USER MOD reduce.3.24.130724 H: found=0, std=0, add=1087, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1085 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 120 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 122 SER OG : rot 180:sc= -0.0625 USER MOD Set 2.1: A 12 LYS NZ :NH3+ 159:sc= 0.921 (180deg=0) USER MOD Set 2.2: A 89 HIS : no HD1:sc= 0.733 K(o=1.7,f=-6.8!) USER MOD Set 3.1: A 29 TYR OH : rot -20:sc= 1.22 USER MOD Set 3.2: A 97 THR OG1 : rot 113:sc= 2.09 USER MOD Single : A 5 ASN : amide:sc= -0.141 X(o=-0.14,f=-0.14) USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ -141:sc= 0.131 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 HIS : no HD1:sc= -0.204 K(o=-0.2,f=-7!) USER MOD Single : A 39 ASN : amide:sc= -0.147 X(o=-0.15,f=-0.34) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 SER OG : rot -34:sc= 0.236 USER MOD Single : A 53 SER OG : rot -84:sc= 0.486 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 CYS SG : rot 47:sc= 0.526 USER MOD Single : A 58 GLN : amide:sc= -1.13 K(o=-1.1,f=-3!) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot 180:sc=-0.00379 USER MOD Single : A 74 ASN : amide:sc= -0.0657 K(o=-0.066,f=-1.8!) USER MOD Single : A 76 LYS NZ :NH3+ 176:sc= 0.293 (180deg=0.216) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= -0.406 K(o=-0.41,f=-2) USER MOD Single : A 81 THR OG1 : rot 76:sc= 0.502 USER MOD Single : A 83 CYS SG : rot 81:sc= -1.12 USER MOD Single : A 87 CYS SG : rot 85:sc= -0.436 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ -163:sc= -0.0288 (180deg=-0.286) USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 107 HIS : no HD1:sc= 0.393 K(o=0.39,f=-1.6!) USER MOD Single : A 112 THR OG1 : rot 27:sc= -0.533 USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 121 THR OG1 : rot 180:sc= 0.00471 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 ASN : amide:sc=-0.00295 K(o=-0.003,f=-0.95) USER MOD Single : A 135 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 2 -4.047 -0.357 -4.704 1.00 13.00 N ATOM 2 CA GLY A 2 -4.806 -0.118 -5.917 1.00 45.03 C ATOM 3 C GLY A 2 -4.138 0.889 -6.832 1.00 11.32 C ATOM 4 O GLY A 2 -4.746 1.369 -7.788 1.00 41.55 O ATOM 0 HA2 GLY A 2 -4.936 -1.059 -6.451 1.00 45.03 H new ATOM 0 HA3 GLY A 2 -5.802 0.240 -5.654 1.00 45.03 H new ATOM 8 N ALA A 3 -2.883 1.212 -6.537 1.00 52.30 N ATOM 9 CA ALA A 3 -2.131 2.168 -7.340 1.00 53.44 C ATOM 10 C ALA A 3 -1.283 1.457 -8.389 1.00 35.03 C ATOM 11 O ALA A 3 -0.257 0.856 -8.067 1.00 11.31 O ATOM 12 CB ALA A 3 -1.255 3.034 -6.447 1.00 52.35 C ATOM 0 H ALA A 3 -2.366 0.825 -5.747 1.00 52.30 H new ATOM 0 HA ALA A 3 -2.844 2.808 -7.861 1.00 53.44 H new ATOM 0 HB1 ALA A 3 -0.699 3.743 -7.060 1.00 52.35 H new ATOM 0 HB2 ALA A 3 -1.882 3.578 -5.740 1.00 52.35 H new ATOM 0 HB3 ALA A 3 -0.556 2.402 -5.900 1.00 52.35 H new ATOM 18 N ARG A 4 -1.717 1.528 -9.643 1.00 13.11 N ATOM 19 CA ARG A 4 -0.997 0.889 -10.737 1.00 71.43 C ATOM 20 C ARG A 4 0.083 1.814 -11.292 1.00 2.10 C ATOM 21 O ARG A 4 -0.201 2.936 -11.709 1.00 1.15 O ATOM 22 CB ARG A 4 -1.968 0.495 -11.853 1.00 20.45 C ATOM 23 CG ARG A 4 -1.458 -0.635 -12.732 1.00 0.02 C ATOM 24 CD ARG A 4 -2.600 -1.500 -13.244 1.00 32.20 C ATOM 25 NE ARG A 4 -2.119 -2.736 -13.854 1.00 15.22 N ATOM 26 CZ ARG A 4 -1.689 -3.781 -13.155 1.00 14.33 C ATOM 27 NH1 ARG A 4 -1.680 -3.739 -11.830 1.00 60.05 N ATOM 28 NH2 ARG A 4 -1.266 -4.872 -13.783 1.00 2.24 N ATOM 0 H ARG A 4 -2.563 2.022 -9.926 1.00 13.11 H new ATOM 0 HA ARG A 4 -0.517 -0.009 -10.347 1.00 71.43 H new ATOM 0 HB2 ARG A 4 -2.918 0.198 -11.409 1.00 20.45 H new ATOM 0 HB3 ARG A 4 -2.166 1.367 -12.476 1.00 20.45 H new ATOM 0 HG2 ARG A 4 -0.907 -0.221 -13.576 1.00 0.02 H new ATOM 0 HG3 ARG A 4 -0.759 -1.251 -12.166 1.00 0.02 H new ATOM 0 HD2 ARG A 4 -3.271 -1.740 -12.419 1.00 32.20 H new ATOM 0 HD3 ARG A 4 -3.181 -0.938 -13.975 1.00 32.20 H new ATOM 0 HE ARG A 4 -2.113 -2.801 -14.872 1.00 15.22 H new ATOM 0 HH11 ARG A 4 -2.004 -2.903 -11.344 1.00 60.05 H new ATOM 0 HH12 ARG A 4 -1.349 -4.543 -11.297 1.00 60.05 H new ATOM 0 HH21 ARG A 4 -1.271 -4.908 -14.802 1.00 2.24 H new ATOM 0 HH22 ARG A 4 -0.936 -5.674 -13.246 1.00 2.24 H new ATOM 42 N ASN A 5 1.322 1.334 -11.293 1.00 33.22 N ATOM 43 CA ASN A 5 2.445 2.118 -11.794 1.00 31.45 C ATOM 44 C ASN A 5 3.727 1.291 -11.801 1.00 3.10 C ATOM 45 O ASN A 5 4.008 0.557 -10.855 1.00 35.15 O ATOM 46 CB ASN A 5 2.640 3.373 -10.940 1.00 43.01 C ATOM 47 CG ASN A 5 3.428 3.095 -9.675 1.00 21.22 C ATOM 48 OD1 ASN A 5 2.947 2.414 -8.768 1.00 64.32 O ATOM 49 ND2 ASN A 5 4.645 3.622 -9.608 1.00 4.32 N ATOM 0 H ASN A 5 1.574 0.406 -10.953 1.00 33.22 H new ATOM 0 HA ASN A 5 2.219 2.415 -12.818 1.00 31.45 H new ATOM 0 HB2 ASN A 5 3.157 4.132 -11.527 1.00 43.01 H new ATOM 0 HB3 ASN A 5 1.666 3.784 -10.675 1.00 43.01 H new ATOM 0 HD21 ASN A 5 5.222 3.469 -8.781 1.00 4.32 H new ATOM 0 HD22 ASN A 5 5.003 4.180 -10.384 1.00 4.32 H new ATOM 56 N SER A 6 4.499 1.416 -12.875 1.00 73.11 N ATOM 57 CA SER A 6 5.750 0.678 -13.007 1.00 71.14 C ATOM 58 C SER A 6 6.782 1.492 -13.781 1.00 74.14 C ATOM 59 O SER A 6 7.217 1.098 -14.864 1.00 43.33 O ATOM 60 CB SER A 6 5.506 -0.658 -13.712 1.00 4.52 C ATOM 61 OG SER A 6 4.729 -1.526 -12.904 1.00 64.02 O ATOM 0 H SER A 6 4.281 2.021 -13.667 1.00 73.11 H new ATOM 0 HA SER A 6 6.138 0.488 -12.006 1.00 71.14 H new ATOM 0 HB2 SER A 6 4.996 -0.485 -14.660 1.00 4.52 H new ATOM 0 HB3 SER A 6 6.461 -1.130 -13.945 1.00 4.52 H new ATOM 0 HG SER A 6 4.585 -2.372 -13.377 1.00 64.02 H new ATOM 67 N VAL A 7 7.171 2.632 -13.218 1.00 13.31 N ATOM 68 CA VAL A 7 8.154 3.503 -13.853 1.00 42.54 C ATOM 69 C VAL A 7 9.551 3.249 -13.301 1.00 14.21 C ATOM 70 O VAL A 7 10.467 2.886 -14.040 1.00 71.43 O ATOM 71 CB VAL A 7 7.797 4.988 -13.657 1.00 11.12 C ATOM 72 CG1 VAL A 7 8.722 5.872 -14.480 1.00 2.33 C ATOM 73 CG2 VAL A 7 6.342 5.239 -14.022 1.00 50.12 C ATOM 0 H VAL A 7 6.820 2.974 -12.323 1.00 13.31 H new ATOM 0 HA VAL A 7 8.141 3.272 -14.918 1.00 42.54 H new ATOM 0 HB VAL A 7 7.932 5.241 -12.605 1.00 11.12 H new ATOM 0 HG11 VAL A 7 8.455 6.918 -14.329 1.00 2.33 H new ATOM 0 HG12 VAL A 7 9.753 5.712 -14.166 1.00 2.33 H new ATOM 0 HG13 VAL A 7 8.621 5.621 -15.536 1.00 2.33 H new ATOM 0 HG21 VAL A 7 6.107 6.294 -13.877 1.00 50.12 H new ATOM 0 HG22 VAL A 7 6.177 4.970 -15.065 1.00 50.12 H new ATOM 0 HG23 VAL A 7 5.697 4.633 -13.385 1.00 50.12 H new ATOM 83 N LEU A 8 9.709 3.441 -11.996 1.00 75.52 N ATOM 84 CA LEU A 8 10.996 3.233 -11.342 1.00 11.11 C ATOM 85 C LEU A 8 10.897 2.145 -10.278 1.00 11.33 C ATOM 86 O LEU A 8 10.038 2.201 -9.397 1.00 42.53 O ATOM 87 CB LEU A 8 11.487 4.537 -10.711 1.00 14.21 C ATOM 88 CG LEU A 8 11.840 5.662 -11.684 1.00 25.03 C ATOM 89 CD1 LEU A 8 12.369 6.873 -10.930 1.00 32.52 C ATOM 90 CD2 LEU A 8 12.857 5.183 -12.708 1.00 22.11 C ATOM 0 H LEU A 8 8.962 3.740 -11.370 1.00 75.52 H new ATOM 0 HA LEU A 8 11.712 2.911 -12.098 1.00 11.11 H new ATOM 0 HB2 LEU A 8 10.717 4.901 -10.031 1.00 14.21 H new ATOM 0 HB3 LEU A 8 12.367 4.316 -10.107 1.00 14.21 H new ATOM 0 HG LEU A 8 10.934 5.956 -12.213 1.00 25.03 H new ATOM 0 HD11 LEU A 8 12.615 7.664 -11.639 1.00 32.52 H new ATOM 0 HD12 LEU A 8 11.608 7.231 -10.237 1.00 32.52 H new ATOM 0 HD13 LEU A 8 13.264 6.593 -10.374 1.00 32.52 H new ATOM 0 HD21 LEU A 8 13.096 5.997 -13.392 1.00 22.11 H new ATOM 0 HD22 LEU A 8 13.764 4.861 -12.197 1.00 22.11 H new ATOM 0 HD23 LEU A 8 12.441 4.347 -13.270 1.00 22.11 H new ATOM 102 N ARG A 9 11.783 1.157 -10.363 1.00 24.33 N ATOM 103 CA ARG A 9 11.796 0.057 -9.406 1.00 45.01 C ATOM 104 C ARG A 9 12.537 0.453 -8.132 1.00 74.45 C ATOM 105 O ARG A 9 12.847 1.625 -7.921 1.00 50.53 O ATOM 106 CB ARG A 9 12.448 -1.179 -10.027 1.00 62.23 C ATOM 107 CG ARG A 9 13.925 -0.997 -10.337 1.00 45.15 C ATOM 108 CD ARG A 9 14.479 -2.177 -11.121 1.00 45.11 C ATOM 109 NE ARG A 9 14.308 -3.438 -10.405 1.00 1.24 N ATOM 110 CZ ARG A 9 14.662 -4.619 -10.900 1.00 60.34 C ATOM 111 NH1 ARG A 9 15.204 -4.698 -12.107 1.00 50.45 N ATOM 112 NH2 ARG A 9 14.475 -5.722 -10.187 1.00 42.13 N ATOM 0 H ARG A 9 12.501 1.096 -11.085 1.00 24.33 H new ATOM 0 HA ARG A 9 10.764 -0.178 -9.146 1.00 45.01 H new ATOM 0 HB2 ARG A 9 12.329 -2.023 -9.347 1.00 62.23 H new ATOM 0 HB3 ARG A 9 11.921 -1.434 -10.946 1.00 62.23 H new ATOM 0 HG2 ARG A 9 14.068 -0.080 -10.908 1.00 45.15 H new ATOM 0 HG3 ARG A 9 14.482 -0.883 -9.407 1.00 45.15 H new ATOM 0 HD2 ARG A 9 13.978 -2.238 -12.087 1.00 45.11 H new ATOM 0 HD3 ARG A 9 15.538 -2.014 -11.321 1.00 45.11 H new ATOM 0 HE ARG A 9 13.894 -3.411 -9.473 1.00 1.24 H new ATOM 0 HH11 ARG A 9 15.350 -3.851 -12.657 1.00 50.45 H new ATOM 0 HH12 ARG A 9 15.475 -5.605 -12.486 1.00 50.45 H new ATOM 0 HH21 ARG A 9 14.059 -5.664 -9.258 1.00 42.13 H new ATOM 0 HH22 ARG A 9 14.747 -6.628 -10.568 1.00 42.13 H new ATOM 126 N GLY A 10 12.819 -0.535 -7.288 1.00 24.24 N ATOM 127 CA GLY A 10 13.522 -0.270 -6.046 1.00 1.14 C ATOM 128 C GLY A 10 14.939 0.216 -6.274 1.00 35.22 C ATOM 129 O GLY A 10 15.387 1.171 -5.639 1.00 12.50 O ATOM 0 H GLY A 10 12.574 -1.513 -7.442 1.00 24.24 H new ATOM 0 HA2 GLY A 10 12.973 0.477 -5.474 1.00 1.14 H new ATOM 0 HA3 GLY A 10 13.545 -1.179 -5.444 1.00 1.14 H new ATOM 133 N LYS A 11 15.650 -0.445 -7.182 1.00 73.33 N ATOM 134 CA LYS A 11 17.027 -0.076 -7.493 1.00 42.20 C ATOM 135 C LYS A 11 17.077 1.240 -8.262 1.00 24.04 C ATOM 136 O LYS A 11 18.072 1.964 -8.210 1.00 51.22 O ATOM 137 CB LYS A 11 17.700 -1.182 -8.310 1.00 30.02 C ATOM 138 CG LYS A 11 19.156 -1.407 -7.944 1.00 30.31 C ATOM 139 CD LYS A 11 19.352 -2.729 -7.222 1.00 74.10 C ATOM 140 CE LYS A 11 20.678 -2.766 -6.477 1.00 13.43 C ATOM 141 NZ LYS A 11 21.755 -3.391 -7.293 1.00 74.03 N ATOM 0 H LYS A 11 15.296 -1.239 -7.715 1.00 73.33 H new ATOM 0 HA LYS A 11 17.564 0.052 -6.553 1.00 42.20 H new ATOM 0 HB2 LYS A 11 17.150 -2.113 -8.168 1.00 30.02 H new ATOM 0 HB3 LYS A 11 17.635 -0.931 -9.369 1.00 30.02 H new ATOM 0 HG2 LYS A 11 19.766 -1.391 -8.847 1.00 30.31 H new ATOM 0 HG3 LYS A 11 19.503 -0.591 -7.311 1.00 30.31 H new ATOM 0 HD2 LYS A 11 18.534 -2.886 -6.519 1.00 74.10 H new ATOM 0 HD3 LYS A 11 19.315 -3.547 -7.942 1.00 74.10 H new ATOM 0 HE2 LYS A 11 20.970 -1.752 -6.205 1.00 13.43 H new ATOM 0 HE3 LYS A 11 20.557 -3.323 -5.548 1.00 13.43 H new ATOM 0 HZ1 LYS A 11 22.642 -3.397 -6.750 1.00 74.03 H new ATOM 0 HZ2 LYS A 11 21.488 -4.367 -7.531 1.00 74.03 H new ATOM 0 HZ3 LYS A 11 21.888 -2.845 -8.168 1.00 74.03 H new ATOM 155 N LYS A 12 15.997 1.547 -8.973 1.00 15.01 N ATOM 156 CA LYS A 12 15.916 2.778 -9.750 1.00 51.35 C ATOM 157 C LYS A 12 15.514 3.954 -8.866 1.00 21.51 C ATOM 158 O LYS A 12 16.034 5.059 -9.012 1.00 72.33 O ATOM 159 CB LYS A 12 14.911 2.619 -10.893 1.00 71.23 C ATOM 160 CG LYS A 12 15.428 1.771 -12.044 1.00 4.03 C ATOM 161 CD LYS A 12 14.393 1.641 -13.149 1.00 14.14 C ATOM 162 CE LYS A 12 14.871 0.711 -14.252 1.00 53.23 C ATOM 163 NZ LYS A 12 14.300 1.082 -15.577 1.00 15.03 N ATOM 0 H LYS A 12 15.165 0.959 -9.027 1.00 15.01 H new ATOM 0 HA LYS A 12 16.903 2.980 -10.167 1.00 51.35 H new ATOM 0 HB2 LYS A 12 13.998 2.169 -10.503 1.00 71.23 H new ATOM 0 HB3 LYS A 12 14.644 3.606 -11.271 1.00 71.23 H new ATOM 0 HG2 LYS A 12 16.337 2.218 -12.446 1.00 4.03 H new ATOM 0 HG3 LYS A 12 15.695 0.780 -11.676 1.00 4.03 H new ATOM 0 HD2 LYS A 12 13.459 1.263 -12.732 1.00 14.14 H new ATOM 0 HD3 LYS A 12 14.180 2.625 -13.568 1.00 14.14 H new ATOM 0 HE2 LYS A 12 15.959 0.740 -14.305 1.00 53.23 H new ATOM 0 HE3 LYS A 12 14.590 -0.314 -14.010 1.00 53.23 H new ATOM 0 HZ1 LYS A 12 14.892 0.685 -16.334 1.00 15.03 H new ATOM 0 HZ2 LYS A 12 13.335 0.703 -15.658 1.00 15.03 H new ATOM 0 HZ3 LYS A 12 14.274 2.118 -15.666 1.00 15.03 H new ATOM 177 N ALA A 13 14.586 3.707 -7.948 1.00 24.12 N ATOM 178 CA ALA A 13 14.116 4.745 -7.037 1.00 60.52 C ATOM 179 C ALA A 13 15.285 5.437 -6.344 1.00 73.41 C ATOM 180 O ALA A 13 15.266 6.650 -6.136 1.00 21.34 O ATOM 181 CB ALA A 13 13.165 4.154 -6.008 1.00 71.33 C ATOM 0 H ALA A 13 14.144 2.797 -7.815 1.00 24.12 H new ATOM 0 HA ALA A 13 13.580 5.492 -7.623 1.00 60.52 H new ATOM 0 HB1 ALA A 13 12.823 4.940 -5.335 1.00 71.33 H new ATOM 0 HB2 ALA A 13 12.308 3.712 -6.516 1.00 71.33 H new ATOM 0 HB3 ALA A 13 13.682 3.385 -5.434 1.00 71.33 H new ATOM 187 N ASP A 14 16.302 4.658 -5.990 1.00 45.14 N ATOM 188 CA ASP A 14 17.480 5.197 -5.321 1.00 11.23 C ATOM 189 C ASP A 14 18.165 6.248 -6.188 1.00 2.45 C ATOM 190 O ASP A 14 18.290 7.406 -5.791 1.00 12.04 O ATOM 191 CB ASP A 14 18.462 4.072 -4.988 1.00 73.35 C ATOM 192 CG ASP A 14 18.984 4.159 -3.568 1.00 35.31 C ATOM 193 OD1 ASP A 14 19.663 5.157 -3.245 1.00 65.24 O ATOM 194 OD2 ASP A 14 18.714 3.230 -2.779 1.00 73.14 O ATOM 0 H ASP A 14 16.334 3.652 -6.155 1.00 45.14 H new ATOM 0 HA ASP A 14 17.156 5.672 -4.395 1.00 11.23 H new ATOM 0 HB2 ASP A 14 17.970 3.110 -5.133 1.00 73.35 H new ATOM 0 HB3 ASP A 14 19.301 4.109 -5.683 1.00 73.35 H new ATOM 199 N GLU A 15 18.606 5.836 -7.372 1.00 31.33 N ATOM 200 CA GLU A 15 19.280 6.743 -8.293 1.00 21.03 C ATOM 201 C GLU A 15 18.512 8.055 -8.425 1.00 41.20 C ATOM 202 O GLU A 15 19.107 9.129 -8.525 1.00 42.55 O ATOM 203 CB GLU A 15 19.433 6.089 -9.668 1.00 12.41 C ATOM 204 CG GLU A 15 20.784 5.428 -9.880 1.00 55.13 C ATOM 205 CD GLU A 15 21.093 4.379 -8.830 1.00 30.32 C ATOM 206 OE1 GLU A 15 21.604 4.750 -7.753 1.00 72.13 O ATOM 207 OE2 GLU A 15 20.822 3.187 -9.085 1.00 40.24 O ATOM 0 H GLU A 15 18.509 4.881 -7.716 1.00 31.33 H new ATOM 0 HA GLU A 15 20.269 6.960 -7.889 1.00 21.03 H new ATOM 0 HB2 GLU A 15 18.649 5.343 -9.795 1.00 12.41 H new ATOM 0 HB3 GLU A 15 19.282 6.844 -10.439 1.00 12.41 H new ATOM 0 HG2 GLU A 15 20.807 4.966 -10.867 1.00 55.13 H new ATOM 0 HG3 GLU A 15 21.563 6.190 -9.867 1.00 55.13 H new ATOM 214 N LEU A 16 17.186 7.960 -8.423 1.00 71.04 N ATOM 215 CA LEU A 16 16.335 9.139 -8.543 1.00 52.34 C ATOM 216 C LEU A 16 16.547 10.085 -7.366 1.00 12.32 C ATOM 217 O LEU A 16 16.836 11.266 -7.552 1.00 34.24 O ATOM 218 CB LEU A 16 14.865 8.724 -8.621 1.00 1.53 C ATOM 219 CG LEU A 16 13.876 9.825 -9.003 1.00 44.44 C ATOM 220 CD1 LEU A 16 13.634 10.758 -7.827 1.00 74.10 C ATOM 221 CD2 LEU A 16 14.384 10.603 -10.207 1.00 61.35 C ATOM 0 H LEU A 16 16.678 7.080 -8.340 1.00 71.04 H new ATOM 0 HA LEU A 16 16.607 9.663 -9.459 1.00 52.34 H new ATOM 0 HB2 LEU A 16 14.775 7.915 -9.346 1.00 1.53 H new ATOM 0 HB3 LEU A 16 14.571 8.319 -7.653 1.00 1.53 H new ATOM 0 HG LEU A 16 12.928 9.358 -9.270 1.00 44.44 H new ATOM 0 HD11 LEU A 16 12.927 11.535 -8.118 1.00 74.10 H new ATOM 0 HD12 LEU A 16 13.225 10.191 -6.991 1.00 74.10 H new ATOM 0 HD13 LEU A 16 14.576 11.218 -7.528 1.00 74.10 H new ATOM 0 HD21 LEU A 16 13.667 11.383 -10.465 1.00 61.35 H new ATOM 0 HD22 LEU A 16 15.345 11.058 -9.967 1.00 61.35 H new ATOM 0 HD23 LEU A 16 14.504 9.926 -11.053 1.00 61.35 H new ATOM 233 N GLU A 17 16.402 9.557 -6.155 1.00 13.40 N ATOM 234 CA GLU A 17 16.579 10.355 -4.947 1.00 73.22 C ATOM 235 C GLU A 17 18.008 10.882 -4.848 1.00 22.40 C ATOM 236 O GLU A 17 18.276 11.851 -4.137 1.00 4.41 O ATOM 237 CB GLU A 17 16.243 9.525 -3.706 1.00 64.00 C ATOM 238 CG GLU A 17 15.218 10.181 -2.795 1.00 54.13 C ATOM 239 CD GLU A 17 15.787 10.526 -1.432 1.00 64.14 C ATOM 240 OE1 GLU A 17 16.995 10.826 -1.352 1.00 14.31 O ATOM 241 OE2 GLU A 17 15.020 10.496 -0.446 1.00 72.54 O ATOM 0 H GLU A 17 16.162 8.580 -5.984 1.00 13.40 H new ATOM 0 HA GLU A 17 15.899 11.205 -5.001 1.00 73.22 H new ATOM 0 HB2 GLU A 17 15.867 8.552 -4.021 1.00 64.00 H new ATOM 0 HB3 GLU A 