23 VAL A 112 3.523 3.606 -2.461 1.00 74.23 H new ATOM 1718 N LYS A 113 2.992 6.244 -6.963 1.00 25.02 N ATOM 1719 CA LYS A 113 3.180 7.336 -7.941 1.00 74.45 C ATOM 1720 C LYS A 113 1.817 7.886 -8.412 1.00 75.14 C ATOM 1721 O LYS A 113 0.978 7.137 -8.920 1.00 63.22 O ATOM 1722 CB LYS A 113 4.021 6.792 -9.127 1.00 13.41 C ATOM 1723 CG LYS A 113 5.435 6.325 -8.698 1.00 53.44 C ATOM 1724 CD LYS A 113 6.208 5.590 -9.808 1.00 15.14 C ATOM 1725 CE LYS A 113 6.433 6.454 -11.050 1.00 51.42 C ATOM 1726 NZ LYS A 113 7.238 5.763 -12.081 1.00 55.10 N ATOM 0 H LYS A 113 2.386 5.496 -7.301 1.00 25.02 H new ATOM 0 HA LYS A 113 3.712 8.168 -7.479 1.00 74.45 H new ATOM 0 HB2 LYS A 113 3.493 5.958 -9.588 1.00 13.41 H new ATOM 0 HB3 LYS A 113 4.115 7.569 -9.886 1.00 13.41 H new ATOM 0 HG2 LYS A 113 6.013 7.192 -8.378 1.00 53.44 H new ATOM 0 HG3 LYS A 113 5.344 5.667 -7.834 1.00 53.44 H new ATOM 0 HD2 LYS A 113 7.173 5.265 -9.418 1.00 15.14 H new ATOM 0 HD3 LYS A 113 5.660 4.691 -10.091 1.00 15.14 H new ATOM 0 HE2 LYS A 113 5.469 6.734 -11.474 1.00 51.42 H new ATOM 0 HE3 LYS A 113 6.934 7.378 -10.761 1.00 51.42 H new ATOM 0 HZ1 LYS A 113 7.362 6.389 -12.902 1.00 55.10 H new ATOM 0 HZ2 LYS A 113 8.169 5.518 -11.688 1.00 55.10 H new ATOM 0 HZ3 LYS A 113 6.749 4.895 -12.379 1.00 55.10 H new ATOM 1740 N LEU A 114 1.602 9.200 -8.213 1.00 70.33 N ATOM 1741 CA LEU A 114 0.336 9.878 -8.560 1.00 53.33 C ATOM 1742 C LEU A 114 0.466 10.700 -9.864 1.00 14.04 C ATOM 1743 O LEU A 114 1.280 11.624 -9.947 1.00 63.42 O ATOM 1744 CB LEU A 114 -0.109 10.793 -7.390 1.00 22.43 C ATOM 1745 CG LEU A 114 -0.326 10.083 -6.015 1.00 13.32 C ATOM 1746 CD1 LEU A 114 -0.693 11.096 -4.918 1.00 43.24 C ATOM 1747 CD2 LEU A 114 -1.397 8.987 -6.127 1.00 41.13 C ATOM 0 H LEU A 114 2.300 9.823 -7.807 1.00 70.33 H new ATOM 0 HA LEU A 114 -0.420 9.112 -8.729 1.00 53.33 H new ATOM 0 HB2 LEU A 114 0.640 11.574 -7.260 1.00 22.43 H new ATOM 0 HB3 LEU A 114 -1.039 11.287 -7.673 1.00 22.43 H new ATOM 0 HG LEU A 114 0.615 9.611 -5.732 1.00 13.32 H new ATOM 0 HD11 LEU A 114 -0.838 10.572 -3.973 1.00 43.24 H new ATOM 0 HD12 LEU A 114 0.112 11.823 -4.810 1.00 43.24 H new ATOM 0 HD13 LEU A 114 -1.614 11.611 -5.192 1.00 43.24 H new ATOM 0 HD21 LEU A 114 -1.530 8.508 -5.157 1.00 41.13 H new ATOM 0 HD22 LEU A 114 -2.340 9.431 -6.444 1.00 41.13 H new ATOM 0 HD23 LEU A 114 -1.082 8.244 -6.859 1.00 41.13 H new ATOM 1759 N GLU A 115 -0.354 10.360 -10.874 1.00 63.33 N ATOM 1760 CA GLU A 115 -0.397 11.074 -12.166 1.00 34.42 C ATOM 1761 C GLU A 115 -1.648 11.990 -12.231 1.00 70.10 C ATOM 1762 O GLU A 115 -2.776 11.508 -12.061 1.00 0.45 O ATOM 1763 CB GLU A 115 -0.423 10.075 -13.356 1.00 42.42 C ATOM 1764 CG GLU A 115 0.870 9.249 -13.560 1.00 44.13 C ATOM 1765 CD GLU A 115 1.115 8.142 -12.504 1.00 60.23 C ATOM 1766 OE1 GLU A 115 0.384 7.127 -12.510 1.00 3.55 O ATOM 1767 OE2 GLU A 115 2.051 8.274 -11.686 1.00 62.12 O ATOM 0 H GLU A 115 -1.009 9.580 -10.819 1.00 63.33 H new ATOM 0 HA GLU A 115 0.504 11.683 -12.242 1.00 34.42 H new ATOM 0 HB2 GLU A 115 -1.255 9.386 -13.211 1.00 42.42 H new ATOM 0 HB3 GLU A 115 -0.626 10.632 -14.271 1.00 42.42 H new ATOM 0 HG2 GLU A 115 0.836 8.787 -14.547 1.00 44.13 H new ATOM 0 HG3 GLU A 115 1.722 9.929 -13.555 1.00 44.13 H new ATOM 1774 N PRO A 116 -1.465 13.329 -12.472 1.00 32.54 N ATOM 1775 CA PRO A 116 -2.595 14.290 -12.579 1.00 34.21 C ATOM 1776 C PRO A 116 -3.475 14.037 -13.831 1.00 41.20 C ATOM 1777 O PRO A 116 -3.005 14.143 -14.970 1.00 4.01 O ATOM 1778 CB PRO A 116 -1.889 15.675 -12.641 1.00 12.31 C ATOM 1779 CG PRO A 116 -0.515 15.382 -13.175 1.00 44.15 C ATOM 1780 CD PRO A 116 -0.150 14.004 -12.657 1.00 5.32 C ATOM 0 HA PRO A 116 -3.291 14.203 -11.745 1.00 34.21 H new ATOM 0 HB2 PRO A 116 -2.427 16.365 -13.291 1.00 12.31 H new ATOM 0 HB3 PRO A 116 -1.840 16.138 -11.656 1.00 12.31 H new ATOM 0 HG2 PRO A 116 -0.507 15.404 -14.265 1.00 44.15 H new ATOM 0 HG3 PRO A 116 0.203 16.129 -12.836 1.00 44.15 H new ATOM 0 HD2 PRO A 116 0.479 13.465 -13.365 1.00 5.32 H new ATOM 0 HD3 PRO A 116 0.404 14.063 -11.720 1.00 5.32 H new ATOM 1788 N LEU A 117 -4.748 13.662 -13.604 1.00 24.30 N ATOM 1789 CA LEU A 117 -5.747 13.475 -14.695 1.00 53.03 C ATOM 1790 C LEU A 117 -6.768 14.640 -14.705 1.00 15.32 C ATOM 1791 O LEU A 117 -7.929 14.453 -15.094 1.00 2.22 O ATOM 1792 CB LEU A 117 -6.485 12.116 -14.525 1.00 12.33 C ATOM 1793 CG LEU A 117 -5.608 10.840 -14.351 1.00 14.02 C ATOM 1794 CD1 LEU A 117 -6.490 9.575 -14.248 1.00 11.11 C ATOM 1795 CD2 LEU A 117 -4.566 10.707 -15.479 1.00 43.20 C ATOM 0 H LEU A 117 -5.119 13.479 -12.672 1.00 24.30 H new ATOM 0 HA LEU A 117 -5.218 13.471 -15.648 1.00 53.03 H new ATOM 0 HB2 LEU A 117 -7.140 12.195 -13.658 1.00 12.33 H new ATOM 0 HB3 LEU A 117 -7.124 11.969 -15.395 1.00 12.33 H new ATOM 0 HG LEU A 117 -5.057 10.943 -13.416 1.00 14.02 H new ATOM 0 HD11 LEU A 117 -5.855 8.697 -14.127 1.00 11.11 H new ATOM 0 HD12 LEU A 117 -7.154 9.664 -13.388 1.00 11.11 H new ATOM 0 HD13 LEU A 117 -7.084 9.471 -15.156 1.00 11.11 H new ATOM 0 HD21 LEU A 117 -3.974 9.805 -15.323 1.00 43.20 H new ATOM 0 HD22 LEU A 117 -5.076 10.644 -16.440 1.00 43.20 H new ATOM 0 HD23 LEU A 117 -3.910 11.577 -15.473 1.00 43.20 H new ATOM 1807 N GLU A 118 -6.306 15.841 -14.287 1.00 63.33 N ATOM 1808 CA GLU A 118 -7.145 17.066 -14.165 1.00 74.44 C ATOM 1809 C GLU A 118 -8.282 16.892 -13.122 1.00 22.33 C ATOM 1810 O GLU A 118 -8.121 17.239 -11.948 1.00 44.31 O ATOM 1811 CB GLU A 118 -7.727 17.500 -15.549 1.00 13.42 C ATOM 1812 CG GLU A 118 -6.676 17.953 -16.577 1.00 61.33 C ATOM 1813 CD GLU A 118 -7.288 18.319 -17.941 1.00 65.03 C ATOM 1814 OE1 GLU A 118 -7.513 17.408 -18.763 1.00 63.51 O ATOM 1815 OE2 GLU A 118 -7.553 19.513 -18.191 1.00 20.31 O ATOM 0 H GLU A 118 -5.333 15.993 -14.022 1.00 63.33 H new ATOM 0 HA GLU A 118 -6.490 17.860 -13.807 1.00 74.44 H new ATOM 0 HB2 GLU A 118 -8.289 16.666 -15.969 1.00 13.42 H new ATOM 0 HB3 GLU A 118 -8.435 18.314 -15.391 1.00 13.42 H new ATOM 0 HG2 GLU A 118 -6.138 18.815 -16.183 1.00 61.33 H new ATOM 0 HG3 GLU A 118 -5.944 17.157 -16.715 1.00 61.33 H new ATOM 1822 N ASN A 119 -9.424 16.351 -13.585 1.00 23.34 N ATOM 1823 CA ASN A 119 -10.617 16.092 -12.768 1.00 32.41 C ATOM 1824 C ASN A 119 -10.425 14.834 -11.881 1.00 3.12 C ATOM 1825 O ASN A 119 -10.880 14.791 -10.731 1.00 71.32 O ATOM 1826 CB ASN A 119 -11.821 15.942 -13.732 1.00 62.21 C ATOM 1827 CG ASN A 119 -13.119 15.545 -13.038 1.00 23.33 C ATOM 1828 OD1 ASN A 119 -13.868 16.382 -12.561 1.00 23.15 O ATOM 1829 ND2 ASN A 119 -13.392 14.261 -12.995 1.00 65.12 N ATOM 0 H ASN A 119 -9.542 16.077 -14.560 1.00 23.34 H new ATOM 0 HA ASN A 119 -10.797 16.920 -12.082 1.00 32.41 H new ATOM 0 HB2 ASN A 119 -11.974 16.885 -14.257 1.00 62.21 H new ATOM 0 HB3 ASN A 119 -11.579 15.193 -14.486 1.00 62.21 H new ATOM 0 HD21 ASN A 119 -14.252 13.937 -12.553 1.00 65.12 H new ATOM 