USER MOD reduce.3.24.130724 H: found=0, std=0, add=898, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 749 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 40 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 THR OG1 : rot 180:sc= -0.111 USER MOD Single : A 50 THR OG1 : rot 34:sc= 0.0281 USER MOD Single : A 53 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 62 ASN : amide:sc=-0.00879 K(o=-0.0088,f=-2.5!) USER MOD Single : A 63 MET CE :methyl -150:sc= -0.125 (180deg=-0.35) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 39:sc= 0.545 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 75 GLN : amide:sc= -0.178 K(o=-0.18,f=-0.82) USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 GLN : amide:sc= -1.76 X(o=-1.8,f=-1.5) USER MOD Single : A 88 ASN : amide:sc= -0.494 K(o=-0.49,f=-1.8) USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 GLN : amide:sc= -0.635 K(o=-0.64,f=-1.5) USER MOD Single : A 101 SER OG : rot 90:sc= 0.00174 USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 110 ASN : amide:sc= -0.177 K(o=-0.18,f=-1.7!) USER MOD Single : A 115 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 116 GLN : amide:sc= -2.01! C(o=-2!,f=-1.7!) USER MOD Single : A 120 SER OG : rot 80:sc= 0.0389 USER MOD Single : A 121 ASN : amide:sc= -5.08! C(o=-5.1!,f=-6!) USER MOD Single : A 122 THR OG1 : rot 180:sc=0.000539 USER MOD Single : A 123 THR OG1 : rot 180:sc= -0.116 USER MOD Single : A 125 HIS : no HD1:sc= -0.965 X(o=-0.96,f=-0.69) USER MOD Single : A 127 TYR OH : rot 175:sc= -0.723 USER MOD Single : A 130 LYS NZ :NH3+ 162:sc= -0.018 (180deg=-0.233) USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 135 LYS NZ :NH3+ -171:sc= 0.0439 (180deg=0.0267) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 MET CE :methyl -162:sc= -0.109 (180deg=-0.569) USER MOD Single : A 144 HIS : no HD1:sc= -0.289 K(o=-0.29,f=-0.95) USER MOD Single : A 169 THR OG1 : rot -51:sc= 0.881 USER MOD Single : A 178 LYS NZ :NH3+ 177:sc= 0.00433 (180deg=0.00218) USER MOD ----------------------------------------------------------------- ATOM 21 N TYR A 40 62.749 -28.131 -67.467 1.00 33.22 N ATOM 22 CA TYR A 40 62.171 -28.719 -66.264 1.00 75.50 C ATOM 23 C TYR A 40 61.709 -27.634 -65.296 1.00 15.25 C ATOM 24 O TYR A 40 62.523 -26.992 -64.631 1.00 21.43 O ATOM 25 CB TYR A 40 63.190 -29.631 -65.577 1.00 21.00 C ATOM 26 CG TYR A 40 62.617 -30.411 -64.416 1.00 24.31 C ATOM 27 CD1 TYR A 40 61.842 -31.544 -64.629 1.00 60.25 C ATOM 28 CD2 TYR A 40 62.853 -30.015 -63.104 1.00 35.12 C ATOM 29 CE1 TYR A 40 61.317 -32.259 -63.571 1.00 4.21 C ATOM 30 CE2 TYR A 40 62.332 -30.726 -62.040 1.00 74.11 C ATOM 31 CZ TYR A 40 61.564 -31.847 -62.278 1.00 61.22 C ATOM 32 OH TYR A 40 61.044 -32.557 -61.222 1.00 3.31 O ATOM 0 HA TYR A 40 61.304 -29.311 -66.559 1.00 75.50 H new ATOM 0 HB2 TYR A 40 63.592 -30.330 -66.310 1.00 21.00 H new ATOM 0 HB3 TYR A 40 64.025 -29.027 -65.221 1.00 21.00 H new ATOM 0 HD1 TYR A 40 61.647 -31.871 -65.640 1.00 60.25 H new ATOM 0 HD2 TYR A 40 63.453 -29.138 -62.914 1.00 35.12 H new ATOM 0 HE1 TYR A 40 60.716 -33.137 -63.755 1.00 4.21 H new ATOM 0 HE2 TYR A 40 62.525 -30.406 -61.027 1.00 74.11 H new ATOM 0 HH TYR A 40 61.313 -32.134 -60.380 1.00 3.31 H new ATOM 41 N ARG A 41 60.397 -27.436 -65.221 1.00 72.11 N ATOM 42 CA ARG A 41 59.825 -26.430 -64.335 1.00 54.24 C ATOM 43 C ARG A 41 58.506 -26.915 -63.742 1.00 61.34 C ATOM 44 O ARG A 41 57.814 -27.745 -64.333 1.00 73.34 O ATOM 45 CB ARG A 41 59.605 -25.119 -65.093 1.00 25.55 C ATOM 46 CG ARG A 41 58.609 -25.235 -66.235 1.00 33.35 C ATOM 47 CD ARG A 41 58.770 -24.099 -67.233 1.00 24.43 C ATOM 48 NE ARG A 41 59.966 -24.258 -68.055 1.00 74.54 N ATOM 49 CZ ARG A 41 60.273 -23.457 -69.069 1.00 43.34 C ATOM 50 NH1 ARG A 41 59.476 -22.444 -69.383 1.00 11.42 N ATOM 51 NH2 ARG A 41 61.379 -23.666 -69.772 1.00 14.22 N ATOM 0 H ARG A 41 59.710 -27.959 -65.764 1.00 72.11 H new ATOM 0 HA ARG A 41 60.528 -26.257 -63.520 1.00 54.24 H new ATOM 0 HB2 ARG A 41 59.256 -24.359 -64.394 1.00 25.55 H new ATOM 0 HB3 ARG A 41 60.560 -24.773 -65.489 1.00 25.55 H new ATOM 0 HG2 ARG A 41 58.746 -26.189 -66.743 1.00 33.35 H new ATOM 0 HG3 ARG A 41 57.595 -25.229 -65.836 1.00 33.35 H new ATOM 0 HD2 ARG A 41 57.891 -24.055 -67.876 1.00 24.43 H new ATOM 0 HD3 ARG A 41 58.821 -23.151 -66.698 1.00 24.43 H new ATOM 0 HE ARG A 41 60.601 -25.027 -67.839 1.00 74.54 H new ATOM 0 HH11 ARG A 41 58.625 -22.279 -68.845 1.00 11.42 H new ATOM 0 HH12 ARG A 41 59.714 -21.830 -70.162 1.00 11.42 H new ATOM 0 HH21 ARG A 41 61.995 -24.443 -69.534 1.00 14.22 H new ATOM 0 HH22 ARG A 41 61.613 -23.050 -70.550 1.00 14.22 H new ATOM 62 N LYS A 42 58.162 -26.391 -62.570 1.00 15.10 N ATOM 63 CA LYS A 42 56.925 -26.769 -61.896 1.00 31.11 C ATOM 64 C LYS A 42 56.578 -25.770 -60.798 1.00 42.31 C ATOM 65 O LYS A 42 57.461 -25.231 -60.132 1.00 22.22 O ATOM 66 CB LYS A 42 57.053 -28.173 -61.301 1.00 72.03 C ATOM 67 CG LYS A 42 58.281 -28.353 -60.426 1.00 4.03 C ATOM 68 CD LYS A 42 58.377 -29.769 -59.883 1.00 42.21 C ATOM 69 CE LYS A 42 59.690 -29.998 -59.151 1.00 4.44 C ATOM 70 NZ LYS A 42 59.675 -31.266 -58.368 1.00 52.01 N ATOM 0 H LYS A 42 58.723 -25.703 -62.067 1.00 15.10 H new ATOM 0 HA LYS A 42 56.122 -26.766 -62.633 1.00 31.11 H new ATOM 0 HB2 LYS A 42 56.162 -28.391 -60.712 1.00 72.03 H new ATOM 0 HB3 LYS A 42 57.085 -28.901 -62.112 1.00 72.03 H new ATOM 0 HG2 LYS A 42 59.177 -28.122 -61.003 1.00 4.03 H new ATOM 0 HG3 LYS A 42 58.245 -27.646 -59.597 1.00 4.03 H new ATOM 0 HD2 LYS A 42 57.544 -29.957 -59.206 1.00 42.21 H new ATOM 0 HD3 LYS A 42 58.288 -30.481 -60.703 1.00 42.21 H new ATOM 0 HE2 LYS A 42 60.507 -30.026 -59.871 1.00 4.44 H new ATOM 0 HE3 LYS A 42 59.884 -29.160 -58.481 1.00 4.44 H new ATOM 0 HZ1 LYS A 42 60.588 -31.386 -57.884 1.00 52.01 H new ATOM 0 HZ2 LYS A 42 58.911 -31.230 -57.663 1.00 52.01 H new ATOM 0 HZ3 LYS A 42 59.516 -32.069 -59.010 1.00 52.01 H new ATOM 80 N LYS A 43 55.284 -25.529 -60.613 1.00 24.34 N ATOM 81 CA LYS A 43 54.818 -24.596 -59.593 1.00 62.40 C ATOM 82 C LYS A 43 53.425 -24.979 -59.102 1.00 61.45 C ATOM 83 O LYS A 43 52.758 -25.825 -59.695 1.00 70.41 O ATOM 84 CB LYS A 43 54.802 -23.169 -60.147 1.00 43.21 C ATOM 85 CG LYS A 43 53.888 -22.993 -61.347 1.00 20.41 C ATOM 86 CD LYS A 43 52.527 -22.454 -60.939 1.00 21.34 C ATOM 87 CE LYS A 43 52.500 -20.934 -60.962 1.00 24.52 C ATOM 88 NZ LYS A 43 51.220 -20.393 -60.429 1.00 43.52 N ATOM 0 H LYS A 43 54.540 -25.967 -61.156 1.00 24.34 H new ATOM 0 HA LYS A 43 55.507 -24.643 -58.750 1.00 62.40 H new ATOM 0 HB2 LYS A 43 54.488 -22.485 -59.358 1.00 43.21 H new ATOM 0 HB3 LYS A 43 55.816 -22.886 -60.429 1.00 43.21 H new ATOM 0 HG2 LYS A 43 54.351 -22.312 -62.061 1.00 20.41 H new ATOM 0 HG3 LYS A 43 53.764 -23.950 -61.854 1.00 20.41 H new ATOM 0 HD2 LYS A 43 51.764 -22.843 -61.613 1.00 21.34 H new ATOM 0 HD3 LYS A 43 52.279 -22.808 -59.938 1.00 21.34 H new ATOM 0 HE2 LYS A 43 53.331 -20.547 -60.372 1.00 24.52 H new ATOM 0 HE3 LYS A 43 52.644 -20.584 -61.984 1.00 24.52 H new ATOM 0 HZ1 LYS A 43 51.242 -19.354 -60.462 1.00 43.52 H new ATOM 0 HZ2 LYS A 43 50.429 -20.741 -61.007 1.00 43.52 H new ATOM 0 HZ3 LYS A 43 51.094 -20.706 -59.445 1.00 43.52 H new ATOM 98 N GLY A 44 52.991 -24.346 -58.015 1.00 54.10 N ATOM 99 CA GLY A 44 51.680 -24.633 -57.465 1.00 43.12 C ATOM 100 C GLY A 44 51.742 -25.581 -56.284 1.00 23.34 C ATOM 101 O GLY A 44 52.413 -26.612 -56.339 1.00 31.24 O ATOM 0 H GLY A 44 53.524 -23.640 -57.507 1.00 54.10 H new ATOM 0 HA2 GLY A 44 51.208 -23.701 -57.155 1.00 43.12 H new ATOM 0 HA3 GLY A 44 51.050 -25.066 -58.242 1.00 43.12 H new ATOM 105 N LYS A 45 51.042 -25.233 -55.210 1.00 45.34 N ATOM 106 CA LYS A 45 51.019 -26.059 -54.008 1.00 52.54 C ATOM 107 C LYS A 45 49.599 -26.515 -53.689 1.00 51.33 C ATOM 108 O LYS A 45 48.629 -25.825 -54.000 1.00 51.03 O ATOM 109 CB LYS A 45 51.597 -25.286 -52.821 1.00 45.24 C ATOM 110 CG LYS A 45 53.110 -25.359 -52.727 1.00 32.53 C ATOM 111 CD LYS A 45 53.774 -24.259 -53.538 1.00 33.41 C ATOM 112 CE LYS A 45 53.740 -22.927 -52.805 1.00 4.32 C ATOM 113 NZ LYS A 45 53.861 -21.776 -53.741 1.00 24.13 N ATOM 0 H LYS A 45 50.482 -24.383 -55.147 1.00 45.34 H new ATOM 0 HA LYS A 45 51.633 -26.941 -54.192 1.00 52.54 H new ATOM 0 HB2 LYS A 45 51.296 -24.241 -52.897 1.00 45.24 H new ATOM 0 HB3 LYS A 45 51.165 -25.676 -51.899 1.00 45.24 H new ATOM 0 HG2 LYS A 45 53.415 -25.277 -51.684 1.00 32.53 H new ATOM 0 HG3 LYS A 45 53.451 -26.331 -53.083 1.00 32.53 H new ATOM 0 HD2 LYS A 45 54.808 -24.534 -53.747 1.00 33.41 H new ATOM 0 HD3 LYS A 45 53.270 -24.159 -54.499 1.00 33.41 H new ATOM 0 HE2 LYS A 45 52.808 -22.844 -52.246 1.00 4.32 H new ATOM 0 HE3 LYS A 45 54.552 -22.891 -52.079 1.00 4.32 H new ATOM 0 HZ1 LYS A 45 53.834 -20.887 -53.203 1.00 24.13 H new ATOM 0 HZ2 LYS A 45 54.762 -21.841 -54.257 1.00 24.13 H new ATOM 0 HZ3 LYS A 45 53.072 -21.795 -54.418 1.00 24.13 H new ATOM 123 N GLY A 46 49.485 -27.683 -53.063 1.00 44.55 N ATOM 124 CA GLY A 46 48.179 -28.211 -52.710 1.00 64.34 C ATOM 125 C GLY A 46 47.507 -27.409 -51.613 1.00 21.10 C ATOM 126 O GLY A 46 48.155 -26.987 -50.656 1.00 22.44 O ATOM 0 H GLY A 46 50.273 -28.273 -52.794 1.00 44.55 H new ATOM 0 HA2 GLY A 46 47.542 -28.217 -53.594 1.00 64.34 H new ATOM 0 HA3 GLY A 46 48.284 -29.246 -52.386 1.00 64.34 H new ATOM 130 N LYS A 47 46.202 -27.195 -51.753 1.00 34.22 N ATOM 131 CA LYS A 47 45.441 -26.438 -50.767 1.00 14.50 C ATOM 132 C LYS A 47 44.372 -27.312 -50.117 1.00 63.52 C ATOM 133 O LYS A 47 44.096 -28.418 -50.579 1.00 74.21 O ATOM 134 CB LYS A 47 44.789 -25.219 -51.422 1.00 72.21 C ATOM 135 CG LYS A 47 45.670 -23.981 -51.416 1.00 51.31 C ATOM 136 CD LYS A 47 45.807 -23.402 -50.018 1.00 34.12 C ATOM 137 CE LYS A 47 44.533 -22.698 -49.578 1.00 45.04 C ATOM 138 NZ LYS A 47 44.720 -21.958 -48.299 1.00 32.14 N ATOM 0 H LYS A 47 45.650 -27.536 -52.540 1.00 34.22 H new ATOM 0 HA LYS A 47 46.131 -26.101 -49.993 1.00 14.50 H new ATOM 0 HB2 LYS A 47 44.530 -25.465 -52.452 1.00 72.21 H new ATOM 0 HB3 LYS A 47 43.857 -24.994 -50.904 1.00 72.21 H new ATOM 0 HG2 LYS A 47 46.657 -24.233 -51.805 1.00 51.31 H new ATOM 0 HG3 LYS A 47 45.247 -23.229 -52.083 1.00 51.31 H new ATOM 0 HD2 LYS A 47 46.044 -24.200 -49.314 1.00 34.12 H new ATOM 0 HD3 LYS A 47 46.639 -22.698 -49.995 1.00 34.12 H new ATOM 0 HE2 LYS A 47 44.215 -22.004 -50.356 1.00 45.04 H new ATOM 0 HE3 LYS A 47 43.735 -23.431 -49.460 1.00 45.04 H new ATOM 0 HZ1 LYS A 47 43.829 -21.492 -48.034 1.00 32.14 H new ATOM 0 HZ2 LYS A 47 44.999 -22.624 -47.550 1.00 32.14 H new ATOM 0 HZ3 LYS A 47 45.463 -21.240 -48.419 1.00 32.14 H new ATOM 148 N GLY A 48 43.772 -26.806 -49.044 1.00 22.03 N ATOM 149 CA GLY A 48 42.740 -27.553 -48.350 1.00 30.44 C ATOM 150 C GLY A 48 41.665 -26.656 -47.770 1.00 25.02 C ATOM 151 O GLY A 48 41.616 -25.461 -48.067 1.00 2.41 O ATOM 0 H GLY A 48 43.982 -25.892 -48.643 1.00 22.03 H new ATOM 0 HA2 GLY A 48 42.283 -28.263 -49.040 1.00 30.44 H new ATOM 0 HA3 GLY A 48 43.194 -28.135 -47.548 1.00 30.44 H new ATOM 155 N THR A 49 40.799 -27.230 -46.941 1.00 21.11 N ATOM 156 CA THR A 49 39.718 -26.475 -46.321 1.00 10.34 C ATOM 157 C THR A 49 39.711 -26.667 -44.808 1.00 72.21 C ATOM 158 O THR A 49 40.221 -27.664 -44.296 1.00 23.15 O ATOM 159 CB THR A 49 38.347 -26.890 -46.886 1.00 10.01 C ATOM 160 OG1 THR A 49 37.299 -26.241 -46.157 1.00 24.34 O ATOM 161 CG2 THR A 49 38.164 -28.398 -46.810 1.00 73.22 C ATOM 0 H THR A 49 40.826 -28.217 -46.683 1.00 21.11 H new ATOM 0 HA THR A 49 39.894 -25.424 -46.551 1.00 10.34 H new ATOM 0 HB THR A 49 38.304 -26.586 -47.932 1.00 10.01 H new ATOM 0 HG1 THR A 49 36.431 -26.509 -46.524 1.00 24.34 H new ATOM 0 HG21 THR A 49 37.188 -28.667 -47.215 1.00 73.22 H new ATOM 0 HG22 THR A 49 38.945 -28.889 -47.390 1.00 73.22 H new ATOM 0 HG23 THR A 49 38.227 -28.720 -45.771 1.00 73.22 H new ATOM 169 N THR A 50 39.128 -25.706 -44.097 1.00 34.22 N ATOM 170 CA THR A 50 39.055 -25.770 -42.643 1.00 3.01 C ATOM 171 C THR A 50 37.740 -26.391 -42.185 1.00 13.00 C ATOM 172 O THR A 50 36.666 -26.012 -42.653 1.00 74.43 O ATOM 173 CB THR A 50 39.196 -24.372 -42.012 1.00 41.15 C ATOM 174 OG1 THR A 50 38.223 -23.482 -42.571 1.00 3.20 O ATOM 175 CG2 THR A 50 40.593 -23.813 -42.241 1.00 45.43 C ATOM 0 H THR A 50 38.700 -24.875 -44.505 1.00 34.22 H new ATOM 0 HA THR A 50 39.884 -26.396 -42.312 1.00 3.01 H new ATOM 0 HB THR A 50 39.030 -24.464 -40.939 1.00 41.15 H new ATOM 0 HG1 THR A 50 37.402 -23.979 -42.771 1.00 3.20 H new ATOM 0 HG21 THR A 50 40.669 -22.825 -41.787 1.00 45.43 H new ATOM 0 HG22 THR A 50 41.329 -24.478 -41.789 1.00 45.43 H new ATOM 0 HG23 THR A 50 40.783 -23.735 -43.312 1.00 45.43 H new ATOM 183 N VAL A 51 37.831 -27.346 -41.266 1.00 52.52 N ATOM 184 CA VAL A 51 36.647 -28.019 -40.744 1.00 33.03 C ATOM 185 C VAL A 51 36.334 -27.558 -39.326 1.00 24.35 C ATOM 186 O VAL A 51 37.154 -27.699 -38.419 1.00 34.23 O ATOM 187 CB VAL A 51 36.825 -29.550 -40.746 1.00 64.21 C ATOM 188 CG1 VAL A 51 35.525 -30.239 -40.360 1.00 51.02 C ATOM 189 CG2 VAL A 51 37.308 -30.027 -42.107 1.00 33.24 C ATOM 0 H VAL A 51 38.712 -27.671 -40.867 1.00 52.52 H new ATOM 0 HA VAL A 51 35.818 -27.756 -41.401 1.00 33.03 H new ATOM 0 HB VAL A 51 37.580 -29.812 -40.005 1.00 64.21 H new ATOM 0 HG11 VAL A 51 35.670 -31.319 -40.367 1.00 51.02 H new ATOM 0 HG12 VAL A 51 35.226 -29.919 -39.362 1.00 51.02 H new ATOM 0 HG13 VAL A 51 34.746 -29.973 -41.075 1.00 51.02 H new ATOM 0 HG21 VAL A 51 37.429 -31.110 -42.091 1.00 33.24 H new ATOM 0 HG22 VAL A 51 36.577 -29.754 -42.868 1.00 33.24 H new ATOM 0 HG23 VAL A 51 38.265 -29.559 -42.338 1.00 33.24 H new ATOM 199 N GLY A 52 35.140 -27.003 -39.140 1.00 24.23 N ATOM 200 CA GLY A 52 34.739 -26.529 -37.828 1.00 45.01 C ATOM 201 C GLY A 52 33.339 -26.973 -37.454 1.00 14.44 C ATOM 202 O GLY A 52 32.684 -27.687 -38.213 1.00 1.44 O ATOM 0 H GLY A 52 34.444 -26.873 -39.874 1.00 24.23 H new ATOM 0 HA2 GLY A 52 35.444 -26.895 -37.082 1.00 45.01 H new ATOM 0 HA3 GLY A 52 34.789 -25.440 -37.807 1.00 45.01 H new ATOM 206 N MET A 53 32.879 -26.553 -36.279 1.00 33.12 N ATOM 207 CA MET A 53 31.549 -26.914 -35.806 1.00 4.13 C ATOM 208 C MET A 53 31.180 -26.116 -34.560 1.00 25.34 C ATOM 209 O MET A 53 32.050 -25.711 -33.790 1.00 10.33 O ATOM 210 CB MET A 53 31.480 -28.413 -35.505 1.00 24.34 C ATOM 211 CG MET A 53 32.448 -28.860 -34.422 1.00 61.11 C ATOM 212 SD MET A 53 32.838 -30.617 -34.522 1.00 21.13 S ATOM 213 CE MET A 53 34.385 -30.672 -33.619 1.00 73.04 C ATOM 0 H MET A 53 33.409 -25.962 -35.638 1.00 33.12 H new ATOM 0 HA MET A 53 30.834 -26.676 -36.593 1.00 4.13 H new ATOM 0 HB2 MET A 53 30.465 -28.668 -35.201 1.00 24.34 H new ATOM 0 HB3 MET A 53 31.688 -28.969 -36.419 1.00 24.34 H new ATOM 0 HG2 MET A 53 33.369 -28.282 -34.502 1.00 61.11 H new ATOM 0 HG3 MET A 53 32.019 -28.642 -33.444 1.00 61.11 H new ATOM 0 HE1 MET A 53 34.755 -31.697 -33.593 1.00 73.04 H new ATOM 0 HE2 MET A 53 35.118 -30.034 -34.113 1.00 73.04 H new ATOM 0 HE3 MET A 53 34.225 -30.318 -32.600 1.00 73.04 H new ATOM 221 N GLY A 54 29.883 -25.891 -34.368 1.00 52.32 N ATOM 222 CA GLY A 54 29.423 -25.142 -33.214 1.00 65.03 C ATOM 223 C GLY A 54 28.782 -26.028 -32.164 1.00 31.42 C ATOM 224 O GLY A 54 28.801 -27.253 -32.280 1.00 14.12 O ATOM 0 H GLY A 54 29.143 -26.214 -34.991 1.00 52.32 H new ATOM 0 HA2 GLY A 54 30.265 -24.610 -32.771 1.00 65.03 H new ATOM 0 HA3 GLY A 54 28.704 -24.389 -33.537 1.00 65.03 H new ATOM 266 N ARG A 58 20.052 -24.808 -24.847 1.00 0.04 N ATOM 267 CA ARG A 58 18.712 -24.281 -24.617 1.00 13.34 C ATOM 268 C ARG A 58 18.539 -23.851 -23.163 1.00 64.42 C ATOM 269 O ARG A 58 19.451 -23.998 -22.349 1.00 22.22 O ATOM 270 CB ARG A 58 17.659 -25.332 -24.976 1.00 43.11 C ATOM 271 CG ARG A 58 17.962 -26.714 -24.419 1.00 61.34 C ATOM 272 CD ARG A 58 16.797 -27.668 -24.633 1.00 62.35 C ATOM 273 NE ARG A 58 15.568 -27.178 -24.015 1.00 61.22 N ATOM 274 CZ ARG A 58 14.362 -27.661 -24.293 1.00 70.11 C ATOM 275 NH1 ARG A 58 14.225 -28.643 -25.174 1.00 70.52 N ATOM 276 NH2 ARG A 58 13.291 -27.164 -23.689 1.00 62.24 N ATOM 0 HA ARG A 58 18.578 -23.408 -25.256 1.00 13.34 H new ATOM 0 HB2 ARG A 58 16.689 -25.004 -24.603 1.00 43.11 H new ATOM 0 HB3 ARG A 58 17.578 -25.397 -26.061 1.00 43.11 H new ATOM 0 HG2 ARG A 58 18.854 -27.114 -24.900 1.00 61.34 H new ATOM 0 HG3 ARG A 58 18.181 -26.638 -23.354 1.00 61.34 H new ATOM 0 HD2 ARG A 58 16.635 -27.808 -25.702 1.00 62.35 H new ATOM 0 HD3 ARG A 58 17.047 -28.644 -24.218 1.00 62.35 H new ATOM 0 HE ARG A 58 15.639 -26.423 -23.332 1.00 61.22 H new ATOM 0 HH11 ARG A 58 15.046 -29.029 -25.640 1.00 70.52 H new ATOM 0 HH12 ARG A 58 13.298 -29.012 -25.386 1.00 70.52 H new ATOM 0 HH21 ARG A 58 13.392 -26.410 -23.010 1.00 62.24 H new ATOM 0 HH22 ARG A 58 12.366 -27.536 -23.904 1.00 62.24 H new ATOM 287 N ARG A 59 17.365 -23.318 -22.844 1.00 44.13 N ATOM 288 CA ARG A 59 17.073 -22.864 -21.489 1.00 72.15 C ATOM 289 C ARG A 59 15.894 -23.632 -20.901 1.00 43.45 C ATOM 290 O ARG A 59 15.307 -24.491 -21.560 1.00 33.02 O ATOM 291 CB ARG A 59 16.772 -21.364 -21.486 1.00 21.12 C ATOM 292 CG ARG A 59 18.018 -20.493 -21.490 1.00 2.22 C ATOM 293 CD ARG A 59 18.657 -20.442 -22.869 1.00 62.02 C ATOM 294 NE ARG A 59 19.442 -19.227 -23.063 1.00 60.35 N ATOM 295 CZ ARG A 59 20.369 -19.093 -24.005 1.00 34.33 C ATOM 296 NH1 ARG A 59 20.626 -20.096 -24.834 1.00 0.01 N ATOM 297 NH2 ARG A 59 21.042 -17.955 -24.120 1.00 14.32 N ATOM 0 H ARG A 59 16.599 -23.190 -23.506 1.00 44.13 H new ATOM 0 HA ARG A 59 17.951 -23.053 -20.871 1.00 72.15 H new ATOM 0 HB2 ARG A 59 16.167 -21.122 -22.360 1.00 21.12 H new ATOM 0 HB3 ARG A 59 16.174 -21.124 -20.607 1.00 21.12 H new ATOM 0 HG2 ARG A 59 17.759 -19.484 -21.170 1.00 2.22 H new ATOM 0 HG3 ARG A 59 18.737 -20.881 -20.769 1.00 2.22 H new ATOM 0 HD2 ARG A 59 19.298 -21.313 -23.004 1.00 62.02 H new ATOM 0 HD3 ARG A 59 17.880 -20.497 -23.631 1.00 62.02 H new ATOM 0 HE ARG A 59 19.269 -18.437 -22.441 1.00 60.35 H new ATOM 0 HH11 ARG A 59 20.111 -20.973 -24.749 1.00 0.01 H new ATOM 0 HH12 ARG A 59 21.338 -19.991 -25.557 1.00 0.01 H new ATOM 0 HH21 ARG A 59 20.848 -17.181 -23.484 1.00 14.32 H new ATOM 0 HH22 ARG A 59 21.753 -17.854 -24.844 1.00 14.32 H new ATOM 308 N PHE A 60 15.550 -23.316 -19.656 1.00 70.23 N ATOM 309 CA PHE A 60 14.441 -23.978 -18.978 1.00 21.51 C ATOM 310 C PHE A 60 13.561 -22.961 -18.258 1.00 23.00 C ATOM 311 O PHE A 60 13.948 -21.805 -18.079 1.00 10.24 O ATOM 312 CB PHE A 60 14.970 -25.009 -17.979 1.00 52.43 C ATOM 313 CG PHE A 60 15.958 -24.445 -17.000 1.00 54.11 C ATOM 314 CD1 PHE A 60 15.545 -24.005 -15.754 1.00 5.54 C ATOM 315 CD2 PHE A 60 17.302 -24.353 -17.327 1.00 11.44 C ATOM 316 CE1 PHE A 60 16.451 -23.486 -14.849 1.00 60.42 C ATOM 317 CE2 PHE A 60 18.214 -23.836 -16.426 1.00 60.34 C ATOM 318 CZ PHE A 60 17.788 -23.400 -15.187 1.00 40.30 C ATOM 0 H PHE A 60 16.023 -22.606 -19.097 1.00 70.23 H new ATOM 0 HA PHE A 60 13.838 -24.487 -19.730 1.00 21.51 H new ATOM 0 HB2 PHE A 60 14.130 -25.435 -17.430 1.00 52.43 H new ATOM 0 HB3 PHE A 60 15.440 -25.826 -18.527 1.00 52.43 H new ATOM 0 HD1 PHE A 60 14.501 -24.068 -15.486 1.00 5.54 H new ATOM 0 HD2 PHE A 60 17.640 -24.689 -18.296 1.00 11.44 H new ATOM 0 HE1 PHE A 60 16.115 -23.148 -13.880 1.00 60.42 H new ATOM 0 HE2 PHE A 60 19.259 -23.773 -16.691 1.00 60.34 H new ATOM 0 HZ PHE A 60 18.499 -22.992 -14.483 1.00 40.30 H new ATOM 327 N ILE A 61 12.376 -23.399 -17.847 1.00 20.50 N ATOM 328 CA ILE A 61 11.440 -22.528 -17.146 1.00 73.52 C ATOM 329 C ILE A 61 10.844 -23.228 -15.930 1.00 2.12 C ATOM 330 O ILE A 61 10.238 -24.293 -16.049 1.00 21.40 O ATOM 331 CB ILE A 61 10.299 -22.067 -18.071 1.00 54.51 C ATOM 332 CG1 ILE A 61 10.866 -21.510 -19.378 1.00 23.41 C ATOM 333 CG2 ILE A 61 9.439 -21.025 -17.372 1.00 60.01 C ATOM 334 CD1 ILE A 61 11.037 -22.555 -20.458 1.00 44.32 C ATOM 0 H ILE A 61 12.041 -24.352 -17.987 1.00 20.50 H new ATOM 0 HA ILE A 61 12.005 -21.655 -16.819 1.00 73.52 H new ATOM 0 HB ILE A 61 9.672 -22.927 -18.307 1.00 54.51 H new ATOM 0 HG12 ILE A 61 10.205 -20.725 -19.745 1.00 23.41 H new ATOM 0 HG13 ILE A 61 11.832 -21.046 -19.177 1.00 23.41 H new ATOM 0 HG21 ILE A 61 8.637 -20.709 -18.039 1.00 60.01 H new ATOM 0 HG22 ILE A 61 9.010 -21.455 -16.467 1.00 60.01 H new ATOM 0 HG23 ILE A 61 10.053 -20.164 -17.109 1.00 60.01 H new ATOM 0 HD11 ILE A 61 11.443 -22.088 -21.355 1.00 44.32 H new ATOM 0 HD12 ILE A 61 11.721 -23.329 -20.110 1.00 44.32 H new ATOM 0 HD13 ILE A 61 10.070 -23.002 -20.688 1.00 44.32 H new ATOM 345 N ASN A 62 11.017 -22.622 -14.760 1.00 35.31 N ATOM 346 CA ASN A 62 10.494 -23.186 -13.521 1.00 55.51 C ATOM 347 C ASN A 62 9.554 -22.203 -12.829 1.00 35.23 C ATOM 348 O ASN A 62 9.610 -20.999 -13.076 1.00 2.25 O ATOM 349 CB ASN A 62 11.642 -23.560 -12.582 1.00 21.51 C ATOM 350 CG ASN A 62 12.344 -24.836 -13.005 1.00 22.53 C ATOM 351 OD1 ASN A 62 12.130 -25.338 -14.108 1.00 10.51 O ATOM 352 ND2 ASN A 62 13.189 -25.365 -12.127 1.00 24.43 N ATOM 0 H ASN A 62 11.516 -21.740 -14.644 1.00 35.31 H new ATOM 0 HA ASN A 62 9.930 -24.085 -13.770 1.00 55.51 H new ATOM 0 HB2 ASN A 62 12.364 -22.744 -12.553 1.00 21.51 H new ATOM 0 HB3 ASN A 62 11.255 -23.680 -11.570 1.00 21.51 H new ATOM 0 HD21 ASN A 62 13.692 -26.222 -12.356 1.00 24.43 H new ATOM 0 HD22 ASN A 62 13.335 -24.914 -11.224 1.00 24.43 H new ATOM 358 N MET A 63 8.694 -22.726 -11.963 1.00 21.13 N ATOM 359 CA MET A 63 7.743 -21.894 -11.234 1.00 14.05 C ATOM 360 C MET A 63 7.397 -22.519 -9.886 1.00 25.34 C ATOM 361 O MET A 63 7.619 -23.710 -9.667 1.00 42.23 O ATOM 362 CB MET A 63 6.471 -21.694 -12.058 1.00 10.41 C ATOM 363 CG MET A 63 5.787 -22.995 -12.447 1.00 74.50 C ATOM 364 SD MET A 63 4.553 -23.519 -11.243 1.00 21.21 S ATOM 365 CE MET A 63 5.043 -25.221 -10.974 1.00 43.10 C ATOM 0 H MET A 63 8.635 -23.721 -11.748 1.00 21.13 H new ATOM 0 HA MET A 63 8.208 -20.924 -11.057 1.00 14.05 H new ATOM 0 HB2 MET A 63 5.772 -21.082 -11.489 1.00 10.41 H new ATOM 0 HB3 MET A 63 6.718 -21.138 -12.963 1.00 10.41 H new ATOM 0 HG2 MET A 63 5.311 -22.874 -13.420 1.00 74.50 H new ATOM 0 HG3 MET A 63 6.538 -23.777 -12.555 1.00 74.50 H new ATOM 0 HE1 MET A 63 4.166 -25.817 -10.722 1.00 43.10 H new ATOM 0 HE2 MET A 63 5.501 -25.616 -11.881 1.00 43.10 H new ATOM 0 HE3 MET A 63 5.761 -25.268 -10.155 1.00 43.10 H new ATOM 373 N TYR A 64 6.854 -21.707 -8.985 1.00 1.03 N ATOM 374 CA TYR A 64 6.480 -22.180 -7.658 1.00 24.53 C ATOM 375 C TYR A 64 5.264 -21.422 -7.133 1.00 41.44 C ATOM 376 O TYR A 64 5.301 -20.205 -6.962 1.00 74.51 O ATOM 377 CB TYR A 64 7.652 -22.019 -6.687 1.00 63.03 C ATOM 378 CG TYR A 64 7.359 -22.531 -5.295 1.00 13.53 C ATOM 379 CD1 TYR A 64 7.025 -23.863 -5.079 1.00 34.53 C ATOM 380 CD2 TYR A 64 7.418 -21.685 -4.195 1.00 63.52 C ATOM 381 CE1 TYR A 64 6.757 -24.336 -3.809 1.00 21.51 C ATOM 382 CE2 TYR A 64 7.152 -22.148 -2.921 1.00 53.21 C ATOM 383 CZ TYR A 64 6.822 -23.474 -2.733 1.00 53.33 C ATOM 384 OH TYR A 64 6.557 -23.941 -1.466 1.00 54.03 O ATOM 0 H TYR A 64 6.663 -20.719 -9.150 1.00 1.03 H new ATOM 0 HA TYR A 64 6.223 -23.236 -7.736 1.00 24.53 H new ATOM 0 HB2 TYR A 64 8.518 -22.548 -7.085 1.00 63.03 H new ATOM 0 HB3 TYR A 64 7.922 -20.965 -6.628 1.00 63.03 H new ATOM 0 HD1 TYR A 64 6.974 -24.540 -5.919 1.00 34.53 H new ATOM 0 HD2 TYR A 64 7.677 -20.646 -4.338 1.00 63.52 H new ATOM 0 HE1 TYR A 64 6.498 -25.374 -3.659 1.00 21.51 H new ATOM 0 HE2 TYR A 64 7.202 -21.476 -2.077 1.00 53.21 H new ATOM 0 HH TYR A 64 6.647 -23.208 -0.822 1.00 54.03 H new ATOM 393 N GLY A 65 4.183 -22.156 -6.878 1.00 63.51 N ATOM 394 CA GLY A 65 2.970 -21.538 -6.375 1.00 33.04 C ATOM 395 C GLY A 65 2.891 -21.565 -4.861 1.00 43.41 C ATOM 396 O GLY A 65 3.146 -22.595 -4.236 1.00 71.41 O ATOM 0 H GLY A 65 4.127 -23.166 -7.011 1.00 63.51 H new ATOM 0 HA2 GLY A 65 2.922 -20.505 -6.720 1.00 33.04 H new ATOM 0 HA3 GLY A 65 2.104 -22.053 -6.790 1.00 33.04 H new ATOM 400 N PHE A 66 2.538 -20.429 -4.268 1.00 61.03 N ATOM 401 CA PHE A 66 2.428 -20.326 -2.818 1.00 22.31 C ATOM 402 C PHE A 66 1.076 -19.744 -2.415 1.00 41.32 C ATOM 403 O PHE A 66 0.521 -18.894 -3.111 1.00 10.34 O ATOM 404 CB PHE A 66 3.557 -19.455 -2.261 1.00 45.24 C ATOM 405 CG PHE A 66 3.485 -18.023 -2.709 1.00 32.44 C ATOM 406 CD1 PHE A 66 3.873 -17.663 -3.990 1.00 13.24 C ATOM 407 CD2 PHE A 66 3.032 -17.036 -1.849 1.00 23.10 C ATOM 408 CE1 PHE A 66 3.808 -16.347 -4.406 1.00 33.54 C ATOM 409 CE2 PHE A 66 2.965 -15.718 -2.260 1.00 25.23 C ATOM 410 CZ PHE A 66 3.356 -15.373 -3.539 1.00 42.44 C ATOM 0 H PHE A 66 2.323 -19.567 -4.770 1.00 61.03 H new ATOM 0 HA PHE A 66 2.511 -21.329 -2.400 1.00 22.31 H new ATOM 0 HB2 PHE A 66 3.528 -19.489 -1.172 1.00 45.24 H new ATOM 0 HB3 PHE A 66 4.515 -19.876 -2.567 1.00 45.24 H new ATOM 0 HD1 PHE A 66 4.231 -18.421 -4.672 1.00 13.24 H new ATOM 0 HD2 PHE A 66 2.728 -17.299 -0.847 1.00 23.10 H new ATOM 0 HE1 PHE A 66 4.110 -16.081 -5.408 1.00 33.54 H new ATOM 0 HE2 PHE A 66 2.607 -14.958 -1.581 1.00 25.23 H new ATOM 0 HZ PHE A 66 3.308 -14.343 -3.860 1.00 42.44 H new ATOM 419 N ASP A 67 0.552 -20.210 -1.286 1.00 61.13 N ATOM 420 CA ASP A 67 -0.735 -19.737 -0.790 1.00 1.21 C ATOM 421 C ASP A 67 -1.074 -20.390 0.547 1.00 2.23 C ATOM 422 O ASP A 67 -1.943 -21.257 0.640 1.00 24.20 O ATOM 423 CB ASP A 67 -1.838 -20.030 -1.808 1.00 72.21 C ATOM 424 CG ASP A 67 -1.737 -21.428 -2.386 1.00 72.51 C ATOM 425 OD1 ASP A 67 -2.337 -22.355 -1.804 1.00 33.22 O ATOM 426 OD2 ASP A 67 -1.056 -21.594 -3.420 1.00 41.03 O ATOM 0 H ASP A 67 0.998 -20.914 -0.698 1.00 61.13 H new ATOM 0 HA ASP A 67 -0.666 -18.659 -0.642 1.00 1.21 H new ATOM 0 HB2 ASP A 67 -2.810 -19.907 -1.331 1.00 72.21 H new ATOM 0 HB3 ASP A 67 -1.785 -19.301 -2.617 1.00 72.21 H new ATOM 430 N PRO A 68 -0.371 -19.966 1.608 1.00 63.41 N ATOM 431 CA PRO A 68 -0.579 -20.496 2.959 1.00 44.32 C ATOM 432 C PRO A 68 -1.918 -20.066 3.550 1.00 62.31 C ATOM 433 O PRO A 68 -2.605 -19.205 2.999 1.00 1.34 O ATOM 434 CB PRO A 68 0.577 -19.892 3.759 1.00 15.41 C ATOM 435 CG PRO A 68 0.938 -18.648 3.023 1.00 5.24 C ATOM 436 CD PRO A 68 0.681 -18.935 1.571 1.00 54.44 C ATOM 0 HA PRO A 68 -0.600 -21.586 2.971 1.00 44.32 H new ATOM 0 HB2 PRO A 68 0.277 -19.673 4.784 1.00 15.41 H new ATOM 0 HB3 PRO A 68 1.422 -20.579 3.814 1.00 15.41 H new ATOM 0 HG2 PRO A 68 0.339 -17.804 3.366 1.00 5.24 H new ATOM 0 HG3 PRO A 68 1.983 -18.386 3.190 1.00 5.24 H new ATOM 0 HD2 PRO A 68 0.351 -18.044 1.037 1.00 54.44 H new ATOM 0 HD3 PRO A 68 1.578 -19.294 1.067 1.00 54.44 H new ATOM 441 N THR A 69 -2.282 -20.670 4.677 1.00 44.53 N ATOM 442 CA THR A 69 -3.539 -20.350 5.343 1.00 4.22 C ATOM 443 C THR A 69 -3.597 -18.877 5.730 1.00 21.24 C ATOM 444 O THR A 69 -2.858 -18.427 6.606 1.00 54.33 O ATOM 445 CB THR A 69 -3.741 -21.209 6.605 1.00 35.04 C ATOM 446 OG1 THR A 69 -2.616 -21.065 7.481 1.00 51.11 O ATOM 447 CG2 THR A 69 -3.919 -22.676 6.239 1.00 20.32 C ATOM 0 H THR A 69 -1.725 -21.383 5.147 1.00 44.53 H new ATOM 0 HA THR A 69 -4.337 -20.568 4.633 1.00 4.22 H new ATOM 0 HB THR A 69 -4.643 -20.865 7.111 1.00 35.04 H new ATOM 0 HG1 THR A 69 -2.318 -20.131 7.480 1.00 51.11 H new ATOM 0 HG21 THR A 69 -4.060 -23.263 7.147 1.00 20.32 H new ATOM 0 HG22 THR A 69 -4.792 -22.787 5.596 1.00 20.32 H new ATOM 0 HG23 THR A 69 -3.033 -23.030 5.712 1.00 20.32 H new ATOM 468 N TYR A 71 -4.778 -15.203 7.247 1.00 72.10 N ATOM 469 CA TYR A 71 -4.971 -14.836 8.645 1.00 51.22 C ATOM 470 C TYR A 71 -6.291 -14.096 8.835 1.00 42.43 C ATOM 471 O TYR A 71 -7.103 -14.002 7.914 1.00 53.10 O ATOM 472 CB TYR A 71 -3.812 -13.966 9.131 1.00 74.22 C ATOM 473 CG TYR A 71 -2.451 -14.497 8.738 1.00 25.10 C ATOM 474 CD1 TYR A 71 -1.752 -15.359 9.574 1.00 13.12 C ATOM 475 CD2 TYR A 71 -1.864 -14.135 7.532 1.00 64.13 C ATOM 476 CE1 TYR A 71 -0.509 -15.846 9.220 1.00 73.41 C ATOM 477 CE2 TYR A 71 -0.622 -14.617 7.168 1.00 1.33 C ATOM 478 CZ TYR A 71 0.052 -15.472 8.016 1.00 34.10 C ATOM 479 OH TYR A 71 1.290 -15.955 7.658 1.00 2.00 O ATOM 0 HA TYR A 71 -5.000 -15.752 9.234 1.00 51.22 H new ATOM 0 HB2 TYR A 71 -3.930 -12.960 8.729 1.00 74.22 H new ATOM 0 HB3 TYR A 71 -3.861 -13.883 10.217 1.00 74.22 H new ATOM 0 HD1 TYR A 71 -2.188 -15.653 10.517 1.00 13.12 H new ATOM 0 HD2 TYR A 71 -2.388 -13.465 6.867 1.00 64.13 H new ATOM 0 HE1 TYR A 71 0.021 -16.515 9.881 1.00 73.41 H new ATOM 0 HE2 TYR A 71 -0.181 -14.327 6.226 1.00 1.33 H new ATOM 0 HH TYR A 71 1.540 -15.596 6.781 1.00 2.00 H new ATOM 488 N SER A 72 -6.500 -13.571 10.038 1.00 62.33 N ATOM 489 CA SER A 72 -7.722 -12.841 10.353 1.00 2.31 C ATOM 490 C SER A 72 -7.416 -11.604 11.191 1.00 21.45 C ATOM 491 O SER A 72 -7.228 -11.693 12.405 1.00 32.30 O ATOM 492 CB SER A 72 -8.705 -13.746 11.099 1.00 72.20 C ATOM 493 OG SER A 72 -10.045 -13.361 10.849 1.00 53.24 O ATOM 0 H SER A 72 -5.838 -13.638 10.811 1.00 62.33 H new ATOM 0 HA SER A 72 -8.175 -12.520 9.415 1.00 2.31 H new ATOM 0 HB2 SER A 72 -8.557 -14.781 10.790 1.00 72.20 H new ATOM 0 HB3 SER A 72 -8.504 -13.701 12.169 1.00 72.20 H new ATOM 0 HG SER A 72 -10.653 -13.956 11.336 1.00 53.24 H new ATOM 498 N PHE A 73 -7.368 -10.449 10.535 1.00 22.04 N ATOM 499 CA PHE A 73 -7.083 -9.193 11.219 1.00 41.44 C ATOM 500 C PHE A 73 -7.539 -8.002 10.380 1.00 31.22 C ATOM 501 O PHE A 73 -8.177 -8.169 9.340 1.00 31.13 O ATOM 502 CB PHE A 73 -5.588 -9.078 11.519 1.00 52.12 C ATOM 503 CG PHE A 73 -4.734 -8.994 10.286 1.00 44.24 C ATOM 504 CD1 PHE A 73 -4.152 -7.794 9.911 1.00 65.34 C ATOM 505 CD2 PHE A 73 -4.514 -10.115 9.502 1.00 21.40 C ATOM 506 CE1 PHE A 73 -3.367 -7.713 8.777 1.00 74.12 C ATOM 507 CE2 PHE A 73 -3.729 -10.040 8.366 1.00 51.31 C ATOM 508 CZ PHE A 73 -3.153 -8.838 8.004 1.00 44.33 C ATOM 0 H PHE A 73 -7.523 -10.357 9.531 1.00 22.04 H new ATOM 0 HA PHE A 73 -7.635 -9.186 12.159 1.00 41.44 H new ATOM 0 HB2 PHE A 73 -5.416 -8.193 12.132 1.00 52.12 H new ATOM 0 HB3 PHE A 73 -5.277 -9.940 12.109 1.00 52.12 H new ATOM 0 HD1 PHE A 73 -4.314 -6.912 10.512 1.00 65.34 H new ATOM 0 HD2 PHE A 73 -4.961 -11.058 9.781 1.00 21.40 H new ATOM 0 HE1 PHE A 73 -2.921 -6.771 8.495 1.00 74.12 H new ATOM 0 HE2 PHE A 73 -3.566 -10.921 7.762 1.00 51.31 H new ATOM 0 HZ PHE A 73 -2.537 -8.778 7.119 1.00 44.33 H new ATOM 517 N ILE A 74 -7.207 -6.800 10.841 1.00 72.04 N ATOM 518 CA ILE A 74 -7.580 -5.582 10.133 1.00 53.33 C ATOM 519 C ILE A 74 -6.351 -4.865 9.586 1.00 70.10 C ATOM 520 O ILE A 74 -5.364 -4.675 10.296 1.00 4.23 O ATOM 521 CB ILE A 74 -8.360 -4.618 11.046 1.00 23.33 C ATOM 522 CG1 ILE A 74 -9.665 -5.264 11.513 1.00 53.23 C ATOM 523 CG2 ILE A 74 -8.640 -3.310 10.320 1.00 72.13 C ATOM 524 CD1 ILE A 74 -9.502 -6.142 12.734 1.00 61.21 C ATOM 0 H ILE A 74 -6.681 -6.644 11.701 1.00 72.04 H new ATOM 0 HA ILE A 74 -8.220 -5.882 9.304 1.00 53.33 H new ATOM 0 HB ILE A 74 -7.751 -4.401 11.923 1.00 23.33 H new ATOM 0 HG12 ILE A 74 -10.390 -4.481 11.733 1.00 53.23 H new ATOM 0 HG13 ILE A 74 -10.077 -5.860 10.699 1.00 53.23 H new ATOM 0 HG21 ILE A 74 -9.192 -2.639 10.978 1.00 72.13 H new ATOM 0 HG22 ILE A 74 -7.697 -2.843 10.034 1.00 72.13 H new ATOM 0 HG23 ILE A 74 -9.232 -3.509 9.426 1.00 72.13 H new ATOM 0 HD11 ILE A 74 -10.468 -6.567 13.008 1.00 61.21 H new ATOM 0 HD12 ILE A 74 -8.801 -6.947 12.512 1.00 61.21 H new ATOM 0 HD13 ILE A 74 -9.119 -5.546 13.562 1.00 61.21 H new ATOM 535 N GLN A 75 -6.418 -4.468 8.319 1.00 11.33 N ATOM 536 CA GLN A 75 -5.311 -3.771 7.677 1.00 12.12 C ATOM 537 C GLN A 75 -5.461 -2.260 7.823 1.00 35.11 C ATOM 538 O GLN A 75 -6.381 -1.661 7.265 1.00 62.21 O ATOM 539 CB GLN A 75 -5.233 -4.147 6.197 1.00 71.31 C ATOM 540 CG GLN A 75 -3.854 -3.944 5.589 1.00 31.31 C ATOM 541 CD GLN A 75 -2.840 -4.955 6.090 1.00 44.13 C ATOM 542 OE1 GLN A 75 -2.267 -4.795 7.167 1.00 64.34 O ATOM 543 NE2 GLN A 75 -2.616 -6.005 5.308 1.00 31.23 N ATOM 0 H GLN A 75 -7.228 -4.618 7.717 1.00 11.33 H new ATOM 0 HA GLN A 75 -4.388 -4.076 8.171 1.00 12.12 H new ATOM 0 HB2 GLN A 75 -5.522 -5.191 6.080 1.00 71.31 H new ATOM 0 HB3 GLN A 75 -5.957 -3.552 5.641 1.00 71.31 H new ATOM 0 HG2 GLN A 75 -3.926 -4.014 4.504 1.00 31.31 H new ATOM 0 HG3 GLN A 75 -3.503 -2.938 5.821 1.00 31.31 H new ATOM 0 HE21 GLN A 75 -3.114 -6.097 4.423 1.00 31.23 H new ATOM 0 HE22 GLN A 75 -1.946 -6.719 5.593 1.00 31.23 H new ATOM 550 N PHE A 76 -4.552 -1.650 8.577 1.00 62.03 N ATOM 551 CA PHE A 76 -4.584 -0.209 8.797 1.00 64.45 C ATOM 552 C PHE A 76 -3.812 0.526 7.705 1.00 12.15 C ATOM 553 O PHE A 76 -2.709 0.124 7.332 1.00 43.13 O ATOM 554 CB PHE A 76 -4.000 0.133 10.169 1.00 13.32 C ATOM 555 CG PHE A 76 -3.799 1.604 10.386 1.00 65.41 C ATOM 556 CD1 PHE A 76 -2.649 2.234 9.938 1.00 60.24 C ATOM 557 CD2 PHE A 76 -4.760 2.360 11.039 1.00 13.03 C ATOM 558 CE1 PHE A 76 -2.461 3.589 10.134 1.00 5.43 C ATOM 559 CE2 PHE A 76 -4.578 3.715 11.240 1.00 73.14 C ATOM 560 CZ PHE A 76 -3.426 4.331 10.788 1.00 13.43 C ATOM 0 H PHE A 76 -3.784 -2.131 9.046 1.00 62.03 H new ATOM 0 HA PHE A 76 -5.624 0.115 8.762 1.00 64.45 H new ATOM 0 HB2 PHE A 76 -4.663 -0.253 10.943 1.00 13.32 H new ATOM 0 HB3 PHE A 76 -3.044 -0.377 10.285 1.00 13.32 H new ATOM 0 HD1 PHE A 76 -1.890 1.659 9.429 1.00 60.24 H new ATOM 0 HD2 PHE A 76 -5.662 1.884 11.395 1.00 13.03 H new ATOM 0 HE1 PHE A 76 -1.561 4.067 9.777 1.00 5.43 H new ATOM 0 HE2 PHE A 76 -5.335 4.292 11.750 1.00 73.14 H new ATOM 0 HZ PHE A 76 -3.281 5.389 10.946 1.00 13.43 H new ATOM 569 N VAL A 77 -4.398 1.606 7.198 1.00 54.45 N ATOM 570 CA VAL A 77 -3.766 2.397 6.149 1.00 75.34 C ATOM 571 C VAL A 77 -4.097 3.877 6.303 1.00 32.11 C ATOM 572 O VAL A 77 -5.192 4.237 6.735 1.00 20.11 O ATOM 573 CB VAL A 77 -4.203 1.927 4.749 1.00 44.02 C ATOM 574 CG1 VAL A 77 -3.497 2.733 3.670 1.00 64.54 C ATOM 575 CG2 VAL A 77 -3.932 0.440 4.577 1.00 3.33 C ATOM 0 H VAL A 77 -5.309 1.953 7.497 1.00 54.45 H new ATOM 0 HA VAL A 77 -2.690 2.255 6.251 1.00 75.34 H new ATOM 0 HB VAL A 77 -5.276 2.092 4.649 1.00 44.02 H new ATOM 0 HG11 VAL A 77 -3.819 2.386 2.688 1.00 64.54 H new ATOM 0 HG12 VAL A 77 -3.747 3.788 3.782 1.00 64.54 H new ATOM 0 HG13 VAL A 77 -2.419 2.603 3.766 1.00 64.54 H new ATOM 0 HG21 VAL A 77 -4.247 0.125 3.582 1.00 3.33 H new ATOM 0 HG22 VAL A 77 -2.866 0.248 4.698 1.00 3.33 H new ATOM 0 HG23 VAL A 77 -4.489 -0.121 5.328 1.00 3.33 H new ATOM 585 N ASP A 78 -3.144 4.731 5.945 1.00 4.23 N ATOM 586 CA ASP A 78 -3.335 6.173 6.041 1.00 25.13 C ATOM 587 C ASP A 78 -3.741 6.760 4.693 1.00 51.42 C ATOM 588 O ASP A 78 -3.243 6.360 3.640 1.00 24.31 O ATOM 589 CB ASP A 78 -2.055 6.847 6.540 1.00 33.33 C ATOM 590 CG ASP A 78 -1.903 6.761 8.046 1.00 54.42 C ATOM 591 OD1 ASP A 78 -2.787 7.276 8.762 1.00 62.31 O ATOM 592 OD2 ASP A 78 -0.901 6.176 8.508 1.00 1.03 O ATOM 0 H ASP A 78 -2.232 4.449 5.586 1.00 4.23 H new ATOM 0 HA ASP A 78 -4.137 6.361 6.754 1.00 25.13 H new ATOM 0 HB2 ASP A 78 -1.193 6.380 6.064 1.00 33.33 H new ATOM 0 HB3 ASP A 78 -2.058 7.894 6.238 1.00 33.33 H new ATOM 596 N PRO A 79 -4.668 7.728 4.723 1.00 11.11 N ATOM 597 CA PRO A 79 -5.163 8.389 3.512 1.00 30.23 C ATOM 598 C PRO A 79 -4.108 9.283 2.869 1.00 61.42 C ATOM 599 O PRO A 79 -4.115 9.495 1.655 1.00 53.31 O ATOM 600 CB PRO A 79 -6.337 9.228 4.020 1.00 42.14 C ATOM 601 CG PRO A 79 -6.033 9.476 5.457 1.00 35.41 C ATOM 602 CD PRO A 79 -5.305 8.253 5.943 1.00 40.32 C ATOM 0 HA PRO A 79 -5.438 7.671 2.739 1.00 30.23 H new ATOM 0 HB2 PRO A 79 -6.424 10.163 3.467 1.00 42.14 H new ATOM 0 HB3 PRO A 79 -7.282 8.699 3.901 1.00 42.14 H new ATOM 0 HG2 PRO A 79 -5.420 10.369 5.578 1.00 35.41 H new ATOM 0 HG3 PRO A 79 -6.948 9.638 6.027 1.00 35.41 H new ATOM 0 HD2 PRO A 79 -4.568 8.501 6.706 1.00 40.32 H new ATOM 0 HD3 PRO A 79 -5.988 7.527 6.384 1.00 40.32 H new ATOM 607 N LEU A 80 -3.202 9.806 3.688 1.00 44.23 N ATOM 608 CA LEU A 80 -2.141 10.678 3.199 1.00 75.20 C ATOM 609 C LEU A 80 -1.443 10.061 1.990 1.00 5.45 C ATOM 610 O LEU A 80 -1.589 10.539 0.864 1.00 14.35 O ATOM 611 CB LEU A 80 -1.121 10.947 4.308 1.00 41.54 C ATOM 612 CG LEU A 80 0.018 11.902 3.954 1.00 30.25 C ATOM 613 CD1 LEU A 80 0.434 12.711 5.174 1.00 31.23 C ATOM 614 CD2 LEU A 80 1.205 11.131 3.394 1.00 71.11 C ATOM 0 H LEU A 80 -3.181 9.641 4.694 1.00 44.23 H new ATOM 0 HA LEU A 80 -2.593 11.622 2.893 1.00 75.20 H new ATOM 0 HB2 LEU A 80 -1.651 11.349 5.172 1.00 41.54 H new ATOM 0 HB3 LEU A 80 -0.688 9.995 4.615 1.00 41.54 H new ATOM 0 HG LEU A 80 -0.336 12.592 3.188 1.00 30.25 H new ATOM 0 HD11 LEU A 80 1.246 13.386 4.903 1.00 31.23 H new ATOM 0 HD12 LEU A 80 -0.416 13.292 5.533 1.00 31.23 H new ATOM 0 HD13 LEU A 80 0.770 12.036 5.961 1.00 31.23 H new ATOM 0 HD21 LEU A 80 2.007 11.827 3.147 1.00 71.11 H new ATOM 0 HD22 LEU A 80 1.559 10.418 4.138 1.00 71.11 H new ATOM 0 HD23 LEU A 80 0.900 10.596 2.495 1.00 71.11 H new ATOM 625 N THR A 81 -0.686 8.995 2.231 1.00 2.40 N ATOM 626 CA THR A 81 0.033 8.311 1.164 1.00 63.40 C ATOM 627 C THR A 81 -0.448 6.873 1.010 1.00 72.42 C ATOM 628 O THR A 81 -0.645 6.390 -0.104 1.00 71.52 O ATOM 629 CB THR A 81 1.552 8.308 1.422 1.00 73.11 C ATOM 630 OG1 THR A 81 2.213 7.489 0.450 1.00 5.20 O ATOM 631 CG2 THR A 81 1.862 7.795 2.821 1.00 53.15 C ATOM 0 H THR A 81 -0.555 8.587 3.157 1.00 2.40 H new ATOM 0 HA THR A 81 -0.171 8.859 0.244 1.00 63.40 H new ATOM 0 HB THR A 81 1.915 9.333 1.339 1.00 73.11 H new ATOM 0 HG1 THR A 81 3.178 7.494 0.620 1.00 5.20 H new ATOM 0 HG21 THR A 81 2.940 7.802 2.980 1.00 53.15 H new ATOM 0 HG22 THR A 81 1.382 8.438 3.559 1.00 53.15 H new ATOM 0 HG23 THR A 81 1.486 6.777 2.927 1.00 53.15 H new ATOM 639 N GLY A 82 -0.636 6.193 2.137 1.00 51.42 N ATOM 640 CA GLY A 82 -1.093 4.816 2.105 1.00 43.13 C ATOM 641 C GLY A 82 -0.279 3.913 3.009 1.00 12.13 C ATOM 642 O GLY A 82 0.096 2.808 2.618 1.00 32.43 O ATOM 0 H GLY A 82 -0.480 6.571 3.071 1.00 51.42 H new ATOM 0 HA2 GLY A 82 -2.140 4.777 2.406 1.00 43.13 H new ATOM 0 HA3 GLY A 82 -1.041 4.443 1.082 1.00 43.13 H new ATOM 646 N ALA A 83 -0.002 4.385 4.220 1.00 32.21 N ATOM 647 CA ALA A 83 0.774 3.612 5.182 1.00 43.51 C ATOM 648 C ALA A 83 0.205 2.207 5.343 1.00 0.24 C ATOM 649 O ALA A 83 -0.889 1.912 4.864 1.00 43.22 O ATOM 650 CB ALA A 83 0.811 4.325 6.525 1.00 22.51 C ATOM 0 H ALA A 83 -0.303 5.299 4.558 1.00 32.21 H new ATOM 0 HA ALA A 83 1.792 3.523 4.802 1.00 43.51 H new ATOM 0 HB1 ALA A 83 1.394 3.736 7.234 1.00 22.51 H new ATOM 0 HB2 ALA A 83 1.271 5.306 6.404 1.00 22.51 H new ATOM 0 HB3 ALA A 83 -0.205 4.444 6.902 1.00 22.51 H new ATOM 656 N GLN A 84 0.955 1.344 6.022 1.00 31.23 N ATOM 657 CA GLN A 84 0.525 -0.032 6.244 1.00 44.23 C ATOM 658 C GLN A 84 0.819 -0.469 7.675 1.00 23.13 C ATOM 659 O GLN A 84 1.947 -0.348 8.152 1.00 23.52 O ATOM 660 CB GLN A 84 1.219 -0.972 5.258 1.00 1.32 