17 17.157 9.346 -3.141 1.00 64.00 H new ATOM 0 HG2 GLU A 17 14.844 11.088 -3.269 1.00 54.13 H new ATOM 0 HG3 GLU A 17 14.367 9.512 -2.671 1.00 54.13 H new ATOM 248 N ARG A 18 18.921 10.237 -5.566 1.00 15.22 N ATOM 249 CA ARG A 18 20.323 10.639 -5.559 1.00 3.32 C ATOM 250 C ARG A 18 20.543 11.862 -6.444 1.00 11.12 C ATOM 251 O ARG A 18 21.411 12.690 -6.170 1.00 60.40 O ATOM 252 CB ARG A 18 21.209 9.486 -6.034 1.00 13.44 C ATOM 253 CG ARG A 18 21.492 8.451 -4.957 1.00 1.04 C ATOM 254 CD ARG A 18 22.985 8.210 -4.795 1.00 50.44 C ATOM 255 NE ARG A 18 23.615 7.818 -6.053 1.00 43.35 N ATOM 256 CZ ARG A 18 24.921 7.897 -6.277 1.00 33.44 C ATOM 257 NH1 ARG A 18 25.733 8.352 -5.331 1.00 12.10 N ATOM 258 NH2 ARG A 18 25.420 7.521 -7.447 1.00 63.13 N ATOM 0 H ARG A 18 18.716 9.434 -6.160 1.00 15.22 H new ATOM 0 HA ARG A 18 20.595 10.899 -4.536 1.00 3.32 H new ATOM 0 HB2 ARG A 18 20.729 8.995 -6.880 1.00 13.44 H new ATOM 0 HB3 ARG A 18 22.155 9.891 -6.395 1.00 13.44 H new ATOM 0 HG2 ARG A 18 21.071 8.786 -4.009 1.00 1.04 H new ATOM 0 HG3 ARG A 18 20.997 7.514 -5.212 1.00 1.04 H new ATOM 0 HD2 ARG A 18 23.460 9.116 -4.419 1.00 50.44 H new ATOM 0 HD3 ARG A 18 23.148 7.431 -4.050 1.00 50.44 H new ATOM 0 HE ARG A 18 23.018 7.464 -6.801 1.00 43.35 H new ATOM 0 HH11 ARG A 18 25.354 8.642 -4.430 1.00 12.10 H new ATOM 0 HH12 ARG A 18 26.736 8.412 -5.505 1.00 12.10 H new ATOM 0 HH21 ARG A 18 24.800 7.170 -8.177 1.00 63.13 H new ATOM 0 HH22 ARG A 18 26.424 7.583 -7.617 1.00 63.13 H new ATOM 272 N ILE A 19 19.752 11.967 -7.506 1.00 44.33 N ATOM 273 CA ILE A 19 19.859 13.088 -8.431 1.00 75.32 C ATOM 274 C ILE A 19 19.490 14.401 -7.749 1.00 1.24 C ATOM 275 O ILE A 19 18.481 14.486 -7.049 1.00 22.03 O ATOM 276 CB ILE A 19 18.956 12.890 -9.662 1.00 64.25 C ATOM 277 CG1 ILE A 19 19.360 11.625 -10.422 1.00 32.12 C ATOM 278 CG2 ILE A 19 19.029 14.107 -10.573 1.00 41.15 C ATOM 279 CD1 ILE A 19 18.195 10.911 -11.070 1.00 55.22 C ATOM 0 H ILE A 19 19.029 11.289 -7.747 1.00 44.33 H new ATOM 0 HA ILE A 19 20.898 13.130 -8.756 1.00 75.32 H new ATOM 0 HB ILE A 19 17.927 12.774 -9.323 1.00 64.25 H new ATOM 0 HG12 ILE A 19 20.087 11.889 -11.190 1.00 32.12 H new ATOM 0 HG13 ILE A 19 19.858 10.941 -9.734 1.00 32.12 H new ATOM 0 HG21 ILE A 19 18.385 13.952 -11.439 1.00 41.15 H new ATOM 0 HG22 ILE A 19 18.697 14.990 -10.027 1.00 41.15 H new ATOM 0 HG23 ILE A 19 20.057 14.251 -10.906 1.00 41.15 H new ATOM 0 HD11 ILE A 19 18.556 10.024 -11.591 1.00 55.22 H new ATOM 0 HD12 ILE A 19 17.478 10.616 -10.304 1.00 55.22 H new ATOM 0 HD13 ILE A 19 17.710 11.578 -11.783 1.00 55.22 H new ATOM 291 N ARG A 20 20.313 15.423 -7.959 1.00 1.41 N ATOM 292 CA ARG A 20 20.073 16.733 -7.365 1.00 11.42 C ATOM 293 C ARG A 20 19.233 17.604 -8.293 1.00 23.12 C ATOM 294 O ARG A 20 19.492 17.679 -9.495 1.00 63.20 O ATOM 295 CB ARG A 20 21.401 17.427 -7.058 1.00 43.12 C ATOM 296 CG ARG A 20 22.281 16.657 -6.087 1.00 72.32 C ATOM 297 CD ARG A 20 23.742 17.060 -6.220 1.00 3.51 C ATOM 298 NE ARG A 20 24.622 16.188 -5.447 1.00 20.44 N ATOM 299 CZ ARG A 20 24.791 16.293 -4.133 1.00 40.04 C ATOM 300 NH1 ARG A 20 24.143 17.227 -3.450 1.00 42.53 N ATOM 301 NH2 ARG A 20 25.609 15.463 -3.500 1.00 10.32 N ATOM 0 H ARG A 20 21.152 15.369 -8.536 1.00 1.41 H new ATOM 0 HA ARG A 20 19.523 16.589 -6.435 1.00 11.42 H new ATOM 0 HB2 ARG A 20 21.947 17.576 -7.990 1.00 43.12 H new ATOM 0 HB3 ARG A 20 21.198 18.415 -6.646 1.00 43.12 H new ATOM 0 HG2 ARG A 20 21.944 16.838 -5.066 1.00 72.32 H new ATOM 0 HG3 ARG A 20 22.179 15.588 -6.271 1.00 72.32 H new ATOM 0 HD2 ARG A 20 24.032 17.029 -7.270 1.00 3.51 H new ATOM 0 HD3 ARG A 20 23.866 18.090 -5.885 1.00 3.51 H new ATOM 0 HE ARG A 20 25.135 15.459 -5.942 1.00 20.44 H new ATOM 0 HH11 ARG A 20 23.513 17.867 -3.933 1.00 42.53 H new ATOM 0 HH12 ARG A 20 24.275 17.305 -2.442 1.00 42.53 H new ATOM 0 HH21 ARG A 20 26.109 14.743 -4.022 1.00 10.32 H new ATOM 0 HH22 ARG A 20 25.738 15.544 -2.491 1.00 10.32 H new ATOM 315 N LEU A 21 18.227 18.261 -7.728 1.00 65.05 N ATOM 316 CA LEU A 21 17.346 19.129 -8.505 1.00 32.41 C ATOM 317 C LEU A 21 18.128 20.285 -9.121 1.00 65.12 C ATOM 318 O LEU A 21 17.891 20.666 -10.267 1.00 44.25 O ATOM 319 CB LEU A 21 16.223 19.672 -7.621 1.00 0.45 C ATOM 320 CG LEU A 21 15.118 18.680 -7.255 1.00 50.21 C ATOM 321 CD1 LEU A 21 14.261 19.228 -6.124 1.00 24.41 C ATOM 322 CD2 LEU A 21 14.260 18.365 -8.471 1.00 53.24 C ATOM 0 H LEU A 21 18.000 18.210 -6.735 1.00 65.05 H new ATOM 0 HA LEU A 21 16.911 18.537 -9.311 1.00 32.41 H new ATOM 0 HB2 LEU A 21 16.664 20.050 -6.699 1.00 0.45 H new ATOM 0 HB3 LEU A 21 15.767 20.522 -8.128 1.00 0.45 H new ATOM 0 HG LEU A 21 15.585 17.756 -6.915 1.00 50.21 H new ATOM 0 HD11 LEU A 21 13.480 18.508 -5.878 1.00 24.41 H new ATOM 0 HD12 LEU A 21 14.884 19.402 -5.247 1.00 24.41 H new ATOM 0 HD13 LEU A 21 13.804 20.167 -6.436 1.00 24.41 H new ATOM 0 HD21 LEU A 21 13.479 17.658 -8.192 1.00 53.24 H new ATOM 0 HD22 LEU A 21 13.803 19.283 -8.841 1.00 53.24 H new ATOM 0 HD23 LEU A 21 14.882 17.929 -9.252 1.00 53.24 H new ATOM 334 N ARG A 22 19.061 20.838 -8.353 1.00 55.31 N ATOM 335 CA ARG A 22 19.878 21.950 -8.824 1.00 45.12 C ATOM 336 C ARG A 22 21.363 21.614 -8.723 1.00 64.44 C ATOM 337 O ARG A 22 21.771 20.701 -8.006 1.00 3.04 O ATOM 338 CB ARG A 22 19.573 23.213 -8.017 1.00 50.40 C ATOM 339 CG ARG A 22 18.532 24.112 -8.662 1.00 4.33 C ATOM 340 CD ARG A 22 17.120 23.677 -8.301 1.00 44.53 C ATOM 341 NE ARG A 22 16.167 24.780 -8.394 1.00 60.34 N ATOM 342 CZ ARG A 22 15.739 25.285 -9.546 1.00 1.23 C ATOM 343 NH1 ARG A 22 16.176 24.789 -10.695 1.00 5.01 N ATOM 344 NH2 ARG A 22 14.871 26.289 -9.550 1.00 10.21 N ATOM 0 H ARG A 22 19.270 20.534 -7.402 1.00 55.31 H new ATOM 0 HA ARG A 22 19.634 22.129 -9.871 1.00 45.12 H new ATOM 0 HB2 ARG A 22 19.227 22.925 -7.024 1.00 50.40 H new ATOM 0 HB3 ARG A 22 20.495 23.778 -7.881 1.00 50.40 H new ATOM 0 HG2 ARG A 22 18.690 25.142 -8.341 1.00 4.33 H new ATOM 0 HG3 ARG A 22 18.654 24.093 -9.745 1.00 4.33 H new ATOM 0 HD2 ARG A 22 16.808 22.871 -8.965 1.00 44.53 H new ATOM 0 HD3 ARG A 22 17.112 23.276 -7.288 1.00 44.53 H new ATOM 0 HE ARG A 22 15.811 25.184 -7.528 1.00 60.34 H new ATOM 0 HH11 ARG A 22 16.843 24.017 -10.697 1.00 5.01 H new ATOM 0 HH12 ARG A 22 15.845 25.179 -11.578 1.00 5.01 H new ATOM 0 HH21 ARG A 22 14.532 26.674 -8.668 1.00 10.21 H new ATOM 0 HH22 ARG A 22 14.543 26.676 -10.435 1.00 10.21 H new ATOM 358 N PRO A 23 22.192 22.370 -9.458 1.00 40.12 N ATOM 359 CA PRO A 23 23.645 22.171 -9.468 1.00 64.42 C ATOM 360 C PRO A 23 24.293 22.572 -8.148 1.00 51.03 C ATOM 361 O PRO A 23 25.282 21.975 -7.724 1.00 13.30 O ATOM 362 CB PRO A 23 24.120 23.089 -10.598 1.00 20.25 C ATOM 363 CG PRO A 23 23.074 24.146 -10.694 1.00 4.32 C ATOM 364 CD PRO A 23 21.776 23.476 -10.337 1.00 5.14 C ATOM 0 HA PRO A 23 23.913 21.124 -9.610 1.00 64.42 H new ATOM 0 HB2 PRO A 23 25.097 23.518 -10.375 1.00 20.25 H new ATOM 0 HB3 PRO A 23 24.218 22.543 -11.536 1.00 20.25 H new ATOM 0 HG2 PRO A 23 23.288 24.970 -10.013 1.00 4.32 H new ATOM 0 HG3 PRO A 23 23.034 24.565 -11.699 1.00 4.32 H new ATOM 0 HD2 PRO A 23 21.098 24.160 -9.828 1.00 5.14 H new ATOM 0 HD3 PRO A 23 21.255 23.111 -11.222 1.00 5.14 H new ATOM 372 N GLY A 24 23.729 23.588 -7.500 1.00 74.45 N ATOM 373 CA GLY A 24 24.267 24.050 -6.234 1.00 72.24 C ATOM 374 C GLY A 24 23.219 24.088 -5.139 1.00 53.34 C ATOM 375 O GLY A 24 23.245 24.963 -4.275 1.00 72.43 O ATOM 0 H GLY A 24 22.910 24.099 -7.830 1.00 74.45 H new ATOM 0 HA2 GLY A 24 25.083 23.395 -5.929 1.00 72.24 H new ATOM 0 HA3 GLY A 24 24.689 25.047 -6.364 1.00 72.24 H new ATOM 379 N GLY A 25 22.293 23.134 -5.176 1.00 22.52 N ATOM 380 CA GLY A 25 21.244 23.081 -4.174 1.00 64.34 C ATOM 381 C GLY A 25 21.397 21.901 -3.236 1.00 31.20 C ATOM 382 O GLY A 25 22.362 21.142 -3.332 1.00 24.40 O ATOM 0 H GLY A 25 22.251 22.398 -5.881 1.00 22.52 H new ATOM 0 HA2 GLY A 25 21.252 24.005 -3.595 1.00 64.34 H new ATOM 0 HA3 GLY A 25 20.275 23.024 -4.670 1.00 64.34 H new ATOM 386 N LYS A 26 20.444 21.745 -2.324 1.00 12.31 N ATOM 387 CA LYS A 26 20.476 20.649 -1.363 1.00 14.22 C ATOM 388 C LYS A 26 19.186 19.835 -1.421 1.00 33.22 C ATOM 389 O LYS A 26 18.823 19.159 -0.459 1.00 52.15 O ATOM 390 CB LYS A 26 20.686 21.190 0.053 1.00 31.14 C ATOM 391 CG LYS A 26 19.554 22.080 0.538 1.00 70.45 C ATOM 392 CD LYS A 26 19.867 22.690 1.893 1.00 21.25 C ATOM 393 CE LYS A 26 20.758 23.915 1.761 1.00 21.51 C ATOM 394 NZ LYS A 26 21.896 23.881 2.721 1.00 12.23 N ATOM 0 H LYS A 26 19.639 22.364 -2.230 1.00 12.31 H new ATOM 0 HA LYS A 26 21.309 19.996 -1.623 1.00 14.22 H new ATOM 0 HB2 LYS A 26 20.798 20.352 0.740 1.00 31.14 H new ATOM 0 HB3 LYS A 26 21.619 21.754 0.083 1.00 31.14 H new ATOM 0 HG2 LYS A 26 19.378 22.874 -0.188 1.00 70.45 H new ATOM 0 HG3 LYS A 26 18.635 21.498 0.603 1.00 70.45 H new ATOM 0 HD2 LYS A 26 18.938 22.967 2.392 1.00 21.25 H new ATOM 0 HD3 LYS A 26 20.358 21.948 2.522 1.00 21.25 H new ATOM 0 HE2 LYS A 26 21.144 23.975 0.743 1.00 21.51 H new ATOM 0 HE3 LYS A 26 20.166 24.814 1.932 1.00 21.51 H new ATOM 0 HZ1 LYS A 26 22.479 24.733 2.599 1.00 12.23 H new ATOM 0 HZ2 LYS A 26 21.529 23.849 3.694 1.00 12.23 H new ATOM 0 HZ3 LYS A 26 22.476 23.036 2.542 1.00 12.23 H new ATOM 408 N LYS A 27 18.500 19.905 -2.556 1.00 55.04 N ATOM 409 CA LYS A 27 17.252 19.174 -2.743 1.00 14.22 C ATOM 410 C LYS A 27 17.355 18.214 -3.924 1.00 50.33 C ATOM 411 O LYS A 27 17.773 18.600 -5.016 1.00 52.13 O ATOM 412 CB LYS A 27 16.094 20.149 -2.963 1.00 40.51 C ATOM 413 CG LYS A 27 15.448 20.628 -1.675 1.00 33.33 C ATOM 414 CD LYS A 27 13.932 20.583 -1.760 1.00 31.43 C ATOM 415 CE LYS A 27 13.362 21.914 -2.227 1.00 50.54 C ATOM 416 NZ LYS A 27 11.882 21.970 -2.065 1.00 33.23 N ATOM 0 H LYS A 27 18.787 20.461 -3.361 1.00 55.04 H new ATOM 0 HA LYS A 27 17.062 18.592 -1.841 1.00 14.22 H new ATOM 0 HB2 LYS A 27 16.458 21.012 -3.520 1.00 40.51 H new ATOM 0 HB3 LYS A 27 15.337 19.667 -3.582 1.00 40.51 H new ATOM 0 HG2 LYS A 27 15.785 20.007 -0.845 1.00 33.33 H new ATOM 0 HG3 LYS A 27 15.771 21.647 -1.462 1.00 33.33 H new ATOM 0 HD2 LYS A 27 13.628 19.794 -2.448 1.00 31.43 H new ATOM 0 HD3 LYS A 27 13.519 20.331 -0.783 1.00 31.43 H new ATOM 0 HE2 LYS A 27 13.820 22.724 -1.660 1.00 50.54 H new ATOM 0 HE3 LYS A 27 13.619 22.072 -3.274 1.00 50.54 H new ATOM 0 HZ1 LYS A 27 11.531 22.892 -2.394 1.00 33.23 H new ATOM 0 HZ2 LYS A 27 11.442 21.212 -2.626 1.00 33.23 H new ATOM 0 HZ3 LYS A 27 11.638 21.845 -1.062 1.00 33.23 H new ATOM 430 N LYS A 28 16.970 16.962 -3.699 1.00 30.23 N ATOM 431 CA LYS A 28 17.016 15.947 -4.745 1.00 25.41 C ATOM 432 C LYS A 28 15.611 15.581 -5.209 1.00 4.41 C ATOM 433 O LYS A 28 14.626 15.861 -4.523 1.00 73.54 O ATOM 434 CB LYS A 28 17.740 14.697 -4.239 1.00 62.30 C ATOM 435 CG LYS A 28 19.241 14.880 -4.095 1.00 54.14 C ATOM 436 CD LYS A 28 19.739 14.370 -2.753 1.00 44.25 C ATOM 437 CE LYS A 28 20.166 15.513 -1.846 1.00 4.01 C ATOM 438 NZ LYS A 28 19.051 15.974 -0.973 1.00 14.44 N ATOM 0 H LYS A 28 16.622 16.626 -2.801 1.00 30.23 H new ATOM 0 HA LYS A 28 17.564 16.358 -5.593 1.00 25.41 H new ATOM 0 HB2 LYS A 28 17.323 14.412 -3.273 1.00 62.30 H new ATOM 0 HB3 LYS A 28 17.547 13.873 -4.926 1.00 62.30 H new ATOM 0 HG2 LYS A 28 19.752 14.350 -4.899 1.00 54.14 H new ATOM 0 HG3 LYS A 28 19.491 15.936 -4.200 1.00 54.14 H new ATOM 0 HD2 LYS A 28 18.952 13.793 -2.267 1.00 44.25 H new ATOM 0 HD3 LYS A 28 20.580 13.694 -2.909 1.00 44.25 H new ATOM 0 HE2 LYS A 28 21.003 15.192 -1.227 1.00 4.01 H new ATOM 0 HE3 LYS A 28 20.520 16.346 -2.453 1.00 4.01 H new ATOM 0 HZ1 LYS A 28 19.080 17.010 -0.891 1.00 14.44 H new ATOM 0 HZ2 LYS A 28 18.142 15.685 -1.389 1.00 14.44 H new ATOM 0 HZ3 LYS A 28 19.151 15.549 -0.029 1.00 14.44 H new ATOM 452 N TYR A 29 15.523 14.951 -6.375 1.00 71.22 N ATOM 453 CA TYR A 29 14.236 14.547 -6.931 1.00 75.10 C ATOM 454 C TYR A 29 13.539 13.544 -6.017 1.00 64.43 C ATOM 455 O TYR A 29 14.189 12.800 -5.283 1.00 53.04 O ATOM 456 CB TYR A 29 14.427 13.940 -8.323 1.00 2.52 C ATOM 457 CG TYR A 29 14.577 14.972 -9.418 1.00 2.54 C ATOM 458 CD1 TYR A 29 15.823 15.492 -9.744 1.00 40.13 C ATOM 459 CD2 TYR A 29 13.471 15.424 -10.128 1.00 34.44 C ATOM 460 CE1 TYR A 29 15.963 16.435 -10.744 1.00 33.02 C ATOM 461 CE2 TYR A 29 13.603 16.366 -11.131 1.00 33.44 C ATOM 462 CZ TYR A 29 14.851 16.868 -11.434 1.00 31.23 C ATOM 463 OH TYR A 29 14.988 17.806 -12.432 1.00 4.41 O ATOM 0 H TYR A 29 16.327 14.709 -6.954 1.00 71.22 H new ATOM 0 HA TYR A 29 13.608 15.434 -7.012 1.00 75.10 H new ATOM 0 HB2 TYR A 29 15.310 13.301 -8.314 1.00 2.52 H new ATOM 0 HB3 TYR A 29 13.574 13.301 -8.552 1.00 2.52 H new ATOM 0 HD1 TYR A 29 16.697 15.154 -9.207 1.00 40.13 H new ATOM 0 HD2 TYR A 29 12.492 15.033 -9.892 1.00 34.44 H new ATOM 0 HE1 TYR A 29 16.939 16.831 -10.984 1.00 33.02 H new ATOM 0 HE2 TYR A 29 12.734 16.707 -11.674 1.00 33.44 H new ATOM 0 HH TYR A 29 15.835 18.285 -12.317 1.00 4.41 H new ATOM 473 N ARG A 30 12.211 13.531 -6.069 1.00 53.10 N ATOM 474 CA ARG A 30 11.423 12.621 -5.246 1.00 74.10 C ATOM 475 C ARG A 30 10.177 12.156 -5.992 1.00 2.40 C ATOM 476 O ARG A 30 9.825 12.702 -7.038 1.00 1.34 O ATOM 477 CB ARG A 30 11.024 13.300 -3.935 1.00 70.43 C ATOM 478 CG ARG A 30 11.549 12.592 -2.697 1.00 60.50 C ATOM 479 CD ARG A 30 10.416 12.167 -1.777 1.00 14.11 C ATOM 480 NE ARG A 30 10.911 11.633 -0.511 1.00 2.23 N ATOM 481 CZ ARG A 30 10.151 11.477 0.569 1.00 73.43 C ATOM 482 NH1 ARG A 30 8.870 11.814 0.535 1.00 40.32 N ATOM 483 NH2 ARG A 30 10.675 10.985 1.684 1.00 41.02 N ATOM 0 H ARG A 30 11.658 14.140 -6.672 1.00 53.10 H new ATOM 0 HA ARG A 30 12.037 11.749 -5.022 1.00 74.10 H new ATOM 0 HB2 ARG A 30 11.393 14.326 -3.940 1.00 70.43 H new ATOM 0 HB3 ARG A 30 9.937 13.353 -3.879 1.00 70.43 H new ATOM 0 HG2 ARG A 30 12.126 11.716 -2.994 1.00 60.50 H new ATOM 0 HG3 ARG A 30 12.228 13.253 -2.159 1.00 60.50 H new ATOM 0 HD2 ARG A 30 9.768 13.021 -1.582 1.00 14.11 H new ATOM 0 HD3 ARG A 30 9.808 11.413 -2.276 1.00 14.11 H new ATOM 0 HE ARG A 30 11.893 11.365 -0.452 1.00 2.23 H new ATOM 0 HH11 ARG A 30 8.465 12.194 -0.321 1.00 40.32 H new ATOM 0 HH12 ARG A 30 8.289 11.694 1.364 1.00 40.32 H new ATOM 0 HH21 ARG A 30 11.661 10.726 1.713 1.00 41.02 H new ATOM 0 HH22 ARG A 30 10.092 10.866 2.512 1.00 41.02 H new ATOM 497 N LEU A 31 9.511 11.143 -5.446 1.00 52.43 N ATOM 498 CA LEU A 31 8.302 10.603 -6.059 1.00 61.15 C ATOM 499 C LEU A 31 7.346 11.724 -6.457 1.00 52.44 C ATOM 500 O LEU A 31 6.714 11.670 -7.512 1.00 0.23 O ATOM 501 CB LEU A 31 7.605 9.640 -5.097 1.00 71.41 C ATOM 502 CG LEU A 31 7.471 8.194 -5.575 1.00 43.24 C ATOM 503 CD1 LEU A 31 8.813 7.483 -5.513 1.00 32.24 C ATOM 504 CD2 LEU A 31 6.433 7.452 -4.745 1.00 41.12 C ATOM 0 H LEU A 31 9.788 10.680 -4.581 1.00 52.43 H new ATOM 0 HA LEU A 31 8.592 10.061 -6.959 1.00 61.15 H new ATOM 0 HB2 LEU A 31 8.152 9.641 -4.154 1.00 71.41 H new ATOM 0 HB3 LEU A 31 6.608 10.026 -4.887 1.00 71.41 H new ATOM 0 HG LEU A 31 7.138 8.205 -6.613 1.00 43.24 H new ATOM 0 HD11 LEU A 31 8.697 6.455 -5.857 1.00 32.24 H new ATOM 0 HD12 LEU A 31 9.529 8.001 -6.152 1.00 32.24 H new ATOM 0 HD13 LEU A 31 9.177 7.482 -4.486 1.00 32.24 H new ATOM 0 HD21 LEU A 31 6.351 6.424 -5.099 1.00 41.12 H new ATOM 0 HD22 LEU A 31 6.737 7.452 -3.698 1.00 41.12 H new ATOM 0 HD23 LEU A 31 5.467 7.948 -4.842 1.00 41.12 H new ATOM 516 N LYS A 32 7.248 12.739 -5.606 1.00 42.42 N ATOM 517 CA LYS A 32 6.372 13.875 -5.869 1.00 22.30 C ATOM 518 C LYS A 32 6.597 14.423 -7.274 1.00 54.41 