0 HD22 ASN A 119 -12.744 13.588 -13.404 1.00 65.12 H new ATOM 1836 N ARG A 120 -9.759 13.811 -12.436 1.00 31.41 N ATOM 1837 CA ARG A 120 -9.407 12.578 -11.689 1.00 22.24 C ATOM 1838 C ARG A 120 -7.898 12.569 -11.332 1.00 41.05 C ATOM 1839 O ARG A 120 -7.177 13.537 -11.601 1.00 61.12 O ATOM 1840 CB ARG A 120 -9.772 11.307 -12.514 1.00 23.12 C ATOM 1841 CG ARG A 120 -11.258 11.214 -12.932 1.00 44.02 C ATOM 1842 CD ARG A 120 -11.625 9.833 -13.523 1.00 24.44 C ATOM 1843 NE ARG A 120 -10.764 9.429 -14.653 1.00 24.41 N ATOM 1844 CZ ARG A 120 -11.041 9.568 -15.934 1.00 74.31 C ATOM 1845 NH1 ARG A 120 -12.108 10.187 -16.341 1.00 71.23 N ATOM 1846 NH2 ARG A 120 -10.214 9.096 -16.806 1.00 23.44 N ATOM 0 H ARG A 120 -9.448 13.807 -13.407 1.00 31.41 H new ATOM 0 HA ARG A 120 -9.985 12.567 -10.765 1.00 22.24 H new ATOM 0 HB2 ARG A 120 -9.154 11.283 -13.411 1.00 23.12 H new ATOM 0 HB3 ARG A 120 -9.517 10.424 -11.928 1.00 23.12 H new ATOM 0 HG2 ARG A 120 -11.888 11.413 -12.065 1.00 44.02 H new ATOM 0 HG3 ARG A 120 -11.474 11.989 -13.668 1.00 44.02 H new ATOM 0 HD2 ARG A 120 -11.557 9.081 -12.737 1.00 24.44 H new ATOM 0 HD3 ARG A 120 -12.663 9.853 -13.856 1.00 24.44 H new ATOM 0 HE ARG A 120 -9.868 9.001 -14.419 1.00 24.41 H new ATOM 0 HH11 ARG A 120 -12.759 10.582 -15.662 1.00 71.23 H new ATOM 0 HH12 ARG A 120 -12.295 10.278 -17.340 1.00 71.23 H new ATOM 0 HH21 ARG A 120 -9.363 8.625 -16.499 1.00 23.44 H new ATOM 0 HH22 ARG A 120 -10.412 9.194 -17.802 1.00 23.44 H new ATOM 1860 N THR A 121 -7.433 11.474 -10.708 1.00 41.43 N ATOM 1861 CA THR A 121 -5.990 11.218 -10.463 1.00 31.41 C ATOM 1862 C THR A 121 -5.713 9.701 -10.497 1.00 15.34 C ATOM 1863 O THR A 121 -6.541 8.895 -10.061 1.00 20.30 O ATOM 1864 CB THR A 121 -5.491 11.851 -9.109 1.00 12.45 C ATOM 1865 OG1 THR A 121 -5.619 13.279 -9.178 1.00 60.11 O ATOM 1866 CG2 THR A 121 -4.022 11.506 -8.768 1.00 41.41 C ATOM 0 H THR A 121 -8.042 10.736 -10.356 1.00 41.43 H new ATOM 0 HA THR A 121 -5.427 11.703 -11.260 1.00 31.41 H new ATOM 0 HB THR A 121 -6.114 11.427 -8.322 1.00 12.45 H new ATOM 0 HG1 THR A 121 -6.010 13.531 -10.041 1.00 60.11 H new ATOM 0 HG21 THR A 121 -3.748 11.976 -7.823 1.00 41.41 H new ATOM 0 HG22 THR A 121 -3.913 10.425 -8.681 1.00 41.41 H new ATOM 0 HG23 THR A 121 -3.369 11.874 -9.559 1.00 41.41 H new ATOM 1874 N ARG A 122 -4.532 9.336 -11.011 1.00 73.30 N ATOM 1875 CA ARG A 122 -4.086 7.946 -11.178 1.00 13.04 C ATOM 1876 C ARG A 122 -3.069 7.595 -10.069 1.00 3.13 C ATOM 1877 O ARG A 122 -2.164 8.369 -9.803 1.00 5.35 O ATOM 1878 CB ARG A 122 -3.421 7.794 -12.576 1.00 12.31 C ATOM 1879 CG ARG A 122 -2.838 6.397 -12.878 1.00 35.00 C ATOM 1880 CD ARG A 122 -3.905 5.337 -13.188 1.00 52.20 C ATOM 1881 NE ARG A 122 -4.558 5.560 -14.492 1.00 5.22 N ATOM 1882 CZ ARG A 122 -4.131 5.110 -15.656 1.00 0.42 C ATOM 1883 NH1 ARG A 122 -2.981 4.521 -15.784 1.00 62.42 N ATOM 1884 NH2 ARG A 122 -4.864 5.278 -16.704 1.00 42.51 N ATOM 0 H ARG A 122 -3.842 10.016 -11.331 1.00 73.30 H new ATOM 0 HA ARG A 122 -4.938 7.270 -11.105 1.00 13.04 H new ATOM 0 HB2 ARG A 122 -4.160 8.035 -13.340 1.00 12.31 H new ATOM 0 HB3 ARG A 122 -2.622 8.530 -12.662 1.00 12.31 H new ATOM 0 HG2 ARG A 122 -2.157 6.473 -13.725 1.00 35.00 H new ATOM 0 HG3 ARG A 122 -2.248 6.067 -12.023 1.00 35.00 H new ATOM 0 HD2 ARG A 122 -3.445 4.349 -13.180 1.00 52.20 H new ATOM 0 HD3 ARG A 122 -4.659 5.344 -12.401 1.00 52.20 H new ATOM 0 HE ARG A 122 -5.416 6.111 -14.494 1.00 5.22 H new ATOM 0 HH11 ARG A 122 -2.379 4.395 -14.970 1.00 62.42 H new ATOM 0 HH12 ARG A 122 -2.680 4.184 -16.698 1.00 62.42 H new ATOM 0 HH21 ARG A 122 -5.763 5.754 -16.627 1.00 42.51 H new ATOM 0 HH22 ARG A 122 -4.545 4.935 -17.610 1.00 42.51 H new ATOM 1898 N MET A 123 -3.242 6.445 -9.407 1.00 43.32 N ATOM 1899 CA MET A 123 -2.275 5.923 -8.425 1.00 54.21 C ATOM 1900 C MET A 123 -1.702 4.580 -8.916 1.00 2.31 C ATOM 1901 O MET A 123 -2.457 3.643 -9.196 1.00 42.13 O ATOM 1902 CB MET A 123 -2.946 5.742 -7.041 1.00 1.33 C ATOM 1903 CG MET A 123 -1.978 5.309 -5.922 1.00 34.35 C ATOM 1904 SD MET A 123 -2.800 5.099 -4.332 1.00 2.23 S ATOM 1905 CE MET A 123 -3.909 3.743 -4.699 1.00 31.52 C ATOM 0 H MET A 123 -4.058 5.846 -9.535 1.00 43.32 H new ATOM 0 HA MET A 123 -1.462 6.642 -8.321 1.00 54.21 H new ATOM 0 HB2 MET A 123 -3.419 6.681 -6.754 1.00 1.33 H new ATOM 0 HB3 MET A 123 -3.739 4.999 -7.128 1.00 1.33 H new ATOM 0 HG2 MET A 123 -1.499 4.372 -6.205 1.00 34.35 H new ATOM 0 HG3 MET A 123 -1.188 6.054 -5.822 1.00 34.35 H new ATOM 0 HE1 MET A 123 -3.913 3.040 -3.866 1.00 31.52 H new ATOM 0 HE2 MET A 123 -4.917 4.129 -4.853 1.00 31.52 H new ATOM 0 HE3 MET A 123 -3.574 3.233 -5.602 1.00 31.52 H new ATOM 1915 N THR A 124 -0.366 4.497 -9.016 1.00 63.24 N ATOM 1916 CA THR A 124 0.340 3.258 -9.404 1.00 53.10 C ATOM 1917 C THR A 124 1.277 2.813 -8.260 1.00 3.21 C ATOM 1918 O THR A 124 2.254 3.499 -7.957 1.00 3.11 O ATOM 1919 CB THR A 124 1.159 3.462 -10.726 1.00 25.21 C ATOM 1920 OG1 THR A 124 0.315 4.051 -11.734 1.00 13.43 O ATOM 1921 CG2 THR A 124 1.731 2.131 -11.262 1.00 51.03 C ATOM 0 H THR A 124 0.257 5.283 -8.831 1.00 63.24 H new ATOM 0 HA THR A 124 -0.403 2.482 -9.587 1.00 53.10 H new ATOM 0 HB THR A 124 1.995 4.122 -10.495 1.00 25.21 H new ATOM 0 HG1 THR A 124 0.496 5.012 -11.791 1.00 13.43 H new ATOM 0 HG21 THR A 124 2.291 2.318 -12.178 1.00 51.03 H new ATOM 0 HG22 THR A 124 2.393 1.693 -10.515 1.00 51.03 H new ATOM 0 HG23 THR A 124 0.913 1.441 -11.471 1.00 51.03 H new ATOM 1929 N ILE A 125 0.958 1.670 -7.617 1.00 62.20 N ATOM 1930 CA ILE A 125 1.767 1.096 -6.509 1.00 53.30 C ATOM 1931 C ILE A 125 2.521 -0.158 -7.009 1.00 32.14 C ATOM 1932 O ILE A 125 1.888 -1.174 -7.305 1.00 70.01 O ATOM 1933 CB ILE A 125 0.852 0.680 -5.291 1.00 35.40 C ATOM 1934 CG1 ILE A 125 -0.091 1.849 -4.862 1.00 64.50 C ATOM 1935 CG2 ILE A 125 1.707 0.183 -4.088 1.00 60.15 C ATOM 1936 CD1 ILE A 125 -1.123 1.461 -3.812 1.00 30.24 C ATOM 0 H ILE A 125 0.134 1.116 -7.848 1.00 62.20 H new ATOM 0 HA ILE A 125 2.472 1.859 -6.180 1.00 53.30 H new ATOM 0 HB ILE A 125 0.225 -0.148 -5.621 1.00 35.40 H new ATOM 0 HG12 ILE A 125 0.516 2.668 -4.475 1.00 64.50 H new ATOM 0 HG13 ILE A 125 -0.609 2.226 -5.744 1.00 64.50 H new ATOM 0 HG21 ILE A 125 1.049 -0.096 -3.265 1.00 60.15 H new ATOM 0 HG22 ILE A 125 2.295 -0.683 -4.393 1.00 60.15 H new ATOM 0 HG23 ILE A 125 2.376 0.980 -3.763 1.00 60.15 H new ATOM 0 HD11 ILE A 125 -1.738 2.327 -3.569 1.00 30.24 H new ATOM 0 HD12 ILE A 125 -1.757 0.664 -4.202 1.00 30.24 H new ATOM 0 HD13 ILE A 125 -0.614 1.113 -2.913 1.00 30.24 H new ATOM 1948 N ILE A 126 3.864 -0.092 -7.104 1.00 52.23 N ATOM 1949 CA ILE A 126 4.687 -1.234 -7.572 1.00 21.32 C ATOM 1950 C ILE A 126 5.466 -1.844 -6.376 1.00 62.21 C ATOM 1951 O ILE A 126 6.466 -1.278 -5.941 1.00 25.53 O ATOM 1952 CB ILE A 126 5.719 -0.834 -8.717 1.00 65.41 C ATOM 1953 CG1 ILE A 126 5.071 0.072 -9.833 1.00 62.12 C ATOM 1954 CG2 ILE A 126 6.345 -2.109 -9.340 1.00 62.13 C ATOM 1955 CD1 ILE A 126 4.977 1.553 -9.489 1.00 11.44 C ATOM 0 H ILE A 126 4.405 0.738 -6.864 1.00 52.23 H new ATOM 0 HA ILE A 126 3.997 -1.962 -7.998 1.00 21.32 H new ATOM 0 HB ILE A 126 6.503 -0.238 -8.250 1.00 65.41 H new ATOM 0 HG12 ILE A 126 5.651 -0.036 -10.749 1.00 62.12 H new ATOM 0 HG13 ILE A 126 4.069 -0.300 -10.045 1.00 62.12 H new ATOM 0 HG21 ILE A 126 7.049 -1.824 -10.122 1.00 62.13 H new ATOM 0 HG22 ILE A 126 6.869 -2.672 -8.567 1.00 62.13 H new ATOM 0 HG23 ILE A 126 5.558 -2.728 -9.769 1.00 62.13 H new ATOM 0 HD11 ILE A 126 4.518 2.091 -10.319 1.00 11.44 H new ATOM 0 HD12 ILE A 126 4.369 1.681 -8.593 1.00 11.44 H new ATOM 0 HD13 ILE A 126 5.976 1.949 -9.309 1.00 11.44 H new ATOM 1967 N SER A 127 4.986 -2.985 -5.854 1.00 52.14 N ATOM 1968 CA SER A 127 5.638 -3.713 -4.734 1.00 42.31 C ATOM 1969 C SER A 127 6.639 -4.758 -5.282 1.00 31.35 C ATOM 1970 O SER A 127 6.239 -5.751 -5.900 1.00 11.15 O ATOM 1971 CB SER A 127 4.567 -4.394 -3.840 1.00 74.03 C ATOM 1972 OG SER A 127 3.691 -3.431 -3.267 1.00 74.43 O ATOM 0 H SER A 127 4.135 -3.435 -6.191 1.00 52.14 H new ATOM 0 HA SER A 127 6.190 -2.998 -4.125 1.00 42.31 H new ATOM 0 HB2 SER A 127 3.992 -5.105 -4.433 1.00 74.03 H new ATOM 0 HB3 SER A 127 5.057 -4.961 -3.048 1.00 74.03 H new ATOM 0 HG SER A 127 3.025 -3.885 -2.710 1.00 74.43 H new ATOM 1978 N THR A 128 7.946 -4.502 -5.088 1.00 61.41 N ATOM 1979 CA THR A 128 9.038 -5.371 -5.587 1.00 71.35 C ATOM 1980 C THR A 128 9.533 -6.340 -4.483 1.00 71.15 C ATOM 1981 O THR A 128 10.103 -5.920 -3.474 1.00 74.31 O ATOM 1982 CB THR A 128 10.237 -4.514 -6.124 1.00 4.15 C ATOM 1983 OG1 THR A 128 10.746 -3.659 -5.086 1.00 2.43 O ATOM 1984 CG2 THR A 128 9.831 -3.644 -7.332 1.00 12.41 C ATOM 0 H THR A 128 8.280 -3.684 -4.579 1.00 61.41 H new ATOM 0 HA THR A 128 8.634 -5.962 -6.409 1.00 71.35 H new ATOM 0 HB THR A 128 11.008 -5.214 -6.446 1.00 4.15 H new ATOM 0 HG1 THR A 128 10.624 -4.093 -4.216 1.00 2.43 H new ATOM 0 HG21 THR A 128 10.692 -3.068 -7.671 1.00 12.41 H new ATOM 0 HG22 THR A 128 9.482 -4.285 -8.141 1.00 12.41 H new ATOM 0 HG23 THR A 128 9.032 -2.964 -7.038 1.00 12.41 H new ATOM 1992 N PHE A 129 9.314 -7.645 -4.706 1.00 33.02 N ATOM 1993 CA PHE A 129 9.630 -8.726 -3.745 1.00 14.23 C ATOM 1994 C PHE A 129 11.062 -9.282 -3.972 1.00 33.02 C ATOM 1995 O PHE A 129 11.581 -9.244 -5.095 1.00 14.43 O ATOM 1996 CB PHE A 129 8.583 -9.862 -3.895 1.00 11.21 C ATOM 1997 CG PHE A 129 7.129 -9.368 -3.918 1.00 13.44 C ATOM 1998 CD1 PHE A 129 6.455 -9.053 -2.742 1.00 75.33 C ATOM 1999 CD2 PHE A 129 6.438 -9.222 -5.124 1.00 24.33 C ATOM 2000 CE1 PHE A 129 5.145 -8.606 -2.771 1.00 50.24 C ATOM 2001 CE2 PHE A 129 5.132 -8.782 -5.153 1.00 44.34 C ATOM 2002 CZ PHE A 129 4.483 -8.474 -3.976 1.00 55.04 C ATOM 0 H PHE A 129 8.905 -7.990 -5.574 1.00 33.02 H new ATOM 0 HA PHE A 129 9.591 -8.318 -2.735 1.00 14.23 H new ATOM 0 HB2 PHE A 129 8.785 -10.410 -4.815 1.00 11.21 H new ATOM 0 HB3 PHE A 129 8.704 -10.566 -3.072 1.00 11.21 H new ATOM 0 HD1 PHE A 129 6.961 -9.159 -1.794 1.00 75.33 H new ATOM 0 HD2 PHE A 129 6.937 -9.459 -6.052 1.00 24.33 H new ATOM 0 HE1 PHE A 129 4.639 -8.360 -1.849 1.00 50.24 H new ATOM 0 HE2 PHE A 129 4.617 -8.679 -6.097 1.00 44.34 H new ATOM 0 HZ PHE A 129 3.459 -8.130 -3.996 1.00 55.04 H new ATOM 2012 N GLU A 130 11.673 -9.829 -2.908 1.00 3.22 N ATOM 2013 CA GLU A 130 13.070 -10.337 -2.942 1.00 33.42 C ATOM 2014 C GLU A 130 13.217 -11.684 -3.696 1.00 30.01 C ATOM 2015 O GLU A 130 14.261 -11.941 -4.307 1.00 75.22 O ATOM 2016 CB GLU A 130 13.607 -10.464 -1.490 1.00 74.25 C ATOM 2017 CG GLU A 130 13.717 -9.125 -0.727 1.00 60.21 C ATOM 2018 CD GLU A 130 14.774 -8.170 -1.316 1.00 62.13 C ATOM 2019 OE1 GLU A 130 14.440 -7.358 -2.208 1.00 22.20 O ATOM 2020 OE2 GLU A 130 15.951 -8.231 -0.898 1.00 22.42 O ATOM 0 H GLU A 130 11.221 -9.935 -2.000 1.00 3.22 H new ATOM 0 HA GLU A 130 13.663 -9.614 -3.502 1.00 33.42 H new ATOM 0 HB2 GLU A 130 12.952 -11.133 -0.931 1.00 74.25 H new ATOM 0 HB3 GLU A 130 14.591 -10.932 -1.520 1.00 74.25 H new ATOM 0 HG2 GLU A 130 12.746 -8.630 -0.735 1.00 60.21 H new ATOM 0 HG3 GLU A 130 13.962 -9.328 0.315 1.00 60.21 H new ATOM 2027 N SER A 131 12.178 -12.543 -3.647 1.00 22.21 N ATOM 2028 CA SER A 131 12.216 -13.888 -4.280 1.00 0.55 C ATOM 2029 C SER A 131 10.863 -14.257 -4.924 1.00 30.10 C ATOM 2030 O SER A 131 9.823 -13.677 -4.584 1.00 73.43 O ATOM 2031 CB SER A 131 12.613 -14.953 -3.227 1.00 11.13 C ATOM 2032 OG SER A 131 12.746 -16.247 -3.802 1.00 52.24 O ATOM 0 H SER A 131 11.298 -12.333 -3.176 1.00 22.21 H new ATOM 0 HA SER A 131 12.962 -13.863 -5.074 1.00 0.55 H new ATOM 0 HB2 SER A 131 13.554 -14.666 -2.758 1.00 11.13 H new ATOM 0 HB3 SER A 131 11.860 -14.982 -2.439 1.00 11.13 H new ATOM 0 HG SER A 131 13.121 -16.863 -3.138 1.00 52.24 H new ATOM 2038 N GLU A 132 10.895 -15.233 -5.861 1.00 62.43 N ATOM 2039 CA GLU A 132 9.675 -15.769 -6.508 1.00 23.24 C ATOM 2040 C GLU A 132 8.770 -16.463 -5.468 1.00 64.31 C ATOM 2041 O GLU A 132 7.568 -16.216 -5.429 1.00 54.22 O ATOM 2042 CB GLU A 132 10.023 -16.757 -7.655 1.00 52.21 C ATOM 2043 CG GLU A 132 8.788 -17.269 -8.436 1.00 35.21 C ATOM 2044 CD GLU A 132 9.110 -18.358 -9.474 1.00 54.54 C ATOM 2045 OE1 GLU A 132 9.444 -18.020 -10.634 1.00 73.11 O ATOM 2046 OE2 GLU A 132 9.025 -19.562 -9.139 1.00 71.14 O ATOM 0 H GLU A 132 11.758 -15.667 -6.187 1.00 62.43 H new ATOM 0 HA GLU A 132 9.138 -14.926 -6.942 1.00 23.24 H new ATOM 0 HB2 GLU A 132 10.703 -16.266 -8.351 1.00 52.21 H new ATOM 0 HB3 GLU A 132 10.556 -17.611 -7.237 1.00 52.21 H new ATOM 0 HG2 GLU A 132 8.060 -17.662 -7.726 1.00 35.21 H new ATOM 0 HG3 GLU A 132 8.317 -16.427 -8.943 1.00 35.21 H new ATOM 2053 N GLU A 133 9.387 -17.304 -4.614 1.00 4.14 N ATOM 2054 CA GLU A 133 8.688 -18.032 -3.525 1.00 71.54 C ATOM 2055 C GLU A 133 7.936 -17.054 -2.578 1.00 45.14 C ATOM 2056 O GLU A 133 6.846 -17.368 -2.088 1.00 14.14 O ATOM 2057 CB GLU A 133 9.709 -18.892 -2.727 1.00 75.33 C ATOM 2058 CG GLU A 133 10.727 -18.072 -1.900 1.00 53.35 C ATOM 2059 CD GLU A 133 11.860 -18.906 -1.287 1.00 1.21 C ATOM 2060 OE1 GLU A 133 11.598 -19.674 -0.340 1.00 74.32 O ATOM 2061 OE2 GLU A 133 13.023 -18.782 -1.748 1.00 24.02 O ATOM 0 H GLU A 133 10.387 -17.501 -4.657 1.00 4.14 H new ATOM 0 HA GLU A 133 7.943 -18.688 -3.975 1.00 71.54 H new ATOM 0 HB2 GLU A 133 9.162 -19.553 -2.055 1.00 75.33 H new ATOM 0 HB3 GLU A 133 10.254 -19.527 -3.425 1.00 75.33 H new ATOM 0 HG2 GLU A 133 11.162 -17.304 -2.539 1.00 53.35 H new ATOM 0 HG3 GLU A 133 10.196 -17.557 -1.099 1.00 53.35 H new ATOM 2068 N GLN A 134 8.542 -15.859 -2.355 1.00 4.45 N ATOM 2069 CA GLN A 134 7.933 -14.780 -1.560 1.00 4.10 C ATOM 2070 C GLN A 134 6.693 -14.218 -2.277 1.00 23.24 C ATOM 2071 O GLN A 134 5.621 -14.149 -1.696 1.00 4.44 O ATOM 2072 CB GLN A 134 8.950 -13.629 -1.314 1.00 4.40 C ATOM 2073 CG GLN A 134 8.407 -12.483 -0.422 1.00 12.55 C ATOM 2074 CD GLN A 134 9.304 -11.245 -0.367 1.00 75.42 C ATOM 2075 OE1 GLN A 134 10.517 -11.327 -0.512 1.00 44.01 O ATOM 2076 NE2 GLN A 134 8.707 -10.088 -0.146 1.00 45.43 N ATOM 0 H GLN A 134 9.464 -15.625 -2.724 1.00 4.45 H new ATOM 0 HA GLN A 134 7.637 -15.202 -0.600 1.00 4.10 H new ATOM 0 HB2 GLN A 134 9.845 -14.043 -0.850 1.00 4.40 H new ATOM 0 HB3 GLN A 134 9.252 -13.214 -2.276 1.00 4.40 H new ATOM 0 HG2 GLN A 134 7.424 -12.188 -0.789 1.00 12.55 H new ATOM 0 HG3 GLN A 134 8.269 -12.862 0.591 1.00 12.55 H new ATOM 0 HE21 GLN A 134 7.694 -10.051 -0.029 1.00 45.43 H new ATOM 0 HE22 GLN A 134 9.258 -9.232 -0.092 1.00 45.43 H new ATOM 2085 N MET A 135 6.860 -13.865 -3.568 1.00 72.11 N ATOM 2086 CA MET A 135 5.816 -13.176 -4.371 1.00 43.41 C ATOM 2087 C MET A 135 4.570 -14.082 -4.599 1.00 74.31 C ATOM 2088 O MET A 135 3.442 -13.595 -4.729 1.00 4.00 O ATOM 2089 CB MET A 135 6.457 -12.649 -5.704 1.00 2.52 C ATOM 2090 CG MET A 135 6.298 -13.508 -6.976 1.00 65.40 C ATOM 2091 SD MET A 135 4.727 -13.216 -7.819 1.00 14.20 S ATOM 2092 CE MET A 135 4.813 -11.450 -8.181 1.00 3.52 C ATOM 0 H MET A 135 7.719 -14.047 -4.087 1.00 72.11 H new ATOM 0 HA MET A 135 5.439 -12.315 -3.819 1.00 43.41 H new ATOM 0 HB2 MET A 135 6.035 -11.666 -5.911 1.00 2.52 H new ATOM 0 HB3 MET A 135 7.523 -12.508 -5.528 1.00 2.52 H new ATOM 0 HG2 MET A 135 7.119 -13.293 -7.660 1.00 65.40 H new ATOM 0 HG3 MET A 135 6.373 -14.562 -6.710 1.00 65.40 H new ATOM 0 HE1 MET A 135 4.475 -11.271 -9.202 1.00 3.52 H new ATOM 0 HE2 MET A 135 4.174 -10.905 -7.486 1.00 3.52 H new ATOM 0 HE3 MET A 135 5.842 -11.106 -8.074 1.00 3.52 H new ATOM 2102 N GLN A 136 4.806 -15.406 -4.626 1.00 3.20 N ATOM 2103 CA GLN A 136 3.734 -16.425 -4.658 1.00 32.21 C ATOM 2104 C GLN A 136 3.034 -16.536 -3.280 1.00 15.22 C ATOM 2105 O GLN A 136 1.812 -16.653 -3.201 1.00 44.02 O ATOM 2106 CB GLN A 136 4.329 -17.799 -5.074 1.00 13.12 C ATOM 2107 CG GLN A 136 5.017 -17.826 -6.461 1.00 71.25 C ATOM 2108 CD GLN A 136 4.073 -17.527 -7.625 1.00 43.22 C ATOM 2109 OE1 GLN A 136 3.471 -18.426 -8.200 1.00 14.32 O ATOM 2110 NE2 GLN A 136 3.931 -16.262 -7.974 1.00 54.10 N ATOM 0 H GLN A 136 5.746 -15.803 -4.626 1.00 3.20 H new ATOM 0 HA GLN A 136 2.987 -16.121 -5.391 1.00 32.21 H new ATOM 0 HB2 GLN A 136 5.054 -18.106 -4.320 1.00 13.12 H new ATOM 0 HB3 GLN A 136 3.530 -18.540 -5.068 1.00 13.12 H new ATOM 0 HG2 GLN A 136 5.828 -17.098 -6.468 1.00 71.25 H new ATOM 0 HG3 GLN A 136 5.467 -18.807 -6.614 1.00 71.25 H new ATOM 0 HE21 GLN A 136 4.445 -15.535 -7.477 1.00 54.10 H new ATOM 0 HE22 GLN A 136 3.307 -16.012 -8.741 1.00 54.10 H new ATOM 2119 N LYS A 137 3.839 -16.483 -2.199 1.00 23.45 N ATOM 2120 CA LYS A 137 3.350 -16.599 -0.804 1.00 31.10 C ATOM 2121 C LYS A 137 2.504 -15.362 -0.386 1.00 72.34 C ATOM 2122 O LYS A 137 1.591 -15.477 0.432 1.00 40.55 O ATOM 2123 CB LYS A 137 4.557 -16.833 0.154 1.00 53.21 C ATOM 2124 CG LYS A 137 4.198 -17.271 1.597 1.00 33.30 C ATOM 2125 CD LYS A 137 3.244 -18.495 1.632 1.00 50.34 C ATOM 2126 CE LYS A 137 3.047 -19.068 3.048 1.00 33.50 C ATOM 2127 NZ LYS A 137 4.253 -19.791 3.530 1.00 70.04 N ATOM 0 H LYS A 137 4.849 -16.358 -2.266 1.00 23.45 H new ATOM 0 HA LYS A 137 2.684 -17.459 -0.736 1.00 31.10 H new ATOM 0 HB2 LYS A 137 5.204 -17.592 -0.286 1.00 53.21 H new ATOM 0 HB3 LYS A 137 5.138 -15.912 0.208 1.00 53.21 H new ATOM 0 HG2 LYS A 137 5.113 -17.513 2.137 1.00 33.30 H new ATOM 0 HG3 LYS A 137 3.731 -16.436 2.120 1.00 33.30 H new ATOM 0 HD2 LYS A 137 2.275 -18.204 1.226 1.00 50.34 H new ATOM 0 HD3 LYS A 137 3.640 -19.276 0.983 1.00 50.34 H new ATOM 0 HE2 LYS A 137 2.811 -18.257 3.737 1.00 33.50 H new ATOM 0 HE3 LYS A 137 2.194 -19.746 3.049 1.00 33.50 H new ATOM 0 HZ1 LYS A 137 4.096 -20.116 4.505 1.00 70.04 H new ATOM 0 HZ2 LYS A 137 4.435 -20.611 2.916 1.00 70.04 H new ATOM 0 HZ3 LYS A 137 5.073 -19.152 3.506 1.00 70.04 H new ATOM 2141 N MET A 138 2.813 -14.192 -0.975 1.00 44.12 N ATOM 2142 CA MET A 138 2.012 -12.950 -0.802 1.00 53.52 C ATOM 2143 C MET A 138 0.581 -13.144 -1.363 1.00 1.02 C ATOM 2144 O MET A 138 -0.413 -12.735 -0.747 1.00 51.12 O ATOM 2145 CB MET A 138 2.717 -11.768 -1.526 1.00 22.42 C ATOM 2146 CG MET A 138 4.183 -11.496 -1.099 1.00 31.32 C ATOM 2147 SD MET A 138 4.386 -10.360 0.302 1.00 51.03 S ATOM 2148 CE MET A 138 3.787 -11.306 1.696 1.00 3.22 C ATOM 0 H MET A 138 3.622 -14.073 -1.585 1.00 44.12 H new ATOM 0 HA MET A 138 1.935 -12.725 0.262 1.00 53.52 H new ATOM 0 HB2 MET A 138 2.700 -11.961 -2.599 1.00 22.42 H new ATOM 0 HB3 MET A 138 2.134 -10.863 -1.356 1.00 22.42 H new ATOM 0 HG2 MET A 138 4.652 -12.447 -0.845 1.00 31.32 H new ATOM 0 HG3 MET A 138 4.724 -11.092 -1.955 1.00 31.32 H new ATOM 0 HE1 MET A 138 4.149 -10.858 2.622 1.00 3.22 H new ATOM 0 HE2 MET A 138 2.697 -11.306 1.694 1.00 3.22 H new ATOM 0 HE3 MET A 138 4.150 -12.331 1.623 1.00 3.22 H new ATOM 2158 N ALA A 139 0.509 -13.782 -2.545 1.00 34.51 N ATOM 2159 CA ALA A 139 -0.761 -14.193 -3.175 1.00 4.35 C ATOM 2160 C ALA A 139 -1.521 -15.230 -2.310 1.00 74.02 C ATOM 2161 O ALA A 139 -2.751 -15.181 -2.212 1.00 25.44 O ATOM 2162 CB ALA A 139 -0.488 -14.759 -4.574 1.00 32.13 C ATOM 0 H ALA A 139 1.333 -14.029 -3.093 1.00 34.51 H new ATOM 0 HA ALA A 139 -1.397 -13.312 -3.259 1.00 4.35 H new ATOM 0 HB1 ALA A 139 -1.429 -15.061 -5.034 1.00 32.13 H new ATOM 0 HB2 ALA A 139 -0.012 -13.995 -5.189 1.00 32.13 H new ATOM 0 HB3 ALA A 139 0.171 -15.624 -4.494 1.00 32.13 H new ATOM 2168 N GLU A 140 -0.768 -16.161 -1.689 1.00 3.11 N ATOM 2169 CA GLU A 140 -1.328 -17.185 -0.773 1.00 0.33 C ATOM 2170 C GLU A 140 -1.971 -16.558 0.487 1.00 13.24 C ATOM 2171 O GLU A 140 -2.974 -17.068 0.993 1.00 20.14 O ATOM 2172 CB GLU A 140 -0.230 -18.207 -0.364 1.00 34.20 C ATOM 2173 CG GLU A 140 0.314 -19.071 -1.523 1.00 25.22 C ATOM 2174 CD GLU A 140 -0.747 -20.008 -2.126 1.00 11.24 C ATOM 2175 OE1 GLU A 140 -0.920 -21.136 -1.614 1.00 1.20 O ATOM 2176 OE2 GLU A 140 -1.423 -19.616 -3.106 1.00 15.04 O ATOM 0 H GLU A 140 0.243 -16.227 -1.806 1.00 3.11 H new ATOM 0 HA GLU A 140 -2.118 -17.703 -1.317 1.00 0.33 H new ATOM 0 HB2 GLU A 140 0.601 -17.665 0.088 1.00 34.20 H new ATOM 0 HB3 GLU A 140 -0.635 -18.867 0.403 1.00 34.20 H new ATOM 0 HG2 GLU A 140 0.700 -18.418 -2.305 1.00 25.22 H new ATOM 0 HG3 GLU A 140 1.153 -19.666 -1.162 1.00 25.22 H new ATOM 2183 N MET A 141 -1.382 -15.452 0.980 1.00 70.31 N ATOM 2184 CA MET A 141 -1.923 -14.687 2.134 1.00 34.12 C ATOM 2185 C MET A 141 -3.114 -13.779 1.727 1.00 53.25 C ATOM 2186 O MET A 141 -3.818 -13.247 2.594 1.00 11.25 O ATOM 2187 CB MET A 141 -0.797 -13.826 2.764 1.00 34.11 C ATOM 2188 CG MET A 141 0.385 -14.638 3.312 1.00 22.13 C ATOM 2189 SD MET A 141 -0.076 -15.782 4.634 1.00 61.13 S ATOM 2190 CE MET A 141 -0.636 -14.663 5.920 1.00 22.04 C ATOM 0 H MET A 141 -0.522 -15.060 0.596 1.00 70.31 H new ATOM 0 HA MET A 141 -2.294 -15.408 2.863 1.00 34.12 H new ATOM 0 HB2 MET A 141 -0.426 -13.127 2.014 1.00 34.11 H new ATOM 0 HB3 MET A 141 -1.220 -13.230 3.573 1.00 34.11 H new ATOM 0 HG2 MET A 141 0.837 -15.202 2.496 1.00 22.13 H new ATOM 0 HG3 MET A 141 1.145 -13.952 3.685 1.00 22.13 H new ATOM 0 HE1 MET A 141 -0.729 -15.207 6.860 1.00 22.04 H new ATOM 0 HE2 MET A 141 0.085 -13.854 6.038 1.00 22.04 H new ATOM 0 HE3 MET A 141 -1.605 -14.247 5.644 1.00 22.04 H new ATOM 2200 N GLY A 142 -3.319 -13.604 0.405 1.00 74.34 N ATOM 2201 CA GLY A 142 -4.353 -12.696 -0.116 1.00 31.32 C ATOM 2202 C GLY A 142 -3.981 -11.213 0.021 1.00 35.33 C ATOM 2203 O GLY A 142 -4.853 -10.346 -0.024 1.00 2.33 O ATOM 0 H GLY A 142 -2.780 -14.081 -0.318 1.00 74.34 H new ATOM 0 HA2 GLY A 142 -4.531 -12.924 -1.167 1.00 31.32 H new ATOM 0 HA3 GLY A 142 -5.288 -12.880 0.413 1.00 31.32 H new ATOM 2207 N MET A 143 -2.665 -10.936 0.171 1.00 51.35 N ATOM 2208 CA MET A 143 -2.111 -9.567 0.323 1.00 3.44 C ATOM 2209 C MET A 143 -2.387 -8.702 -0.930 1.00 41.15 C ATOM 2210 O MET A 143 -2.818 -7.554 -0.824 1.00 23.22 O ATOM 2211 CB MET A 143 -0.578 -9.658 0.571 1.00 73.20 C ATOM 2212 CG MET A 143 0.166 -8.312 0.666 1.00 64.24 C ATOM 2213 SD MET A 143 1.955 -8.543 0.762 1.00 31.15 S ATOM 2214 CE MET A 143 2.565 -6.857 0.870 1.00 21.41 C ATOM 0 H MET A 143 -1.949 -11.663 0.190 1.00 51.35 H new ATOM 0 HA MET A 143 -2.601 -9.091 1.173 1.00 3.44 H new ATOM 0 HB2 MET A 143 -0.411 -10.210 1.496 1.00 73.20 H new ATOM 0 HB3 MET A 143 -0.133 -10.242 -0.234 1.00 73.20 H new ATOM 0 HG2 MET A 143 -0.076 -7.700 -0.203 1.00 64.24 H new ATOM 0 HG3 MET A 143 -0.178 -7.767 1.545 1.00 64.24 H new ATOM 0 HE1 MET A 143 3.632 -6.870 1.094 1.00 21.41 H new ATOM 0 HE2 MET A 143 2.399 -6.349 -0.080 1.00 21.41 H new ATOM 0 HE3 MET A 143 2.034 -6.328 1.662 1.00 21.41 H new ATOM 2224 N GLU A 144 -2.144 -9.299 -2.104 1.00 1.14 N ATOM 2225 CA GLU A 144 -2.226 -8.619 -3.413 1.00 23.44 C ATOM 2226 C GLU A 144 -3.651 -8.073 -3.721 1.00 1.12 C ATOM 2227 O GLU A 144 -3.840 -6.866 -3.921 1.00 11.55 O ATOM 2228 CB GLU A 144 -1.764 -9.604 -4.513 1.00 71.05 C ATOM 2229 CG GLU A 144 -0.319 -10.122 -4.334 1.00 54.04 C ATOM 2230 CD GLU A 144 0.161 -11.006 -5.496 1.00 22.01 C ATOM 2231 OE1 GLU A 144 -0.654 -11.800 -6.027 1.00 51.13 O ATOM 2232 OE2 GLU A 144 1.358 -10.936 -5.861 1.00 43.31 O ATOM 0 H GLU A 144 -1.881 -10.282 -2.177 1.00 1.14 H new ATOM 0 HA GLU A 144 -1.571 -7.748 -3.386 1.00 23.44 H new ATOM 0 HB2 GLU A 144 -2.444 -10.456 -4.531 1.00 71.05 H new ATOM 0 HB3 GLU A 144 -1.844 -9.112 -5.482 1.00 71.05 H new ATOM 0 HG2 GLU A 144 0.354 -9.271 -4.233 1.00 54.04 H new ATOM 0 HG3 GLU A 144 -0.257 -10.690 -3.406 1.00 54.04 H new ATOM 2239 N GLU A 145 -4.646 -8.977 -3.747 1.00 51.24 N ATOM 2240 CA GLU A 145 -6.070 -8.612 -3.965 1.00 53.50 C ATOM 2241 C GLU A 145 -6.704 -7.972 -2.698 1.00 74.53 C ATOM 2242 O GLU A 145 -7.749 -7.312 -2.788 1.00 21.14 O ATOM 2243 CB GLU A 145 -6.873 -9.861 -4.411 1.00 33.20 C ATOM 2244 CG GLU A 145 -6.893 -11.024 -3.394 1.00 14.42 C ATOM 2245 CD GLU A 145 -7.805 -12.178 -3.833 1.00 34.42 C ATOM 2246 OE1 GLU A 145 -9.038 -11.980 -3.865 1.00 32.20 O ATOM 2247 OE2 GLU A 145 -7.304 -13.269 -4.174 1.00 24.13 O ATOM 0 H GLU A 145 -4.494 -9.978 -3.619 1.00 51.24 H new ATOM 0 HA GLU A 145 -6.108 -7.862 -4.755 1.00 53.50 H new ATOM 0 HB2 GLU A 145 -7.900 -9.560 -4.615 1.00 33.20 H new ATOM 0 HB3 GLU A 145 -6.456 -10.226 -5.349 1.00 33.20 H new ATOM 0 HG2 GLU A 145 -5.879 -11.399 -3.257 1.00 14.42 H new ATOM 0 HG3 GLU A 145 -7.227 -10.650 -2.426 1.00 14.42 H new ATOM 2254 N GLY A 146 -6.070 -8.194 -1.525 1.00 5.41 N ATOM 2255 CA GLY A 146 -6.466 -7.530 -0.268 1.00 33.02 C ATOM 2256 C GLY A 146 -6.222 -6.018 -0.294 1.00 23.22 C ATOM 2257 O GLY A 146 -7.038 -5.237 0.222 1.00 44.10 O ATOM 0 H GLY A 146 -5.279 -8.831 -1.425 1.00 5.41 H new ATOM 0 HA2 GLY A 146 -7.523 -7.720 -0.079 1.00 33.02 H new ATOM 0 HA3 GLY A 146 -5.910 -7.969 0.560 1.00 33.02 H new ATOM 2261 N MET A 147 -5.079 -5.616 -0.907 1.00 10.12 N ATOM 2262 CA MET A 147 -4.784 -4.201 -1.218 1.00 0.35 C ATOM 2263 C MET A 147 -5.867 -3.622 -2.148 1.00 23.13 C ATOM 2264 O MET A 147 -6.400 -2.561 -1.876 1.00 54.41 O ATOM 2265 CB MET A 147 -3.393 -4.041 -1.892 1.00 43.43 C ATOM 2266 CG MET A 147 -2.190 -4.270 -0.974 1.00 74.24 C ATOM 2267 SD MET A 147 -0.607 -4.046 -1.823 1.00 51.45 S ATOM 2268 CE MET A 147 -0.669 -2.313 -2.279 1.00 73.33 C ATOM 0 H MET A 147 -4.344 -6.261 -1.196 1.00 10.12 H new ATOM 0 HA MET A 147 -4.776 -3.655 -0.274 1.00 0.35 H new ATOM 0 HB2 MET A 147 -3.330 -4.739 -2.727 1.00 43.43 H new ATOM 0 HB3 MET A 147 -3.324 -3.037 -2.310 1.00 43.43 H new ATOM 0 HG2 MET A 147 -2.246 -3.581 -0.131 1.00 74.24 H new ATOM 0 HG3 MET A 147 -2.238 -5.279 -0.565 1.00 74.24 H new ATOM 0 HE1 MET A 147 -0.513 -2.214 -3.353 1.00 73.33 H new ATOM 0 HE2 MET A 147 -1.643 -1.902 -2.014 1.00 73.33 H new ATOM 0 HE3 MET A 147 0.112 -1.769 -1.747 1.00 73.33 H new ATOM 2278 N ARG A 148 -6.200 -4.370 -3.221 1.00 41.33 N ATOM 2279 CA ARG A 148 -7.173 -3.935 -4.256 1.00 64.43 C ATOM 2280 C ARG A 148 -8.540 -3.514 -3.652 1.00 62.51 C ATOM 2281 O ARG A 148 -9.075 -2.462 -4.007 1.00 64.15 O ATOM 2282 CB ARG A 148 -7.348 -5.071 -5.297 1.00 63.10 C ATOM 2283 CG ARG A 148 -8.421 -4.806 -6.372 1.00 2.31 C ATOM 2284 CD ARG A 148 -8.424 -5.872 -7.474 1.00 34.24 C ATOM 2285 NE ARG A 148 -9.501 -5.642 -8.453 1.00 23.21 N ATOM 2286 CZ ARG A 148 -9.636 -6.275 -9.598 1.00 71.52 C ATOM 2287 NH1 ARG A 148 -8.782 -7.173 -9.974 1.00 32.22 N ATOM 2288 NH2 ARG A 148 -10.643 -6.009 -10.363 1.00 44.44 N ATOM 0 H ARG A 148 -5.804 -5.293 -3.398 1.00 41.33 H new ATOM 0 HA ARG A 148 -6.774 -3.046 -4.744 1.00 64.43 H new ATOM 0 HB2 ARG A 148 -6.392 -5.240 -5.793 1.00 63.10 H new ATOM 0 HB3 ARG A 148 -7.602 -5.991 -4.770 1.00 63.10 H new ATOM 0 HG2 ARG A 148 -9.403 -4.773 -5.900 1.00 2.31 H new ATOM 0 HG3 ARG A 148 -8.249 -3.827 -6.819 1.00 2.31 H new ATOM 0 HD2 ARG A 148 -7.461 -5.870 -7.985 1.00 34.24 H new ATOM 0 HD3 ARG A 148 -8.544 -6.858 -7.026 1.00 34.24 H new ATOM 0 HE ARG A 148 -10.199 -4.934 -8.224 1.00 23.21 H new ATOM 0 HH11 ARG A 148 -7.986 -7.401 -9.378 1.00 32.22 H new ATOM 0 HH12 ARG A 148 -8.905 -7.652 -10.866 1.00 32.22 H new ATOM 0 HH21 ARG A 148 -11.329 -5.310 -10.078 1.00 44.44 H new ATOM 0 HH22 ARG A 148 -10.751 -6.498 -11.252 1.00 44.44 H new ATOM 2302 N GLU A 149 -9.067 -4.337 -2.724 1.00 31.25 N ATOM 2303 CA GLU A 149 -10.313 -4.028 -1.972 1.00 10.22 C ATOM 2304 C GLU A 149 -10.196 -2.701 -1.198 1.00 21.14 C ATOM 2305 O GLU A 149 -11.074 -1.837 -1.270 1.00 52.02 O ATOM 2306 CB GLU A 149 -10.627 -5.177 -0.982 1.00 64.42 C ATOM 2307 CG GLU A 149 -10.930 -6.532 -1.643 1.00 33.55 C ATOM 2308 CD GLU A 149 -12.227 -6.519 -2.474 1.00 43.45 C ATOM 2309 OE1 GLU A 149 -13.313 -6.775 -1.908 