C ATOM 661 CG GLN A 84 2.682 -1.223 5.585 1.00 72.20 C ATOM 662 CD GLN A 84 3.506 0.050 5.594 1.00 51.34 C ATOM 663 OE1 GLN A 84 3.528 0.795 4.614 1.00 43.31 O ATOM 664 NE2 GLN A 84 4.188 0.307 6.704 1.00 53.25 N ATOM 0 H GLN A 84 1.862 1.573 6.427 1.00 31.23 H new ATOM 0 HA GLN A 84 -0.552 -0.080 6.082 1.00 44.23 H new ATOM 0 HB2 GLN A 84 0.690 -1.925 5.243 1.00 1.32 H new ATOM 0 HB3 GLN A 84 1.146 -0.551 4.255 1.00 1.32 H new ATOM 0 HG2 GLN A 84 2.755 -1.705 6.560 1.00 72.20 H new ATOM 0 HG3 GLN A 84 3.100 -1.916 4.855 1.00 72.20 H new ATOM 0 HE21 GLN A 84 4.141 -0.338 7.493 1.00 53.25 H new ATOM 0 HE22 GLN A 84 4.759 1.150 6.768 1.00 53.25 H new ATOM 671 N ILE A 85 -0.203 -0.977 8.355 1.00 0.23 N ATOM 672 CA ILE A 85 -0.053 -1.434 9.732 1.00 64.11 C ATOM 673 C ILE A 85 -1.061 -2.529 10.061 1.00 43.32 C ATOM 674 O ILE A 85 -2.182 -2.529 9.550 1.00 33.21 O ATOM 675 CB ILE A 85 -0.227 -0.274 10.731 1.00 0.44 C ATOM 676 CG1 ILE A 85 0.912 0.735 10.577 1.00 61.31 C ATOM 677 CG2 ILE A 85 -0.282 -0.806 12.155 1.00 12.11 C ATOM 678 CD1 ILE A 85 0.811 1.910 11.525 1.00 61.02 C ATOM 0 H ILE A 85 -1.144 -1.083 7.976 1.00 0.23 H new ATOM 0 HA ILE A 85 0.957 -1.834 9.824 1.00 64.11 H new ATOM 0 HB ILE A 85 -1.168 0.233 10.517 1.00 0.44 H new ATOM 0 HG12 ILE A 85 1.862 0.226 10.742 1.00 61.31 H new ATOM 0 HG13 ILE A 85 0.922 1.105 9.552 1.00 61.31 H new ATOM 0 HG21 ILE A 85 -0.405 0.025 12.849 1.00 12.11 H new ATOM 0 HG22 ILE A 85 -1.124 -1.491 12.255 1.00 12.11 H new ATOM 0 HG23 ILE A 85 0.644 -1.334 12.382 1.00 12.11 H new ATOM 0 HD11 ILE A 85 1.651 2.584 11.360 1.00 61.02 H new ATOM 0 HD12 ILE A 85 -0.123 2.443 11.346 1.00 61.02 H new ATOM 0 HD13 ILE A 85 0.832 1.550 12.554 1.00 61.02 H new ATOM 689 N GLU A 86 -0.657 -3.459 10.919 1.00 12.23 N ATOM 690 CA GLU A 86 -1.527 -4.561 11.318 1.00 61.43 C ATOM 691 C GLU A 86 -2.290 -4.217 12.594 1.00 75.12 C ATOM 692 O GLU A 86 -1.722 -4.213 13.686 1.00 31.30 O ATOM 693 CB GLU A 86 -0.708 -5.836 11.527 1.00 24.52 C ATOM 694 CG GLU A 86 0.561 -5.619 12.335 1.00 45.42 C ATOM 695 CD GLU A 86 1.259 -6.919 12.685 1.00 2.51 C ATOM 696 OE1 GLU A 86 2.503 -6.966 12.595 1.00 0.11 O ATOM 697 OE2 GLU A 86 0.560 -7.889 13.048 1.00 34.41 O ATOM 0 H GLU A 86 0.267 -3.473 11.352 1.00 12.23 H new ATOM 0 HA GLU A 86 -2.249 -4.729 10.519 1.00 61.43 H new ATOM 0 HB2 GLU A 86 -1.328 -6.577 12.032 1.00 24.52 H new ATOM 0 HB3 GLU A 86 -0.443 -6.251 10.555 1.00 24.52 H new ATOM 0 HG2 GLU A 86 1.244 -4.985 11.769 1.00 45.42 H new ATOM 0 HG3 GLU A 86 0.316 -5.084 13.253 1.00 45.42 H new ATOM 702 N GLU A 87 -3.579 -3.929 12.446 1.00 65.32 N ATOM 703 CA GLU A 87 -4.419 -3.582 13.587 1.00 32.43 C ATOM 704 C GLU A 87 -5.470 -4.659 13.835 1.00 51.42 C ATOM 705 O GLU A 87 -5.907 -5.341 12.909 1.00 74.12 O ATOM 706 CB GLU A 87 -5.101 -2.232 13.355 1.00 3.11 C ATOM 707 CG GLU A 87 -6.304 -2.309 12.431 1.00 51.34 C ATOM 708 CD GLU A 87 -6.804 -0.941 12.009 1.00 71.32 C ATOM 709 OE1 GLU A 87 -6.939 -0.709 10.789 1.00 61.02 O ATOM 710 OE2 GLU A 87 -7.059 -0.103 12.898 1.00 22.21 O ATOM 0 H GLU A 87 -4.064 -3.929 11.549 1.00 65.32 H new ATOM 0 HA GLU A 87 -3.781 -3.511 14.468 1.00 32.43 H new ATOM 0 HB2 GLU A 87 -5.417 -1.824 14.315 1.00 3.11 H new ATOM 0 HB3 GLU A 87 -4.375 -1.535 12.936 1.00 3.11 H new ATOM 0 HG2 GLU A 87 -6.040 -2.885 11.544 1.00 51.34 H new ATOM 0 HG3 GLU A 87 -7.109 -2.847 12.932 1.00 51.34 H new ATOM 715 N ASN A 88 -5.872 -4.807 15.093 1.00 44.10 N ATOM 716 CA ASN A 88 -6.873 -5.802 15.464 1.00 35.04 C ATOM 717 C ASN A 88 -8.108 -5.135 16.061 1.00 53.34 C ATOM 718 O ASN A 88 -8.156 -3.915 16.211 1.00 43.15 O ATOM 719 CB ASN A 88 -6.283 -6.799 16.466 1.00 63.34 C ATOM 720 CG ASN A 88 -5.641 -6.111 17.655 1.00 43.41 C ATOM 721 OD1 ASN A 88 -4.642 -5.405 17.514 1.00 53.40 O ATOM 722 ND2 ASN A 88 -6.214 -6.315 18.836 1.00 35.31 N ATOM 0 H ASN A 88 -5.521 -4.251 15.873 1.00 44.10 H new ATOM 0 HA ASN A 88 -7.171 -6.336 14.562 1.00 35.04 H new ATOM 0 HB2 ASN A 88 -7.070 -7.466 16.817 1.00 63.34 H new ATOM 0 HB3 ASN A 88 -5.540 -7.419 15.964 1.00 63.34 H new ATOM 0 HD21 ASN A 88 -5.827 -5.879 19.673 1.00 35.31 H new ATOM 0 HD22 ASN A 88 -7.041 -6.908 18.906 1.00 35.31 H new ATOM 728 N VAL A 89 -9.106 -5.946 16.399 1.00 21.44 N ATOM 729 CA VAL A 89 -10.342 -5.435 16.981 1.00 54.20 C ATOM 730 C VAL A 89 -10.055 -4.530 18.174 1.00 54.34 C ATOM 731 O VAL A 89 -10.743 -3.532 18.388 1.00 14.32 O ATOM 732 CB VAL A 89 -11.265 -6.583 17.431 1.00 44.54 C ATOM 733 CG1 VAL A 89 -10.491 -7.600 18.256 1.00 43.15 C ATOM 734 CG2 VAL A 89 -12.449 -6.037 18.216 1.00 33.31 C ATOM 0 H VAL A 89 -9.083 -6.959 16.280 1.00 21.44 H new ATOM 0 HA VAL A 89 -10.844 -4.858 16.204 1.00 54.20 H new ATOM 0 HB VAL A 89 -11.647 -7.088 16.544 1.00 44.54 H new ATOM 0 HG11 VAL A 89 -11.160 -8.403 18.565 1.00 43.15 H new ATOM 0 HG12 VAL A 89 -9.680 -8.014 17.656 1.00 43.15 H new ATOM 0 HG13 VAL A 89 -10.077 -7.113 19.139 1.00 43.15 H new ATOM 0 HG21 VAL A 89 -13.091 -6.861 18.526 1.00 33.31 H new ATOM 0 HG22 VAL A 89 -12.088 -5.507 19.097 1.00 33.31 H new ATOM 0 HG23 VAL A 89 -13.017 -5.351 17.587 1.00 33.31 H new ATOM 744 N TYR A 90 -9.034 -4.886 18.946 1.00 4.53 N ATOM 745 CA TYR A 90 -8.658 -4.106 20.120 1.00 31.35 C ATOM 746 C TYR A 90 -7.375 -3.322 19.863 1.00 72.34 C ATOM 747 O TYR A 90 -6.581 -3.093 20.775 1.00 72.42 O ATOM 748 CB TYR A 90 -8.473 -5.024 21.330 1.00 51.20 C ATOM 749 CG TYR A 90 -9.509 -6.122 21.420 1.00 34.25 C ATOM 750 CD1 TYR A 90 -10.865 -5.826 21.423 1.00 43.54 C ATOM 751 CD2 TYR A 90 -9.129 -7.457 21.501 1.00 22.50 C ATOM 752 CE1 TYR A 90 -11.815 -6.826 21.506 1.00 12.32 C ATOM 753 CE2 TYR A 90 -10.072 -8.463 21.583 1.00 32.14 C ATOM 754 CZ TYR A 90 -11.413 -8.143 21.586 1.00 32.23 C ATOM 755 OH TYR A 90 -12.355 -9.143 21.667 1.00 23.01 O ATOM 0 H TYR A 90 -8.453 -5.708 18.781 1.00 4.53 H new ATOM 0 HA TYR A 90 -9.461 -3.399 20.328 1.00 31.35 H new ATOM 0 HB2 TYR A 90 -7.481 -5.474 21.286 1.00 51.20 H new ATOM 0 HB3 TYR A 90 -8.511 -4.425 22.240 1.00 51.20 H new ATOM 0 HD1 TYR A 90 -11.183 -4.796 21.359 1.00 43.54 H new ATOM 0 HD2 TYR A 90 -8.079 -7.712 21.500 1.00 22.50 H new ATOM 0 HE1 TYR A 90 -12.866 -6.578 21.508 1.00 12.32 H new ATOM 0 HE2 TYR A 90 -9.760 -9.495 21.644 1.00 32.14 H new ATOM 0 HH TYR A 90 -11.906 -10.013 21.716 1.00 23.01 H new ATOM 764 N ALA A 91 -7.180 -2.911 18.614 1.00 21.21 N ATOM 765 CA ALA A 91 -5.997 -2.149 18.236 1.00 74.31 C ATOM 766 C ALA A 91 -5.789 -0.960 19.167 1.00 25.34 C ATOM 767 O ALA A 91 -6.707 -0.173 19.400 1.00 50.34 O ATOM 768 CB ALA A 91 -6.110 -1.679 16.793 1.00 31.01 C ATOM 0 H ALA A 91 -7.827 -3.093 17.847 1.00 21.21 H new ATOM 0 HA ALA A 91 -5.130 -2.803 18.326 1.00 74.31 H new ATOM 0 HB1 ALA A 91 -5.219 -1.111 16.524 1.00 31.01 H new ATOM 0 HB2 ALA A 91 -6.201 -2.543 16.135 1.00 31.01 H new ATOM 0 HB3 ALA A 91 -6.990 -1.046 16.685 1.00 31.01 H new ATOM 774 N ASP A 92 -4.577 -0.834 19.698 1.00 60.00 N ATOM 775 CA ASP A 92 -4.249 0.261 20.604 1.00 72.22 C ATOM 776 C ASP A 92 -3.423 1.327 19.890 1.00 25.11 C ATOM 777 O ASP A 92 -2.460 1.015 19.191 1.00 54.25 O ATOM 778 CB ASP A 92 -3.484 -0.266 21.818 1.00 14.43 C ATOM 779 CG ASP A 92 -4.332 -1.174 22.687 1.00 24.32 C ATOM 780 OD1 ASP A 92 -5.051 -0.653 23.566 1.00 60.20 O ATOM 781 OD2 ASP A 92 -4.278 -2.405 22.489 1.00 13.32 O ATOM 0 H ASP A 92 -3.806 -1.477 19.517 1.00 60.00 H new ATOM 0 HA ASP A 92 -5.181 0.714 20.941 1.00 72.22 H new ATOM 0 HB2 ASP A 92 -2.603 -0.811 21.480 1.00 14.43 H new ATOM 0 HB3 ASP A 92 -3.130 0.575 22.414 1.00 14.43 H new ATOM 785 N ILE A 93 -3.808 2.586 20.072 1.00 1.45 N ATOM 786 CA ILE A 93 -3.104 3.698 19.447 1.00 31.53 C ATOM 787 C ILE A 93 -1.606 3.625 19.722 1.00 21.14 C ATOM 788 O ILE A 93 -0.789 3.972 18.870 1.00 53.13 O ATOM 789 CB ILE A 93 -3.639 5.054 19.942 1.00 65.33 C ATOM 790 CG1 ILE A 93 -5.132 5.182 19.630 1.00 5.45 C ATOM 791 CG2 ILE A 93 -2.861 6.196 19.306 1.00 0.23 C ATOM 792 CD1 ILE A 93 -5.456 5.057 18.159 1.00 74.21 C ATOM 0 H ILE A 93 -4.604 2.861 20.648 1.00 1.45 H new ATOM 0 HA ILE A 93 -3.279 3.618 18.374 1.00 31.53 H new ATOM 0 HB ILE A 93 -3.506 5.107 21.023 1.00 65.33 H new ATOM 0 HG12 ILE A 93 -5.677 4.414 20.180 1.00 5.45 H new ATOM 0 HG13 ILE A 93 -5.489 6.147 19.991 1.00 5.45 H new ATOM 0 HG21 ILE A 93 -3.252 7.148 19.666 1.00 0.23 H new ATOM 0 HG22 ILE A 93 -1.808 6.112 19.573 1.00 0.23 H new ATOM 0 HG23 ILE A 93 -2.965 6.148 18.222 1.00 0.23 H new ATOM 0 HD11 ILE A 93 -6.532 5.158 18.013 1.00 74.21 H new ATOM 0 HD12 ILE A 93 -4.940 5.841 17.605 1.00 74.21 H new ATOM 0 HD13 ILE A 93 -5.131 4.082 17.796 1.00 74.21 H new ATOM 803 N ARG A 94 -1.252 3.168 20.919 1.00 25.54 N ATOM 804 CA ARG A 94 0.148 3.049 21.308 1.00 13.32 C ATOM 805 C ARG A 94 0.903 2.137 20.345 1.00 12.44 C ATOM 806 O ARG A 94 2.082 2.355 20.062 1.00 45.34 O ATOM 807 CB ARG A 94 0.259 2.506 22.734 1.00 22.25 C ATOM 808 CG ARG A 94 -0.517 1.219 22.959 1.00 71.23 C ATOM 809 CD ARG A 94 -1.406 1.312 24.188 1.00 1.21 C ATOM 810 NE ARG A 94 -0.632 1.291 25.427 1.00 11.41 N ATOM 811 CZ ARG A 94 -0.129 0.182 25.960 1.00 31.52 C ATOM 812 NH1 ARG A 94 -0.317 -0.988 25.365 1.00 5.44 N ATOM 813 NH2 ARG A 94 0.564 0.244 27.089 1.00 13.13 N ATOM 0 H ARG A 94 -1.915 2.874 21.636 1.00 25.54 H new ATOM 0 HA ARG A 94 0.596 4.042 21.269 1.00 13.32 H new ATOM 0 HB2 ARG A 94 1.310 2.332 22.966 1.00 22.25 H new ATOM 0 HB3 ARG A 94 -0.100 3.263 23.431 1.00 22.25 H new ATOM 0 HG2 ARG A 94 -1.128 1.003 22.082 1.00 71.23 H new ATOM 0 HG3 ARG A 94 0.179 0.388 23.074 1.00 71.23 H new ATOM 0 HD2 ARG A 94 -1.992 2.230 24.143 1.00 1.21 H new ATOM 0 HD3 ARG A 94 -2.113 0.482 