C ATOM 519 O LYS A 32 5.645 14.734 -7.990 1.00 64.02 O ATOM 520 CB LYS A 32 6.610 14.979 -4.836 1.00 14.11 C ATOM 521 CG LYS A 32 5.433 15.925 -4.673 1.00 40.14 C ATOM 522 CD LYS A 32 4.403 15.371 -3.702 1.00 31.50 C ATOM 523 CE LYS A 32 2.987 15.720 -4.134 1.00 20.12 C ATOM 524 NZ LYS A 32 2.647 17.137 -3.828 1.00 23.34 N ATOM 0 H LYS A 32 7.764 12.799 -4.728 1.00 42.42 H new ATOM 0 HA LYS A 32 5.341 13.531 -5.793 1.00 22.30 H new ATOM 0 HB2 LYS A 32 6.833 14.521 -3.872 1.00 14.11 H new ATOM 0 HB3 LYS A 32 7.489 15.554 -5.127 1.00 14.11 H new ATOM 0 HG2 LYS A 32 5.788 16.891 -4.316 1.00 40.14 H new ATOM 0 HG3 LYS A 32 4.965 16.096 -5.643 1.00 40.14 H new ATOM 0 HD2 LYS A 32 4.508 14.288 -3.637 1.00 31.50 H new ATOM 0 HD3 LYS A 32 4.589 15.770 -2.705 1.00 31.50 H new ATOM 0 HE2 LYS A 32 2.880 15.544 -5.204 1.00 20.12 H new ATOM 0 HE3 LYS A 32 2.281 15.060 -3.630 1.00 20.12 H new ATOM 0 HZ1 LYS A 32 1.674 17.335 -4.138 1.00 23.34 H new ATOM 0 HZ2 LYS A 32 2.724 17.299 -2.804 1.00 23.34 H new ATOM 0 HZ3 LYS A 32 3.305 17.768 -4.329 1.00 23.34 H new ATOM 538 N HIS A 33 7.862 14.535 -7.664 1.00 74.32 N ATOM 539 CA HIS A 33 8.214 15.043 -8.987 1.00 52.20 C ATOM 540 C HIS A 33 7.758 14.077 -10.077 1.00 41.23 C ATOM 541 O HIS A 33 7.377 14.565 -11.142 1.00 21.33 O ATOM 542 CB HIS A 33 9.724 15.267 -9.087 1.00 4.11 C ATOM 543 CG HIS A 33 10.239 16.305 -8.138 1.00 42.15 C ATOM 544 ND1 HIS A 33 11.082 16.013 -7.088 1.00 22.31 N ATOM 545 CD2 HIS A 33 10.025 17.641 -8.087 1.00 72.31 C ATOM 546 CE1 HIS A 33 11.365 17.124 -6.431 1.00 40.45 C ATOM 547 NE2 HIS A 33 10.736 18.127 -7.018 1.00 31.13 N ATOM 0 H HIS A 33 8.661 14.281 -7.084 1.00 74.32 H new ATOM 0 HA HIS A 33 7.704 15.995 -9.131 1.00 52.20 H new ATOM 0 HB2 HIS A 33 10.236 14.324 -8.895 1.00 4.11 H new ATOM 0 HB3 HIS A 33 9.973 15.563 -10.106 1.00 4.11 H new ATOM 0 HD2 HIS A 33 9.409 18.217 -8.762 1.00 72.31 H new ATOM 0 HE1 HIS A 33 12.002 17.199 -5.562 1.00 40.45 H new ATOM 0 HE2 HIS A 33 10.773 19.103 -6.725 1.00 31.13 H new ATOM 555 N ILE A 34 7.785 12.769 -9.850 1.00 11.43 N ATOM 556 CA ILE A 34 7.358 11.809 -10.860 1.00 70.01 C ATOM 557 C ILE A 34 5.868 11.947 -11.155 1.00 14.02 C ATOM 558 O ILE A 34 5.436 11.815 -12.300 1.00 51.14 O ATOM 559 CB ILE A 34 7.653 10.362 -10.422 1.00 45.33 C ATOM 560 CG1 ILE A 34 9.146 10.183 -10.144 1.00 41.04 C ATOM 561 CG2 ILE A 34 7.185 9.381 -11.488 1.00 22.10 C ATOM 562 CD1 ILE A 34 9.509 8.798 -9.659 1.00 10.14 C ATOM 0 H ILE A 34 8.098 12.349 -8.975 1.00 11.43 H new ATOM 0 HA ILE A 34 7.926 12.028 -11.764 1.00 70.01 H new ATOM 0 HB ILE A 34 7.106 10.158 -9.502 1.00 45.33 H new ATOM 0 HG12 ILE A 34 9.705 10.398 -11.055 1.00 41.04 H new ATOM 0 HG13 ILE A 34 9.458 10.914 -9.398 1.00 41.04 H new ATOM 0 HG21 ILE A 34 7.400 8.362 -11.165 1.00 22.10 H new ATOM 0 HG22 ILE A 34 6.112 9.494 -11.641 1.00 22.10 H new ATOM 0 HG23 ILE A 34 7.708 9.583 -12.423 1.00 22.10 H new ATOM 0 HD11 ILE A 34 10.583 8.744 -9.482 1.00 10.14 H new ATOM 0 HD12 ILE A 34 8.978 8.587 -8.731 1.00 10.14 H new ATOM 0 HD13 ILE A 34 9.228 8.063 -10.413 1.00 10.14 H new ATOM 574 N VAL A 35 5.087 12.214 -10.113 1.00 32.22 N ATOM 575 CA VAL A 35 3.645 12.372 -10.260 1.00 23.31 C ATOM 576 C VAL A 35 3.312 13.559 -11.158 1.00 43.32 C ATOM 577 O VAL A 35 2.595 13.418 -12.148 1.00 42.11 O ATOM 578 CB VAL A 35 2.960 12.568 -8.895 1.00 21.13 C ATOM 579 CG1 VAL A 35 1.464 12.774 -9.072 1.00 13.40 C ATOM 580 CG2 VAL A 35 3.240 11.382 -7.984 1.00 12.23 C ATOM 0 H VAL A 35 5.429 12.325 -9.158 1.00 32.22 H new ATOM 0 HA VAL A 35 3.271 11.456 -10.718 1.00 23.31 H new ATOM 0 HB VAL A 35 3.372 13.462 -8.427 1.00 21.13 H new ATOM 0 HG11 VAL A 35 0.998 12.911 -8.096 1.00 13.40 H new ATOM 0 HG12 VAL A 35 1.288 13.658 -9.685 1.00 13.40 H new ATOM 0 HG13 VAL A 35 1.032 11.901 -9.562 1.00 13.40 H new ATOM 0 HG21 VAL A 35 2.748 11.537 -7.024 1.00 12.23 H new ATOM 0 HG22 VAL A 35 2.858 10.471 -8.445 1.00 12.23 H new ATOM 0 HG23 VAL A 35 4.315 11.287 -7.830 1.00 12.23 H new ATOM 590 N TRP A 36 3.836 14.727 -10.805 1.00 34.31 N ATOM 591 CA TRP A 36 3.595 15.938 -11.580 1.00 24.31 C ATOM 592 C TRP A 36 3.894 15.709 -13.056 1.00 62.03 C ATOM 593 O TRP A 36 3.128 16.124 -13.927 1.00 31.25 O ATOM 594 CB TRP A 36 4.450 17.089 -11.045 1.00 63.11 C ATOM 595 CG TRP A 36 4.117 18.413 -11.664 1.00 53.33 C ATOM 596 CD1 TRP A 36 3.054 19.214 -11.364 1.00 24.11 C ATOM 597 CD2 TRP A 36 4.853 19.088 -12.691 1.00 44.25 C ATOM 598 NE1 TRP A 36 3.084 20.347 -12.142 1.00 4.52 N ATOM 599 CE2 TRP A 36 4.178 20.293 -12.964 1.00 44.12 C ATOM 600 CE3 TRP A 36 6.017 18.792 -13.406 1.00 1.30 C ATOM 601 CZ2 TRP A 36 4.629 21.199 -13.920 1.00 64.01 C ATOM 602 CZ3 TRP A 36 6.463 19.691 -14.355 1.00 32.43 C ATOM 603 CH2 TRP A 36 5.771 20.883 -14.605 1.00 21.12 C ATOM 0 H TRP A 36 4.431 14.861 -9.987 1.00 34.31 H new ATOM 0 HA TRP A 36 2.542 16.200 -11.480 1.00 24.31 H new ATOM 0 HB2 TRP A 36 4.320 17.158 -9.965 1.00 63.11 H new ATOM 0 HB3 TRP A 36 5.501 16.866 -11.225 1.00 63.11 H new ATOM 0 HD1 TRP A 36 2.300 18.991 -10.624 1.00 24.11 H new ATOM 0 HE1 TRP A 36 2.402 21.105 -12.112 1.00 4.52 H new ATOM 0 HE3 TRP A 36 6.558 17.876 -13.220 1.00 1.30 H new ATOM 0 HZ2 TRP A 36 4.097 22.118 -14.114 1.00 64.01 H new ATOM 0 HZ3 TRP A 36 7.361 19.471 -14.914 1.00 32.43 H new ATOM 0 HH2 TRP A 36 6.146 21.566 -15.353 1.00 21.12 H new ATOM 614 N ALA A 37 5.012 15.047 -13.333 1.00 51.23 N ATOM 615 CA ALA A 37 5.411 14.761 -14.706 1.00 40.24 C ATOM 616 C ALA A 37 4.334 13.966 -15.436 1.00 4.51 C ATOM 617 O ALA A 37 3.784 14.422 -16.437 1.00 64.34 O ATOM 618 CB ALA A 37 6.732 14.005 -14.725 1.00 62.01 C ATOM 0 H ALA A 37 5.658 14.698 -12.625 1.00 51.23 H new ATOM 0 HA ALA A 37 5.540 15.710 -15.226 1.00 40.24 H new ATOM 0 HB1 ALA A 37 7.018 13.798 -15.756 1.00 62.01 H new ATOM 0 HB2 ALA A 37 7.504 14.609 -14.249 1.00 62.01 H new ATOM 0 HB3 ALA A 37 6.621 13.065 -14.184 1.00 62.01 H new ATOM 624 N ALA A 38 4.038 12.774 -14.929 1.00 13.43 N ATOM 625 CA ALA A 38 3.026 11.916 -15.533 1.00 24.54 C ATOM 626 C ALA A 38 1.674 12.619 -15.589 1.00 3.42 C ATOM 627 O ALA A 38 0.893 12.411 -16.517 1.00 74.10 O ATOM 628 CB ALA A 38 2.912 10.610 -14.760 1.00 23.23 C ATOM 0 H ALA A 38 4.485 12.380 -14.101 1.00 13.43 H new ATOM 0 HA ALA A 38 3.334 11.695 -16.555 1.00 24.54 H new ATOM 0 HB1 ALA A 38 2.153 9.979 -15.222 1.00 23.23 H new ATOM 0 HB2 ALA A 38 3.872 10.093 -14.775 1.00 23.23 H new ATOM 0 HB3 ALA A 38 2.630 10.821 -13.729 1.00 23.23 H new ATOM 634 N ASN A 39 1.403 13.453 -14.590 1.00 4.31 N ATOM 635 CA ASN A 39 0.144 14.186 -14.526 1.00 20.14 C ATOM 636 C ASN A 39 0.044 15.197 -15.664 1.00 31.24 C ATOM 637 O ASN A 39 -0.875 15.142 -16.479 1.00 24.31 O ATOM 638 CB ASN A 39 0.014 14.901 -13.179 1.00 44.01 C ATOM 639 CG ASN A 39 -0.529 13.993 -12.093 1.00 25.44 C ATOM 640 OD1 ASN A 39 -0.022 12.893 -11.876 1.00 22.10 O ATOM 641 ND2 ASN A 39 -1.566 14.453 -11.402 1.00 2.54 N ATOM 0 H ASN A 39 2.038 13.638 -13.814 1.00 4.31 H new ATOM 0 HA ASN A 39 -0.671 13.469 -14.629 1.00 20.14 H new ATOM 0 HB2 ASN A 39 0.990 15.281 -12.877 1.00 44.01 H new ATOM 0 HB3 ASN A 39 -0.643 15.763 -13.290 1.00 44.01 H new ATOM 0 HD21 ASN A 39 -1.974 13.888 -10.657 1.00 2.54 H new ATOM 0 HD22 ASN A 39 -1.955 15.371 -11.616 1.00 2.54 H new ATOM 648 N LYS A 40 0.999 16.121 -15.712 1.00 14.43 N ATOM 649 CA LYS A 40 1.023 17.144 -16.750 1.00 2.31 C ATOM 650 C LYS A 40 0.844 16.522 -18.131 1.00 35.44 C ATOM 651 O LYS A 40 0.258 17.132 -19.026 1.00 54.22 O ATOM 652 CB LYS A 40 2.338 17.925 -16.696 1.00 12.31 C ATOM 653 CG LYS A 40 2.338 19.044 -15.669 1.00 74.35 C ATOM 654 CD LYS A 40 1.513 20.231 -16.138 1.00 32.13 C ATOM 655 CE LYS A 40 1.190 21.173 -14.989 1.00 4.03 C ATOM 656 NZ LYS A 40 0.732 22.505 -15.475 1.00 51.22 N ATOM 0 H LYS A 40 1.767 16.182 -15.043 1.00 14.43 H new ATOM 0 HA LYS A 40 0.194 17.829 -16.569 1.00 2.31 H new ATOM 0 HB2 LYS A 40 3.151 17.236 -16.470 1.00 12.31 H new ATOM 0 HB3 LYS A 40 2.541 18.346 -17.680 1.00 12.31 H new ATOM 0 HG2 LYS A 40 1.939 18.673 -14.725 1.00 74.35 H new ATOM 0 HG3 LYS A 40 3.362 19.364 -15.478 1.00 74.35 H new ATOM 0 HD2 LYS A 40 2.059 20.772 -16.911 1.00 32.13 H new ATOM 0 HD3 LYS A 40 0.587 19.876 -16.590 1.00 32.13 H new ATOM 0 HE2 LYS A 40 0.416 20.729 -14.362 1.00 4.03 H new ATOM 0 HE3 LYS A 40 2.074 21.299 -14.363 1.00 4.03 H new ATOM 0 HZ1 LYS A 40 0.522 23.118 -14.661 1.00 51.22 H new ATOM 0 HZ2 LYS A 40 1.480 22.940 -16.052 1.00 51.22 H new ATOM 0 HZ3 LYS A 40 -0.126 22.388 -16.051 1.00 51.22 H new ATOM 670 N LEU A 41 1.353 15.306 -18.297 1.00 42.23 N ATOM 671 CA LEU A 41 1.248 14.601 -19.570 1.00 53.33 C ATOM 672 C LEU A 41 -0.210 14.315 -19.917 1.00 32.44 C ATOM 673 O LEU A 41 -0.747 14.861 -20.881 1.00 10.30 O ATOM 674 CB LEU A 41 2.037 13.291 -19.516 1.00 22.12 C ATOM 675 CG LEU A 41 3.560 13.425 -19.508 1.00 23.05 C ATOM 676 CD1 LEU A 41 4.212 12.092 -19.177 1.00 40.21 C ATOM 677 CD2 LEU A 41 4.057 13.946 -20.849 1.00 41.41 C ATOM 0 H LEU A 41 1.842 14.788 -17.567 1.00 42.23 H new ATOM 0 HA LEU A 41 1.668 15.240 -20.346 1.00 53.33 H new ATOM 0 HB2 LEU A 41 1.736 12.745 -18.622 1.00 22.12 H new ATOM 0 HB3 LEU A 41 1.750 12.682 -20.373 1.00 22.12 H new ATOM 0 HG LEU A 41 3.838 14.143 -18.736 1.00 23.05 H new ATOM 0 HD11 LEU A 41 5.296 12.207 -19.176 1.00 40.21 H new ATOM 0 HD12 LEU A 41 3.882 11.760 -18.193 1.00 40.21 H new ATOM 0 HD13 LEU A 41 3.927 11.352 -19.925 1.00 40.21 H new ATOM 0 HD21 LEU A 41 5.143 14.035 -20.825 1.00 41.41 H new ATOM 0 HD22 LEU A 41 3.767 13.253 -21.639 1.00 41.41 H new ATOM 0 HD23 LEU A 41 3.617 14.924 -21.045 1.00 41.41 H new ATOM 689 N ASP A 42 -0.845 13.460 -19.124 1.00 15.44 N ATOM 690 CA ASP A 42 -2.241 13.104 -19.344 1.00 21.20 C ATOM 691 C ASP A 42 -3.088 14.351 -19.581 1.00 4.12 C ATOM 692 O ASP A 42 -3.933 14.379 -20.476 1.00 73.30 O ATOM 693 CB ASP A 42 -2.786 12.322 -18.148 1.00 22.44 C ATOM 694 CG ASP A 42 -2.909 10.839 -18.433 1.00 30.13 C ATOM 695 OD1 ASP A 42 -1.902 10.119 -18.269 1.00 14.31 O ATOM 696 OD2 ASP A 42 -4.011 10.397 -18.820 1.00 24.50 O ATOM 0 H ASP A 42 -0.414 13.000 -18.322 1.00 15.44 H new ATOM 0 HA ASP A 42 -2.294 12.475 -20.233 1.00 21.20 H new ATOM 0 HB2 ASP A 42 -2.129 12.471 -17.291 1.00 22.44 H new ATOM 0 HB3 ASP A 42 -3.764 12.718 -17.873 1.00 22.44 H new ATOM 701 N ARG A 43 -2.858 15.379 -18.771 1.00 73.52 N ATOM 702 CA ARG A 43 -3.601 16.628 -18.892 1.00 73.30 C ATOM 703 C ARG A 43 -3.337 17.290 -20.242 1.00 4.54 C ATOM 704 O ARG A 43 -4.245 17.435 -21.061 1.00 21.22 O ATOM 705 CB ARG A 43 -3.219 17.584 -17.760 1.00 2.20 C ATOM 706 CG ARG A 43 -4.347 17.840 -16.774 1.00 24.01 C ATOM 707 CD ARG A 43 -4.280 19.249 -16.204 1.00 10.31 C ATOM 708 NE ARG A 43 -3.958 19.248 -14.779 1.00 12.21 N ATOM 709 CZ ARG A 43 -4.819 18.894 -13.832 1.00 11.12 C ATOM 710 NH1 ARG A 43 -6.048 18.514 -14.155 1.00 75.34 N ATOM 711 NH2 ARG A 43 -4.452 18.918 -12.557 1.00 22.40 N ATOM 0 H ARG A 43 -2.163 15.372 -18.024 1.00 73.52 H new ATOM 0 HA ARG A 43 -4.664 16.398 -18.822 1.00 73.30 H new ATOM 0 HB2 ARG A 43 -2.364 17.174 -17.223 1.00 2.20 H new ATOM 0 HB3 ARG A 43 -2.900 18.534 -18.190 1.00 2.20 H new ATOM 0 HG2 ARG A 43 -5.306 17.692 -17.270 1.00 24.01 H new ATOM 0 HG3 ARG A 43 -4.293 17.115 -15.962 1.00 24.01 H new ATOM 0 HD2 ARG A 43 -3.528 19.824 -16.745 1.00 10.31 H new ATOM 0 HD3 ARG A 43 -5.236 19.749 -16.359 1.00 10.31 H new ATOM 0 HE ARG A 43 -3.021 19.535 -14.496 1.00 12.21 H new ATOM 0 HH11 ARG A 43 -6.335 18.493 -15.134 1.00 75.34 H new ATOM 0 HH12 ARG A 43 -6.706 18.243 -13.425 1.00 75.34 H new ATOM 0 HH21 ARG A 43 -3.508 19.209 -12.303 1.00 22.40 H new ATOM 0 HH22 ARG A 43 -5.114 18.646 -11.830 1.00 22.40 H new ATOM 725 N PHE A 44 -2.089 17.689 -20.465 1.00 43.14 N ATOM 726 CA PHE A 44 -1.707 18.337 -21.714 1.00 54.24 C ATOM 727 C PHE A 44 -2.225 17.551 -22.915 1.00 73.25 C ATOM 728 O PHE A 44 -2.748 18.126 -23.869 1.00 62.10 O ATOM 729 CB PHE A 44 -0.185 18.472 -21.798 1.00 11.24 C ATOM 730 CG PHE A 44 0.352 19.662 -21.055 1.00 73.03 C ATOM 731 CD1 PHE A 44 -0.188 20.922 -21.256 1.00 35.12 C ATOM 732 CD2 PHE A 44 1.395 19.520 -20.155 1.00 12.23 C ATOM 733 CE1 PHE A 44 0.306 22.019 -20.574 1.00 55.55 C ATOM 734 CE2 PHE A 44 1.892 20.612 -19.469 1.00 72.51 C ATOM 735 CZ PHE A 44 1.346 21.863 -19.679 1.00 42.22 C ATOM 0 H PHE A 44 -1.326 17.575 -19.798 1.00 43.14 H new ATOM 0 HA PHE A 44 -2.155 19.330 -21.731 1.00 54.24 H new ATOM 0 HB2 PHE A 44 0.275 17.567 -21.400 1.00 11.24 H new ATOM 0 HB3 PHE A 44 0.108 18.545 -22.845 1.00 11.24 H new ATOM 0 HD1 PHE A 44 -1.003 21.049 -21.953 1.00 35.12 H new ATOM 0 HD2 PHE A 44 1.825 18.544 -19.987 1.00 12.23 H new ATOM 0 HE1 PHE A 44 -0.121 22.997 -20.741 1.00 55.55 H new ATOM 0 HE2 PHE A 44 2.706 20.487 -18.770 1.00 72.51 H new ATOM 0 HZ PHE A 44 1.732 22.718 -19.144 1.00 42.22 H new ATOM 745 N GLY A 45 -2.075 16.230 -22.861 1.00 71.22 N ATOM 746 CA GLY A 45 -2.531 15.387 -23.950 1.00 33.11 C ATOM 747 C GLY A 45 -1.676 14.146 -24.120 1.00 41.31 C ATOM 748 O GLY A 45 -2.100 13.171 -24.742 1.00 43.30 O ATOM 0 H GLY A 45 -1.646 15.730 -22.082 1.00 71.22 H new ATOM 0 HA2 GLY A 45 -3.564 15.091 -23.768 1.00 33.11 H new ATOM 0 HA3 GLY A 45 -2.523 15.960 -24.877 1.00 33.11 H new ATOM 752 N LEU A 46 -0.469 14.181 -23.567 1.00 65.00 N ATOM 753 CA LEU A 46 0.449 13.051 -23.662 1.00 64.00 C ATOM 754 C LEU A 46 0.088 11.971 -22.647 1.00 74.12 C ATOM 755 O LEU A 46 -0.541 12.248 -21.627 1.00 30.21 O ATOM 756 CB LEU A 46 1.888 13.518 -23.436 1.00 0.13 C ATOM 757 CG LEU A 46 2.606 14.094 -24.657 1.00 71.50 C ATOM 758 CD1 LEU A 46 3.575 15.189 -24.238 1.00 70.32 C ATOM 759 CD2 LEU A 46 3.336 12.995 -25.415 1.00 41.13 C ATOM 0 H LEU A 46 -0.103 14.979 -23.048 1.00 65.00 H new ATOM 0 HA LEU A 46 0.364 12.627 -24.663 1.00 64.00 H new ATOM 0 HB2 LEU A 46 1.884 14.274 -22.651 1.00 0.13 H new ATOM 0 HB3 LEU A 46 2.468 12.674 -23.063 1.00 0.13 H new ATOM 0 HG LEU A 46 1.860 14.531 -25.321 1.00 71.50 H new ATOM 0 HD11 LEU A 46 4.077 15.587 -25.120 1.00 70.32 H new ATOM 0 HD12 LEU A 46 3.027 15.989 -23.740 1.00 70.32 H new ATOM 0 HD13 LEU A 46 4.316 14.776 -23.554 1.00 70.32 H new ATOM 0 HD21 LEU A 46 3.841 13.424 -26.281 1.00 41.13 H new ATOM 0 HD22 LEU A 46 4.072 12.528 -24.760 1.00 41.13 H new ATOM 0 HD23 LEU A 46 2.619 12.245 -25.748 1.00 41.13 H new ATOM 771 N ALA A 47 0.492 10.738 -22.935 1.00 62.24 N ATOM 772 CA ALA A 47 0.215 9.616 -22.047 1.00 60.25 C ATOM 773 C ALA A 47 1.436 9.271 -21.202 1.00 1.34 C ATOM 774 O ALA A 47 2.500 9.868 -21.360 1.00 31.24 O ATOM 775 CB ALA A 47 -0.231 8.404 -22.851 1.00 60.34 C ATOM 0 H ALA A 47 1.012 10.491 -23.777 1.00 62.24 H new ATOM 0 HA ALA A 47 -0.591 9.908 -21.373 1.00 60.25 H new ATOM 0 HB1 ALA A 47 -0.434 7.574 -22.175 1.00 60.34 H new ATOM 0 HB2 ALA A 47 -1.136 8.649 -23.407 1.00 60.34 H new ATOM 0 HB3 ALA A 47 0.557 8.120 -23.548 1.00 60.34 H new ATOM 781 N GLU A 48 1.275 8.305 -20.303 1.00 3.54 N ATOM 782 CA GLU A 48 2.364 7.883 -19.431 1.00 5.25 C ATOM 783 C GLU A 48 3.145 6.730 -20.055 1.00 43.34 C ATOM 784 O GLU A 48 3.919 6.053 -19.379 1.00 53.24 O ATOM 785 CB GLU A 48 1.819 7.463 -18.064 1.00 34.12 C ATOM 786 CG GLU A 48 0.801 6.338 -18.133 1.00 30.22 C ATOM 787 CD GLU A 48 0.752 5.515 -16.861 1.00 35.33 C ATOM 788 OE1 GLU A 48 0.486 6.095 -15.788 1.00 0.35 O ATOM 789 OE2 GLU A 48 0.983 4.289 -16.939 1.00 23.32 O ATOM 0 H GLU A 48 0.400 7.800 -20.160 1.00 3.54 H new ATOM 0 HA GLU A 48 3.039 8.729 -19.301 1.00 5.25 H new ATOM 0 HB2 