1.00 24.44 O ATOM 2310 OE2 GLU A 149 -12.171 -6.241 -3.689 1.00 64.22 O ATOM 0 H GLU A 149 -8.648 -5.232 -2.471 1.00 31.25 H new ATOM 0 HA GLU A 149 -11.122 -3.928 -2.696 1.00 10.22 H new ATOM 0 HB2 GLU A 149 -9.779 -5.299 -0.308 1.00 64.42 H new ATOM 0 HB3 GLU A 149 -11.482 -4.888 -0.370 1.00 64.42 H new ATOM 0 HG2 GLU A 149 -10.095 -6.811 -2.286 1.00 33.55 H new ATOM 0 HG3 GLU A 149 -11.007 -7.298 -0.871 1.00 33.55 H new ATOM 2317 N ALA A 150 -9.077 -2.562 -0.477 1.00 34.53 N ATOM 2318 CA ALA A 150 -8.758 -1.369 0.324 1.00 64.15 C ATOM 2319 C ALA A 150 -8.549 -0.107 -0.554 1.00 62.05 C ATOM 2320 O ALA A 150 -8.864 1.011 -0.147 1.00 14.34 O ATOM 2321 CB ALA A 150 -7.517 -1.667 1.161 1.00 3.20 C ATOM 0 H ALA A 150 -8.357 -3.283 -0.431 1.00 34.53 H new ATOM 0 HA ALA A 150 -9.604 -1.146 0.974 1.00 64.15 H new ATOM 0 HB1 ALA A 150 -7.265 -0.793 1.762 1.00 3.20 H new ATOM 0 HB2 ALA A 150 -7.716 -2.514 1.818 1.00 3.20 H new ATOM 0 HB3 ALA A 150 -6.683 -1.907 0.502 1.00 3.20 H new ATOM 2327 N ILE A 151 -8.041 -0.314 -1.771 1.00 23.44 N ATOM 2328 CA ILE A 151 -7.761 0.767 -2.739 1.00 33.02 C ATOM 2329 C ILE A 151 -9.062 1.248 -3.441 1.00 61.53 C ATOM 2330 O ILE A 151 -9.134 2.374 -3.927 1.00 13.24 O ATOM 2331 CB ILE A 151 -6.647 0.275 -3.748 1.00 45.52 C ATOM 2332 CG1 ILE A 151 -5.285 0.108 -2.983 1.00 45.34 C ATOM 2333 CG2 ILE A 151 -6.483 1.206 -4.972 1.00 15.22 C ATOM 2334 CD1 ILE A 151 -4.200 -0.633 -3.740 1.00 32.00 C ATOM 0 H ILE A 151 -7.808 -1.243 -2.122 1.00 23.44 H new ATOM 0 HA ILE A 151 -7.376 1.644 -2.219 1.00 33.02 H new ATOM 0 HB ILE A 151 -6.968 -0.688 -4.146 1.00 45.52 H new ATOM 0 HG12 ILE A 151 -4.911 1.098 -2.722 1.00 45.34 H new ATOM 0 HG13 ILE A 151 -5.475 -0.418 -2.047 1.00 45.34 H new ATOM 0 HG21 ILE A 151 -5.704 0.814 -5.626 1.00 15.22 H new ATOM 0 HG22 ILE A 151 -7.424 1.257 -5.519 1.00 15.22 H new ATOM 0 HG23 ILE A 151 -6.205 2.205 -4.635 1.00 15.22 H new ATOM 0 HD11 ILE A 151 -3.303 -0.693 -3.124 1.00 32.00 H new ATOM 0 HD12 ILE A 151 -4.545 -1.639 -3.978 1.00 32.00 H new ATOM 0 HD13 ILE A 151 -3.971 -0.100 -4.663 1.00 32.00 H new ATOM 2346 N GLU A 152 -10.105 0.402 -3.439 1.00 74.43 N ATOM 2347 CA GLU A 152 -11.460 0.799 -3.905 1.00 53.13 C ATOM 2348 C GLU A 152 -12.282 1.462 -2.769 1.00 34.33 C ATOM 2349 O GLU A 152 -13.334 2.057 -3.019 1.00 72.32 O ATOM 2350 CB GLU A 152 -12.195 -0.406 -4.545 1.00 14.34 C ATOM 2351 CG GLU A 152 -11.413 -1.009 -5.731 1.00 54.33 C ATOM 2352 CD GLU A 152 -12.173 -2.039 -6.580 1.00 52.53 C ATOM 2353 OE1 GLU A 152 -12.849 -2.923 -6.011 1.00 4.12 O ATOM 2354 OE2 GLU A 152 -12.067 -1.982 -7.830 1.00 4.02 O ATOM 0 H GLU A 152 -10.044 -0.565 -3.121 1.00 74.43 H new ATOM 0 HA GLU A 152 -11.346 1.556 -4.681 1.00 53.13 H new ATOM 0 HB2 GLU A 152 -12.353 -1.175 -3.789 1.00 14.34 H new ATOM 0 HB3 GLU A 152 -13.180 -0.088 -4.887 1.00 14.34 H new ATOM 0 HG2 GLU A 152 -11.093 -0.195 -6.382 1.00 54.33 H new ATOM 0 HG3 GLU A 152 -10.510 -1.481 -5.344 1.00 54.33 H new ATOM 2361 N GLN A 153 -11.786 1.348 -1.514 1.00 52.05 N ATOM 2362 CA GLN A 153 -12.313 2.129 -0.363 1.00 63.05 C ATOM 2363 C GLN A 153 -11.935 3.630 -0.509 1.00 33.02 C ATOM 2364 O GLN A 153 -12.635 4.502 0.009 1.00 42.20 O ATOM 2365 CB GLN A 153 -11.730 1.598 0.971 1.00 71.12 C ATOM 2366 CG GLN A 153 -11.963 0.104 1.265 1.00 32.24 C ATOM 2367 CD GLN A 153 -13.372 -0.225 1.731 1.00 71.45 C ATOM 2368 OE1 GLN A 153 -14.257 -0.541 0.943 1.00 11.20 O ATOM 2369 NE2 GLN A 153 -13.588 -0.134 3.022 1.00 10.45 N ATOM 0 H GLN A 153 -11.019 0.721 -1.270 1.00 52.05 H new ATOM 0 HA GLN A 153 -13.398 2.020 -0.355 1.00 63.05 H new ATOM 0 HB2 GLN A 153 -10.656 1.785 0.975 1.00 71.12 H new ATOM 0 HB3 GLN A 153 -12.158 2.179 1.788 1.00 71.12 H new ATOM 0 HG2 GLN A 153 -11.746 -0.470 0.364 1.00 32.24 H new ATOM 0 HG3 GLN A 153 -11.255 -0.220 2.028 1.00 32.24 H new ATOM 0 HE21 GLN A 153 -12.828 0.132 3.649 1.00 10.45 H new ATOM 0 HE22 GLN A 153 -14.516 -0.329 3.399 1.00 10.45 H new ATOM 2378 N ILE A 154 -10.804 3.899 -1.210 1.00 33.40 N ATOM 2379 CA ILE A 154 -10.297 5.274 -1.472 1.00 73.30 C ATOM 2380 C ILE A 154 -11.338 6.134 -2.226 1.00 23.21 C ATOM 2381 O ILE A 154 -11.431 7.347 -2.000 1.00 64.15 O ATOM 2382 CB ILE A 154 -8.956 5.245 -2.287 1.00 72.12 C ATOM 2383 CG1 ILE A 154 -7.874 4.427 -1.532 1.00 64.34 C ATOM 2384 CG2 ILE A 154 -8.436 6.675 -2.600 1.00 3.31 C ATOM 2385 CD1 ILE A 154 -6.559 4.277 -2.275 1.00 10.23 C ATOM 0 H ILE A 154 -10.216 3.168 -1.611 1.00 33.40 H new ATOM 0 HA ILE A 154 -10.110 5.726 -0.498 1.00 73.30 H new ATOM 0 HB ILE A 154 -9.166 4.757 -3.239 1.00 72.12 H new ATOM 0 HG12 ILE A 154 -7.681 4.905 -0.572 1.00 64.34 H new ATOM 0 HG13 ILE A 154 -8.271 3.434 -1.319 1.00 64.34 H new ATOM 0 HG21 ILE A 154 -7.506 6.608 -3.165 1.00 3.31 H new ATOM 0 HG22 ILE A 154 -9.180 7.212 -3.188 1.00 3.31 H new ATOM 0 HG23 ILE A 154 -8.256 7.209 -1.667 1.00 3.31 H new ATOM 0 HD11 ILE A 154 -5.865 3.692 -1.672 1.00 10.23 H new ATOM 0 HD12 ILE A 154 -6.733 3.769 -3.223 1.00 10.23 H new ATOM 0 HD13 ILE A 154 -6.133 5.263 -2.464 1.00 10.23 H new ATOM 2397 N ASP A 155 -12.117 5.484 -3.118 1.00 32.32 N ATOM 2398 CA ASP A 155 -13.256 6.115 -3.822 1.00 32.40 C ATOM 2399 C ASP A 155 -14.208 6.797 -2.826 1.00 22.23 C ATOM 2400 O ASP A 155 -14.554 7.963 -3.003 1.00 13.23 O ATOM 2401 CB ASP A 155 -14.024 5.056 -4.651 1.00 43.44 C ATOM 2402 CG ASP A 155 -13.197 4.526 -5.827 1.00 72.32 C ATOM 2403 OD1 ASP A 155 -12.256 3.727 -5.600 1.00 23.11 O ATOM 2404 OD2 ASP A 155 -13.464 4.924 -6.986 1.00 60.14 O ATOM 0 H ASP A 155 -11.974 4.506 -3.371 1.00 32.32 H new ATOM 0 HA ASP A 155 -12.861 6.877 -4.494 1.00 32.40 H new ATOM 0 HB2 ASP A 155 -14.305 4.225 -4.004 1.00 43.44 H new ATOM 0 HB3 ASP A 155 -14.949 5.493 -5.028 1.00 43.44 H new ATOM 2409 N ALA A 156 -14.593 6.058 -1.765 1.00 35.32 N ATOM 2410 CA ALA A 156 -15.400 6.610 -0.658 1.00 42.43 C ATOM 2411 C ALA A 156 -14.649 7.769 0.046 1.00 33.53 C ATOM 2412 O ALA A 156 -15.179 8.864 0.160 1.00 35.30 O ATOM 2413 CB ALA A 156 -15.768 5.506 0.351 1.00 21.13 C ATOM 0 H ALA A 156 -14.356 5.072 -1.652 1.00 35.32 H new ATOM 0 HA ALA A 156 -16.323 7.010 -1.077 1.00 42.43 H new ATOM 0 HB1 ALA A 156 -16.362 5.934 1.158 1.00 21.13 H new ATOM 0 HB2 ALA A 156 -16.345 4.731 -0.153 1.00 21.13 H new ATOM 0 HB3 ALA A 156 -14.857 5.071 0.762 1.00 21.13 H new ATOM 2419 N VAL A 157 -13.373 7.523 0.411 1.00 74.43 N ATOM 2420 CA VAL A 157 -12.543 8.462 1.223 1.00 20.10 C ATOM 2421 C VAL A 157 -12.484 9.889 0.608 1.00 22.22 C ATOM 2422 O VAL A 157 -12.633 10.896 1.315 1.00 31.30 O ATOM 2423 CB VAL A 157 -11.080 7.890 1.411 1.00 52.23 C ATOM 2424 CG1 VAL A 157 -10.163 8.876 2.185 1.00 64.42 C ATOM 2425 CG2 VAL A 157 -11.107 6.506 2.109 1.00 52.03 C ATOM 0 H VAL A 157 -12.880 6.667 0.154 1.00 74.43 H new ATOM 0 HA VAL A 157 -13.026 8.548 2.196 1.00 20.10 H new ATOM 0 HB VAL A 157 -10.657 7.765 