24.188 1.00 1.21 H new ATOM 0 HE ARG A 94 -0.469 2.175 25.909 1.00 11.41 H new ATOM 0 HH11 ARG A 94 -0.849 -1.039 24.496 1.00 5.44 H new ATOM 0 HH12 ARG A 94 0.070 -1.837 25.776 1.00 5.44 H new ATOM 0 HH21 ARG A 94 0.711 1.143 27.548 1.00 13.13 H new ATOM 0 HH22 ARG A 94 0.950 -0.607 27.498 1.00 13.13 H new ATOM 824 N ASP A 95 0.217 1.113 19.847 1.00 22.32 N ATOM 825 CA ASP A 95 0.822 0.168 18.916 1.00 22.12 C ATOM 826 C ASP A 95 0.916 0.768 17.517 1.00 54.51 C ATOM 827 O ASP A 95 1.977 0.750 16.893 1.00 33.35 O ATOM 828 CB ASP A 95 0.013 -1.130 18.876 1.00 24.30 C ATOM 829 CG ASP A 95 0.429 -2.106 19.959 1.00 24.51 C ATOM 830 OD1 ASP A 95 0.753 -1.649 21.076 1.00 62.14 O ATOM 831 OD2 ASP A 95 0.431 -3.325 19.691 1.00 21.32 O ATOM 0 H ASP A 95 -0.758 0.917 20.073 1.00 22.32 H new ATOM 0 HA ASP A 95 1.831 -0.053 19.265 1.00 22.12 H new ATOM 0 HB2 ASP A 95 -1.046 -0.898 18.988 1.00 24.30 H new ATOM 0 HB3 ASP A 95 0.135 -1.601 17.901 1.00 24.30 H new ATOM 835 N ILE A 96 -0.201 1.296 17.030 1.00 63.14 N ATOM 836 CA ILE A 96 -0.245 1.901 15.704 1.00 61.03 C ATOM 837 C ILE A 96 0.747 3.053 15.593 1.00 43.05 C ATOM 838 O ILE A 96 1.577 3.085 14.686 1.00 34.20 O ATOM 839 CB ILE A 96 -1.656 2.418 15.367 1.00 54.41 C ATOM 840 CG1 ILE A 96 -2.666 1.269 15.404 1.00 53.22 C ATOM 841 CG2 ILE A 96 -1.661 3.092 14.003 1.00 5.25 C ATOM 842 CD1 ILE A 96 -4.075 1.693 15.056 1.00 45.51 C ATOM 0 H ILE A 96 -1.088 1.317 17.533 1.00 63.14 H new ATOM 0 HA ILE A 96 0.026 1.121 14.992 1.00 61.03 H new ATOM 0 HB ILE A 96 -1.946 3.155 16.116 1.00 54.41 H new ATOM 0 HG12 ILE A 96 -2.347 0.493 14.709 1.00 53.22 H new ATOM 0 HG13 ILE A 96 -2.664 0.826 16.400 1.00 53.22 H new ATOM 0 HG21 ILE A 96 -2.665 3.452 13.779 1.00 5.25 H new ATOM 0 HG22 ILE A 96 -0.967 3.933 14.010 1.00 5.25 H new ATOM 0 HG23 ILE A 96 -1.354 2.375 13.242 1.00 5.25 H new ATOM 0 HD11 ILE A 96 -4.737 0.828 15.102 1.00 45.51 H new ATOM 0 HD12 ILE A 96 -4.414 2.448 15.766 1.00 45.51 H new ATOM 0 HD13 ILE A 96 -4.091 2.109 14.049 1.00 45.51 H new ATOM 853 N GLN A 97 0.654 3.998 16.524 1.00 71.53 N ATOM 854 CA GLN A 97 1.545 5.153 16.530 1.00 61.01 C ATOM 855 C GLN A 97 3.003 4.716 16.449 1.00 71.23 C ATOM 856 O GLN A 97 3.834 5.402 15.855 1.00 62.34 O ATOM 857 CB GLN A 97 1.320 5.989 17.791 1.00 21.31 C ATOM 858 CG GLN A 97 1.921 5.374 19.044 1.00 22.44 C ATOM 859 CD GLN A 97 1.671 6.211 20.283 1.00 20.34 C ATOM 860 OE1 GLN A 97 0.784 7.065 20.300 1.00 22.34 O ATOM 861 NE2 GLN A 97 2.454 5.971 21.328 1.00 0.41 N ATOM 0 H GLN A 97 -0.028 3.987 17.282 1.00 71.53 H new ATOM 0 HA GLN A 97 1.318 5.760 15.654 1.00 61.01 H new ATOM 0 HB2 GLN A 97 1.749 6.980 17.641 1.00 21.31 H new ATOM 0 HB3 GLN A 97 0.249 6.124 17.941 1.00 21.31 H new ATOM 0 HG2 GLN A 97 1.502 4.379 19.192 1.00 22.44 H new ATOM 0 HG3 GLN A 97 2.995 5.251 18.904 1.00 22.44 H new ATOM 0 HE21 GLN A 97 3.177 5.254 21.270 1.00 0.41 H new ATOM 0 HE22 GLN A 97 2.333 6.504 22.189 1.00 0.41 H new ATOM 868 N GLU A 98 3.308 3.569 17.051 1.00 44.04 N ATOM 869 CA GLU A 98 4.667 3.043 17.046 1.00 45.23 C ATOM 870 C GLU A 98 5.175 2.858 15.620 1.00 62.34 C ATOM 871 O GLU A 98 6.166 3.469 15.218 1.00 22.11 O ATOM 872 CB GLU A 98 4.723 1.709 17.796 1.00 65.14 C ATOM 873 CG GLU A 98 6.127 1.303 18.211 1.00 64.03 C ATOM 874 CD GLU A 98 6.616 2.060 19.432 1.00 53.33 C ATOM 875 OE1 GLU A 98 5.897 2.064 20.453 1.00 41.22 O ATOM 876 OE2 GLU A 98 7.715 2.647 19.365 1.00 23.24 O ATOM 0 H GLU A 98 2.632 2.988 17.547 1.00 44.04 H new ATOM 0 HA GLU A 98 5.310 3.764 17.551 1.00 45.23 H new ATOM 0 HB2 GLU A 98 4.095 1.775 18.685 1.00 65.14 H new ATOM 0 HB3 GLU A 98 4.300 0.928 17.164 1.00 65.14 H new ATOM 0 HG2 GLU A 98 6.145 0.233 18.420 1.00 64.03 H new ATOM 0 HG3 GLU A 98 6.812 1.478 17.381 1.00 64.03 H new ATOM 881 N ARG A 99 4.488 2.012 14.859 1.00 75.55 N ATOM 882 CA ARG A 99 4.870 1.745 13.476 1.00 31.20 C ATOM 883 C ARG A 99 4.921 3.038 12.667 1.00 22.53 C ATOM 884 O ARG A 99 5.760 3.196 11.781 1.00 14.21 O ATOM 885 CB ARG A 99 3.887 0.766 12.833 1.00 61.41 C ATOM 886 CG ARG A 99 4.277 -0.692 13.007 1.00 32.33 C ATOM 887 CD ARG A 99 5.465 -1.059 12.132 1.00 11.35 C ATOM 888 NE ARG A 99 5.603 -2.505 11.975 1.00 63.12 N ATOM 889 CZ ARG A 99 6.083 -3.305 12.920 1.00 40.12 C ATOM 890 NH1 ARG A 99 6.469 -2.803 14.085 1.00 22.43 N ATOM 891 NH2 ARG A 99 6.178 -4.610 12.702 1.00 54.12 N ATOM 0 H ARG A 99 3.665 1.500 15.176 1.00 75.55 H new ATOM 0 HA ARG A 99 5.865 1.300 13.479 1.00 31.20 H new ATOM 0 HB2 ARG A 99 2.898 0.922 13.263 1.00 61.41 H new ATOM 0 HB3 ARG A 99 3.810 0.988 11.769 1.00 61.41 H new ATOM 0 HG2 ARG A 99 4.521 -0.882 14.052 1.00 32.33 H new ATOM 0 HG3 ARG A 99 3.429 -1.329 12.757 1.00 32.33 H new ATOM 0 HD2 ARG A 99 5.349 -0.597 11.151 1.00 11.35 H new ATOM 0 HD3 ARG A 99 6.377 -0.653 12.570 1.00 11.35 H new ATOM 0 HE ARG A 99 5.315 -2.923 11.090 1.00 63.12 H new ATOM 0 HH11 ARG A 99 6.398 -1.800 14.257 1.00 22.43 H new ATOM 0 HH12 ARG A 99 6.837 -3.420 14.809 1.00 22.43 H new ATOM 0 HH21 ARG A 99 5.882 -5.000 11.807 1.00 54.12 H new ATOM 0 HH22 ARG A 99 6.547 -5.223 13.429 1.00 54.12 H new ATOM 902 N PHE A 100 4.017 3.961 12.978 1.00 43.44 N ATOM 903 CA PHE A 100 3.956 5.239 12.279 1.00 22.22 C ATOM 904 C PHE A 100 5.326 5.911 12.256 1.00 23.55 C ATOM 905 O PHE A 100 5.678 6.596 11.297 1.00 71.24 O ATOM 906 CB PHE A 100 2.934 6.161 12.946 1.00 50.04 C ATOM 907 CG PHE A 100 2.497 7.302 12.072 1.00 3.15 C ATOM 908 CD1 PHE A 100 1.839 7.064 10.876 1.00 1.01 C ATOM 909 CD2 PHE A 100 2.742 8.613 12.447 1.00 42.32 C ATOM 910 CE1 PHE A 100 1.437 8.112 10.070 1.00 50.54 C ATOM 911 CE2 PHE A 100 2.341 9.665 11.646 1.00 51.15 C ATOM 912 CZ PHE A 100 1.686 9.414 10.456 1.00 31.33 C ATOM 0 H PHE A 100 3.316 3.847 13.710 1.00 43.44 H new ATOM 0 HA PHE A 100 3.646 5.049 11.251 1.00 22.22 H new ATOM 0 HB2 PHE A 100 2.059 5.576 13.230 1.00 50.04 H new ATOM 0 HB3 PHE A 100 3.362 6.561 13.865 1.00 50.04 H new ATOM 0 HD1 PHE A 100 1.638 6.048 10.570 1.00 1.01 H new ATOM 0 HD2 PHE A 100 3.253 8.815 13.377 1.00 42.32 H new ATOM 0 HE1 PHE A 100 0.928 7.913 9.138 1.00 50.54 H new ATOM 0 HE2 PHE A 100 2.539 10.682 11.950 1.00 51.15 H new ATOM 0 HZ PHE A 100 1.369 10.234 9.829 1.00 31.33 H new ATOM 921 N SER A 101 6.094 5.711 13.323 1.00 73.23 N ATOM 922 CA SER A 101 7.424 6.300 13.428 1.00 24.44 C ATOM 923 C SER A 101 8.250 6.007 12.179 1.00 22.01 C ATOM 924 O SER A 101 8.927 6.887 11.649 1.00 43.20 O ATOM 925 CB SER A 101 8.145 5.766 14.668 1.00 73.33 C ATOM 926 OG SER A 101 7.515 6.212 15.855 1.00 4.15 O ATOM 0 H SER A 101 5.818 5.146 14.126 1.00 73.23 H new ATOM 0 HA SER A 101 7.309 7.380 13.520 1.00 24.44 H new ATOM 0 HB2 SER A 101 8.155 4.676 14.645 1.00 73.33 H new ATOM 0 HB3 SER A 101 9.184 6.095 14.658 1.00 73.33 H new ATOM 0 HG SER A 101 6.825 5.569 16.120 1.00 4.15 H new ATOM 931 N GLU A 102 8.188 4.762 11.715 1.00 43.10 N ATOM 932 CA GLU A 102 8.930 4.352 10.529 1.00 24.30 C ATOM 933 C GLU A 102 8.519 5.182 9.316 1.00 11.43 C ATOM 934 O GLU A 102 9.342 5.872 8.714 1.00 41.32 O ATOM 935 CB GLU A 102 8.701 2.865 10.246 1.00 24.43 C ATOM 936 CG GLU A 102 9.824 1.972 10.745 1.00 40.42 C ATOM 937 CD GLU A 102 9.683 0.538 10.269 1.00 4.13 C ATOM 938 OE1 GLU A 102 8.838 -0.191 10.828 1.00 33.34 O ATOM 939 OE2 GLU A 102 10.418 0.148 9.338 1.00 0.32 O ATOM 0 H GLU A 102 7.632 4.021 12.142 1.00 43.10 H new ATOM 0 HA GLU A 102 9.990 4.519 10.719 1.00 24.30 H new ATOM 0 HB2 GLU A 102 7.766 2.554 10.713 1.00 24.43 H new ATOM 0 HB3 GLU A 102 8.584 2.722 9.172 1.00 24.43 H new ATOM 0 HG2 GLU A 102 10.780 2.372 10.405 1.00 40.42 H new ATOM 0 HG3 GLU A 102 9.840 1.989 11.835 1.00 40.42 H new ATOM 944 N VAL A 103 7.239 5.108 8.962 1.00 3.23 N ATOM 945 CA VAL A 103 6.717 5.851 7.822 1.00 31.21 C ATOM 946 C VAL A 103 7.022 7.339 7.950 1.00 71.34 C ATOM 947 O VAL A 103 7.626 7.938 7.060 1.00 35.43 O ATOM 948 CB VAL A 103 5.196 5.661 7.676 1.00 10.32 C ATOM 949 CG1 VAL A 103 4.663 6.484 6.513 1.00 25.44 C ATOM 950 CG2 VAL A 103 4.858 4.188 7.497 1.00 61.43 C ATOM 0 H VAL A 103 6.545 4.541 9.449 1.00 3.23 H new ATOM 0 HA VAL A 103 7.211 5.456 6.934 1.00 31.21 H new ATOM 0 HB VAL A 103 4.715 6.013 8.589 1.00 10.32 H new ATOM 0 HG11 VAL A 103 3.587 6.336 6.426 1.00 25.44 H new ATOM 0 HG12 VAL A 103 4.872 7.539 6.688 1.00 25.44 H new ATOM 0 HG13 VAL A 103 5.148 6.167 5.590 1.00 25.44 H new ATOM 0 HG21 VAL A 103 3.779 4.072 7.395 1.00 61.43 H new ATOM 0 HG22 VAL A 103 5.350 3.808 6.601 1.00 61.43 H new ATOM 0 HG23 VAL A 103 5.203 3.627 8.366 1.00 61.43 H new ATOM 960 N ARG A 104 6.601 7.930 9.064 1.00 61.25 N ATOM 961 CA ARG A 104 6.829 9.350 9.308 1.00 12.50 C ATOM 962 C ARG A 104 8.312 9.690 9.193 1.00 42.25 C ATOM 963 O ARG A 104 8.679 10.744 8.672 1.00 21.43 O ATOM 964 CB ARG A 104 6.311 9.739 10.693 1.00 23.03 C ATOM 965 CG ARG A 104 5.989 11.218 10.829 1.00 4.42 C ATOM 966 CD ARG A 104 7.200 12.013 11.292 1.00 60.23 C ATOM 967 NE ARG A 104 7.429 11.876 12.727 1.00 1.22 N ATOM 968 CZ ARG A 104 6.675 12.462 13.651 1.00 74.50 C ATOM 969 NH1 ARG A 104 5.650 13.221 13.292 1.00 75.04 N ATOM 970 NH2 ARG A 104 6.949 12.289 14.938 1.00 42.43 N ATOM 0 H ARG A 104 6.101 7.448 9.811 1.00 61.25 H new ATOM 0 HA ARG A 104 6.285 9.916 8.552 1.00 12.50 H new ATOM 0 HB2 ARG A 104 5.415 9.159 10.913 1.00 23.03 H new ATOM 0 HB3 ARG A 104 7.057 9.468 11.440 1.00 23.03 H new ATOM 0 HG2 ARG A 104 5.643 11.605 9.871 1.00 4.42 H new ATOM 0 HG3 ARG A 104 5.173 11.350 11.539 1.00 4.42 H new ATOM 0 HD2 ARG A 104 8.084 11.676 10.750 1.00 60.23 H new ATOM 0 HD3 ARG A 104 7.058 13.065 11.047 1.00 60.23 H new ATOM 0 HE ARG A 104 8.211 11.299 13.038 1.00 1.22 