GLU A 48 2.650 7.151 -17.431 1.00 34.12 H new ATOM 0 HB3 GLU A 48 1.360 8.328 -17.584 1.00 34.12 H new ATOM 0 HG2 GLU A 48 -0.186 6.758 -18.327 1.00 30.22 H new ATOM 0 HG3 GLU A 48 1.042 5.687 -18.973 1.00 30.22 H new ATOM 796 N SER A 49 2.935 6.514 -21.350 1.00 35.34 N ATOM 797 CA SER A 49 3.616 5.441 -22.065 1.00 52.34 C ATOM 798 C SER A 49 5.047 5.839 -22.409 1.00 34.04 C ATOM 799 O SER A 49 5.834 5.022 -22.888 1.00 51.04 O ATOM 800 CB SER A 49 2.852 5.087 -23.343 1.00 72.15 C ATOM 801 OG SER A 49 3.458 3.995 -24.014 1.00 1.23 O ATOM 0 H SER A 49 2.299 7.067 -21.925 1.00 35.34 H new ATOM 0 HA SER A 49 3.648 4.567 -21.414 1.00 52.34 H new ATOM 0 HB2 SER A 49 1.820 4.839 -23.096 1.00 72.15 H new ATOM 0 HB3 SER A 49 2.822 5.953 -24.004 1.00 72.15 H new ATOM 0 HG SER A 49 4.429 4.031 -23.887 1.00 1.23 H new ATOM 807 N LEU A 50 5.380 7.101 -22.160 1.00 63.24 N ATOM 808 CA LEU A 50 6.717 7.611 -22.443 1.00 70.40 C ATOM 809 C LEU A 50 7.503 7.823 -21.153 1.00 0.23 C ATOM 810 O LEU A 50 8.341 8.720 -21.064 1.00 61.00 O ATOM 811 CB LEU A 50 6.630 8.925 -23.221 1.00 42.21 C ATOM 812 CG LEU A 50 5.637 8.951 -24.385 1.00 11.12 C ATOM 813 CD1 LEU A 50 5.333 10.384 -24.794 1.00 44.24 C ATOM 814 CD2 LEU A 50 6.180 8.161 -25.566 1.00 55.22 C ATOM 0 H LEU A 50 4.742 7.790 -21.762 1.00 63.24 H new ATOM 0 HA LEU A 50 7.240 6.871 -23.049 1.00 70.40 H new ATOM 0 HB2 LEU A 50 6.363 9.720 -22.524 1.00 42.21 H new ATOM 0 HB3 LEU A 50 7.621 9.161 -23.609 1.00 42.21 H new ATOM 0 HG LEU A 50 4.709 8.484 -24.057 1.00 11.12 H new ATOM 0 HD11 LEU A 50 4.625 10.383 -25.623 1.00 44.24 H new ATOM 0 HD12 LEU A 50 4.901 10.920 -23.949 1.00 44.24 H new ATOM 0 HD13 LEU A 50 6.254 10.877 -25.104 1.00 44.24 H new ATOM 0 HD21 LEU A 50 5.461 8.190 -26.385 1.00 55.22 H new ATOM 0 HD22 LEU A 50 7.122 8.600 -25.895 1.00 55.22 H new ATOM 0 HD23 LEU A 50 6.347 7.126 -25.266 1.00 55.22 H new ATOM 826 N LEU A 51 7.228 6.989 -20.155 1.00 43.23 N ATOM 827 CA LEU A 51 7.910 7.083 -18.870 1.00 35.30 C ATOM 828 C LEU A 51 8.535 5.746 -18.486 1.00 54.14 C ATOM 829 O LEU A 51 9.580 5.701 -17.838 1.00 51.31 O ATOM 830 CB LEU A 51 6.933 7.532 -17.782 1.00 44.01 C ATOM 831 CG LEU A 51 6.526 9.006 -17.813 1.00 61.13 C ATOM 832 CD1 LEU A 51 5.354 9.256 -16.877 1.00 32.04 C ATOM 833 CD2 LEU A 51 7.706 9.893 -17.442 1.00 14.42 C ATOM 0 H LEU A 51 6.537 6.241 -20.212 1.00 43.23 H new ATOM 0 HA LEU A 51 8.705 7.822 -18.963 1.00 35.30 H new ATOM 0 HB2 LEU A 51 6.031 6.925 -17.858 1.00 44.01 H new ATOM 0 HB3 LEU A 51 7.379 7.319 -16.811 1.00 44.01 H new ATOM 0 HG LEU A 51 6.214 9.256 -18.827 1.00 61.13 H new ATOM 0 HD11 LEU A 51 5.079 10.310 -16.912 1.00 32.04 H new ATOM 0 HD12 LEU A 51 4.504 8.648 -17.188 1.00 32.04 H new ATOM 0 HD13 LEU A 51 5.638 8.989 -15.859 1.00 32.04 H new ATOM 0 HD21 LEU A 51 7.398 10.938 -17.469 1.00 14.42 H new ATOM 0 HD22 LEU A 51 8.049 9.642 -16.438 1.00 14.42 H new ATOM 0 HD23 LEU A 51 8.517 9.735 -18.152 1.00 14.42 H new ATOM 845 N GLU A 52 7.888 4.657 -18.893 1.00 71.23 N ATOM 846 CA GLU A 52 8.382 3.318 -18.593 1.00 33.43 C ATOM 847 C GLU A 52 9.559 2.958 -19.494 1.00 32.15 C ATOM 848 O GLU A 52 10.601 2.503 -19.020 1.00 52.23 O ATOM 849 CB GLU A 52 7.263 2.288 -18.760 1.00 71.42 C ATOM 850 CG GLU A 52 5.905 2.785 -18.294 1.00 50.43 C ATOM 851 CD GLU A 52 4.940 1.651 -18.000 1.00 61.53 C ATOM 852 OE1 GLU A 52 5.364 0.479 -18.065 1.00 50.15 O ATOM 853 OE2 GLU A 52 3.762 1.939 -17.703 1.00 44.14 O ATOM 0 H GLU A 52 7.021 4.676 -19.431 1.00 71.23 H new ATOM 0 HA GLU A 52 8.723 3.308 -17.558 1.00 33.43 H new ATOM 0 HB2 GLU A 52 7.196 2.004 -19.810 1.00 71.42 H new ATOM 0 HB3 GLU A 52 7.522 1.388 -18.202 1.00 71.42 H new ATOM 0 HG2 GLU A 52 6.032 3.391 -17.397 1.00 50.43 H new ATOM 0 HG3 GLU A 52 5.477 3.433 -19.059 1.00 50.43 H new ATOM 860 N SER A 53 9.386 3.165 -20.795 1.00 20.51 N ATOM 861 CA SER A 53 10.432 2.858 -21.764 1.00 62.34 C ATOM 862 C SER A 53 11.253 4.102 -22.089 1.00 34.44 C ATOM 863 O SER A 53 10.705 5.165 -22.379 1.00 21.43 O ATOM 864 CB SER A 53 9.818 2.290 -23.045 1.00 53.33 C ATOM 865 OG SER A 53 9.869 3.236 -24.099 1.00 31.05 O ATOM 0 H SER A 53 8.531 3.544 -21.203 1.00 20.51 H new ATOM 0 HA SER A 53 11.094 2.112 -21.324 1.00 62.34 H new ATOM 0 HB2 SER A 53 10.352 1.386 -23.338 1.00 53.33 H new ATOM 0 HB3 SER A 53 8.783 2.003 -22.860 1.00 53.33 H new ATOM 0 HG SER A 53 9.100 3.840 -24.034 1.00 31.05 H new ATOM 871 N LYS A 54 12.574 3.961 -22.038 1.00 23.25 N ATOM 872 CA LYS A 54 13.474 5.071 -22.327 1.00 40.21 C ATOM 873 C LYS A 54 13.222 5.625 -23.726 1.00 33.34 C ATOM 874 O LYS A 54 13.320 6.831 -23.951 1.00 10.21 O ATOM 875 CB LYS A 54 14.931 4.619 -22.201 1.00 2.01 C ATOM 876 CG LYS A 54 15.360 3.641 -23.281 1.00 44.14 C ATOM 877 CD LYS A 54 16.718 3.032 -22.974 1.00 23.22 C ATOM 878 CE LYS A 54 16.581 1.698 -22.256 1.00 24.51 C ATOM 879 NZ LYS A 54 16.706 0.548 -23.194 1.00 14.11 N ATOM 0 H LYS A 54 13.045 3.088 -21.799 1.00 23.25 H new ATOM 0 HA LYS A 54 13.281 5.861 -21.602 1.00 40.21 H new ATOM 0 HB2 LYS A 54 15.579 5.495 -22.238 1.00 2.01 H new ATOM 0 HB3 LYS A 54 15.076 4.156 -21.225 1.00 2.01 H new ATOM 0 HG2 LYS A 54 14.617 2.849 -23.372 1.00 44.14 H new ATOM 0 HG3 LYS A 54 15.399 4.153 -24.242 1.00 44.14 H new ATOM 0 HD2 LYS A 54 17.273 2.892 -23.901 1.00 23.22 H new ATOM 0 HD3 LYS A 54 17.296 3.721 -22.358 1.00 23.22 H new ATOM 0 HE2 LYS A 54 17.346 1.621 -21.483 1.00 24.51 H new ATOM 0 HE3 LYS A 54 15.615 1.654 -21.754 1.00 24.51 H new ATOM 0 HZ1 LYS A 54 16.607 -0.343 -22.666 1.00 14.11 H new ATOM 0 HZ2 LYS A 54 15.961 0.607 -23.917 1.00 14.11 H new ATOM 0 HZ3 LYS A 54 17.638 0.576 -23.655 1.00 14.11 H new ATOM 893 N GLU A 55 12.896 4.737 -24.660 1.00 21.33 N ATOM 894 CA GLU A 55 12.629 5.140 -26.036 1.00 31.31 C ATOM 895 C GLU A 55 11.434 6.087 -26.104 1.00 14.14 C ATOM 896 O GLU A 55 11.405 7.010 -26.917 1.00 75.13 O ATOM 897 CB GLU A 55 12.370 3.911 -26.909 1.00 73.13 C ATOM 898 CG GLU A 55 12.160 4.241 -28.377 1.00 34.22 C ATOM 899 CD GLU A 55 12.178 3.008 -29.261 1.00 65.42 C ATOM 900 OE1 GLU A 55 12.063 1.890 -28.719 1.00 1.33 O ATOM 901 OE2 GLU A 55 12.307 3.164 -30.493 1.00 72.03 O ATOM 0 H GLU A 55 12.810 3.735 -24.489 1.00 21.33 H new ATOM 0 HA GLU A 55 13.508 5.665 -26.411 1.00 31.31 H new ATOM 0 HB2 GLU A 55 13.213 3.226 -26.816 1.00 73.13 H new ATOM 0 HB3 GLU A 55 11.491 3.388 -26.533 1.00 73.13 H new ATOM 0 HG2 GLU A 55 11.207 4.756 -28.497 1.00 34.22 H new ATOM 0 HG3 GLU A 55 12.938 4.930 -28.705 1.00 34.22 H new ATOM 908 N GLY A 56 10.450 5.851 -25.242 1.00 5.22 N ATOM 909 CA GLY A 56 9.266 6.689 -25.221 1.00 22.02 C ATOM 910 C GLY A 56 9.560 8.095 -24.735 1.00 43.21 C ATOM 911 O GLY A 56 9.121 9.074 -25.342 1.00 13.51 O ATOM 0 H GLY A 56 10.452 5.094 -24.558 1.00 5.22 H new ATOM 0 HA2 GLY A 56 8.840 6.736 -26.223 1.00 22.02 H new ATOM 0 HA3 GLY A 56 8.514 6.234 -24.576 1.00 22.02 H new ATOM 915 N CYS A 57 10.301 8.197 -23.638 1.00 64.21 N ATOM 916 CA CYS A 57 10.651 9.493 -23.069 1.00 62.21 C ATOM 917 C CYS A 57 11.299 10.391 -24.118 1.00 45.43 C ATOM 918 O CYS A 57 11.077 11.601 -24.135 1.00 61.13 O ATOM 919 CB CYS A 57 11.596 9.314 -21.880 1.00 64.23 C ATOM 920 SG CYS A 57 11.014 10.085 -20.352 1.00 2.11 S ATOM 0 H CYS A 57 10.671 7.397 -23.124 1.00 64.21 H new ATOM 0 HA CYS A 57 9.733 9.970 -22.725 1.00 62.21 H new ATOM 0 HB2 CYS A 57 11.743 8.248 -21.704 1.00 64.23 H new ATOM 0 HB3 CYS A 57 12.569 9.732 -22.137 1.00 64.23 H new ATOM 0 HG CYS A 57 9.764 9.782 -20.162 1.00 2.11 H new ATOM 926 N GLN A 58 12.099 9.788 -24.991 1.00 31.52 N ATOM 927 CA GLN A 58 12.781 10.535 -26.043 1.00 11.44 C ATOM 928 C GLN A 58 11.776 11.216 -26.965 1.00 71.34 C ATOM 929 O GLN A 58 12.118 12.148 -27.694 1.00 33.41 O ATOM 930 CB GLN A 58 13.686 9.604 -26.852 1.00 53.10 C ATOM 931 CG GLN A 58 15.122 10.093 -26.958 1.00 41.42 C ATOM 932 CD GLN A 58 15.284 11.212 -27.967 1.00 72.24 C ATOM 933 OE1 GLN A 58 15.023 12.378 -27.668 1.00 13.43 O ATOM 934 NE2 GLN A 58 15.718 10.864 -29.174 1.00 30.13 N ATOM 0 H GLN A 58 12.291 8.786 -24.992 1.00 31.52 H new ATOM 0 HA GLN A 58 13.392 11.305 -25.571 1.00 11.44 H new ATOM 0 HB2 GLN A 58 13.680 8.616 -26.392 1.00 53.10 H new ATOM 0 HB3 GLN A 58 13.274 9.492 -27.855 1.00 53.10 H new ATOM 0 HG2 GLN A 58 15.457 10.439 -25.980 1.00 41.42 H new ATOM 0 HG3 GLN A 58 15.766 9.260 -27.239 1.00 41.42 H new ATOM 0 HE21 GLN A 58 15.923 9.886 -29.380 1.00 30.13 H new ATOM 0 HE22 GLN A 58 15.846 11.575 -29.894 1.00 30.13 H new ATOM 943 N LYS A 59 10.535 10.744 -26.931 1.00 22.52 N ATOM 944 CA LYS A 59 9.479 11.308 -27.764 1.00 2.11 C ATOM 945 C LYS A 59 8.907 12.574 -27.134 1.00 52.05 C ATOM 946 O LYS A 59 8.248 13.369 -27.806 1.00 61.20 O ATOM 947 CB LYS A 59 8.362 10.281 -27.973 1.00 33.54 C ATOM 948 CG LYS A 59 7.902 10.169 -29.415 1.00 70.32 C ATOM 949 CD LYS A 59 6.736 9.205 -29.555 1.00 25.44 C ATOM 950 CE LYS A 59 5.424 9.945 -29.773 1.00 74.32 C ATOM 951 NZ LYS A 59 5.267 10.391 -31.185 1.00 34.10 N ATOM 0 H LYS A 59 10.235 9.972 -26.336 1.00 22.52 H new ATOM 0 HA LYS A 59 9.912 11.567 -28.730 1.00 2.11 H new ATOM 0 HB2 LYS A 59 8.709 9.305 -27.634 1.00 33.54 H new ATOM 0 HB3 LYS A 59 7.510 10.551 -27.349 1.00 33.54 H new ATOM 0 HG2 LYS A 59 7.608 11.153 -29.782 1.00 70.32 H new ATOM 0 HG3 LYS A 59 8.731 9.832 -30.037 1.00 70.32 H new ATOM 0 HD2 LYS A 59 6.918 8.531 -30.392 1.00 25.44 H new ATOM 0 HD3 LYS A 59 6.663 8.588 -28.659 1.00 25.44 H new ATOM 0 HE2 LYS A 59 4.591 9.296 -29.503 1.00 74.32 H new ATOM 0 HE3 LYS A 59 5.381 10.810 -29.112 1.00 74.32 H new ATOM 0 HZ1 LYS A 59 4.361 10.891 -31.293 1.00 34.10 H new ATOM 0 HZ2 LYS A 59 6.047 11.031 -31.436 1.00 34.10 H new ATOM 0 HZ3 LYS A 59 5.282 9.563 -31.814 1.00 34.10 H new ATOM 965 N ILE A 60 9.164 12.756 -25.844 1.00 1.40 N ATOM 966 CA ILE A 60 8.676 13.927 -25.125 1.00 20.40 C ATOM 967 C ILE A 60 9.668 15.082 -25.222 1.00 1.42 C ATOM 968 O ILE A 60 9.306 16.194 -25.608 1.00 25.13 O ATOM 969 CB ILE A 60 8.418 13.610 -23.641 1.00 2.24 C ATOM 970 CG1 ILE A 60 7.210 12.681 -23.499 1.00 31.01 C ATOM 971 CG2 ILE A 60 8.200 14.894 -22.854 1.00 62.24 C ATOM 972 CD1 ILE A 60 6.851 12.372 -22.062 1.00 1.11 C ATOM 0 H ILE A 60 9.708 12.108 -25.274 1.00 1.40 H new ATOM 0 HA ILE A 60 7.736 14.217 -25.594 1.00 20.40 H new ATOM 0 HB ILE A 60 9.294 13.103 -23.236 1.00 2.24 H new ATOM 0 HG12 ILE A 60 6.351 13.138 -23.989 1.00 31.01 H new ATOM 0 HG13 ILE A 60 7.416 11.747 -24.022 1.00 31.01 H new ATOM 0 HG21 ILE A 60 8.019 14.652 -21.807 1.00 62.24 H new ATOM 0 HG22 ILE A 60 9.086 15.524 -22.933 1.00 62.24 H new ATOM 0 HG23 ILE A 60 7.339 15.426 -23.258 1.00 62.24 H new ATOM 0 HD11 ILE A 60 5.986 11.709 -22.038 1.00 1.11 H new ATOM 0 HD12 ILE A 60 7.695 11.886 -21.573 1.00 1.11 H new ATOM 0 HD13 ILE A 60 6.613 13.298 -21.539 1.00 1.11 H new ATOM 984 N LEU A 61 10.919 14.811 -24.870 1.00 33.21 N ATOM 985 CA LEU A 61 11.965 15.827 -24.917 1.00 43.12 C ATOM 986 C LEU A 61 12.143 16.359 -26.337 1.00 10.35 C ATOM 987 O LEU A 61 12.499 17.521 -26.536 1.00 22.23 O ATOM 988 CB LEU A 61 13.287 15.252 -24.407 1.00 3.13 C ATOM 989 CG LEU A 61 13.305 14.807 -22.945 1.00 5.54 C ATOM 990 CD1 LEU A 61 14.591 14.058 -22.630 1.00 4.14 C ATOM 991 CD2 LEU A 61 13.143 16.005 -22.020 1.00 74.35 C ATOM 0 H LEU A 61 11.235 13.896 -24.549 1.00 33.21 H new ATOM 0 HA LEU A 61 11.664 16.653 -24.273 1.00 43.12 H new ATOM 0 HB2 LEU A 61 13.553 14.398 -25.029 1.00 3.13 H new ATOM 0 HB3 LEU A 61 14.065 16.003 -24.547 1.00 3.13 H new ATOM 0 HG LEU A 61 12.466 14.131 -22.781 1.00 5.54 H new ATOM 0 HD11 LEU A 61 14.585 13.749 -21.585 1.00 4.14 H new ATOM 0 HD12 LEU A 61 14.665 13.177 -23.268 1.00 4.14 H new ATOM 0 HD13 LEU A 61 15.446 14.710 -22.811 1.00 4.14 H new ATOM 0 HD21 LEU A 61 13.158 15.669 -20.983 1.00 74.35 H new ATOM 0 HD22 LEU A 61 13.961 16.706 -22.186 1.00 74.35 H new ATOM 0 HD23 LEU A 61 12.194 16.499 -22.227 1.00 74.35 H new ATOM 1003 N THR A 62 11.890 15.502 -27.320 1.00 11.31 N ATOM 1004 CA THR A 62 12.021 15.884 -28.721 1.00 25.35 C ATOM 1005 C THR A 62 10.973 16.922 -29.107 1.00 51.51 C ATOM 1006 O THR A 62 11.240 17.822 -29.902 1.00 25.43 O ATOM 1007 CB THR A 62 11.887 14.665 -29.651 1.00 73.11 C ATOM 1008 OG1 THR A 62 12.492 14.947 -30.918 1.00 13.05 O ATOM 1009 CG2 THR A 62 10.425 14.296 -29.853 1.00 3.13 C ATOM 0 H THR A 62 11.593 14.538 -27.172 1.00 11.31 H new ATOM 0 HA THR A 62 13.016 16.314 -28.840 1.00 25.35 H new ATOM 0 HB THR A 62 12.397 13.822 -29.184 1.00 73.11 H new ATOM 0 HG1 THR A 62 12.404 14.166 -31.504 1.00 13.05 H new ATOM 0 HG21 THR A 62 10.356 13.432 -30.514 1.00 3.13 H new ATOM 0 HG22 THR A 62 9.975 14.054 -28.890 1.00 3.13 H new ATOM 0 HG23 THR A 62 9.896 15.138 -30.300 1.00 3.13 H new ATOM 1017 N VAL A 63 9.778 16.790 -28.538 1.00 11.31 N ATOM 1018 CA VAL A 63 8.690 17.718 -28.822 1.00 51.42 C ATOM 1019 C VAL A 63 8.892 19.041 -28.094 1.00 5.25 C ATOM 1020 O VAL A 63 8.794 20.113 -28.694 1.00 35.34 O ATOM 1021 CB VAL A 63 7.327 17.124 -28.417 1.00 5.41 C ATOM 1022 CG1 VAL A 63 6.214 18.135 -28.648 1.00 23.11 C ATOM 1023 CG2 VAL A 63 7.057 15.839 -29.184 1.00 43.32 C ATOM 0 H VAL A 63 9.540 16.050 -27.878 1.00 11.31 H new ATOM 0 HA VAL A 63 8.696 17.895 -29.898 1.00 51.42 H new ATOM 0 HB VAL A 63 7.356 16.887 -27.354 1.00 5.41 H new ATOM 0 HG11 VAL A 63 5.259 17.698 -28.356 1.00 23.11 H new ATOM 0 HG12 VAL A 63 6.403 19.027 -28.050 1.00 23.11 H new ATOM 0 HG13 VAL A 63 6.182 18.406 -29.703 1.00 23.11 H new ATOM 0 HG21 VAL A 63 6.090 15.433 -28.885 1.00 43.32 H new ATOM 0 HG22 VAL A 63 7.048 16.049 -30.254 1.00 43.32 H new ATOM 0 HG23 VAL A 63 7.839 15.112 -28.964 1.00 43.32 H new ATOM 1033 N LEU A 64 9.173 18.960 -26.798 1.00 43.01 N ATOM 1034 CA LEU A 64 9.390 20.153 -25.986 1.00 71.03 C ATOM 1035 C LEU A 64 10.747 20.780 -26.293 1.00 25.04 C ATOM 1036 O LEU A 64 11.023 21.910 -25.890 1.00 34.22 O ATOM 1037 CB LEU A 64 9.299 19.806 -24.500 1.00 14.12 C ATOM 1038 CG LEU A 64 8.113 18.934 -24.085 1.00 32.32 C ATOM 1039 CD1 LEU A 64 8.432 18.171 -22.808 1.00 44.15 C ATOM 1040 CD2 LEU A 64 6.865 19.785 -23.903 1.00 1.03 C ATOM 0 H LEU A 64 9.256 18.081 -26.287 1.00 43.01 H new ATOM 0 HA LEU A 64 8.612 20.877 -26.231 1.00 71.03 H new ATOM 0 HB2 LEU A 64 10.218 19.297 -24.210 1.00 14.12 H new ATOM 0 HB3 LEU A 64 9.257 20.736 -23.932 1.00 14.12 H new ATOM 0 HG LEU A 64 7.923 18.210 -24.878 1.00 32.32 H new ATOM 0 HD11 LEU A 64 7.577 17.556 -22.528 1.00 44.15 H new ATOM 0 HD12 LEU A 64 9.300 17.532 -22.973 1.00 44.15 H new ATOM 0 HD13 LEU A 64 8.649 18.877 -22.007 1.00 44.15 H new ATOM 0 HD21 LEU A 64 6.031 19.149 -23.608 1.00 1.03 H new ATOM 0 HD22 LEU A 64 7.043 20.532 -23.129 1.00 1.03 H new ATOM 0 HD23 LEU A 64 6.626 20.285 -24.841 1.00 1.03 H new ATOM 1052 N ASP A 65 11.586 20.041 -27.008 1.00 74.45 N ATOM 1053 CA ASP A 65 12.913 20.527 -27.371 1.00 55.23 C ATOM 1054 C ASP A 65 12.823 21.871 -28.085 1.00 70.32 C ATOM 1055 O ASP A 65 13.292 22.896 -27.592 1.00 23.23 O ATOM 1056 CB ASP A 65 13.625 19.507 -28.263 1.00 32.43 C ATOM 1057 CG ASP A 65 14.774 18.819 -27.552 1.00 3.25 C ATOM 1058 OD1 ASP A 65 14.757 18.772 -26.303 1.00 61.31 O ATOM 1059 OD2 ASP A 65 15.690 18.326 -28.243 1.00 44.02 O ATOM 0 H ASP A 65 11.372 19.103 -27.348 1.00 74.45 H new ATOM 0 HA ASP A 65 13.488 20.662 -26.455 1.00 55.23 H new ATOM 0 HB2 ASP A 65 12.908 18.758 -28.597 1.00 32.43 H new ATOM 0 HB3 ASP A 65 14.001 20.008 -29.155 1.00 32.43 H new ATOM 1064 N PRO A 66 12.208 21.869 -29.277 1.00 42.40 N ATOM 1065 