0.414 1.00 52.23 H new ATOM 0 HG11 VAL A 157 -9.169 8.442 2.291 1.00 64.42 H new ATOM 0 HG12 VAL A 157 -10.092 9.815 1.636 1.00 64.42 H new ATOM 0 HG13 VAL A 157 -10.583 9.064 3.173 1.00 64.42 H new ATOM 0 HG21 VAL A 157 -10.088 6.137 2.225 1.00 52.03 H new ATOM 0 HG22 VAL A 157 -11.572 6.602 3.090 1.00 52.03 H new ATOM 0 HG23 VAL A 157 -11.680 5.804 1.503 1.00 52.03 H new ATOM 2435 N LEU A 158 -12.302 9.947 -0.719 1.00 63.53 N ATOM 2436 CA LEU A 158 -12.149 11.219 -1.460 1.00 55.43 C ATOM 2437 C LEU A 158 -13.518 11.815 -1.873 1.00 13.44 C ATOM 2438 O LEU A 158 -13.685 13.039 -1.875 1.00 11.11 O ATOM 2439 CB LEU A 158 -11.243 10.997 -2.697 1.00 55.25 C ATOM 2440 CG LEU A 158 -9.889 10.261 -2.416 1.00 40.51 C ATOM 2441 CD1 LEU A 158 -9.014 10.190 -3.672 1.00 73.21 C ATOM 2442 CD2 LEU A 158 -9.123 10.890 -1.233 1.00 35.30 C ATOM 0 H LEU A 158 -12.256 9.119 -1.313 1.00 63.53 H new ATOM 0 HA LEU A 158 -11.677 11.944 -0.798 1.00 55.43 H new ATOM 0 HB2 LEU A 158 -11.802 10.424 -3.437 1.00 55.25 H new ATOM 0 HB3 LEU A 158 -11.024 11.967 -3.144 1.00 55.25 H new ATOM 0 HG LEU A 158 -10.139 9.239 -2.130 1.00 40.51 H new ATOM 0 HD11 LEU A 158 -8.083 9.673 -3.438 1.00 73.21 H new ATOM 0 HD12 LEU A 158 -9.544 9.647 -4.455 1.00 73.21 H new ATOM 0 HD13 LEU A 158 -8.791 11.199 -4.018 1.00 73.21 H new ATOM 0 HD21 LEU A 158 -8.191 10.348 -1.074 1.00 35.30 H new ATOM 0 HD22 LEU A 158 -8.902 11.934 -1.456 1.00 35.30 H new ATOM 0 HD23 LEU A 158 -9.734 10.833 -0.332 1.00 35.30 H new ATOM 2454 N SER A 159 -14.492 10.940 -2.200 1.00 32.01 N ATOM 2455 CA SER A 159 -15.859 11.357 -2.634 1.00 52.11 C ATOM 2456 C SER A 159 -16.695 11.896 -1.449 1.00 32.53 C ATOM 2457 O SER A 159 -17.652 12.658 -1.644 1.00 2.01 O ATOM 2458 CB SER A 159 -16.601 10.165 -3.289 1.00 3.15 C ATOM 2459 OG SER A 159 -17.886 10.529 -3.773 1.00 43.35 O ATOM 0 H SER A 159 -14.363 9.929 -2.174 1.00 32.01 H new ATOM 0 HA SER A 159 -15.740 12.160 -3.361 1.00 52.11 H new ATOM 0 HB2 SER A 159 -16.002 9.776 -4.112 1.00 3.15 H new ATOM 0 HB3 SER A 159 -16.704 9.360 -2.561 1.00 3.15 H new ATOM 0 HG SER A 159 -18.316 9.748 -4.179 1.00 43.35 H new ATOM 2465 N GLU A 160 -16.336 11.472 -0.229 1.00 22.43 N ATOM 2466 CA GLU A 160 -16.988 11.925 1.012 1.00 43.34 C ATOM 2467 C GLU A 160 -16.481 13.321 1.470 1.00 13.33 C ATOM 2468 O GLU A 160 -15.311 13.669 1.264 1.00 54.24 O ATOM 2469 CB GLU A 160 -16.724 10.922 2.171 1.00 31.53 C ATOM 2470 CG GLU A 160 -17.450 9.572 2.072 1.00 25.42 C ATOM 2471 CD GLU A 160 -17.195 8.692 3.300 1.00 75.23 C ATOM 2472 OE1 GLU A 160 -17.817 8.950 4.356 1.00 73.31 O ATOM 2473 OE2 GLU A 160 -16.342 7.781 3.234 1.00 50.33 O ATOM 0 H GLU A 160 -15.582 10.803 -0.073 1.00 22.43 H new ATOM 0 HA GLU A 160 -18.053 11.986 0.788 1.00 43.34 H new ATOM 0 HB2 GLU A 160 -15.652 10.732 2.224 1.00 31.53 H new ATOM 0 HB3 GLU A 160 -17.010 11.398 3.109 1.00 31.53 H new ATOM 0 HG2 GLU A 160 -18.521 9.743 1.965 1.00 25.42 H new ATOM 0 HG3 GLU A 160 -17.120 9.048 1.175 1.00 25.42 H new ATOM 2480 N PRO A 161 -17.368 14.121 2.142 1.00 73.23 N ATOM 2481 CA PRO A 161 -16.940 15.180 3.096 1.00 50.50 C ATOM 2482 C PRO A 161 -16.674 14.584 4.522 1.00 54.42 C ATOM 2483 O PRO A 161 -16.920 15.242 5.537 1.00 54.32 O ATOM 2484 CB PRO A 161 -18.160 16.136 3.084 1.00 61.14 C ATOM 2485 CG PRO A 161 -19.338 15.224 2.873 1.00 25.30 C ATOM 2486 CD PRO A 161 -18.846 14.114 1.964 1.00 1.35 C ATOM 0 HA PRO A 161 -16.005 15.671 2.827 1.00 50.50 H new ATOM 0 HB2 PRO A 161 -18.245 16.686 4.021 1.00 61.14 H new ATOM 0 HB3 PRO A 161 -18.080 16.875 2.287 1.00 61.14 H new ATOM 0 HG2 PRO A 161 -19.696 14.823 3.821 1.00 25.30 H new ATOM 0 HG3 PRO A 161 -20.171 15.761 2.419 1.00 25.30 H new ATOM 0 HD2 PRO A 161 -19.276 13.152 2.243 1.00 1.35 H new ATOM 0 HD3 PRO A 161 -19.123 14.298 0.926 1.00 1.35 H new ATOM 2494 N ALA A 162 -16.141 13.329 4.545 1.00 73.45 N ATOM 2495 CA ALA A 162 -15.893 12.509 5.762 1.00 33.42 C ATOM 2496 C ALA A 162 -17.193 12.014 6.453 1.00 54.01 C ATOM 2497 O ALA A 162 -17.159 11.616 7.628 1.00 3.41 O ATOM 2498 CB ALA A 162 -14.950 13.243 6.749 1.00 4.51 C ATOM 0 H ALA A 162 -15.864 12.848 3.689 1.00 73.45 H new ATOM 0 HA ALA A 162 -15.387 11.605 5.424 1.00 33.42 H new ATOM 0 HB1 ALA A 162 -14.787 12.620 7.628 1.00 4.51 H new ATOM 0 HB2 ALA A 162 -13.995 13.440 6.262 1.00 4.51 H new ATOM 0 HB3 ALA A 162 -15.404 14.187 7.052 1.00 4.51 H new ATOM 2504 N ASN A 163 -18.327 11.966 5.703 1.00 52.01 N ATOM 2505 CA ASN A 163 -19.634 11.549 6.280 1.00 74.21 C ATOM 2506 C ASN A 163 -20.694 11.112 5.222 1.00 52.04 C ATOM 2507 O ASN A 163 -21.871 10.946 5.569 1.00 51.35 O ATOM 2508 CB ASN A 163 -20.200 12.690 7.175 1.00 41.32 C ATOM 2509 CG ASN A 163 -20.538 13.971 6.402 1.00 31.54 C ATOM 2510 OD1 ASN A 163 -19.716 14.872 6.270 1.00 62.23 O ATOM 2511 ND2 ASN A 163 -21.751 14.055 5.879 1.00 42.15 N ATOM 0 H ASN A 163 -18.363 12.207 4.713 1.00 52.01 H new ATOM 0 HA ASN A 163 -19.434 10.659 6.876 1.00 74.21 H new ATOM 0 HB2 ASN A 163 -21.098 12.333 7.679 1.00 41.32 H new ATOM 0 HB3 ASN A 163 -19.472 12.926 7.951 1.00 41.32 H new ATOM 0 HD21 ASN A 163 -22.022 14.884 5.351 1.00 42.15 H new ATOM 0 HD22 ASN A 163 -22.415 13.291 6.004 1.00 42.15 H new ATOM 2518 N ALA A 164 -20.290 10.889 3.957 1.00 12.05 N ATOM 2519 CA ALA A 164 -21.248 10.542 2.869 1.00 1.34 C ATOM 2520 C ALA A 164 -21.540 9.027 2.847 1.00 34.42 C ATOM 2521 O ALA A 164 -20.797 8.240 2.247 1.00 34.22 O ATOM 2522 CB ALA A 164 -20.746 11.029 1.499 1.00 11.00 C ATOM 0 H ALA A 164 -19.317 10.940 3.656 1.00 12.05 H new ATOM 0 HA ALA A 164 -22.183 11.061 3.079 1.00 1.34 H new ATOM 0 HB1 ALA A 164 -21.469 10.759 0.729 1.00 11.00 H new ATOM 0 HB2 ALA A 164 -20.626 12.112 1.520 1.00 11.00 H new ATOM 0 HB3 ALA A 164 -19.787 10.562 1.276 1.00 11.00 H new ATOM 2528 N LEU A 165 -22.616 8.634 3.543 1.00 3.20 N ATOM 2529 CA LEU A 165 -23.063 7.232 3.626 1.00 73.32 C ATOM 2530 C LEU A 165 -23.957 6.867 2.415 1.00 64.20 C ATOM 2531 O LEU A 165 -25.135 7.244 2.360 1.00 0.34 O ATOM 2532 CB LEU A 165 -23.817 7.001 4.962 1.00 71.10 C ATOM 2533 CG LEU A 165 -22.978 7.204 6.265 1.00 61.14 C ATOM 2534 CD1 LEU A 165 -23.831 6.950 7.531 1.00 15.11 C ATOM 2535 CD2 LEU A 165 -21.703 6.327 6.250 1.00 2.14 C ATOM 0 H LEU A 165 -23.205 9.281 4.067 1.00 3.20 H new ATOM 0 HA LEU A 165 -22.189 6.581 3.600 1.00 73.32 H new ATOM 0 HB2 LEU A 165 -24.672 7.676 4.995 1.00 71.10 H new ATOM 0 HB3 LEU A 165 -24.212 5.985 4.962 1.00 71.10 H new ATOM 0 HG LEU A 165 -22.658 8.246 6.296 1.00 61.14 H new ATOM 0 HD11 LEU A 165 -23.217 7.100 8.419 1.00 15.11 H new ATOM 0 HD12 LEU A 165 -24.671 7.644 7.549 1.00 15.11 H new ATOM 0 HD13 LEU A 165 -24.206 5.927 7.518 1.00 15.11 H new ATOM 0 HD21 LEU A 165 -21.139 6.489 7.169 1.00 2.14 H new ATOM 0 HD22 LEU A 165 -21.985 5.277 6.178 1.00 2.14 H new ATOM 0 HD23 LEU A 165 -21.086 6.597 5.393 1.00 2.14 H new ATOM 2547 N