H new ATOM 0 HH11 ARG A 104 5.438 13.357 12.304 1.00 75.04 H new ATOM 0 HH12 ARG A 104 5.073 13.669 14.004 1.00 75.04 H new ATOM 0 HH21 ARG A 104 7.738 11.706 15.218 1.00 42.43 H new ATOM 0 HH22 ARG A 104 6.370 12.739 15.648 1.00 42.43 H new ATOM 981 N LYS A 105 9.160 8.792 9.681 1.00 42.52 N ATOM 982 CA LYS A 105 10.603 8.995 9.633 1.00 43.23 C ATOM 983 C LYS A 105 11.088 9.113 8.192 1.00 44.45 C ATOM 984 O LYS A 105 11.805 10.051 7.842 1.00 1.30 O ATOM 985 CB LYS A 105 11.325 7.841 10.333 1.00 71.23 C ATOM 986 CG LYS A 105 12.839 7.960 10.295 1.00 54.13 C ATOM 987 CD LYS A 105 13.332 9.089 11.183 1.00 61.31 C ATOM 988 CE LYS A 105 13.386 8.667 12.643 1.00 10.53 C ATOM 989 NZ LYS A 105 13.458 9.839 13.559 1.00 73.32 N ATOM 0 H LYS A 105 8.873 7.915 10.115 1.00 42.52 H new ATOM 0 HA LYS A 105 10.831 9.926 10.152 1.00 43.23 H new ATOM 0 HB2 LYS A 105 10.998 7.796 11.372 1.00 71.23 H new ATOM 0 HB3 LYS A 105 11.031 6.902 9.865 1.00 71.23 H new ATOM 0 HG2 LYS A 105 13.287 7.020 10.618 1.00 54.13 H new ATOM 0 HG3 LYS A 105 13.166 8.133 9.270 1.00 54.13 H new ATOM 0 HD2 LYS A 105 14.324 9.403 10.857 1.00 61.31 H new ATOM 0 HD3 LYS A 105 12.674 9.951 11.076 1.00 61.31 H new ATOM 0 HE2 LYS A 105 12.503 8.074 12.882 1.00 10.53 H new ATOM 0 HE3 LYS A 105 14.254 8.027 12.804 1.00 10.53 H new ATOM 0 HZ1 LYS A 105 13.493 9.508 14.544 1.00 73.32 H new ATOM 0 HZ2 LYS A 105 14.313 10.392 13.349 1.00 73.32 H new ATOM 0 HZ3 LYS A 105 12.618 10.437 13.425 1.00 73.32 H new ATOM 999 N LYS A 106 10.691 8.158 7.359 1.00 51.34 N ATOM 1000 CA LYS A 106 11.082 8.156 5.954 1.00 52.12 C ATOM 1001 C LYS A 106 10.552 9.396 5.239 1.00 13.42 C ATOM 1002 O LYS A 106 11.223 9.959 4.376 1.00 32.34 O ATOM 1003 CB LYS A 106 10.562 6.893 5.260 1.00 21.52 C ATOM 1004 CG LYS A 106 11.525 5.721 5.333 1.00 15.21 C ATOM 1005 CD LYS A 106 12.639 5.849 4.307 1.00 31.42 C ATOM 1006 CE LYS A 106 12.133 5.581 2.898 1.00 24.01 C ATOM 1007 NZ LYS A 106 13.185 4.971 2.038 1.00 21.23 N ATOM 0 H LYS A 106 10.098 7.374 7.632 1.00 51.34 H new ATOM 0 HA LYS A 106 12.171 8.168 5.906 1.00 52.12 H new ATOM 0 HB2 LYS A 106 9.614 6.603 5.714 1.00 21.52 H new ATOM 0 HB3 LYS A 106 10.358 7.121 4.214 1.00 21.52 H new ATOM 0 HG2 LYS A 106 11.955 5.664 6.333 1.00 15.21 H new ATOM 0 HG3 LYS A 106 10.981 4.791 5.167 1.00 15.21 H new ATOM 0 HD2 LYS A 106 13.067 6.850 4.357 1.00 31.42 H new ATOM 0 HD3 LYS A 106 13.438 5.148 4.547 1.00 31.42 H new ATOM 0 HE2 LYS A 106 11.270 4.917 2.942 1.00 24.01 H new ATOM 0 HE3 LYS A 106 11.794 6.515 2.450 1.00 24.01 H new ATOM 0 HZ1 LYS A 106 12.801 4.804 1.086 1.00 21.23 H new ATOM 0 HZ2 LYS A 106 13.999 5.616 1.975 1.00 21.23 H new ATOM 0 HZ3 LYS A 106 13.491 4.067 2.452 1.00 21.23 H new ATOM 1017 N MET A 107 9.345 9.813 5.606 1.00 30.14 N ATOM 1018 CA MET A 107 8.727 10.988 5.002 1.00 33.41 C ATOM 1019 C MET A 107 9.562 12.237 5.265 1.00 4.21 C ATOM 1020 O MET A 107 10.006 12.907 4.332 1.00 30.43 O ATOM 1021 CB MET A 107 7.311 11.182 5.545 1.00 64.21 C ATOM 1022 CG MET A 107 6.538 12.289 4.846 1.00 44.12 C ATOM 1023 SD MET A 107 5.973 11.809 3.202 1.00 3.12 S ATOM 1024 CE MET A 107 5.207 13.331 2.650 1.00 72.31 C ATOM 0 H MET A 107 8.776 9.355 6.318 1.00 30.14 H new ATOM 0 HA MET A 107 8.676 10.828 3.925 1.00 33.41 H new ATOM 0 HB2 MET A 107 6.761 10.246 5.444 1.00 64.21 H new ATOM 0 HB3 MET A 107 7.367 11.406 6.610 1.00 64.21 H new ATOM 0 HG2 MET A 107 5.678 12.567 5.455 1.00 44.12 H new ATOM 0 HG3 MET A 107 7.170 13.173 4.765 1.00 44.12 H new ATOM 0 HE1 MET A 107 4.808 13.194 1.645 1.00 72.31 H new ATOM 0 HE2 MET A 107 4.397 13.598 3.329 1.00 72.31 H new ATOM 0 HE3 MET A 107 5.949 14.129 2.640 1.00 72.31 H new ATOM 1032 N VAL A 108 9.771 12.546 6.540 1.00 25.13 N ATOM 1033 CA VAL A 108 10.553 13.715 6.926 1.00 11.41 C ATOM 1034 C VAL A 108 11.987 13.608 6.418 1.00 4.22 C ATOM 1035 O VAL A 108 12.606 14.611 6.066 1.00 23.32 O ATOM 1036 CB VAL A 108 10.574 13.896 8.456 1.00 31.43 C ATOM 1037 CG1 VAL A 108 11.235 12.701 9.126 1.00 1.25 C ATOM 1038 CG2 VAL A 108 11.285 15.188 8.829 1.00 2.11 C ATOM 0 H VAL A 108 9.410 12.003 7.324 1.00 25.13 H new ATOM 0 HA VAL A 108 10.073 14.582 6.472 1.00 11.41 H new ATOM 0 HB VAL A 108 9.546 13.958 8.812 1.00 31.43 H new ATOM 0 HG11 VAL A 108 11.241 12.847 10.206 1.00 1.25 H new ATOM 0 HG12 VAL A 108 10.679 11.795 8.885 1.00 1.25 H new ATOM 0 HG13 VAL A 108 12.260 12.604 8.768 1.00 1.25 H new ATOM 0 HG21 VAL A 108 11.291 15.300 9.913 1.00 2.11 H new ATOM 0 HG22 VAL A 108 12.311 15.158 8.462 1.00 2.11 H new ATOM 0 HG23 VAL A 108 10.764 16.033 8.380 1.00 2.11 H new ATOM 1048 N GLU A 109 12.508 12.386 6.384 1.00 0.30 N ATOM 1049 CA GLU A 109 13.869 12.149 5.919 1.00 65.20 C ATOM 1050 C GLU A 109 14.009 12.505 4.442 1.00 60.44 C ATOM 1051 O GLU A 109 15.001 13.106 4.029 1.00 42.13 O ATOM 1052 CB GLU A 109 14.262 10.687 6.142 1.00 45.04 C ATOM 1053 CG GLU A 109 15.579 10.304 5.488 1.00 41.50 C ATOM 1054 CD GLU A 109 16.098 8.962 5.967 1.00 71.24 C ATOM 1055 OE1 GLU A 109 17.254 8.623 5.636 1.00 72.01 O ATOM 1056 OE2 GLU A 109 15.351 8.252 6.671 1.00 41.14 O ATOM 0 H GLU A 109 12.008 11.545 6.673 1.00 0.30 H new ATOM 0 HA GLU A 109 14.538 12.789 6.495 1.00 65.20 H new ATOM 0 HB2 GLU A 109 14.329 10.497 7.213 1.00 45.04 H new ATOM 0 HB3 GLU A 109 13.472 10.044 5.753 1.00 45.04 H new ATOM 0 HG2 GLU A 109 15.448 10.274 4.406 1.00 41.50 H new ATOM 0 HG3 GLU A 109 16.322 11.073 5.698 1.00 41.50 H new ATOM 1061 N ASN A 110 13.009 12.131 3.651 1.00 14.44 N ATOM 1062 CA ASN A 110 13.020 12.408 2.219 1.00 23.33 C ATOM 1063 C ASN A 110 13.293 13.886 1.955 1.00 24.21 C ATOM 1064 O ASN A 110 13.903 14.244 0.947 1.00 61.33 O ATOM 1065 CB ASN A 110 11.686 12.004 1.590 1.00 52.13 C ATOM 1066 CG ASN A 110 11.657 10.542 1.186 1.00 31.04 C ATOM 1067 OD1 ASN A 110 12.689 9.956 0.859 1.00 70.52 O ATOM 1068 ND2 ASN A 110 10.471 9.946 1.207 1.00 4.02 N ATOM 0 H ASN A 110 12.180 11.635 3.978 1.00 14.44 H new ATOM 0 HA ASN A 110 13.819 11.821 1.766 1.00 23.33 H new ATOM 0 HB2 ASN A 110 10.880 12.199 2.297 1.00 52.13 H new ATOM 0 HB3 ASN A 110 11.498 12.624 0.714 1.00 52.13 H new ATOM 0 HD21 ASN A 110 10.389 8.964 0.945 1.00 4.02 H new ATOM 0 HD22 ASN A 110 9.641 10.471 1.485 1.00 4.02 H new ATOM 1074 N ASP A 111 12.838 14.738 2.866 1.00 23.25 N ATOM 1075 CA ASP A 111 13.035 16.177 2.733 1.00 42.31 C ATOM 1076 C ASP A 111 12.284 16.718 1.520 1.00 14.25 C ATOM 1077 O ASP A 111 12.894 17.131 0.534 1.00 31.52 O ATOM 1078 CB ASP A 111 14.524 16.502 2.613 1.00 34.32 C ATOM 1079 CG ASP A 111 14.847 17.913 3.062 1.00 64.42 C ATOM 1080 OD1 ASP A 111 16.048 18.252 3.139 1.00 43.32 O ATOM 1081 OD2 ASP A 111 13.900 18.680 3.337 1.00 74.35 O ATOM 0 H ASP A 111 12.330 14.458 3.705 1.00 23.25 H new ATOM 0 HA ASP A 111 12.638 16.657 3.628 1.00 42.31 H new ATOM 0 HB2 ASP A 111 15.097 15.793 3.211 1.00 34.32 H new ATOM 0 HB3 ASP A 111 14.839 16.372 1.578 1.00 34.32 H new ATOM 1085 N ASP A 112 10.958 16.710 1.599 1.00 73.23 N ATOM 1086 CA ASP A 112 10.124 17.200 0.507 1.00 11.30 C ATOM 1087 C ASP A 112 9.227 18.340 0.978 1.00 31.01 C ATOM 1088 O ASP A 112 8.940 19.269 0.222 1.00 24.52 O ATOM 1089 CB ASP A 112 9.271 16.064 -0.060 1.00 41.14 C ATOM 1090 CG ASP A 112 8.613 16.435 -1.374 1.00 21.12 C ATOM 1091 OD1 ASP A 112 7.437 16.066 -1.573 1.00 42.04 O ATOM 1092 OD2 ASP A 112 9.275 17.093 -2.204 1.00 51.31 O ATOM 0 H ASP A 112 10.437 16.370 2.407 1.00 73.23 H new ATOM 0 HA ASP A 112 10.780 17.578 -0.277 1.00 11.30 H new ATOM 0 HB2 ASP A 112 9.895 15.183 -0.206 1.00 41.14 H new ATOM 0 HB3 ASP A 112 8.503 15.794 0.664 1.00 41.14 H new ATOM 1096 N ILE A 113 8.787 18.262 2.229 1.00 52.11 N ATOM 1097 CA ILE A 113 7.923 19.288 2.799 1.00 24.05 C ATOM 1098 C ILE A 113 8.487 19.812 4.116 1.00 61.12 C ATOM 1099 O ILE A 113 9.440 19.254 4.660 1.00 64.13 O ATOM 1100 CB ILE A 113 6.499 18.754 3.041 1.00 10.52 C ATOM 1101 CG1 ILE A 113 6.547 17.469 3.871 1.00 43.35 C ATOM 1102 CG2 ILE A 113 5.794 18.509 1.716 1.00 54.52 C ATOM 1103 CD1 ILE A 113 6.671 17.715 5.358 1.00 60.42 C ATOM 0 H ILE A 113 9.014 17.499 2.867 1.00 52.11 H new ATOM 0 HA ILE A 113 7.879 20.102 2.075 1.00 24.05 H new ATOM 0 HB ILE A 113 5.935 19.503 3.598 1.00 10.52 H new ATOM 0 HG12 ILE A 113 5.644 16.889 3.681 1.00 43.35 H new ATOM 0 HG13 ILE A 113 7.390 16.863 3.540 1.00 43.35 H new ATOM 0 HG21 ILE A 113 4.789 18.132 1.903 1.00 54.52 H new ATOM 0 HG22 ILE A 113 5.733 19.443 1.158 1.00 54.52 H new ATOM 0 HG23 ILE A 113 6.354 17.776 1.136 1.00 54.52 H new ATOM 0 HD11 ILE A 113 6.699 16.761 5.884 1.00 60.42 H new ATOM 0 HD12 ILE A 113 7.588 18.268 5.560 1.00 60.42 H new ATOM 0 HD13 ILE A 113 5.815 18.294 5.704 1.00 60.42 H new ATOM 1114 N GLU A 114 7.890 20.886 4.623 1.00 63.24 N ATOM 1115 CA GLU A 114 8.333 21.484 5.877 1.00 63.52 C ATOM 1116 C GLU A 114 7.164 21.652 6.843 1.00 53.43 C ATOM 1117 O GLU A 114 7.321 21.507 8.055 1.00 42.24 O ATOM 1118 CB GLU A 114 8.991 22.842 5.616 1.00 15.34 C ATOM 1119 CG GLU A 114 8.053 23.864 4.998 1.00 12.30 C ATOM 1120 CD GLU A 114 8.759 25.151 4.620 1.00 31.34 C ATOM 1121 OE1 GLU A 114 9.989 25.234 4.821 1.00 31.33 O ATOM 1122 OE2 GLU A 114 8.083 26.075 4.122 1.00 24.41 O ATOM 0 H GLU A 114 7.099 21.359 4.185 1.00 63.24 H new ATOM 0 HA GLU A 114 9.064 20.814 6.330 1.00 63.52 H new ATOM 0 HB2 GLU A 114 9.376 23.237 6.556 1.00 15.34 H new ATOM 0 HB3 GLU A 114 9.847 22.701 4.956 1.00 15.34 H new ATOM 0 HG2 GLU A 114 7.588 23.435 4.110 1.00 12.30 H new ATOM 0 HG3 GLU A 114 7.251 24.087 5.701 1.00 12.30 H new ATOM 1127 N MET A 115 5.991 21.957 6.297 1.00 33.11 N ATOM 1128 CA MET A 115 4.795 22.144 7.109 1.00 32.34 C ATOM 1129 C