CA PRO A 66 12.043 23.080 -30.086 1.00 3.44 C ATOM 1066 C PRO A 66 11.052 24.060 -29.467 1.00 21.15 C ATOM 1067 O PRO A 66 10.881 25.176 -29.955 1.00 24.30 O ATOM 1068 CB PRO A 66 11.507 22.548 -31.418 1.00 23.54 C ATOM 1069 CG PRO A 66 10.838 21.262 -31.071 1.00 31.44 C ATOM 1070 CD PRO A 66 11.625 20.683 -29.928 1.00 3.25 C ATOM 0 HA PRO A 66 12.975 23.638 -30.178 1.00 3.44 H new ATOM 0 HB2 PRO A 66 10.806 23.249 -31.871 1.00 23.54 H new ATOM 0 HB3 PRO A 66 12.313 22.394 -32.136 1.00 23.54 H new ATOM 0 HG2 PRO A 66 9.799 21.427 -30.786 1.00 31.44 H new ATOM 0 HG3 PRO A 66 10.831 20.583 -31.924 1.00 31.44 H new ATOM 0 HD2 PRO A 66 10.987 20.123 -29.244 1.00 3.25 H new ATOM 0 HD3 PRO A 66 12.397 19.997 -30.278 1.00 3.25 H new ATOM 1078 N MET A 67 10.402 23.635 -28.388 1.00 52.51 N ATOM 1079 CA MET A 67 9.429 24.476 -27.701 1.00 42.51 C ATOM 1080 C MET A 67 10.047 25.124 -26.467 1.00 24.42 C ATOM 1081 O MET A 67 9.495 26.074 -25.910 1.00 40.21 O ATOM 1082 CB MET A 67 8.204 23.652 -27.299 1.00 11.11 C ATOM 1083 CG MET A 67 7.421 23.108 -28.484 1.00 33.04 C ATOM 1084 SD MET A 67 6.216 24.288 -29.121 1.00 11.04 S ATOM 1085 CE MET A 67 5.145 23.203 -30.061 1.00 62.40 C ATOM 0 H MET A 67 10.532 22.713 -27.971 1.00 52.51 H new ATOM 0 HA MET A 67 9.118 25.264 -28.387 1.00 42.51 H new ATOM 0 HB2 MET A 67 8.526 22.819 -26.674 1.00 11.11 H new ATOM 0 HB3 MET A 67 7.544 24.271 -26.691 1.00 11.11 H new ATOM 0 HG2 MET A 67 8.115 22.838 -29.280 1.00 33.04 H new ATOM 0 HG3 MET A 67 6.907 22.194 -28.186 1.00 33.04 H new ATOM 0 HE1 MET A 67 4.346 23.787 -30.518 1.00 62.40 H new ATOM 0 HE2 MET A 67 5.723 22.707 -30.840 1.00 62.40 H new ATOM 0 HE3 MET A 67 4.713 22.454 -29.397 1.00 62.40 H new ATOM 1095 N VAL A 68 11.195 24.606 -26.043 1.00 64.12 N ATOM 1096 CA VAL A 68 11.888 25.136 -24.875 1.00 35.02 C ATOM 1097 C VAL A 68 11.969 26.657 -24.926 1.00 64.54 C ATOM 1098 O VAL A 68 11.513 27.359 -24.023 1.00 62.01 O ATOM 1099 CB VAL A 68 13.313 24.561 -24.759 1.00 2.43 C ATOM 1100 CG1 VAL A 68 14.243 25.569 -24.101 1.00 75.21 C ATOM 1101 CG2 VAL A 68 13.296 23.253 -23.983 1.00 53.10 C ATOM 0 H VAL A 68 11.665 23.819 -26.491 1.00 64.12 H new ATOM 0 HA VAL A 68 11.310 24.835 -24.001 1.00 35.02 H new ATOM 0 HB VAL A 68 13.688 24.358 -25.762 1.00 2.43 H new ATOM 0 HG11 VAL A 68 15.245 25.146 -24.027 1.00 75.21 H new ATOM 0 HG12 VAL A 68 14.276 26.479 -24.701 1.00 75.21 H new ATOM 0 HG13 VAL A 68 13.875 25.806 -23.103 1.00 75.21 H new ATOM 0 HG21 VAL A 68 14.310 22.860 -23.910 1.00 53.10 H new ATOM 0 HG22 VAL A 68 12.902 23.429 -22.982 1.00 53.10 H new ATOM 0 HG23 VAL A 68 12.664 22.531 -24.500 1.00 53.10 H new ATOM 1111 N PRO A 69 12.562 27.181 -26.009 1.00 24.50 N ATOM 1112 CA PRO A 69 12.715 28.626 -26.206 1.00 34.50 C ATOM 1113 C PRO A 69 11.385 29.319 -26.479 1.00 52.11 C ATOM 1114 O PRO A 69 11.157 30.446 -26.037 1.00 52.44 O ATOM 1115 CB PRO A 69 13.630 28.723 -27.429 1.00 43.34 C ATOM 1116 CG PRO A 69 13.406 27.449 -28.171 1.00 24.44 C ATOM 1117 CD PRO A 69 13.128 26.405 -27.124 1.00 71.04 C ATOM 0 HA PRO A 69 13.114 29.118 -25.319 1.00 34.50 H new ATOM 0 HB2 PRO A 69 13.380 29.588 -28.043 1.00 43.34 H new ATOM 0 HB3 PRO A 69 14.674 28.832 -27.135 1.00 43.34 H new ATOM 0 HG2 PRO A 69 12.568 27.542 -28.862 1.00 24.44 H new ATOM 0 HG3 PRO A 69 14.281 27.184 -28.764 1.00 24.44 H new ATOM 0 HD2 PRO A 69 12.428 25.651 -27.485 1.00 71.04 H new ATOM 0 HD3 PRO A 69 14.037 25.881 -26.828 1.00 71.04 H new ATOM 1125 N THR A 70 10.507 28.638 -27.209 1.00 0.53 N ATOM 1126 CA THR A 70 9.199 29.187 -27.542 1.00 23.13 C ATOM 1127 C THR A 70 8.124 28.655 -26.601 1.00 23.33 C ATOM 1128 O THR A 70 6.984 28.433 -27.007 1.00 63.32 O ATOM 1129 CB THR A 70 8.804 28.859 -28.993 1.00 71.25 C ATOM 1130 OG1 THR A 70 9.978 28.720 -29.801 1.00 21.42 O ATOM 1131 CG2 THR A 70 7.910 29.946 -29.570 1.00 44.22 C ATOM 0 H THR A 70 10.679 27.704 -27.581 1.00 0.53 H new ATOM 0 HA THR A 70 9.273 30.269 -27.430 1.00 23.13 H new ATOM 0 HB THR A 70 8.251 27.920 -28.992 1.00 71.25 H new ATOM 0 HG1 THR A 70 9.718 28.510 -30.722 1.00 21.42 H new ATOM 0 HG21 THR A 70 7.644 29.692 -30.596 1.00 44.22 H new ATOM 0 HG22 THR A 70 7.004 30.028 -28.970 1.00 44.22 H new ATOM 0 HG23 THR A 70 8.441 30.898 -29.558 1.00 44.22 H new ATOM 1139 N GLY A 71 8.494 28.453 -25.340 1.00 61.11 N ATOM 1140 CA GLY A 71 7.548 27.949 -24.361 1.00 75.10 C ATOM 1141 C GLY A 71 7.697 28.622 -23.011 1.00 70.44 C ATOM 1142 O GLY A 71 8.772 29.118 -22.672 1.00 15.43 O ATOM 0 H GLY A 71 9.432 28.629 -24.979 1.00 61.11 H new ATOM 0 HA2 GLY A 71 6.533 28.101 -24.729 1.00 75.10 H new ATOM 0 HA3 GLY A 71 7.688 26.874 -24.245 1.00 75.10 H new ATOM 1146 N SER A 72 6.616 28.641 -22.239 1.00 72.32 N ATOM 1147 CA SER A 72 6.630 29.264 -20.920 1.00 41.51 C ATOM 1148 C SER A 72 7.437 28.426 -19.933 1.00 23.42 C ATOM 1149 O SER A 72 7.903 27.337 -20.263 1.00 23.04 O ATOM 1150 CB SER A 72 5.201 29.445 -20.404 1.00 45.42 C ATOM 1151 OG SER A 72 4.763 28.296 -19.698 1.00 35.54 O ATOM 0 H SER A 72 5.719 28.233 -22.503 1.00 72.32 H new ATOM 0 HA SER A 72 7.103 30.242 -21.011 1.00 41.51 H new ATOM 0 HB2 SER A 72 5.155 30.316 -19.751 1.00 45.42 H new ATOM 0 HB3 SER A 72 4.531 29.638 -21.241 1.00 45.42 H new ATOM 0 HG SER A 72 3.848 28.438 -19.378 1.00 35.54 H new ATOM 1157 N GLU A 73 7.597 28.946 -18.719 1.00 11.02 N ATOM 1158 CA GLU A 73 8.350 28.247 -17.684 1.00 4.41 C ATOM 1159 C GLU A 73 7.767 26.859 -17.432 1.00 4.02 C ATOM 1160 O GLU A 73 8.498 25.907 -17.164 1.00 54.23 O ATOM 1161 CB GLU A 73 8.346 29.057 -16.386 1.00 1.45 C ATOM 1162 CG GLU A 73 9.634 29.825 -16.144 1.00 13.11 C ATOM 1163 CD GLU A 73 9.391 31.283 -15.808 1.00 41.04 C ATOM 1164 OE1 GLU A 73 8.964 31.566 -14.670 1.00 4.20 O ATOM 1165 OE2 GLU A 73 9.628 32.141 -16.684 1.00 44.11 O ATOM 0 H GLU A 73 7.216 29.847 -18.429 1.00 11.02 H new ATOM 0 HA GLU A 73 9.377 28.134 -18.030 1.00 4.41 H new ATOM 0 HB2 GLU A 73 7.513 29.759 -16.409 1.00 1.45 H new ATOM 0 HB3 GLU A 73 8.172 28.383 -15.547 1.00 1.45 H new ATOM 0 HG2 GLU A 73 10.185 29.355 -15.329 1.00 13.11 H new ATOM 0 HG3 GLU A 73 10.263 29.761 -17.032 1.00 13.11 H new ATOM 1172 N ASN A 74 6.445 26.754 -17.518 1.00 33.12 N ATOM 1173 CA ASN A 74 5.763 25.483 -17.298 1.00 30.33 C ATOM 1174 C ASN A 74 6.251 24.426 -18.285 1.00 24.45 C ATOM 1175 O ASN A 74 6.093 23.227 -18.055 1.00 21.11 O ATOM 1176 CB ASN A 74 4.249 25.663 -17.432 1.00 34.24 C ATOM 1177 CG ASN A 74 3.620 26.224 -16.172 1.00 13.33 C ATOM 1178 OD1 ASN A 74 4.294 26.415 -15.160 1.00 32.12 O ATOM 1179 ND2 ASN A 74 2.320 26.490 -16.228 1.00 35.41 N ATOM 0 H ASN A 74 5.825 27.533 -17.738 1.00 33.12 H new ATOM 0 HA ASN A 74 5.994 25.145 -16.288 1.00 30.33 H new ATOM 0 HB2 ASN A 74 4.038 26.330 -18.268 1.00 34.24 H new ATOM 0 HB3 ASN A 74 3.791 24.702 -17.667 1.00 34.24 H new ATOM 0 HD21 ASN A 74 1.841 26.868 -15.411 1.00 35.41 H new ATOM 0 HD22 ASN A 74 1.800 26.316 -17.088 1.00 35.41 H new ATOM 1186 N LEU A 75 6.844 24.880 -19.382 1.00 73.42 N ATOM 1187 CA LEU A 75 7.357 23.974 -20.405 1.00 23.22 C ATOM 1188 C LEU A 75 8.824 23.644 -20.153 1.00 54.32 C ATOM 1189 O LEU A 75 9.331 22.624 -20.623 1.00 32.13 O ATOM 1190 CB LEU A 75 7.193 24.596 -21.793 1.00 74.24 C ATOM 1191 CG LEU A 75 7.436 23.662 -22.979 1.00 41.14 C ATOM 1192 CD1 LEU A 75 6.228 23.647 -23.903 1.00 11.31 C ATOM 1193 CD2 LEU A 75 8.686 24.079 -23.740 1.00 60.03 C ATOM 0 H LEU A 75 6.982 25.870 -19.587 1.00 73.42 H new ATOM 0 HA LEU A 75 6.782 23.049 -20.358 1.00 23.22 H new ATOM 0 HB2 LEU A 75 6.182 24.997 -21.873 1.00 74.24 H new ATOM 0 HB3 LEU A 75 7.878 25.440 -21.874 1.00 74.24 H new ATOM 0 HG LEU A 75 7.588 22.653 -22.596 1.00 41.14 H new ATOM 0 HD11 LEU A 75 6.419 22.977 -24.741 1.00 11.31 H new ATOM 0 HD12 LEU A 75 5.353 23.300 -23.353 1.00 11.31 H new ATOM 0 HD13 LEU A 75 6.044 24.654 -24.278 1.00 11.31 H new ATOM 0 HD21 LEU A 75 8.843 23.403 -24.580 1.00 60.03 H new ATOM 0 HD22 LEU A 75 8.564 25.097 -24.111 1.00 60.03 H new ATOM 0 HD23 LEU A 75 9.548 24.037 -23.074 1.00 60.03 H new ATOM 1205 N LYS A 76 9.502 24.509 -19.408 1.00 22.11 N ATOM 1206 CA LYS A 76 10.911 24.309 -19.091 1.00 5.24 C ATOM 1207 C LYS A 76 11.069 23.405 -17.872 1.00 55.22 C ATOM 1208 O LYS A 76 11.845 22.448 -17.894 1.00 30.31 O ATOM 1209 CB LYS A 76 11.593 25.654 -18.832 1.00 35.42 C ATOM 1210 CG LYS A 76 12.716 25.963 -19.808 1.00 42.22 C ATOM 1211 CD LYS A 76 12.935 27.460 -19.949 1.00 42.10 C ATOM 1212 CE LYS A 76 12.408 27.979 -21.278 1.00 43.03 C ATOM 1213 NZ LYS A 76 10.922 27.919 -21.347 1.00 25.04 N ATOM 0 H LYS A 76 9.098 25.357 -19.011 1.00 22.11 H new ATOM 0 HA LYS A 76 11.386 23.827 -19.945 1.00 5.24 H new ATOM 0 HB2 LYS A 76 10.847 26.447 -18.886 1.00 35.42 H new ATOM 0 HB3 LYS A 76 11.992 25.661 -17.818 1.00 35.42 H new ATOM 0 HG2 LYS A 76 13.637 25.490 -19.466 1.00 42.22 H new ATOM 0 HG3 LYS A 76 12.481 25.535 -20.783 1.00 42.22 H new ATOM 0 HD2 LYS A 76 12.437 27.980 -19.131 1.00 42.10 H new ATOM 0 HD3 LYS A 76 13.999 27.682 -19.867 1.00 42.10 H new ATOM 0 HE2 LYS A 76 12.737 29.008 -21.422 1.00 43.03 H new ATOM 0 HE3 LYS A 76 12.833 27.392 -22.092 1.00 43.03 H new ATOM 0 HZ1 LYS A 76 10.598 28.344 -22.240 1.00 25.04 H new ATOM 0 HZ2 LYS A 76 10.612 26.927 -21.303 1.00 25.04 H new ATOM 0 HZ3 LYS A 76 10.516 28.444 -20.547 1.00 25.04 H new ATOM 1227 N SER A 77 10.330 23.712 -16.812 1.00 40.32 N ATOM 1228 CA SER A 77 10.391 22.928 -15.584 1.00 51.44 C ATOM 1229 C SER A 77 10.214 21.441 -15.879 1.00 40.13 C ATOM 1230 O SER A 77 10.999 20.608 -15.425 1.00 13.52 O ATOM 1231 CB SER A 77 9.315 23.395 -14.601 1.00 14.02 C ATOM 1232 OG SER A 77 9.878 23.695 -13.335 1.00 71.42 O ATOM 0 H SER A 77 9.681 24.498 -16.778 1.00 40.32 H new ATOM 0 HA SER A 77 11.373 23.078 -15.136 1.00 51.44 H new ATOM 0 HB2 SER A 77 8.813 24.277 -14.998 1.00 14.02 H new ATOM 0 HB3 SER A 77 8.557 22.620 -14.491 1.00 14.02 H new ATOM 0 HG SER A 77 9.171 23.993 -12.725 1.00 71.42 H new ATOM 1238 N LEU A 78 9.177 21.116 -16.643 1.00 13.24 N ATOM 1239 CA LEU A 78 8.895 19.730 -17.000 1.00 52.00 C ATOM 1240 C LEU A 78 9.969 19.178 -17.933 1.00 24.12 C ATOM 1241 O LEU A 78 10.318 18.000 -17.867 1.00 53.35 O ATOM 1242 CB LEU A 78 7.521 19.623 -17.666 1.00 34.14 C ATOM 1243 CG LEU A 78 7.157 18.252 -18.237 1.00 13.54 C ATOM 1244 CD1 LEU A 78 6.990 17.235 -17.117 1.00 62.32 C ATOM 1245 CD2 LEU A 78 5.888 18.343 -19.070 1.00 42.54 C ATOM 0 H LEU A 78 8.518 21.793 -17.027 1.00 13.24 H new ATOM 0 HA LEU A 78 8.896 19.138 -16.085 1.00 52.00 H new ATOM 0 HB2 LEU A 78 6.762 19.903 -16.935 1.00 34.14 H new ATOM 0 HB3 LEU A 78 7.472 20.355 -18.472 1.00 34.14 H new ATOM 0 HG LEU A 78 7.970 17.920 -18.883 1.00 13.54 H new ATOM 0 HD11 LEU A 78 6.731 16.265 -17.542 1.00 62.32 H new ATOM 0 HD12 LEU A 78 7.923 17.150 -16.561 1.00 62.32 H new ATOM 0 HD13 LEU A 78 6.196 17.561 -16.445 1.00 62.32 H new ATOM 0 HD21 LEU A 78 5.643 17.359 -19.469 1.00 42.54 H new ATOM 0 HD22 LEU A 78 5.067 18.696 -18.445 1.00 42.54 H new ATOM 0 HD23 LEU A 78 6.043 19.040 -19.894 1.00 42.54 H new ATOM 1257 N PHE A 79 10.490 20.039 -18.801 1.00 24.44 N ATOM 1258 CA PHE A 79 11.525 19.639 -19.747 1.00 22.12 C ATOM 1259 C PHE A 79 12.771 19.152 -19.015 1.00 34.10 C ATOM 1260 O PHE A 79 13.374 18.148 -19.393 1.00 53.33 O ATOM 1261 CB PHE A 79 11.885 20.809 -20.666 1.00 2.10 C ATOM 1262 CG PHE A 79 12.971 20.485 -21.651 1.00 53.45 C ATOM 1263 CD1 PHE A 79 12.758 19.557 -22.658 1.00 3.13 C ATOM 1264 CD2 PHE A 79 14.206 21.106 -21.570 1.00 33.14 C ATOM 1265 CE1 PHE A 79 13.755 19.256 -23.567 1.00 32.33 C ATOM 1266 CE2 PHE A 79 15.208 20.810 -22.475 1.00 42.33 C ATOM 1267 CZ PHE A 79 14.982 19.884 -23.474 1.00 54.34 C ATOM 0 H PHE A 79 10.212 21.018 -18.869 1.00 24.44 H new ATOM 0 HA PHE A 79 11.135 18.819 -20.349 1.00 22.12 H new ATOM 0 HB2 PHE A 79 10.993 21.121 -21.210 1.00 2.10 H new ATOM 0 HB3 PHE A 79 12.199 21.656 -20.056 1.00 2.10 H new ATOM 0 HD1 PHE A 79 11.801 19.063 -22.734 1.00 3.13 H new ATOM 0 HD2 PHE A 79 14.389 21.831 -20.790 1.00 33.14 H new ATOM 0 HE1 PHE A 79 13.575 18.532 -24.348 1.00 32.33 H new ATOM 0 HE2 PHE A 79 16.166 21.302 -22.401 1.00 42.33 H new ATOM 0 HZ PHE A 79 15.764 19.651 -24.182 1.00 54.34 H new ATOM 1277 N ASN A 80 13.153 19.870 -17.964 1.00 10.03 N ATOM 1278 CA ASN A 80 14.328 19.511 -17.178 1.00 64.53 C ATOM 1279 C ASN A 80 14.082 18.233 -16.384 1.00 24.24 C ATOM 1280 O ASN A 80 15.003 17.455 -16.137 1.00 13.45 O ATOM 1281 CB ASN A 80 14.700 20.652 -16.229 1.00 73.20 C ATOM 1282 CG ASN A 80 15.940 21.400 -16.681 1.00 23.22 C ATOM 1283 OD1 ASN A 80 16.863 20.811 -17.244 1.00 22.33 O ATOM 1284 ND2 ASN A 80 15.966 22.706 -16.435 1.00 54.52 N ATOM 0 H ASN A 80 12.666 20.704 -17.637 1.00 10.03 H new ATOM 0 HA ASN A 80 15.155 19.335 -17.866 1.00 64.53 H new ATOM 0 HB2 ASN A 80 13.865 21.349 -16.158 1.00 73.20 H new ATOM 0 HB3 ASN A 80 14.866 20.250 -15.229 1.00 73.20 H new ATOM 0 HD21 ASN A 80 16.774 23.262 -16.716 1.00 54.52 H new ATOM 0 HD22 ASN A 80 15.178 23.152 -15.966 1.00 54.52 H new ATOM 1291 N THR A 81 12.831 18.022 -15.985 1.00 75.42 N ATOM 1292 CA THR A 81 12.463 16.839 -15.218 1.00 3.21 C ATOM 1293 C THR A 81 12.391 15.605 -16.110 1.00 42.31 C ATOM 1294 O THR A 81 12.805 14.515 -15.714 1.00 60.33 O ATOM 1295 CB THR A 81 11.108 17.027 -14.511 1.00 42.51 C ATOM 1296 OG1 THR A 81 11.146 18.191 -13.678 1.00 31.41 O ATOM 1297 CG2 THR A 81 10.760 15.807 -13.671 1.00 34.10 C ATOM 0 H THR A 81 12.056 18.656 -16.181 1.00 75.42 H new ATOM 0 HA THR A 81 13.240 16.696 -14.467 1.00 3.21 H new ATOM 0 HB THR A 81 10.341 17.153 -15.275 1.00 42.51 H new ATOM 0 HG1 THR A 81 11.084 18.994 -14.236 1.00 31.41 H new ATOM 0 HG21 THR A 81 9.799 15.964 -13.182 1.00 34.10 H new ATOM 0 HG22 THR A 81 10.701 14.928 -14.313 1.00 34.10 H new ATOM 0 HG23 THR A 81 11.531 15.653 -12.916 1.00 34.10 H new ATOM 1305 N VAL A 82 11.863 15.783 -17.317 1.00 20.31 N ATOM 1306 CA VAL A 82 11.739 14.684 -18.267 1.00 63.34 C ATOM 1307 C VAL A 82 13.103 14.097 -18.610 1.00 45.11 C ATOM 1308 O VAL A 82 13.241 12.887 -18.793 1.00 21.04 O ATOM 1309 CB VAL A 82 11.046 15.141 -19.566 1.00 15.21 C ATOM 1310 CG1 VAL A 82 11.065 14.025 -20.601 1.00 24.35 C ATOM 1311 CG2 VAL A 82 9.623 15.591 -19.280 1.00 2.22 C ATOM 0 H VAL A 82 11.514 16.678 -17.660 1.00 20.31 H new ATOM 0 HA VAL A 82 11.128 13.919 -17.788 1.00 63.34 H new ATOM 0 HB VAL A 82 11.595 15.990 -19.972 1.00 15.21 H new ATOM 0 HG11 VAL A 82 10.572 14.365 -21.512 1.00 24.35 H new ATOM 0 HG12 VAL A 82 12.097 13.755 -20.826 1.00 24.35 H new ATOM 0 HG13 VAL A 82 10.540 13.155 -20.207 1.00 24.35 H new ATOM 0 HG21 VAL A 82 9.149 15.910 -20.208 1.00 2.22 H new ATOM 0 HG22 VAL A 82 9.059 14.763 -18.850 1.00 2.22 H new ATOM 0 HG23 VAL A 82 9.639 16.423 -18.576 1.00 2.22 H new ATOM 1321 N CYS A 83 14.108 14.962 -18.696 1.00 71.32 N ATOM 1322 CA CYS A 83 15.464 14.529 -19.017 1.00 44.13 C ATOM 1323 C CYS A 83 15.995 13.572 -17.956 1.00 41.12 C ATOM 1324 O CYS A 83 16.755 12.652 -18.258 1.00 74.24 O ATOM 1325 CB CYS A 83 16.391 15.738 -19.142 1.00 31.42 C ATOM 1326 SG CYS A 83 16.183 16.674 -20.675 1.00 44.13 S ATOM 0 H CYS A 83 14.010 15.966 -18.548 1.00 71.32 H new ATOM 0 HA CYS A 83 15.435 14.003 -19.971 1.00 44.13 H new ATOM 0 HB2 CYS A 83 16.218 16.404 -18.296 1.00 31.42 H new ATOM 0 HB3 CYS A 83 17.424 15.398 -19.074 1.00 31.42 H new ATOM 0 HG CYS A 83 15.163 17.472 -20.561 1.00 44.13 H new ATOM 1332 N VAL A 84 15.591 13.796 -16.709 1.00 51.44 N ATOM 1333 CA VAL A 84 16.026 12.953 -15.602 1.00 1.34 C ATOM 1334 C VAL A 84 15.453 11.546 -15.722 1.00 62.45 C ATOM 1335 O VAL A 84 16.151 10.559 -15.491 1.00 52.25 O ATOM 1336 CB VAL A 84 15.610 13.551 -14.245 1.00 15.31 C ATOM 1337 CG1 VAL A 84 16.014 12.625 -13.107 1.00 5.32 C ATOM 1338 CG2 VAL A 84 16.221 14.932 -14.061 1.00 44.10 C ATOM 0 H VAL A 84 14.963 14.554 -16.441 1.00 51.44 H new ATOM 0 HA VAL A 84 17.114 12.903 -15.652 1.00 1.34 H new ATOM 0 HB VAL A 84 14.525 13.654 -14.231 1.00 15.31 H new ATOM 0 HG11 VAL A 84 15.712 13.064 -12.156 1.00 5.32 H new ATOM 0 HG12 VAL A 84 15.525 11.659 -13.233 1.00 5.32 H new ATOM 0 HG13 VAL A 84 17.095 12.488 -13.116 1.00 5.32 H new ATOM 0 HG21 VAL A 84 15.916 15.339 -13.097 1.00 44.10 H new ATOM 0 HG22 VAL A 84 17.308 14.857 -14.096 1.00 44.10 H new ATOM 0 HG23 VAL A 84 15.877 15.591 -14.858 1.00 44.10 H new ATOM 1348 N ILE A 85 14.178 11.462 -16.087 1.00 23.11 N ATOM 1349 CA ILE A 85 13.510 10.175 -16.240 1.00 72.01 C ATOM 1350 C ILE A 85 14.182 9.333 -17.319 1.00 24.40 C ATOM 1351 O ILE A 85 14.412 8.138 -17.135 1.00 64.40 O ATOM 1352 CB ILE A 85 12.021 10.351 -16.593 1.00 31.45 C ATOM 1353 CG1 ILE A 85 11.281 11.040 -15.445 1.00 61.53 C ATOM 1354 CG2 ILE A 85 11.389 9.004 -16.906 1.00 4.33 C ATOM 1355 CD1 ILE A 85 11.015 10.132 -14.266 1.00 2.20 C ATOM 0 H ILE A 85 13.587 12.270 -16.282 1.00 23.11 H new ATOM 0 HA ILE A 85 13.588 9.662 -15.281 1.00 72.01 H new ATOM 0 HB ILE A 85 11.944 10.981 -17.479 1.00 31.45 H new ATOM 0 HG12 ILE A 85 11.866 11.896 -15.109 1.00 61.53 H new ATOM 0 HG13 ILE A 85 10.332 11.428 -15.816 1.00 61.53 H new ATOM 0 HG21 ILE A 85 10.337 9.144 -17.154 1.00 4.33 H new ATOM 0 HG22 ILE A 85 11.903 8.549 -17.752 1.00 4.33 H new ATOM 0 HG23 ILE A 85 11.473 8.352 -16.037 1.00 4.33 H new ATOM 0 HD11 ILE A 85 10.488 10.688 -13.491 1.00 2.20 H new ATOM 0 HD12 ILE A 85 10.404 9.288 -14.587 1.00 2.20 H new ATOM 0 HD13 ILE A 85 11.961 9.764 -13.869 1.00 2.20 H new ATOM 1367 N TRP A 86 14.494 9.965 -18.445 1.00 21.10 N ATOM 1368 CA TRP A 86 15.141 9.274 -19.555 1.00 12.22 C ATOM 1369 C TRP A 86 16.538 8.805 -19.164 1.00 30.43 C ATOM 1370 O TRP A 86 16.987 7.740 -19.589 1.00 74.43 O ATOM 1371 CB TRP A 86 15.220 10.190 -20.777 1.00 1.25 C ATOM 1372 CG TRP A 86 15.803 9.522 -21.984 1.00 12.11 C ATOM 1373 CD1 TRP A 86 15.119 8.871 -22.972 1.00 71.11 C ATOM 1374 CD2 TRP A 86 17.191 9.436 -22.331 1.00 5.43 C ATOM 1375 NE1 TRP A 86 15.998 8.386 -23.911 1.00 24.12 N ATOM 1376 CE2 TRP A 86 17.274 8.721 -23.541 1.00 11.43 C ATOM 1377 CE3 TRP A 86 18.368 9.895 -21.737 1.00 32.23 C ATOM 1378 CZ2 TRP A 86 18.489 8.454 -24.165 1.00 34.21 C ATOM 1379 CZ3 TRP A 86 19.574 9.631 -22.357 1.00 52.52 C ATOM 1380 CH2 TRP A 86 19.627 8.916 -23.562 1.00 32.45 C ATOM 0 H TRP A 86 14.310 10.954 -18.614 1.00 21.10 H new ATOM 0 HA TRP A 86 14.541 8.399 -19.805 1.00 12.22 H new ATOM 0 HB2 TRP A 86 14.220 10.550 -21.018 1.00 1.25 H new ATOM 0 HB3 TRP A 86 15.822 11.064 -20.528 1.00 1.25 H new ATOM 0 HD1 TRP A 86 14.046 8.755 -23.009 1.00 71.11 H new ATOM 0 HE1 TRP A 86 15.742 7.862 -24.748 1.00 24.12 H new ATOM 0 HE3 TRP A 86 18.336 10.447 -20.809 1.00 32.23 H new ATOM 0 HZ2 TRP A 86 18.532 7.902 -25.092 1.00 34.21 H new ATOM 0 HZ3 TRP A 86 20.491 9.981 -21.906 1.00 52.52 H new ATOM 0 HH2 TRP A 86 20.585 8.726 -24.023 1.00 32.45 H new ATOM 1391 N CYS A 87 17.220 9.606 -18.352 1.00 61.03 N ATOM 1392 CA CYS A 87 18.567 9.272 -17.905 1.00 21.52 C ATOM 1393 C CYS A 87 18.561 8.005 -17.057 1.00 13.13 C ATOM 1394 O CYS A 87 19.348 7.087 -17.288 1.00 52.44 O ATOM 1395 CB CYS A 87 19.163 10.432 -17.105 1.00 60.33 C ATOM 1396 SG CYS A 87 20.027 11.658 -18.116 1.00 0.24 S ATOM 0 H CYS A 87 16.862 10.490 -17.990 1.00 61.03 H new ATOM 0 HA CYS A 87 19.182 9.094 -18.787 1.00 21.52 H new ATOM 0 HB2 CYS A 87 18.364 10.929 -16.555 1.00 60.33 H new ATOM 0 HB3 CYS A 87 19.857 10.031 -16.366 1.00 60.33 H new ATOM 0 HG CYS A 87 19.171 12.519 -18.580 1.00 0.24 H new ATOM 1402 N ILE A 88 17.669 7.962 -16.073 1.00 45.11 N ATOM 1403 CA ILE A 88 17.561 6.807 -15.190 1.00 62.11 C ATOM 1404 C ILE A 88 17.451 5.513 -15.989 1.00 44.11 C ATOM 1405 O ILE A 88 18.051 4.499 -15.633 1.00 0.32 O ATOM 1406 CB ILE A 88 16.341 6.925 -14.256 1.00 34.43 C ATOM 1407 CG1 ILE A 88 16.438 8.200 -13.416 1.00 30.42 C ATOM 1408 CG2 ILE A 88 16.241 5.701 -13.359 1.00 35.23 C ATOM 1409 CD1 ILE A 88 15.097 8.715 -12.942 1.00 51.50 C ATOM 0 H ILE A 88 17.011 8.713 -15.867 1.00 45.11 H new ATOM 0 HA ILE A 88 18.469 6.784 -14.588 1.00 62.11 H new ATOM 0 HB ILE A 88 15.439 6.980 -14.865 1.00 34.43 H new ATOM 0 HG12 ILE A 88 17.071 8.007 -12.550 1.00 30.42 H new ATOM 0 HG13 ILE A 88 16.929 8.976 -14.003 1.00 30.42 H new ATOM 0 HG21 ILE A 88 15.375 5.799 -12.705 1.00 35.23 H new ATOM 0 HG22 ILE A 88 16.133 4.807 -13.974 1.00 35.23 H new ATOM 0 HG23 ILE A 88 17.144 5.618 -12.755 1.00 35.23 H new ATOM 0 HD11 ILE A 88 15.243 9.620 -12.353 1.00 51.50 H new ATOM 0 HD12 ILE A 88 14.468 8.940 -13.804 1.00 51.50 H new ATOM 0 HD13 ILE A 88 14.612 7.956 -12.327 1.00 51.50 H new ATOM 1421 N HIS A 89 16.681 5.555 -17.072 1.00 63.23 N ATOM 1422 CA HIS A 89 16.494 4.387 -17.924 1.00 44.40 C ATOM 1423 C HIS A 89 17.649 4.244 -18.910 1.00 53.13 C ATOM 1424 O HIS A 89 18.050 3.106 -19.150 1.00 74.55 O ATOM 1425 CB HIS A 89 15.170 4.490 -18.684 1.00 14.53 C ATOM 1426 CG HIS A 89 13.973 4.590 -17.789 1.00 23.34 C ATOM 1427 ND1 HIS A 89 13.830 3.849 -16.636 1.00 23.23 N ATOM 1428 CD2 HIS A 89 12.860 5.354 -17.883 1.00 64.30 C ATOM 1429 CE1 HIS A 89 12.679 4.151 -16.060 1.00 33.52 C ATOM 1430 NE2 HIS A 89 12.072 5.064 -16.798 1.00 21.05 N ATOM 0 H HIS A 89 16.176 6.386 -17.380 1.00 63.23 H new ATOM 0 HA HIS A 89 16.471 3.503 -17.287 1.00 44.40 H new ATOM 0 HB2 HIS A 89 15.201 5.364 -19.335 1.00 14.53 H new ATOM 0 HB3 HIS A 89 15.061 3.617 -19.327 1.00 14.53 H new ATOM 0 HD2 HIS A 89 12.634 6.061 -18.667 1.00 64.30 H new ATOM 0 HE1 HIS A 89 12.300 3.725 -15.143 1.00 33.52 H new ATOM 0 HE2 HIS A 89 11.165 5.485 -16.594 1.00 21.05 H new ATOM 1438 N ALA A 90 18.176 5.329 -19.469 1.00 24.13 N ATOM 1439 CA ALA A 90 19.281 5.243 -20.414 1.00 15.30 C ATOM 1440 C ALA A 90 20.524 4.653 -19.754 1.00 44.13 C ATOM 1441 O ALA A 90 21.466 4.248 -20.435 1.00 5.25 O ATOM 1442 CB ALA A 90 19.590 6.615 -20.993 1.00 31.41 C ATOM 0 H ALA A 90 17.854 6.279 -19.283 1.00 24.13 H new ATOM 0 HA ALA A 90 18.981 4.578 -21.224 1.00 15.30 H new ATOM 0 HB1 ALA A 90 20.418 6.535 -21.697 1.00 31.41 H new ATOM 0 HB2 ALA A 90 18.710 6.999 -21.509 1.00 31.41 H new ATOM 0 HB3 ALA A 90 19.864 7.297 -20.188 1.00 31.41 H new ATOM 1448 N GLU A 91 20.518 4.610 -18.426 1.00 3.33 N ATOM 1449 CA GLU A 91 21.646 4.071 -17.674 1.00 44.52 C ATOM 1450 C GLU A 91 22.841 5.018 -17.734 1.00 70.31 C ATOM 1451 O GLU A 91 23.972 4.592 -17.964 1.00 25.04 O ATOM 1452 CB GLU A 91 22.041 2.698 -18.221 1.00 60.34 C ATOM 1453 CG GLU A 91 22.449 1.708 -17.143 1.00 33.23 C ATOM 1454 CD GLU A 91 21.299 0.828 -16.695 1.00 4.43 C ATOM 1455 OE1 GLU A 91 20.696 0.155 -17.557 1.00 62.11 O ATOM 1456 OE2 GLU A 91 21.001 0.811 -15.482 1.00 34.10 O ATOM 0 H GLU A 91 19.745 4.942 -17.848 1.00 3.33 H new ATOM 0 HA GLU A 91 21.340 3.965 -16.633 1.00 44.52 H new ATOM 0 HB2 GLU A 91 21.203 2.285 -18.783 1.00 60.34 H new ATOM 0 HB3 GLU A 91 22.867 2.819 -18.922 1.00 60.34 H new ATOM 0 HG2 GLU A 91 23.257 1.080 -17.518 1.00 33.23 H new ATOM 0 HG3 GLU A 91 22.841 2.253 -16.284 1.00 33.23 H new ATOM 1463 N GLU A 92 22.579 6.305 -17.526 1.00 34.41 N ATOM 1464 CA GLU A 92 23.634 7.312 -17.558 1.00 20.22 C ATOM 1465 C GLU A 92 23.813 7.955 -16.185 1.00 45.22 C ATOM 1466 O GLU A 92 22.838 8.297 -15.514 1.00 74.35 O ATOM 1467 CB GLU A 92 23.312 8.387 -18.598 1.00 54.11 C ATOM 1468 CG GLU A 92 23.494 7.919 -20.033 1.00 3.33 C ATOM 1469 CD GLU A 92 24.911 8.118 -20.536 1.00 4.31 C ATOM 1470 OE1 GLU A 92 25.844 8.092 -19.707 1.00 62.33 O ATOM 1471 OE2 GLU A 92 25.084 8.300 -21.759 1.00 13.02 O ATOM 0 H GLU A 92 21.648 6.674 -17.334 1.00 34.41 H new ATOM 0 HA GLU A 92 24.565 6.817 -17.834 1.00 20.22 H new ATOM 0 HB2 GLU A 92 22.282 8.717 -18.460 1.00 54.11 H new ATOM 0 HB3 GLU A 92 23.951 9.253 -18.423 1.00 54.11 H new ATOM 0 HG2 GLU A 92 23.233 6.863 -20.103 1.00 3.33 H new ATOM 0 HG3 GLU A 92 22.804 8.462 -20.679 1.00 3.33 H new ATOM 1478 N LYS A 93 25.066 8.116 -15.773 1.00 24.42 N ATOM 1479 CA LYS A 93 25.375 8.718 -14.481 1.00 21.40 C ATOM 1480 C LYS A 93 25.189 10.233 -14.528 1.00 54.53 C ATOM 1481 O LYS A 93 25.761 10.912 -15.380 1.00 11.45 O ATOM 1482 CB LYS A 93 26.810 8.384 -14.070 1.00 51.31 C ATOM 1483 CG LYS A 93 27.017 6.920 -13.721 1.00 5.53 C ATOM 1484 CD LYS A 93 27.551 6.133 -14.906 1.00 11.13 C ATOM 1485 CE LYS A 93 28.528 5.054 -14.463 1.00 1.11 C ATOM 1486 NZ LYS A 93 27.941 3.691 -14.584 1.00 41.13 N ATOM 0 H LYS A 93 25.884 7.838 -16.315 1.00 24.42 H new ATOM 0 HA LYS A 93 24.686 8.307 -13.743 1.00 21.40 H new ATOM 0 HB2 LYS A 93 27.484 8.654 -14.883 1.00 51.31 H new ATOM 0 HB3 LYS A 93 27.085 8.996 -13.211 1.00 51.31 H new ATOM 0 HG2 LYS A 93 27.713 6.839 -12.886 1.00 5.53 H new ATOM 0 HG3 LYS A 93 26.073 6.487 -13.391 1.00 5.53 H new ATOM 0 HD2 LYS A 93 26.721 5.675 -15.444 1.00 11.13 H new ATOM 0 HD3 LYS A 93 28.046 6.811 -15.601 1.00 11.13 H new ATOM 0 HE2 LYS A 93 29.434 5.114 -15.066 1.00 1.11 H new ATOM 0 HE3 LYS A 93 28.822 5.232 -13.429 1.00 1.11 H new ATOM 0 HZ1 LYS A 93 28.637 2.984 -14.273 1.00 41.13 H new ATOM 0 HZ2 LYS A 93 27.091 3.625 -13.989 1.00 41.13 H new ATOM 0 HZ3 LYS A 93 27.684 3.510 -15.575 1.00 41.13 H new ATOM 1500 N VAL A 94 24.386 10.753 -13.606 1.00 21.12 N ATOM 1501 CA VAL A 94 24.126 12.186 -13.541 1.00 24.45 C ATOM 1502 C VAL A 94 24.232 12.699 -12.109 1.00 65.11 C ATOM 1503 O VAL A 94 23.930 11.980 -11.156 1.00 2.23 O ATOM 1504 CB VAL A 94 22.732 12.530 -14.096 1.00 63.12 C ATOM 1505 CG1 VAL A 94 22.610 12.088 -15.547 1.00 22.23 C ATOM 1506 CG2 VAL A 94 21.646 11.892 -13.243 1.00 24.12 C ATOM 0 H VAL A 94 23.904 10.204 -12.894 1.00 21.12 H new ATOM 0 HA VAL A 94 24.883 12.673 -14.156 1.00 24.45 H new ATOM 0 HB VAL A 94 22.603 13.612 -14.059 1.00 63.12 H new ATOM 0 HG11 VAL A 94 21.618 12.340 -15.922 1.00 22.23 H new ATOM 0 HG12 VAL A 94 23.364 12.597 -16.147 1.00 22.23 H new ATOM 0 HG13 VAL A 94 22.760 11.010 -15.613 1.00 22.23 H new ATOM 0 HG21 VAL A 94 20.667 12.146 -13.650 1.00 24.12 H new ATOM 0 HG22 VAL A 94 21.770 10.809 -13.246 1.00 24.12 H new ATOM 0 HG23 VAL A 94 21.721 12.263 -12.221 1.00 24.12 H new ATOM 1516 N LYS A 95 24.661 13.948 -11.964 1.00 31.32 N ATOM 1517 CA LYS A 95 24.806 14.560 -10.648 1.00 64.23 C ATOM 1518 C LYS A 95 23.609 15.450 -10.328 1.00 64.34 C ATOM 1519 O LYS A 95 23.112 15.456 -9.202 1.00 24.44 O ATOM 1520 CB LYS A 95 26.096 15.379 -10.583 1.00 24.33 C ATOM 1521 CG LYS A 95 27.224 14.681 -9.843 1.00 21.21 C ATOM 1522 CD LYS A 95 28.463 14.549 -10.711 1.00 53.14 C ATOM 1523 CE LYS A 95 29.568 13.787 -9.995 1.00 21.40 C ATOM 1524 NZ LYS A 95 29.803 12.449 -10.602 1.00 44.52 N ATOM 0 H LYS A 95 24.915 14.557 -12.742 1.00 31.32 H new ATOM 0 HA LYS A 95 24.852 13.762 -9.907 1.00 64.23 H new ATOM 0 HB2 LYS A 95 26.424 15.606 -11.598 1.00 24.33 H new ATOM 0 HB3 LYS A 95 25.888 16.331 -10.095 1.00 24.33 H new ATOM 0 HG2 LYS A 95 27.469 15.241 -8.940 1.00 21.21 H new ATOM 0 HG3 LYS A 95 26.894 13.692 -9.525 1.00 21.21 H new ATOM 0 HD2 LYS A 95 28.206 14.035 -11.637 1.00 53.14 H new ATOM 0 HD3 LYS A 95 28.823 15.540 -10.986 1.00 53.14 H new ATOM 0 HE2 LYS A 95 30.490 14.368 -10.028 1.00 21.40 H new ATOM 0 HE3 LYS A 95 29.304 13.668 -8.944 1.00 21.40 H new ATOM 0 HZ1 LYS A 95 30.563 11.962 -10.085 1.00 44.52 H new ATOM 0 HZ2 LYS A 95 28.931 11.885 -10.547 1.00 44.52 H new ATOM 0 HZ3 LYS A 95 30.080 12.563 -11.598 1.00 44.52 H new ATOM 1538 N ASP A 96 23.151 16.199 -11.325 1.00 52.31 N ATOM 1539 CA ASP A 96 22.011 17.091 -11.150 1.00 45.40 C ATOM 1540 C ASP A 96 21.193 17.187 -12.435 1.00 35.03 C ATOM 1541 O ASP A 96 21.473 16.496 -13.415 1.00 21.02 O ATOM 1542 CB ASP A 96 22.485 18.482 -10.727 1.00 64.32 C ATOM 1543 CG ASP A 96 23.287 19.175 -11.811 1.00 3.33 C ATOM 1544 OD1 ASP A 96 23.827 18.472 -12.690 1.00 60.23 O ATOM 1545 OD2 ASP A 96 23.373 20.420 -11.780 1.00 63.23 O ATOM 0 H ASP A 96 23.552 16.206 -12.263 1.00 52.31 H new ATOM 0 HA ASP A 96 21.375 16.679 -10.366 1.00 45.40 H new ATOM 0 HB2 ASP A 96 21.621 19.095 -10.471 1.00 64.32 H new ATOM 0 HB3 ASP A 96 23.094 18.397 -9.827 1.00 64.32 H new ATOM 1550 N THR A 97 20.181 18.049 -12.424 1.00 20.24 N ATOM 1551 CA THR A 97 19.322 18.234 -13.587 1.00 14.23 C ATOM 1552 C THR A 97 20.109 18.790 -14.768 1.00 53.31 C ATOM 1553 O THR A 97 19.966 18.319 -15.896 1.00 71.34 O ATOM 1554 CB THR A 97 18.150 19.183 -13.273 1.00 41.00 C ATOM 1555 OG1 THR A 97 17.487 18.764 -12.075 1.00 34.14 O ATOM 1556 CG2 THR A 97 17.155 19.212 -14.424 1.00 72.33 C ATOM 0 H THR A 97 19.936 18.630 -11.622 1.00 20.24 H new ATOM 0 HA THR A 97 18.926 17.253 -13.848 1.00 14.23 H new ATOM 0 HB THR A 97 18.552 20.187 -13.134 1.00 41.00 H new ATOM 0 HG1 THR A 97 17.626 19.433 -11.373 1.00 34.14 H new ATOM 0 HG21 THR A 97 16.336 19.889 -14.180 1.00 72.33 H new ATOM 0 HG22 THR A 97 17.655 19.559 -15.328 1.00 72.33 H new ATOM 0 HG23 THR A 97 16.760 18.209 -14.589 1.00 72.33 H new ATOM 1564 N GLU A 98 20.940 19.793 -14.502 1.00 14.53 N ATOM 1565 CA GLU A 98 21.749 20.412 -15.545 1.00 14.30 C ATOM 1566 C GLU A 98 22.594 19.368 -16.269 1.00 60.10 C ATOM 1567 O GLU A 98 22.731 19.404 -17.491 1.00 45.31 O ATOM 1568 CB GLU A 98 22.655 21.491 -14.946 1.00 42.54 C ATOM 1569 CG GLU A 98 21.962 22.830 -14.759 1.00 34.55 C ATOM 1570 CD GLU A 98 22.076 23.721 -15.980 1.00 72.44 C ATOM 1571 OE1 GLU A 98 23.133 24.366 -16.149 1.00 3.12 O ATOM 1572 OE2 GLU A 98 21.110 23.773 -16.770 1.00 3.45 O ATOM 0 H GLU A 98 21.070 20.194 -13.573 1.00 14.53 H new ATOM 0 HA GLU A 98 21.075 20.873 -16.267 1.00 14.30 H new ATOM 0 HB2 GLU A 98 23.028 21.146 -13.982 1.00 42.54 H new ATOM 0 HB3 GLU A 98 23.522 21.627 -15.593 1.00 42.54 H new ATOM 0 HG2 GLU A 98 20.909 22.662 -14.534 1.00 34.55 H new ATOM 0 HG3 GLU A 98 22.394 23.342 -13.899 1.00 34.55 H new ATOM 1579 N GLY A 99 23.159 18.438 -15.505 1.00 5.42 N ATOM 1580 CA GLY A 99 23.983 17.398 -16.091 1.00 54.42 C ATOM 1581 C GLY A 99 23.163 16.334 -16.793 1.00 41.35 C ATOM 1582 O GLY A 99 23.580 15.795 -17.818 1.00 12.22 O ATOM 0 H GLY A 99 23.061 18.387 -14.491 1.00 5.42 H new ATOM 0 HA2 GLY A 99 24.676 17.846 -16.803 1.00 54.42 H new ATOM 0 HA3 GLY A 99 24.584 16.932 -15.310 1.00 54.42 H new ATOM 1586 N ALA A 100 21.993 16.030 -16.241 1.00 23.34 N ATOM 1587 CA ALA A 100 21.113 15.024 -16.822 1.00 5.52 C ATOM 1588 C ALA A 100 20.681 15.419 -18.230 1.00 65.51 C ATOM 1589 O ALA A 100 20.462 14.563 -19.086 1.00 43.15 O ATOM 1590 CB ALA A 100 19.894 14.813 -15.934 1.00 71.21 C ATOM 0 H ALA A 100 21.633 16.466 -15.392 1.00 23.34 H new ATOM 0 HA ALA A 100 21.667 14.088 -16.889 1.00 5.52 H new ATOM 0 HB1 ALA A 100 19.245 14.059 -16.380 1.00 71.21 H new ATOM 0 HB2 ALA A 100 20.216 14.478 -14.948 1.00 71.21 H new ATOM 0 HB3 ALA A 100 19.347 15.751 -15.838 1.00 71.21 H new ATOM 1596 N LYS A 101 20.560 16.722 -18.463 1.00 3.52 N ATOM 1597 CA LYS A 101 20.155 17.232 -19.768 1.00 1.34 C ATOM 1598 C LYS A 101 21.297 17.121 -20.773 1.00 45.23 C ATOM 1599 O LYS A 101 21.119 16.593 -21.870 1.00 43.04 O ATOM 1600 CB LYS A 101 19.704 18.690 -19.651 1.00 3.34 C ATOM 1601 CG LYS A 101 18.594 19.062 -20.618 1.00 53.12 C ATOM 1602 CD LYS A 101 