GLU A 166 -23.368 6.151 1.442 1.00 72.34 N ATOM 2548 CA GLU A 166 -24.079 5.654 0.244 1.00 71.11 C ATOM 2549 C GLU A 166 -23.358 4.414 -0.330 1.00 30.23 C ATOM 2550 O GLU A 166 -22.135 4.427 -0.502 1.00 51.44 O ATOM 2551 CB GLU A 166 -24.179 6.760 -0.850 1.00 63.15 C ATOM 2552 CG GLU A 166 -24.853 6.296 -2.162 1.00 53.34 C ATOM 2553 CD GLU A 166 -24.949 7.390 -3.236 1.00 53.24 C ATOM 2554 OE1 GLU A 166 -23.933 7.678 -3.901 1.00 51.13 O ATOM 2555 OE2 GLU A 166 -26.048 7.944 -3.440 1.00 64.20 O ATOM 0 H GLU A 166 -22.380 5.898 1.461 1.00 72.34 H new ATOM 0 HA GLU A 166 -25.089 5.376 0.545 1.00 71.11 H new ATOM 0 HB2 GLU A 166 -24.738 7.604 -0.447 1.00 63.15 H new ATOM 0 HB3 GLU A 166 -23.176 7.121 -1.078 1.00 63.15 H new ATOM 0 HG2 GLU A 166 -24.294 5.452 -2.567 1.00 53.34 H new ATOM 0 HG3 GLU A 166 -25.856 5.935 -1.935 1.00 53.34 H new ATOM 2562 N HIS A 167 -24.123 3.345 -0.623 1.00 34.11 N ATOM 2563 CA HIS A 167 -23.603 2.167 -1.340 1.00 23.34 C ATOM 2564 C HIS A 167 -23.624 2.443 -2.864 1.00 60.21 C ATOM 2565 O HIS A 167 -24.545 2.017 -3.578 1.00 12.00 O ATOM 2566 CB HIS A 167 -24.430 0.899 -0.995 1.00 51.43 C ATOM 2567 CG HIS A 167 -24.544 0.592 0.478 1.00 25.22 C ATOM 2568 ND1 HIS A 167 -23.547 0.846 1.397 1.00 71.42 N ATOM 2569 CD2 HIS A 167 -25.561 0.042 1.187 1.00 33.02 C ATOM 2570 CE1 HIS A 167 -23.942 0.466 2.595 1.00 11.41 C ATOM 2571 NE2 HIS A 167 -25.157 -0.027 2.497 1.00 73.33 N ATOM 0 H HIS A 167 -25.109 3.274 -0.372 1.00 34.11 H new ATOM 0 HA HIS A 167 -22.576 1.983 -1.025 1.00 23.34 H new ATOM 0 HB2 HIS A 167 -25.433 1.015 -1.405 1.00 51.43 H new ATOM 0 HB3 HIS A 167 -23.979 0.042 -1.495 1.00 51.43 H new ATOM 0 HD2 HIS A 167 -26.513 -0.282 0.793 1.00 33.02 H new ATOM 0 HE1 HIS A 167 -23.365 0.546 3.504 1.00 11.41 H new ATOM 0 HE2 HIS A 167 -25.710 -0.400 3.269 1.00 73.33 H new ATOM 2580 N HIS A 168 -22.634 3.217 -3.343 1.00 41.44 N ATOM 2581 CA HIS A 168 -22.565 3.641 -4.755 1.00 41.20 C ATOM 2582 C HIS A 168 -21.974 2.508 -5.631 1.00 51.51 C ATOM 2583 O HIS A 168 -20.784 2.204 -5.551 1.00 32.10 O ATOM 2584 CB HIS A 168 -21.729 4.951 -4.907 1.00 2.00 C ATOM 2585 CG HIS A 168 -21.872 5.622 -6.259 1.00 71.44 C ATOM 2586 ND1 HIS A 168 -22.629 6.758 -6.451 1.00 34.41 N ATOM 2587 CD2 HIS A 168 -21.367 5.310 -7.484 1.00 71.42 C ATOM 2588 CE1 HIS A 168 -22.590 7.112 -7.716 1.00 75.52 C ATOM 2589 NE2 HIS A 168 -21.834 6.254 -8.364 1.00 13.50 N ATOM 0 H HIS A 168 -21.865 3.564 -2.769 1.00 41.44 H new ATOM 0 HA HIS A 168 -23.578 3.850 -5.097 1.00 41.20 H new ATOM 0 HB2 HIS A 168 -22.031 5.654 -4.131 1.00 2.00 H new ATOM 0 HB3 HIS A 168 -20.677 4.720 -4.737 1.00 2.00 H new ATOM 0 HD1 HIS A 168 -23.143 7.250 -5.720 1.00 34.41 H new ATOM 0 HD2 HIS A 168 -20.721 4.477 -7.719 1.00 71.42 H new ATOM 0 HE1 HIS A 168 -23.094 7.963 -8.150 1.00 75.52 H new ATOM 2598 N HIS A 169 -22.837 1.875 -6.440 1.00 54.50 N ATOM 2599 CA HIS A 169 -22.437 0.868 -7.447 1.00 22.11 C ATOM 2600 C HIS A 169 -22.495 1.508 -8.856 1.00 75.32 C ATOM 2601 O HIS A 169 -23.570 1.659 -9.436 1.00 41.03 O ATOM 2602 CB HIS A 169 -23.358 -0.381 -7.353 1.00 10.43 C ATOM 2603 CG HIS A 169 -23.204 -1.166 -6.070 1.00 62.00 C ATOM 2604 ND1 HIS A 169 -22.750 -2.465 -6.034 1.00 61.23 N ATOM 2605 CD2 HIS A 169 -23.442 -0.831 -4.777 1.00 50.42 C ATOM 2606 CE1 HIS A 169 -22.712 -2.888 -4.791 1.00 50.32 C ATOM 2607 NE2 HIS A 169 -23.124 -1.918 -4.005 1.00 65.20 N ATOM 0 H HIS A 169 -23.842 2.046 -6.417 1.00 54.50 H new ATOM 0 HA HIS A 169 -21.416 0.538 -7.256 1.00 22.11 H new ATOM 0 HB2 HIS A 169 -24.396 -0.062 -7.449 1.00 10.43 H new ATOM 0 HB3 HIS A 169 -23.148 -1.039 -8.196 1.00 10.43 H new ATOM 0 HD1 HIS A 169 -22.483 -3.016 -6.850 1.00 61.23 H new ATOM 0 HD2 HIS A 169 -23.814 0.118 -4.421 1.00 50.42 H new ATOM 0 HE1 HIS A 169 -22.395 -3.869 -4.469 1.00 50.32 H new ATOM 2616 N HIS A 170 -21.320 1.910 -9.373 1.00 53.31 N ATOM 2617 CA HIS A 170 -21.189 2.636 -10.662 1.00 45.51 C ATOM 2618 C HIS A 170 -21.558 1.759 -11.898 1.00 13.33 C ATOM 2619 O HIS A 170 -21.981 2.287 -12.934 1.00 12.34 O ATOM 2620 CB HIS A 170 -19.740 3.191 -10.783 1.00 54.44 C ATOM 2621 CG HIS A 170 -19.431 3.899 -12.083 1.00 30.42 C ATOM 2622 ND1 HIS A 170 -20.008 5.095 -12.444 1.00 14.24 N ATOM 2623 CD2 HIS A 170 -18.618 3.560 -13.116 1.00 23.21 C ATOM 2624 CE1 HIS A 170 -19.573 5.457 -13.629 1.00 10.14 C ATOM 2625 NE2 HIS A 170 -18.725 4.551 -14.061 1.00 32.33 N ATOM 0 H HIS A 170 -20.426 1.742 -8.911 1.00 53.31 H new ATOM 0 HA HIS A 170 -21.906 3.457 -10.659 1.00 45.51 H new ATOM 0 HB2 HIS A 170 -19.562 3.883 -9.959 1.00 54.44 H new ATOM 0 HB3 HIS A 170 -19.040 2.365 -10.662 1.00 54.44 H new ATOM 0 HD2 HIS A 170 -18.002 2.676 -13.182 1.00 23.21 H new ATOM 0 HE1 HIS A 170 -19.864 6.351 -14.160 1.00 10.14 H new ATOM 0 HE2 HIS A 170 -18.228 4.579 -14.951 1.00 32.33 H new ATOM 2634 N HIS A 171 -21.399 0.428 -11.781 1.00 0.40 N ATOM 2635 CA HIS A 171 -21.724 -0.516 -12.874 1.00 14.02 C ATOM 2636 C HIS A 171 -22.230 -1.868 -12.294 1.00 21.23 C ATOM 2637 O HIS A 171 -23.289 -2.354 -12.701 1.00 41.21 O ATOM 2638 CB HIS A 171 -20.492 -0.697 -13.802 1.00 53.11 C ATOM 2639 CG HIS A 171 -20.787 -1.330 -15.139 1.00 31.24 C ATOM 2640 ND1 HIS A 171 -20.009 -2.322 -15.693 1.00 23.51 N ATOM 2641 CD2 HIS A 171 -21.753 -1.068 -16.056 1.00 64.50 C ATOM 2642 CE1 HIS A 171 -20.477 -2.642 -16.882 1.00 13.12 C ATOM 2643 NE2 HIS A 171 -21.532 -1.900 -17.124 1.00 22.50 N ATOM 0 H HIS A 171 -21.046 -0.023 -10.937 1.00 0.40 H new ATOM 0 HA HIS A 171 -22.533 -0.107 -13.479 1.00 14.02 H new ATOM 0 HB2 HIS A 171 -20.038 0.279 -13.972 1.00 53.11 H new ATOM 0 HB3 HIS A 171 -19.752 -1.307 -13.284 1.00 53.11 H new ATOM 0 HD2 HIS A 171 -22.546 -0.341 -15.962 1.00 64.50 H new ATOM 0 HE1 HIS A 171 -20.063 -3.388 -17.545 1.00 13.12 H new ATOM 0 HE2 HIS A 171 -22.098 -1.936 -17.972 1.00 22.50 H new ATOM 2652 N HIS A 172 -21.461 -2.468 -11.354 1.00 62.23 N ATOM 2653 CA HIS A 172 -21.943 -3.617 -10.530 1.00 22.42 C ATOM 2654 C HIS A 172 -21.102 -3.767 -9.254 1.00 3.35 C ATOM 2655 O HIS A 172 -21.137 -2.926 -8.357 1.00 23.23 O ATOM 2656 CB HIS A 172 -21.982 -4.960 -11.331 1.00 34.21 C ATOM 2657 CG HIS A 172 -20.651 -5.644 -11.575 1.00 11.30 C ATOM 2658 ND1 HIS A 172 -19.860 -5.398 -12.676 1.00 34.44 N ATOM 2659 CD2 HIS A 172 -19.998 -6.605 -10.867 1.00 31.41 C ATOM 2660 CE1 HIS A 172 -18.792 -6.168 -12.634 1.00 42.42 C ATOM 2661 NE2 HIS A 172 -18.847 -6.906 -11.549 1.00 2.04 N ATOM 0 H HIS A 172 -20.505 -2.180 -11.143 1.00 62.23 H new ATOM 0 HA HIS A 172 -22.971 -3.390 -10.247 1.00 22.42 H new ATOM 0 HB2 HIS A 172 -22.630 -5.656 -10.798 1.00 34.21 H new ATOM 0 HB3 HIS A 172 -22.448 -4.767 -12.297 1.00 34.21 H new ATOM 0 HD2 HIS A 172 -20.326 -7.049 -9.939 1.00 31.41 H new ATOM 0 HE1 HIS A 172 -18.002 -6.189 -13.370 1.00 42.42 H new ATOM 0 HE2 HIS A 172 -18.148 -7.591 -11.261 1.00 2.04 H new TER 2670 HIS A 172