18.926 20.332 -21.385 1.00 52.33 C ATOM 1603 CE LYS A 101 18.531 20.217 -22.850 1.00 24.34 C ATOM 1604 NZ LYS A 101 18.398 21.553 -23.493 1.00 61.03 N ATOM 0 H LYS A 101 20.737 17.444 -17.765 1.00 3.52 H new ATOM 0 HA LYS A 101 19.321 16.628 -20.124 1.00 1.34 H new ATOM 0 HB2 LYS A 101 19.364 18.876 -18.632 1.00 3.34 H new ATOM 0 HB3 LYS A 101 20.560 19.342 -19.826 1.00 3.34 H new ATOM 0 HG2 LYS A 101 18.432 18.244 -21.320 1.00 53.12 H new ATOM 0 HG3 LYS A 101 17.663 19.200 -20.069 1.00 53.12 H new ATOM 0 HD2 LYS A 101 18.408 21.178 -20.933 1.00 52.33 H new ATOM 0 HD3 LYS A 101 19.994 20.535 -21.310 1.00 52.33 H new ATOM 0 HE2 LYS A 101 19.279 19.630 -23.383 1.00 24.34 H new ATOM 0 HE3 LYS A 101 17.586 19.679 -22.931 1.00 24.34 H new ATOM 0 HZ1 LYS A 101 17.862 21.460 -24.379 1.00 61.03 H new ATOM 0 HZ2 LYS A 101 17.896 22.199 -22.851 1.00 61.03 H new ATOM 0 HZ3 LYS A 101 19.343 21.935 -23.699 1.00 61.03 H new ATOM 1618 N GLN A 102 22.467 17.622 -20.390 1.00 45.43 N ATOM 1619 CA GLN A 102 23.637 17.578 -21.259 1.00 1.51 C ATOM 1620 C GLN A 102 23.833 16.180 -21.836 1.00 72.24 C ATOM 1621 O GLN A 102 24.131 16.024 -23.021 1.00 62.31 O ATOM 1622 CB GLN A 102 24.887 18.005 -20.488 1.00 13.32 C ATOM 1623 CG GLN A 102 25.799 18.933 -21.274 1.00 30.11 C ATOM 1624 CD GLN A 102 27.112 19.201 -20.564 1.00 42.42 C ATOM 1625 OE1 GLN A 102 27.230 20.152 -19.792 1.00 44.21 O ATOM 1626 NE2 GLN A 102 28.107 18.360 -20.822 1.00 52.52 N ATOM 0 H GLN A 102 22.630 18.063 -19.485 1.00 45.43 H new ATOM 0 HA GLN A 102 23.473 18.272 -22.084 1.00 1.51 H new ATOM 0 HB2 GLN A 102 24.583 18.502 -19.567 1.00 13.32 H new ATOM 0 HB3 GLN A 102 25.448 17.116 -20.200 1.00 13.32 H new ATOM 0 HG2 GLN A 102 26.002 18.495 -22.251 1.00 30.11 H new ATOM 0 HG3 GLN A 102 25.285 19.878 -21.449 1.00 30.11 H new ATOM 0 HE21 GLN A 102 27.965 17.585 -21.469 1.00 52.52 H new ATOM 0 HE22 GLN A 102 29.014 18.489 -20.373 1.00 52.52 H new ATOM 1635 N ILE A 103 23.666 15.168 -20.993 1.00 12.21 N ATOM 1636 CA ILE A 103 23.825 13.783 -21.420 1.00 3.04 C ATOM 1637 C ILE A 103 22.786 13.410 -22.472 1.00 12.22 C ATOM 1638 O ILE A 103 23.082 12.690 -23.425 1.00 71.32 O ATOM 1639 CB ILE A 103 23.710 12.810 -20.232 1.00 3.44 C ATOM 1640 CG1 ILE A 103 24.892 12.993 -19.278 1.00 54.24 C ATOM 1641 CG2 ILE A 103 23.639 11.374 -20.728 1.00 43.23 C ATOM 1642 CD1 ILE A 103 24.767 12.192 -18.001 1.00 24.43 C ATOM 0 H ILE A 103 23.420 15.280 -20.009 1.00 12.21 H new ATOM 0 HA ILE A 103 24.822 13.698 -21.852 1.00 3.04 H new ATOM 0 HB ILE A 103 22.792 13.031 -19.688 1.00 3.44 H new ATOM 0 HG12 ILE A 103 25.810 12.704 -19.790 1.00 54.24 H new ATOM 0 HG13 ILE A 103 24.986 14.050 -19.027 1.00 54.24 H new ATOM 0 HG21 ILE A 103 23.558 10.698 -19.876 1.00 43.23 H new ATOM 0 HG22 ILE A 103 22.767 11.254 -21.371 1.00 43.23 H new ATOM 0 HG23 ILE A 103 24.541 11.139 -21.293 1.00 43.23 H new ATOM 0 HD11 ILE A 103 25.640 12.370 -17.373 1.00 24.43 H new ATOM 0 HD12 ILE A 103 23.867 12.497 -17.467 1.00 24.43 H new ATOM 0 HD13 ILE A 103 24.704 11.131 -18.242 1.00 24.43 H new ATOM 1654 N VAL A 104 21.565 13.905 -22.291 1.00 31.44 N ATOM 1655 CA VAL A 104 20.482 13.626 -23.226 1.00 43.20 C ATOM 1656 C VAL A 104 20.764 14.238 -24.593 1.00 42.22 C ATOM 1657 O VAL A 104 20.842 13.531 -25.597 1.00 54.31 O ATOM 1658 CB VAL A 104 19.137 14.164 -22.702 1.00 45.11 C ATOM 1659 CG1 VAL A 104 18.035 13.937 -23.726 1.00 51.32 C ATOM 1660 CG2 VAL A 104 18.783 13.513 -21.373 1.00 71.10 C ATOM 0 H VAL A 104 21.302 14.501 -21.506 1.00 31.44 H new ATOM 0 HA VAL A 104 20.419 12.542 -23.323 1.00 43.20 H new ATOM 0 HB VAL A 104 19.234 15.237 -22.540 1.00 45.11 H new ATOM 0 HG11 VAL A 104 17.093 14.324 -23.338 1.00 51.32 H new ATOM 0 HG12 VAL A 104 18.286 14.455 -24.652 1.00 51.32 H new ATOM 0 HG13 VAL A 104 17.936 12.870 -23.923 1.00 51.32 H new ATOM 0 HG21 VAL A 104 17.830 13.905 -21.018 1.00 71.10 H new ATOM 0 HG22 VAL A 104 18.704 12.434 -21.506 1.00 71.10 H new ATOM 0 HG23 VAL A 104 19.561 13.733 -20.642 1.00 71.10 H new ATOM 1670 N ARG A 105 20.915 15.558 -24.625 1.00 31.04 N ATOM 1671 CA ARG A 105 21.188 16.267 -25.869 1.00 53.21 C ATOM 1672 C ARG A 105 22.383 15.653 -26.593 1.00 14.15 C ATOM 1673 O ARG A 105 22.372 15.505 -27.814 1.00 54.14 O ATOM 1674 CB ARG A 105 21.453 17.748 -25.591 1.00 12.11 C ATOM 1675 CG ARG A 105 21.475 18.608 -26.843 1.00 71.21 C ATOM 1676 CD ARG A 105 21.724 20.071 -26.509 1.00 72.32 C ATOM 1677 NE ARG A 105 20.876 20.963 -27.297 1.00 13.25 N ATOM 1678 CZ ARG A 105 20.730 22.257 -27.034 1.00 64.24 C ATOM 1679 NH1 ARG A 105 21.371 22.807 -26.012 1.00 44.25 N ATOM 1680 NH2 ARG A 105 19.941 23.004 -27.796 1.00 64.04 N ATOM 0 H ARG A 105 20.853 16.158 -23.803 1.00 31.04 H new ATOM 0 HA ARG A 105 20.310 16.177 -26.509 1.00 53.21 H new ATOM 0 HB2 ARG A 105 20.686 18.125 -24.915 1.00 12.11 H new ATOM 0 HB3 ARG A 105 22.408 17.847 -25.076 1.00 12.11 H new ATOM 0 HG2 ARG A 105 22.252 18.250 -27.518 1.00 71.21 H new ATOM 0 HG3 ARG A 105 20.526 18.510 -27.370 1.00 71.21 H new ATOM 0 HD2 ARG A 105 21.538 20.238 -25.448 1.00 72.32 H new ATOM 0 HD3 ARG A 105 22.771 20.312 -26.691 1.00 72.32 H new ATOM 0 HE ARG A 105 20.369 20.571 -28.091 1.00 13.25 H new ATOM 0 HH11 ARG A 105 21.979 22.236 -25.424 1.00 44.25 H new ATOM 0 HH12 ARG A 105 21.256 23.801 -25.813 1.00 44.25 H new ATOM 0 HH21 ARG A 105 19.447 22.585 -28.584 1.00 64.04 H new ATOM 0 HH22 ARG A 105 19.829 23.998 -27.594 1.00 64.04 H new ATOM 1694 N ARG A 106 23.413 15.299 -25.830 1.00 11.10 N ATOM 1695 CA ARG A 106 24.616 14.703 -26.399 1.00 44.51 C ATOM 1696 C ARG A 106 24.264 13.536 -27.316 1.00 44.42 C ATOM 1697 O ARG A 106 24.837 13.384 -28.394 1.00 61.43 O ATOM 1698 CB ARG A 106 25.550 14.226 -25.285 1.00 22.42 C ATOM 1699 CG ARG A 106 26.978 13.988 -25.748 1.00 23.22 C ATOM 1700 CD ARG A 106 27.986 14.481 -24.720 1.00 43.52 C ATOM 1701 NE ARG A 106 28.442 15.838 -25.007 1.00 3.50 N ATOM 1702 CZ ARG A 106 29.200 16.154 -26.051 1.00 12.42 C ATOM 1703 NH1 ARG A 106 29.586 15.213 -26.902 1.00 63.35 N ATOM 1704 NH2 ARG A 106 29.575 17.411 -26.243 1.00 62.24 N ATOM 0 H ARG A 106 23.438 15.415 -24.817 1.00 11.10 H new ATOM 0 HA ARG A 106 25.124 15.466 -26.989 1.00 44.51 H new ATOM 0 HB2 ARG A 106 25.555 14.966 -24.485 1.00 22.42 H new ATOM 0 HB3 ARG A 106 25.155 13.302 -24.862 1.00 22.42 H new ATOM 0 HG2 ARG A 106 27.131 12.924 -25.928 1.00 23.22 H new ATOM 0 HG3 ARG A 106 27.144 14.499 -26.696 1.00 23.22 H new ATOM 0 HD2 ARG A 106 27.535 14.452 -23.728 1.00 43.52 H new ATOM 0 HD3 ARG A 106 28.843 13.807 -24.700 1.00 43.52 H new ATOM 0 HE ARG A 106 28.163 16.585 -24.371 1.00 3.50 H new ATOM 0 HH11 ARG A 106 29.301 14.245 -26.755 1.00 63.35 H new ATOM 0 HH12 ARG A 106 30.168 15.458 -27.703 1.00 63.35 H new ATOM 0 HH21 ARG A 106 29.281 18.136 -25.589 1.00 62.24 H new ATOM 0 HH22 ARG A 106 30.157 17.653 -27.045 1.00 62.24 H new ATOM 1718 N HIS A 107 23.315 12.712 -26.880 1.00 20.34 N ATOM 1719 CA HIS A 107 22.885 11.558 -27.661 1.00 14.45 C ATOM 1720 C HIS A 107 22.105 11.999 -28.896 1.00 51.21 C ATOM 1721 O HIS A 107 22.135 11.258 -29.880 1.00 11.00 O ATOM 1722 CB HIS A 107 22.024 10.628 -26.805 1.00 52.14 C ATOM 1723 CG HIS A 107 22.821 9.653 -25.993 1.00 41.44 C ATOM 1724 ND1 HIS A 107 23.581 8.649 -26.555 1.00 65.12 N ATOM 1725 CD2 HIS A 107 22.973 9.533 -24.653 1.00 70.31 C ATOM 1726 CE1 HIS A 107 24.166 7.954 -25.595 1.00 52.25 C ATOM 1727 NE2 HIS A 107 23.813 8.471 -24.433 1.00 33.34 N ATOM 0 H HIS A 107 22.830 12.823 -25.990 1.00 20.34 H new ATOM 0 HA HIS A 107 23.774 11.019 -27.987 1.00 14.45 H new ATOM 0 HB2 HIS A 107 21.409 11.229 -26.135 1.00 52.14 H new ATOM 0 HB3 HIS A 107 21.343 10.077 -27.454 1.00 52.14 H new ATOM 0 HD2 HIS A 107 22.518 10.157 -23.898 1.00 70.31 H new ATOM 0 HE1 HIS A 107 24.821 7.107 -25.737 1.00 52.25 H new ATOM 0 HE2 HIS A 107 24.116 8.135 -23.519 1.00 33.34 H new ATOM 1735 N LEU A 108 21.431 13.143 -28.874 1.00 22.24 N ATOM 1736 CA LEU A 108 20.670 13.606 -30.029 1.00 32.32 C ATOM 1737 C LEU A 108 21.602 14.090 -31.136 1.00 23.44 C ATOM 1738 O LEU A 108 21.393 13.793 -32.312 1.00 32.42 O ATOM 1739 CB LEU A 108 19.718 14.732 -29.620 1.00 60.21 C ATOM 1740 CG LEU A 108 18.583 14.340 -28.673 1.00 73.24 C ATOM 1741 CD1 LEU A 108 18.111 15.547 -27.878 1.00 42.11 C ATOM 1742 CD2 LEU A 108 17.428 13.726 -29.451 1.00 61.42 C ATOM 0 H LEU A 108 21.396 13.768 -28.068 1.00 22.24 H new ATOM 0 HA LEU A 108 20.088 12.767 -30.410 1.00 32.32 H new ATOM 0 HB2 LEU A 108 20.303 15.521 -29.147 1.00 60.21 H new ATOM 0 HB3 LEU A 108 19.280 15.157 -30.523 1.00 60.21 H new ATOM 0 HG LEU A 108 18.960 13.595 -27.973 1.00 73.24 H new ATOM 0 HD11 LEU A 108 17.303 15.249 -27.210 1.00 42.11 H new ATOM 0 HD12 LEU A 108 18.940 15.943 -27.291 1.00 42.11 H new ATOM 0 HD13 LEU A 108 17.751 16.315 -28.562 1.00 42.11 H new ATOM 0 HD21 LEU A 108 16.629 13.453 -28.761 1.00 61.42 H new ATOM 0 HD22 LEU A 108 17.051 14.449 -30.174 1.00 61.42 H new ATOM 0 HD23 LEU A 108 17.775 12.836 -29.975 1.00 61.42 H new ATOM 1754 N VAL A 109 22.633 14.836 -30.750 1.00 54.20 N ATOM 1755 CA VAL A 109 23.600 15.358 -31.709 1.00 11.13 C ATOM 1756 C VAL A 109 24.306 14.227 -32.448 1.00 32.12 C ATOM 1757 O VAL A 109 24.669 14.366 -33.616 1.00 45.13 O ATOM 1758 CB VAL A 109 24.654 16.242 -31.018 1.00 1.11 C ATOM 1759 CG1 VAL A 109 25.679 16.740 -32.026 1.00 43.54 C ATOM 1760 CG2 VAL A 109 23.987 17.408 -30.305 1.00 42.21 C ATOM 0 H VAL A 109 22.820 15.092 -29.781 1.00 54.20 H new ATOM 0 HA VAL A 109 23.042 15.963 -32.424 1.00 11.13 H new ATOM 0 HB VAL A 109 25.175 15.640 -30.274 1.00 1.11 H new ATOM 0 HG11 VAL A 109 26.415 17.363 -31.518 1.00 43.54 H new ATOM 0 HG12 VAL A 109 26.180 15.888 -32.487 1.00 43.54 H new ATOM 0 HG13 VAL A 109 25.177 17.326 -32.796 1.00 43.54 H new ATOM 0 HG21 VAL A 109 24.747 18.022 -29.822 1.00 42.21 H new ATOM 0 HG22 VAL A 109 23.439 18.011 -31.029 1.00 42.21 H new ATOM 0 HG23 VAL A 109 23.296 17.027 -29.553 1.00 42.21 H new ATOM 1770 N ALA A 110 24.500 13.107 -31.759 1.00 43.51 N ATOM 1771 CA ALA A 110 25.160 11.950 -32.351 1.00 73.04 C ATOM 1772 C ALA A 110 24.298 11.322 -33.441 1.00 25.55 C ATOM 1773 O ALA A 110 24.812 10.711 -34.377 1.00 11.24 O ATOM 1774 CB ALA A 110 25.487 10.923 -31.278 1.00 33.33 C ATOM 0 H ALA A 110 24.209 12.977 -30.790 1.00 43.51 H new ATOM 0 HA ALA A 110 26.089 12.289 -32.810 1.00 73.04 H new ATOM 0 HB1 ALA A 110 25.980 10.064 -31.734 1.00 33.33 H new ATOM 0 HB2 ALA A 110 26.150 11.370 -30.537 1.00 33.33 H new ATOM 0 HB3 ALA A 110 24.567 10.598 -30.793 1.00 33.33 H new ATOM 1780 N GLU A 111 22.984 11.479 -33.313 1.00 3.22 N ATOM 1781 CA GLU A 111 22.051 10.925 -34.287 1.00 0.23 C ATOM 1782 C GLU A 111 21.579 12.001 -35.261 1.00 21.24 C ATOM 1783 O GLU A 111 20.481 11.918 -35.813 1.00 13.21 O ATOM 1784 CB GLU A 111 20.848 10.302 -33.576 1.00 44.03 C ATOM 1785 CG GLU A 111 20.525 8.893 -34.046 1.00 61.31 C ATOM 1786 CD GLU A 111 19.092 8.494 -33.754 1.00 24.03 C ATOM 1787 OE1 GLU A 111 18.202 8.843 -34.558 1.00 21.31 O ATOM 1788 OE2 GLU A 111 18.860 7.831 -32.722 1.00 33.24 O ATOM 0 H GLU A 111 22.542 11.985 -32.545 1.00 3.22 H new ATOM 0 HA GLU A 111 22.571 10.151 -34.852 1.00 0.23 H new ATOM 0 HB2 GLU A 111 21.041 10.283 -32.503 1.00 44.03 H new ATOM 0 HB3 GLU A 111 19.976 10.937 -33.732 1.00 44.03 H new ATOM 0 HG2 GLU A 111 20.707 8.821 -35.118 1.00 61.31 H new ATOM 0 HG3 GLU A 111 21.200 8.188 -33.561 1.00 61.31 H new ATOM 1795 N THR A 112 22.416 13.013 -35.467 1.00 74.34 N ATOM 1796 CA THR A 112 22.087 14.106 -36.372 1.00 63.21 C ATOM 1797 C THR A 112 22.961 14.071 -37.620 1.00 54.02 C ATOM 1798 O THR A 112 23.224 15.103 -38.235 1.00 61.51 O ATOM 1799 CB THR A 112 22.249 15.474 -35.684 1.00 31.23 C ATOM 1800 OG1 THR A 112 21.825 15.389 -34.318 1.00 63.52 O ATOM 1801 CG2 THR A 112 21.443 16.543 -36.405 1.00 64.31 C ATOM 0 H THR A 112 23.328 13.098 -35.018 1.00 74.34 H new ATOM 0 HA THR A 112 21.044 13.973 -36.659 1.00 63.21 H new ATOM 0 HB THR A 112 23.303 15.751 -35.721 1.00 31.23 H new ATOM 0 HG1 THR A 112 21.942 14.471 -33.996 1.00 63.52 H new ATOM 0 HG21 THR A 112 21.574 17.500 -35.900 1.00 64.31 H new ATOM 0 HG22 THR A 112 21.789 16.626 -37.435 1.00 64.31 H new ATOM 0 HG23 THR A 112 20.388 16.270 -36.397 1.00 64.31 H new ATOM 1809 N GLY A 113 23.410 12.875 -37.988 1.00 34.20 N ATOM 1810 CA GLY A 113 24.252 12.727 -39.162 1.00 22.22 C ATOM 1811 C GLY A 113 23.760 11.638 -40.095 1.00 12.03 C ATOM 1812 O GLY A 113 24.531 11.090 -40.884 1.00 32.42 O ATOM 0 H GLY A 113 23.206 12.006 -37.495 1.00 34.20 H new ATOM 0 HA2 GLY A 113 24.288 13.674 -39.701 1.00 22.22 H new ATOM 0 HA3 GLY A 113 25.271 12.499 -38.848 1.00 22.22 H new ATOM 1816 N THR A 114 22.473 11.320 -40.003 1.00 42.44 N ATOM 1817 CA THR A 114 21.880 10.287 -40.843 1.00 11.40 C ATOM 1818 C THR A 114 20.482 10.687 -41.303 1.00 53.11 C ATOM 1819 O THR A 114 19.557 9.876 -41.284 1.00 43.15 O ATOM 1820 CB THR A 114 21.798 8.939 -40.101 1.00 43.45 C ATOM 1821 OG1 THR A 114 22.996 8.719 -39.350 1.00 61.50 O ATOM 1822 CG2 THR A 114 21.590 7.794 -41.081 1.00 64.10 C ATOM 0 H THR A 114 21.821 11.763 -39.355 1.00 42.44 H new ATOM 0 HA THR A 114 22.528 10.176 -41.713 1.00 11.40 H new ATOM 0 HB THR A 114 20.946 8.975 -39.422 1.00 43.45 H new ATOM 0 HG1 THR A 114 22.935 7.861 -38.880 1.00 61.50 H new ATOM 0 HG21 THR A 114 21.535 6.853 -40.534 1.00 64.10 H new ATOM 0 HG22 THR A 114 20.661 7.949 -41.630 1.00 64.10 H new ATOM 0 HG23 THR A 114 22.424 7.759 -41.782 1.00 64.10 H new ATOM 1830 N ALA A 115 20.337 11.942 -41.717 1.00 15.12 N ATOM 1831 CA ALA A 115 19.053 12.448 -42.185 1.00 73.11 C ATOM 1832 C ALA A 115 18.999 12.483 -43.709 1.00 12.40 C ATOM 1833 O ALA A 115 18.378 13.367 -44.296 1.00 25.13 O ATOM 1834 CB ALA A 115 18.793 13.834 -41.613 1.00 41.23 C ATOM 0 H ALA A 115 21.093 12.626 -41.738 1.00 15.12 H new ATOM 0 HA ALA A 115 18.274 11.771 -41.836 1.00 73.11 H new ATOM 0 HB1 ALA A 115 17.831 14.200 -41.970 1.00 41.23 H new ATOM 0 HB2 ALA A 115 18.780 13.782 -40.524 1.00 41.23 H new ATOM 0 HB3 ALA A 115 19.582 14.514 -41.934 1.00 41.23 H new ATOM 1840 N GLU A 116 19.655 11.516 -44.342 1.00 35.22 N ATOM 1841 CA GLU A 116 19.682 11.438 -45.798 1.00 22.12 C ATOM 1842 C GLU A 116 18.621 10.469 -46.311 1.00 72.23 C ATOM 1843 O GLU A 116 18.766 9.884 -47.384 1.00 40.13 O ATOM 1844 CB GLU A 116 21.066 11.000 -46.282 1.00 72.41 C ATOM 1845 CG GLU A 116 22.170 11.990 -45.945 1.00 51.44 C ATOM 1846 CD GLU A 116 23.271 11.372 -45.106 1.00 1.52 C ATOM 1847 OE1 GLU A 116 22.961 10.842 -44.018 1.00 24.33 O ATOM 1848 OE2 GLU A 116 24.441 11.417 -45.537 1.00 32.32 O ATOM 0 H GLU A 116 20.175 10.776 -43.870 1.00 35.22 H new ATOM 0 HA GLU A 116 19.464 12.430 -46.193 1.00 22.12 H new ATOM 0 HB2 GLU A 116 21.308 10.034 -45.839 1.00 72.41 H new ATOM 0 HB3 GLU A 116 21.035 10.856 -47.362 1.00 72.41 H new ATOM 0 HG2 GLU A 116 22.598 12.380 -46.869 1.00 51.44 H new ATOM 0 HG3 GLU A 116 21.742 12.837 -45.409 1.00 51.44 H new ATOM 1855 N LYS A 117 17.555 10.303 -45.535 1.00 73.04 N ATOM 1856 CA LYS A 117 16.469 9.405 -45.910 1.00 21.25 C ATOM 1857 C LYS A 117 15.185 10.186 -46.175 1.00 73.04 C ATOM 1858 O LYS A 117 14.085 9.683 -45.953 1.00 41.33 O ATOM 1859 CB LYS A 117 16.231 8.372 -44.806 1.00 4.23 C ATOM 1860 CG LYS A 117 16.039 6.958 -45.327 1.00 73.53 C ATOM 1861 CD LYS A 117 16.284 5.926 -44.240 1.00 11.14 C ATOM 1862 CE LYS A 117 15.204 4.854 -44.237 1.00 71.33 C ATOM 1863 NZ LYS A 117 15.635 3.631 -44.971 1.00 21.23 N ATOM 0 H LYS A 117 17.420 10.779 -44.643 1.00 73.04 H new ATOM 0 HA LYS A 117 16.756 8.890 -46.826 1.00 21.25 H new ATOM 0 HB2 LYS A 117 17.077 8.385 -44.119 1.00 4.23 H new ATOM 0 HB3 LYS A 117 15.350 8.662 -44.233 1.00 4.23 H new ATOM 0 HG2 LYS A 117 15.026 6.846 -45.715 1.00 73.53 H new ATOM 0 HG3 LYS A 117 16.720 6.780 -46.159 1.00 73.53 H new ATOM 0 HD2 LYS A 117 17.259 5.462 -44.390 1.00 11.14 H new ATOM 0 HD3 LYS A 117 16.312 6.419 -43.268 1.00 11.14 H new ATOM 0 HE2 LYS A 117 14.955 4.592 -43.209 1.00 71.33 H new ATOM 0 HE3 LYS A 117 14.297 5.251 -44.693 1.00 71.33 H new ATOM 0 HZ1 LYS A 117 14.872 2.924 -44.946 1.00 21.23 H new ATOM 0 HZ2 LYS A 117 15.848 3.876 -45.959 1.00 21.23 H new ATOM 0 HZ3 LYS A 117 16.486 3.238 -44.521 1.00 21.23 H new ATOM 1877 N MET A 118 15.336 11.417 -46.654 1.00 1.34 N ATOM 1878 CA MET A 118 14.187 12.265 -46.952 1.00 60.31 C ATOM 1879 C MET A 118 13.394 12.572 -45.686 1.00 10.12 C ATOM 1880 O MET A 118 13.490 11.870 -44.680 1.00 2.22 O ATOM 1881 CB MET A 118 13.283 11.590 -47.984 1.00 64.11 C ATOM 1882 CG MET A 118 13.392 12.194 -49.376 1.00 11.34 C ATOM 1883 SD MET A 118 11.858 12.057 -50.314 1.00 61.03 S ATOM 1884 CE MET A 118 12.495 11.773 -51.965 1.00 11.24 C ATOM 0 H MET A 118 16.240 11.849 -46.844 1.00 1.34 H new ATOM 0 HA MET A 118 14.557 13.204 -47.363 1.00 60.31 H new ATOM 0 HB2 MET A 118 13.533 10.530 -48.036 1.00 64.11 H new ATOM 0 HB3 MET A 118 12.248 11.657 -47.648 1.00 64.11 H new ATOM 0 HG2 MET A 118 13.669 13.245 -49.291 1.00 11.34 H new ATOM 0 HG3 MET A 118 14.193 11.696 -49.922 1.00 11.34 H new ATOM 0 HE1 MET A 118 11.664 11.667 -52.662 1.00 11.24 H new ATOM 0 HE2 MET A 118 13.116 12.617 -52.266 1.00 11.24 H new ATOM 0 HE3 MET A 118 13.093 10.862 -51.972 1.00 11.24 H new ATOM 1894 N PRO A 119 12.591 13.645 -45.735 1.00 62.31 N ATOM 1895 CA PRO A 119 11.766 14.070 -44.600 1.00 53.22 C ATOM 1896 C PRO A 119 10.619 13.102 -44.325 1.00 22.35 C ATOM 1897 O PRO A 119 10.371 12.181 -45.102 1.00 74.41 O ATOM 1898 CB PRO A 119 11.223 15.429 -45.045 1.00 64.30 C ATOM 1899 CG PRO A 119 11.243 15.378 -46.534 1.00 2.41 C ATOM 1900 CD PRO A 119 12.428 14.528 -46.903 1.00 5.23 C ATOM 0 HA PRO A 119 12.337 14.108 -43.672 1.00 53.22 H new ATOM 0 HB2 PRO A 119 10.214 15.594 -44.668 1.00 64.30 H new ATOM 0 HB3 PRO A 119 11.841 16.244 -44.669 1.00 64.30 H new ATOM 0 HG2 PRO A 119 10.319 14.949 -46.922 1.00 2.41 H new ATOM 0 HG3 PRO A 119 11.333 16.378 -46.958 1.00 2.41 H new ATOM 0 HD2 PRO A 119 12.246 13.959 -47.815 1.00 5.23 H new ATOM 0 HD3 PRO A 119 13.318 15.133 -47.077 1.00 5.23 H new ATOM 1908 N SER A 120 9.922 13.320 -43.214 1.00 53.43 N ATOM 1909 CA SER A 120 8.803 12.466 -42.835 1.00 12.52 C ATOM 1910 C SER A 120 7.532 13.288 -42.645 1.00 14.32 C ATOM 1911 O SER A 120 7.499 14.482 -42.945 1.00 13.24 O ATOM 1912 CB SER A 120 9.129 11.704 -41.548 1.00 3.24 C ATOM 1913 OG SER A 120 9.166 12.579 -40.434 1.00 41.31 O ATOM 0 H SER A 120 10.113 14.080 -42.561 1.00 53.43 H new ATOM 0 HA SER A 120 8.635 11.751 -43.640 1.00 12.52 H new ATOM 0 HB2 SER A 120 8.381 10.929 -41.381 1.00 3.24 H new ATOM 0 HB3 SER A 120 10.091 11.202 -41.652 1.00 3.24 H new ATOM 0 HG SER A 120 9.374 12.068 -39.624 1.00 41.31 H new ATOM 1919 N THR A 121 6.485 12.639 -42.145 1.00 0.21 N ATOM 1920 CA THR A 121 5.210 13.307 -41.916 1.00 71.41 C ATOM 1921 C THR A 121 5.359 14.449 -40.917 1.00 54.13 C ATOM 1922 O THR A 121 5.346 14.232 -39.706 1.00 71.11 O ATOM 1923 CB THR A 121 4.144 12.323 -41.397 1.00 35.35 C ATOM 1924 OG1 THR A 121 4.217 11.093 -42.127 1.00 11.33 O ATOM 1925 CG2 THR A 121 2.750 12.916 -41.529 1.00 70.44 C ATOM 0 H THR A 121 6.495 11.651 -41.891 1.00 0.21 H new ATOM 0 HA THR A 121 4.887 13.707 -42.877 1.00 71.41 H new ATOM 0 HB THR A 121 4.341 12.131 -40.342 1.00 35.35 H new ATOM 0 HG1 THR A 121 3.538 10.472 -41.790 1.00 11.33 H new ATOM 0 HG21 THR A 121 2.015 12.203 -41.156 1.00 70.44 H new ATOM 0 HG22 THR A 121 2.690 13.837 -40.948 1.00 70.44 H new ATOM 0 HG23 THR A 121 2.545 13.134 -42.577 1.00 70.44 H new ATOM 1933 N SER A 122 5.501 15.666 -41.434 1.00 41.00 N ATOM 1934 CA SER A 122 5.657 16.842 -40.587 1.00 3.34 C ATOM 1935 C SER A 122 5.619 18.120 -41.419 1.00 62.42 C ATOM 1936 O SER A 122 5.856 18.094 -42.626 1.00 43.44 O ATOM 1937 CB SER A 122 6.971 16.766 -39.807 1.00 73.21 C ATOM 1938 OG SER A 122 7.904 15.922 -40.462 1.00 64.12 O ATOM 0 H SER A 122 5.511 15.863 -42.435 1.00 41.00 H new ATOM 0 HA SER A 122 4.826 16.863 -39.882 1.00 3.34 H new ATOM 0 HB2 SER A 122 7.392 17.765 -39.700 1.00 73.21 H new ATOM 0 HB3 SER A 122 6.780 16.391 -38.802 1.00 73.21 H new ATOM 0 HG SER A 122 8.736 15.891 -39.945 1.00 64.12 H new ATOM 1944 N ARG A 123 5.320 19.237 -40.763 1.00 41.33 N ATOM 1945 CA ARG A 123 5.249 20.526 -41.442 1.00 53.42 C ATOM 1946 C ARG A 123 6.593 21.246 -41.382 1.00 13.50 C ATOM 1947 O ARG A 123 7.332 21.153 -40.401 1.00 60.15 O ATOM 1948 CB ARG A 123 4.162 21.398 -40.814 1.00 31.40 C ATOM 1949 CG ARG A 123 2.801 20.724 -40.751 1.00 24.14 C ATOM 1950 CD ARG A 123 1.690 21.674 -41.171 1.00 1.53 C ATOM 1951 NE ARG A 123 0.391 21.261 -40.647 1.00 41.44 N ATOM 1952 CZ ARG A 123 -0.331 20.272 -41.164 1.00 71.43 C ATOM 1953 NH1 ARG A 123 0.119 19.598 -42.214 1.00 14.03 N ATOM 1954 NH2 ARG A 123 -1.503 19.956 -40.631 1.00 42.45 N ATOM 0 H ARG A 123 5.123 19.275 -39.763 1.00 41.33 H new ATOM 0 HA ARG A 123 5.000 20.345 -42.488 1.00 53.42 H new ATOM 0 HB2 ARG A 123 4.468 21.675 -39.805 1.00 31.40 H new ATOM 0 HB3 ARG A 123 4.074 22.322 -41.385 1.00 31.40 H new ATOM 0 HG2 ARG A 123 2.797 19.848 -41.400 1.00 24.14 H new ATOM 0 HG3 ARG A 123 2.615 20.371 -39.737 1.00 24.14 H new ATOM 0 HD2 ARG A 123 1.920 22.680 -40.819 1.00 1.53 H new ATOM 0 HD3 ARG A 123 1.644 21.720 -42.259 1.00 1.53 H new ATOM 0 HE ARG A 123 0.017 21.759 -39.839 1.00 41.44 H new ATOM 0 HH11 ARG A 123 1.021 19.838 -42.626 1.00 14.03 H new ATOM 0 HH12 ARG A 123 -0.436 18.839 -42.609 1.00 14.03 H new ATOM 0 HH21 ARG A 123 -1.852 20.472 -39.823 1.00 42.45 H new ATOM 0 HH22 ARG A 123 -2.056 19.197 -41.029 1.00 42.45 H new ATOM 1968 N PRO A 124 6.920 21.981 -42.455 1.00 63.23 N ATOM 1969 CA PRO A 124 8.175 22.732 -42.549 1.00 12.34 C ATOM 1970 C PRO A 124 8.210 23.924 -41.599 1.00 21.33 C ATOM 1971 O PRO A 124 7.196 24.284 -41.000 1.00 63.15 O ATOM 1972 CB PRO A 124 8.198 23.206 -44.004 1.00 3.20 C ATOM 1973 CG PRO A 124 6.765 23.251 -44.410 1.00 13.11 C ATOM 1974 CD PRO A 124 6.087 22.137 -43.660 1.00 50.24 C ATOM 0 HA PRO A 124 9.036 22.123 -42.272 1.00 12.34 H new ATOM 0 HB2 PRO A 124 8.666 24.186 -44.094 1.00 3.20 H new ATOM 0 HB3 PRO A 124 8.767 22.522 -44.634 1.00 3.20 H new ATOM 0 HG2 PRO A 124 6.320 24.215 -44.164 1.00 13.11 H new ATOM 0 HG3 PRO A 124 6.660 23.117 -45.487 1.00 13.11 H new ATOM 0 HD2 PRO A 124 5.058 22.391 -43.407 1.00 50.24 H new ATOM 0 HD3 PRO A 124 6.054 21.219 -44.247 1.00 50.24 H new ATOM 1982 N THR A 125 9.383 24.534 -41.466 1.00 32.42 N ATOM 1983 CA THR A 125 9.550 25.686 -40.588 1.00 21.21 C ATOM 1984 C THR A 125 10.370 26.779 -41.265 1.00 2.21 C ATOM 1985 O THR A 125 11.458 26.523 -41.780 1.00 64.30 O ATOM 1986 CB THR A 125 10.236 25.291 -39.266 1.00 62.14 C ATOM 1987 OG1 THR A 125 10.352 26.436 -38.414 1.00 11.52 O ATOM 1988 CG2 THR A 125 11.615 24.705 -39.526 1.00 44.43 C ATOM 0 H THR A 125 10.232 24.250 -41.955 1.00 32.42 H new ATOM 0 HA THR A 125 8.551 26.065 -40.372 1.00 21.21 H new ATOM 0 HB THR A 125 9.624 24.534 -38.776 1.00 62.14 H new ATOM 0 HG1 THR A 125 10.787 26.177 -37.575 1.00 11.52 H new ATOM 0 HG21 THR A 125 12.080 24.434 -38.578 1.00 44.43 H new ATOM 0 HG22 THR A 125 11.521 23.817 -40.151 1.00 44.43 H new ATOM 0 HG23 THR A 125 12.234 25.444 -40.035 1.00 44.43 H new ATOM 1996 N ALA A 126 9.839 27.998 -41.261 1.00 51.14 N ATOM 1997 CA ALA A 126 10.523 29.131 -41.873 1.00 13.25 C ATOM 1998 C ALA A 126 11.385 29.868 -40.853 1.00 30.11 C ATOM 1999 O ALA A 126 11.061 29.940 -39.667 1.00 62.12 O ATOM 2000 CB ALA A 126 9.514 30.081 -42.499 1.00 10.32 C ATOM 0 H ALA A 126 8.938 28.226 -40.841 1.00 51.14 H new ATOM 0 HA ALA A 126 11.179 28.749 -42.655 1.00 13.25 H new ATOM 0 HB1 ALA A 126 10.039 30.922 -42.952 1.00 10.32 H new ATOM 0 HB2 ALA A 126 8.944 29.554 -43.264 1.00 10.32 H new ATOM 0 HB3 ALA A 126 8.835 30.449 -41.730 1.00 10.32 H new ATOM 2006 N PRO A 127 12.510 30.429 -41.323 1.00 15.55 N ATOM 2007 CA PRO A 127 13.441 31.170 -40.466 1.00 40.55 C ATOM 2008 C PRO A 127 12.861 32.497 -39.992 1.00 65.44 C ATOM 2009 O PRO A 127 12.561 33.378 -40.799 1.00 61.01 O ATOM 2010 CB PRO A 127 14.648 31.408 -41.379 1.00 2.52 C ATOM 2011 CG PRO A 127 14.091 31.370 -42.760 1.00 25.00 C ATOM 2012 CD PRO A 127 12.959 30.381 -42.723 1.00 53.14 C ATOM 0 HA PRO A 127 13.680 30.623 -39.554 1.00 40.55 H new ATOM 0 HB2 PRO A 127 15.120 32.368 -41.169 1.00 2.52 H new ATOM 0 HB3 PRO A 127 15.409 30.640 -41.238 1.00 2.52 H new ATOM 0 HG2 PRO A 127 13.739 32.355 -43.066 1.00 25.00 H new ATOM 0 HG3 PRO A 127 14.851 31.066 -43.479 1.00 25.00 H new ATOM 0 HD2 PRO A 127 12.160 30.659 -43.411 1.00 53.14 H new ATOM 0 HD3 PRO A 127 13.289 29.381 -43.005 1.00 53.14 H new ATOM 2020 N SER A 128 12.706 32.636 -38.680 1.00 13.42 N ATOM 2021 CA SER A 128 12.158 33.855 -38.099 1.00 34.54 C ATOM 2022 C SER A 128 13.112 34.439 -37.062 1.00 35.44 C ATOM 2023 O SER A 128 13.248 33.910 -35.959 1.00 1.11 O ATOM 2024 CB SER A 128 10.798 33.574 -37.455 1.00 73.44 C ATOM 2025 OG SER A 128 10.529 34.493 -36.412 1.00 4.53 O ATOM 0 H SER A 128 12.953 31.918 -37.998 1.00 13.42 H new ATOM 0 HA SER A 128 12.029 34.582 -38.900 1.00 34.54 H new ATOM 0 HB2 SER A 128 10.015 33.637 -38.210 1.00 73.44 H new ATOM 0 HB3 SER A 128 10.781 32.558 -37.062 1.00 73.44 H new ATOM 0 HG SER A 128 9.654 34.294 -36.018 1.00 4.53 H new ATOM 2031 N SER A 129 13.773 35.534 -37.424 1.00 63.24 N ATOM 2032 CA SER A 129 14.718 36.189 -36.528 1.00 75.03 C ATOM 2033 C SER A 129 14.221 37.575 -36.132 1.00 3.35 C ATOM 2034 O SER A 129 14.175 38.489 -36.955 1.00 32.54 O ATOM 2035 CB SER A 129 16.092 36.300 -37.193 1.00 12.41 C ATOM 2036 OG SER A 129 17.083 35.636 -36.427 1.00 72.43 O ATOM 0 H SER A 129 13.671 35.986 -38.333 1.00 63.24 H new ATOM 0 HA SER A 129 14.805 35.582 -35.627 1.00 75.03 H new ATOM 0 HB2 SER A 129 16.051 35.869 -38.193 1.00 12.41 H new ATOM 0 HB3 SER A 129 16.360 37.350 -37.309 1.00 12.41 H new ATOM 0 HG SER A 129 17.952 35.719 -36.873 1.00 72.43 H new ATOM 2042 N GLU A 130 13.846 37.723 -34.864 1.00 73.14 N ATOM 2043 CA GLU A 130 13.350 38.998 -34.358 1.00 53.42 C ATOM 2044 C GLU A 130 13.704 39.173 -32.884 1.00 51.12 C ATOM 2045 O GLU A 130 13.231 38.425 -32.027 1.00 71.51 O ATOM 2046 CB GLU A 130 11.835 39.090 -34.544 1.00 44.01 C ATOM 2047 CG GLU A 130 11.332 40.509 -34.754 1.00 32.03 C ATOM 2048 CD GLU A 130 9.930 40.553 -35.328 1.00 10.00 C ATOM 2049 OE1 GLU A 130 9.740 40.076 -36.467 1.00 15.54 O ATOM 2050 OE2 GLU A 130 9.021 41.063 -34.639 1.00 73.41 O ATOM 0 H GLU A 130 13.876 36.976 -34.170 1.00 73.14 H new ATOM 0 HA GLU A 130 13.828 39.796 -34.926 1.00 53.42 H new ATOM 0 HB2 GLU A 130 11.545 38.480 -35.400 1.00 44.01 H new ATOM 0 HB3 GLU A 130 11.344 38.665 -33.669 1.00 44.01 H new ATOM 0 HG2 GLU A 130 11.348 41.040 -33.802 1.00 32.03 H new ATOM 0 HG3 GLU A 130 12.011 41.036 -35.424 1.00 32.03 H new ATOM 2057 N LYS A 131 14.539 40.165 -32.597 1.00 32.15 N ATOM 2058 CA LYS A 131 14.957 40.440 -31.227 1.00 30.33 C ATOM 2059 C LYS A 131 14.765 41.914 -30.885 1.00 71.43 C ATOM 2060 O LYS A 131 15.503 42.475 -30.077 1.00 20.44 O ATOM 2061 CB LYS A 131 16.424 40.048 -31.031 1.00 3.23 C ATOM 2062 CG LYS A 131 17.389 40.859 -31.876 1.00 50.14 C ATOM 2063 CD LYS A 131 18.466 41.509 -31.025 1.00 33.04 C ATOM 2064 CE LYS A 131 19.633 40.563 -30.784 1.00 1.25 C ATOM 2065 NZ LYS A 131 19.479 39.806 -29.511 1.00 22.23 N ATOM 0 H LYS A 131 14.940 40.792 -33.294 1.00 32.15 H new ATOM 0 HA LYS A 131 14.335 39.845 -30.558 1.00 30.33 H new ATOM 0 HB2 LYS A 131 16.686 40.168 -29.980 1.00 3.23 H new ATOM 0 HB3 LYS A 131 16.544 38.992 -31.271 1.00 3.23 H new ATOM 0 HG2 LYS A 131 17.853 40.213 -32.621 1.00 50.14 H new ATOM 0 HG3 LYS A 131 16.840 41.628 -32.419 1.00 50.14 H new ATOM 0 HD2 LYS A 131 18.825 42.413 -31.518 1.00 33.04 H new ATOM 0 HD3 LYS A 131 18.041 41.815 -30.069 1.00 33.04 H new ATOM 0 HE2 LYS A 131 19.711 39.863 -31.616 1.00 1.25 H new ATOM 0 HE3 LYS A 131 20.562 41.132 -30.758 1.00 1.25 H new ATOM 0 HZ1 LYS A 131 20.294 39.173 -29.383 1.00 22.23 H new ATOM 0 HZ2 LYS A 131 19.430 40.473 -28.714 1.00 22.23 H new ATOM 0 HZ3 LYS A 131 18.605 39.243 -29.545 1.00 22.23 H new ATOM 2079 N GLY A 132 13.768 42.537 -31.507 1.00 1.32 N ATOM 2080 CA GLY A 132 13.496 43.939 -31.255 1.00 11.02 C ATOM 2081 C GLY A 132 12.951 44.653 -32.475 1.00 73.53 C ATOM 2082 O GLY A 132 11.978 44.207 -33.081 1.00 51.45 O ATOM 0 H GLY A 132 13.144 42.094 -32.181 1.00 1.32 H new ATOM 0 HA2 GLY A 132 12.780 44.026 -30.437 1.00 11.02 H new ATOM 0 HA3 GLY A 132 14.413 44.431 -30.930 1.00 11.02 H new ATOM 2086 N GLY A 133 13.579 45.768 -32.838 1.00 71.21 N ATOM 2087 CA GLY A 133 13.136 46.528 -33.992 1.00 14.10 C ATOM 2088 C GLY A 133 13.843 47.864 -34.112 1.00 71.32 C ATOM 2089 O GLY A 133 13.213 48.884 -34.387 1.00 14.43 O ATOM 0 H GLY A 133 14.387 46.158 -32.353 1.00 71.21 H new ATOM 0 HA2 GLY A 133 13.311 45.945 -34.896 1.00 14.10 H new ATOM 0 HA3 GLY A 133 12.061 46.694 -33.923 1.00 14.10 H new ATOM 2093 N ASN A 134 15.156 47.858 -33.903 1.00 50.12 N ATOM 2094 CA ASN A 134 15.948 49.079 -33.988 1.00 23.52 C ATOM 2095 C ASN A 134 17.351 48.783 -34.509 1.00 42.51 C ATOM 2096 O ASN A 134 18.180 48.211 -33.800 1.00 40.24 O ATOM 2097 CB ASN A 134 16.033 49.753 -32.617 1.00 12.43 C ATOM 2098 CG ASN A 134 16.390 51.223 -32.716 1.00 30.10 C ATOM 2099 OD1 ASN A 134 17.454 51.582 -33.220 1.00 71.44 O ATOM 2100 ND2 ASN A 134 15.500 52.082 -32.234 1.00 5.21 N ATOM 0 H ASN A 134 15.693 47.022 -33.674 1.00 50.12 H new ATOM 0 HA ASN A 134 15.455 49.754 -34.688 1.00 23.52 H new ATOM 0 HB2 ASN A 134 15.077 49.648 -32.104 1.00 12.43 H new ATOM 0 HB3 ASN A 134 16.779 49.241 -32.009 1.00 12.43 H new ATOM 0 HD21 ASN A 134 15.686 53.084 -32.273 1.00 5.21 H new ATOM 0 HD22 ASN A 134 14.631 51.740 -31.825 1.00 5.21 H new ATOM 2107 N TYR A 135 17.610 49.176 -35.751 1.00 1.20 N ATOM 2108 CA TYR A 135 18.912 48.951 -36.369 1.00 10.42 C ATOM 2109 C TYR A 135 19.311 47.481 -36.276 1.00 75.34 C ATOM 2110 O TYR A 135 18.469 46.612 -36.060 1.00 52.12 O ATOM 2111 CB TYR A 135 19.975 49.823 -35.698 1.00 54.01 C ATOM 2112 CG TYR A 135 20.814 50.614 -36.676 1.00 54.34 C ATOM 2113 CD1 TYR A 135 20.381 51.843 -37.156 1.00 64.11 C ATOM 2114 CD2 TYR A 135 22.039 50.131 -37.120 1.00 62.41 C ATOM 2115 CE1 TYR A 135 21.144 52.570 -38.051 1.00 21.02 C ATOM 2116 CE2 TYR A 135 22.808 50.851 -38.013 1.00 74.13 C ATOM 2117 CZ TYR A 135 22.357 52.069 -38.476 1.00 20.41 C ATOM 2118 OH TYR A 135 23.120 52.789 -39.365 1.00 61.55 O ATOM 0 H TYR A 135 16.936 49.652 -36.350 1.00 1.20 H new ATOM 0 HA TYR A 135 18.839 49.224 -37.422 1.00 10.42 H new ATOM 0 HB2 TYR A 135 19.486 50.513 -35.010 1.00 54.01 H new ATOM 0 HB3 TYR A 135 20.630 49.188 -35.101 1.00 54.01 H new ATOM 0 HD1 TYR A 135 19.432 52.238 -36.825 1.00 64.11 H new ATOM 0 HD2 TYR A 135 22.396 49.177 -36.761 1.00 62.41 H new ATOM 0 HE1 TYR A 135 20.793 53.524 -38.415 1.00 21.02 H new ATOM 0 HE2 TYR A 135 23.758 50.462 -38.347 1.00 74.13 H new ATOM 0 HH TYR A 135 23.945 52.297 -39.562 1.00 61.55 H new TER 2128 TYR A 135