MET A 115 3.734 21.106 6.760 1.00 12.21 C ATOM 1130 O MET A 115 2.904 20.748 7.596 1.00 20.33 O ATOM 1131 CB MET A 115 4.232 23.552 6.911 1.00 24.42 C ATOM 1132 CG MET A 115 4.957 24.616 7.720 1.00 2.44 C ATOM 1133 SD MET A 115 4.488 26.290 7.245 1.00 63.11 S ATOM 1134 CE MET A 115 4.759 27.168 8.782 1.00 12.05 C ATOM 0 H MET A 115 5.844 22.080 5.295 1.00 33.11 H new ATOM 0 HA MET A 115 5.073 22.016 8.155 1.00 32.34 H new ATOM 0 HB2 MET A 115 4.287 23.811 5.854 1.00 24.42 H new ATOM 0 HB3 MET A 115 3.177 23.555 7.185 1.00 24.42 H new ATOM 0 HG2 MET A 115 4.744 24.470 8.779 1.00 2.44 H new ATOM 0 HG3 MET A 115 6.033 24.494 7.592 1.00 2.44 H new ATOM 0 HE1 MET A 115 4.512 28.221 8.648 1.00 12.05 H new ATOM 0 HE2 MET A 115 4.126 26.743 9.561 1.00 12.05 H new ATOM 0 HE3 MET A 115 5.805 27.075 9.074 1.00 12.05 H new ATOM 1142 N GLN A 116 3.765 20.626 5.522 1.00 75.53 N ATOM 1143 CA GLN A 116 2.805 19.630 5.062 1.00 3.32 C ATOM 1144 C GLN A 116 2.702 18.476 6.054 1.00 21.35 C ATOM 1145 O GLN A 116 1.638 17.881 6.222 1.00 35.20 O ATOM 1146 CB GLN A 116 3.206 19.101 3.685 1.00 40.11 C ATOM 1147 CG GLN A 116 2.057 19.065 2.689 1.00 74.14 C ATOM 1148 CD GLN A 116 2.398 18.287 1.432 1.00 25.14 C ATOM 1149 OE1 GLN A 116 2.455 18.848 0.338 1.00 3.52 O ATOM 1150 NE2 GLN A 116 2.628 16.988 1.584 1.00 4.42 N ATOM 0 H GLN A 116 4.446 20.911 4.818 1.00 75.53 H new ATOM 0 HA GLN A 116 1.829 20.110 4.988 1.00 3.32 H new ATOM 0 HB2 GLN A 116 4.005 19.725 3.284 1.00 40.11 H new ATOM 0 HB3 GLN A 116 3.612 18.095 3.795 1.00 40.11 H new ATOM 0 HG2 GLN A 116 1.184 18.617 3.163 1.00 74.14 H new ATOM 0 HG3 GLN A 116 1.784 20.085 2.418 1.00 74.14 H new ATOM 0 HE21 GLN A 116 2.570 16.565 2.510 1.00 4.42 H new ATOM 0 HE22 GLN A 116 2.863 16.414 0.775 1.00 4.42 H new ATOM 1157 N ALA A 117 3.817 18.164 6.709 1.00 44.12 N ATOM 1158 CA ALA A 117 3.851 17.082 7.685 1.00 64.30 C ATOM 1159 C ALA A 117 2.759 17.254 8.734 1.00 5.33 C ATOM 1160 O ALA A 117 1.932 16.363 8.937 1.00 32.34 O ATOM 1161 CB ALA A 117 5.218 17.015 8.350 1.00 62.23 C ATOM 0 H ALA A 117 4.707 18.645 6.581 1.00 44.12 H new ATOM 0 HA ALA A 117 3.668 16.145 7.159 1.00 64.30 H new ATOM 0 HB1 ALA A 117 5.230 16.203 9.077 1.00 62.23 H new ATOM 0 HB2 ALA A 117 5.982 16.836 7.594 1.00 62.23 H new ATOM 0 HB3 ALA A 117 5.423 17.958 8.857 1.00 62.23 H new ATOM 1167 N LEU A 118 2.759 18.404 9.400 1.00 73.24 N ATOM 1168 CA LEU A 118 1.768 18.693 10.429 1.00 40.43 C ATOM 1169 C LEU A 118 0.392 18.923 9.811 1.00 41.51 C ATOM 1170 O LEU A 118 -0.624 18.490 10.354 1.00 41.33 O ATOM 1171 CB LEU A 118 2.187 19.920 11.240 1.00 12.44 C ATOM 1172 CG LEU A 118 1.998 19.820 12.754 1.00 25.42 C ATOM 1173 CD1 LEU A 118 0.570 19.421 13.089 1.00 14.01 C ATOM 1174 CD2 LEU A 118 2.986 18.829 13.351 1.00 41.42 C ATOM 0 H LEU A 118 3.435 19.152 9.245 1.00 73.24 H new ATOM 0 HA LEU A 118 1.708 17.830 11.093 1.00 40.43 H new ATOM 0 HB2 LEU A 118 3.239 20.123 11.038 1.00 12.44 H new ATOM 0 HB3 LEU A 118 1.622 20.779 10.879 1.00 12.44 H new ATOM 0 HG LEU A 118 2.190 20.800 13.190 1.00 25.42 H new ATOM 0 HD11 LEU A 118 0.455 19.355 14.171 1.00 14.01 H new ATOM 0 HD12 LEU A 118 -0.119 20.169 12.696 1.00 14.01 H new ATOM 0 HD13 LEU A 118 0.348 18.453 12.641 1.00 14.01 H new ATOM 0 HD21 LEU A 118 2.837 18.771 14.429 1.00 41.42 H new ATOM 0 HD22 LEU A 118 2.827 17.845 12.909 1.00 41.42 H new ATOM 0 HD23 LEU A 118 4.004 19.160 13.143 1.00 41.42 H new ATOM 1185 N GLY A 119 0.368 19.607 8.671 1.00 0.22 N ATOM 1186 CA GLY A 119 -0.888 19.881 7.998 1.00 74.14 C ATOM 1187 C GLY A 119 -1.647 18.616 7.648 1.00 13.24 C ATOM 1188 O GLY A 119 -2.878 18.600 7.654 1.00 64.32 O ATOM 0 H GLY A 119 1.195 19.976 8.202 1.00 0.22 H new ATOM 0 HA2 GLY A 119 -1.509 20.509 8.637 1.00 74.14 H new ATOM 0 HA3 GLY A 119 -0.693 20.447 7.087 1.00 74.14 H new ATOM 1192 N SER A 120 -0.912 17.552 7.341 1.00 61.11 N ATOM 1193 CA SER A 120 -1.524 16.278 6.982 1.00 15.02 C ATOM 1194 C SER A 120 -1.393 15.271 8.122 1.00 65.55 C ATOM 1195 O SER A 120 -1.003 15.625 9.234 1.00 21.11 O ATOM 1196 CB SER A 120 -0.876 15.717 5.715 1.00 55.02 C ATOM 1197 OG SER A 120 -0.844 16.689 4.685 1.00 30.32 O ATOM 0 H SER A 120 0.108 17.547 7.334 1.00 61.11 H new ATOM 0 HA SER A 120 -2.584 16.452 6.794 1.00 15.02 H new ATOM 0 HB2 SER A 120 0.138 15.385 5.938 1.00 55.02 H new ATOM 0 HB3 SER A 120 -1.430 14.842 5.376 1.00 55.02 H new ATOM 0 HG SER A 120 -0.097 17.304 4.839 1.00 30.32 H new ATOM 1202 N ASN A 121 -1.722 14.016 7.836 1.00 62.55 N ATOM 1203 CA ASN A 121 -1.643 12.959 8.836 1.00 12.44 C ATOM 1204 C ASN A 121 -2.605 13.227 9.989 1.00 4.40 C ATOM 1205 O ASN A 121 -2.217 13.201 11.157 1.00 24.32 O ATOM 1206 CB ASN A 121 -0.214 12.838 9.369 1.00 71.33 C ATOM 1207 CG ASN A 121 0.813 12.760 8.255 1.00 24.24 C ATOM 1208 OD1 ASN A 121 1.152 11.676 7.783 1.00 14.45 O ATOM 1209 ND2 ASN A 121 1.315 13.914 7.832 1.00 63.12 N ATOM 0 H ASN A 121 -2.046 13.706 6.920 1.00 62.55 H new ATOM 0 HA ASN A 121 -1.927 12.021 8.359 1.00 12.44 H new ATOM 0 HB2 ASN A 121 0.008 13.695 10.005 1.00 71.33 H new ATOM 0 HB3 ASN A 121 -0.136 11.949 9.994 1.00 71.33 H new ATOM 0 HD21 ASN A 121 2.011 13.925 7.086 1.00 63.12 H new ATOM 0 HD22 ASN A 121 1.005 14.790 8.253 1.00 63.12 H new ATOM 1215 N THR A 122 -3.866 13.482 9.653 1.00 61.21 N ATOM 1216 CA THR A 122 -4.885 13.756 10.658 1.00 20.05 C ATOM 1217 C THR A 122 -5.859 12.590 10.784 1.00 3.21 C ATOM 1218 O THR A 122 -6.047 12.037 11.869 1.00 22.13 O ATOM 1219 CB THR A 122 -5.674 15.036 10.326 1.00 22.44 C ATOM 1220 OG1 THR A 122 -5.901 15.118 8.915 1.00 42.53 O ATOM 1221 CG2 THR A 122 -4.922 16.272 10.796 1.00 23.04 C ATOM 0 H THR A 122 -4.206 13.504 8.692 1.00 61.21 H new ATOM 0 HA THR A 122 -4.364 13.896 11.605 1.00 20.05 H new ATOM 0 HB THR A 122 -6.631 14.993 10.846 1.00 22.44 H new ATOM 0 HG1 THR A 122 -6.405 15.934 8.712 1.00 42.53 H new ATOM 0 HG21 THR A 122 -5.499 17.164 10.551 1.00 23.04 H new ATOM 0 HG22 THR A 122 -4.775 16.220 11.875 1.00 23.04 H new ATOM 0 HG23 THR A 122 -3.953 16.319 10.300 1.00 23.04 H new ATOM 1229 N THR A 123 -6.479 12.220 9.668 1.00 44.24 N ATOM 1230 CA THR A 123 -7.436 11.121 9.654 1.00 32.15 C ATOM 1231 C THR A 123 -6.768 9.817 9.230 1.00 42.32 C ATOM 1232 O THR A 123 -5.748 9.827 8.541 1.00 4.12 O ATOM 1233 CB THR A 123 -8.614 11.413 8.705 1.00 11.32 C ATOM 1234 OG1 THR A 123 -8.185 11.304 7.343 1.00 25.24 O ATOM 1235 CG2 THR A 123 -9.178 12.803 8.956 1.00 11.52 C ATOM 0 H THR A 123 -6.335 12.666 8.762 1.00 44.24 H new ATOM 0 HA THR A 123 -7.815 11.019 10.671 1.00 32.15 H new ATOM 0 HB THR A 123 -9.398 10.680 8.897 1.00 11.32 H new ATOM 0 HG1 THR A 123 -8.940 11.489 6.746 1.00 25.24 H new ATOM 0 HG21 THR A 123 -10.009 12.987 8.275 1.00 11.52 H new ATOM 0 HG22 THR A 123 -9.531 12.872 9.985 1.00 11.52 H new ATOM 0 HG23 THR A 123 -8.399 13.547 8.788 1.00 11.52 H new ATOM 1243 N ILE A 124 -7.351 8.697 9.645 1.00 2.31 N ATOM 1244 CA ILE A 124 -6.813 7.386 9.306 1.00 1.21 C ATOM 1245 C ILE A 124 -7.839 6.549 8.549 1.00 21.51 C ATOM 1246 O ILE A 124 -9.044 6.773 8.664 1.00 74.12 O ATOM 1247 CB ILE A 124 -6.368 6.617 10.564 1.00 5.34 C ATOM 1248 CG1 ILE A 124 -7.558 6.402 11.503 1.00 21.35 C ATOM 1249 CG2 ILE A 124 -5.253 7.368 11.277 1.00 14.02 C ATOM 1250 CD1 ILE A 124 -8.255 5.076 11.302 1.00 75.03 C ATOM 0 H ILE A 124 -8.196 8.672 10.216 1.00 2.31 H new ATOM 0 HA ILE A 124 -5.945 7.557 8.669 1.00 1.21 H new ATOM 0 HB ILE A 124 -5.987 5.642 10.261 1.00 5.34 H new ATOM 0 HG12 ILE A 124 -7.213 6.469 12.535 1.00 21.35 H new ATOM 0 HG13 ILE A 124 -8.277 7.207 11.355 1.00 21.35 H new ATOM 0 HG21 ILE A 124 -4.949 6.812 12.164 1.00 14.02 H new ATOM 0 HG22 ILE A 124 -4.400 7.476 10.607 1.00 14.02 H new ATOM 0 HG23 ILE A 124 -5.610 8.355 11.572 1.00 14.02 H new ATOM 0 HD11 ILE A 124 -9.087 4.993 12.001 1.00 75.03 H new ATOM 0 HD12 ILE A 124 -8.631 5.014 10.281 1.00 75.03 H new ATOM 0 HD13 ILE A 124 -7.550 4.264 11.479 1.00 75.03 H new ATOM 1261 N HIS A 125 -7.352 5.582 7.776 1.00 24.23 N ATOM 1262 CA HIS A 125 -8.227 4.710 7.002 1.00 52.01 C ATOM 1263 C HIS A 125 -8.146 3.273 7.507 1.00 2.11 C ATOM 1264 O HIS A 125 -7.061 2.759 7.773 1.00 15.13 O ATOM 1265 CB HIS A 125 -7.855 4.764 5.521 1.00 74.35 C ATOM 1266 CG HIS A 125 -9.026 4.598 4.602 1.00 23.40 C ATOM 1267 ND1 HIS A 125 -9.768 3.439 4.531 1.00 13.43 N ATOM 1268 CD2 HIS A 125 -9.582 5.455 3.713 1.00 1.11 C ATOM 1269 CE1 HIS A 125 -10.730 3.588 3.637 1.00 24.35 C ATOM 1270 NE2 HIS A 125 -10.639 4.804 3.128 1.00 51.22 N ATOM 0 H HIS A 125 -6.357 5.384 7.670 1.00 24.23 H new ATOM 0 HA HIS A 125 -9.251 5.062 7.124 1.00 52.01 H new ATOM 0 HB2 HIS A 125 -7.371 5.718 5.311 1.00 74.35 H new ATOM 0 HB3 HIS A 125 -7.124 3.983 5.310 1.00 74.35 H new ATOM 0 HD2 HIS A 125 -9.255 6.463 3.504 1.00 1.11 H new ATOM 0 HE1 HIS A 125 -11.465 2.843 3.368 1.00 24.35 H new ATOM 0 HE2 HIS A 125 -11.255 5.196 2.415 1.00 51.22 H new ATOM 1277 N ALA A 126 -9.302 2.631 7.639 1.00 52.33 N ATOM 1278 CA ALA A 126 -9.362 1.253 8.111 1.00 53.03 C ATOM 1279 C ALA A 126 -9.780 0.306 6.991 1.00 75.42 C ATOM 1280 O ALA A 126 -10.779 0.537 6.310 1.00 50.34 O ATOM 1281 CB ALA A 126 -10.322 1.139 9.285 1.00 3.55 C ATOM 0 H ALA A 126 -10.210 3.043 7.426 1.00 52.33 H new ATOM 0 HA ALA A 126 -8.364 0.965 8.442 1.00 53.03 H new ATOM 0 HB1 ALA A 126 -10.357 0.105 9.627 1.00 3.55 H new ATOM 0 HB2 ALA A 126 -9.980 1.779 10.098 1.00 3.55 H new ATOM 0 HB3 ALA A 126 -11.318 1.451 8.972 1.00 3.55 H new ATOM 1287 N TYR A 127 -9.007 -0.758 6.803 1.00 31.44 N ATOM 1288 CA TYR A 127 -9.295 -1.738 5.763 1.00 71.21 C ATOM 1289 C TYR A 127 -9.493 -3.127 6.363 1.00 41.12 C ATOM 1290 O TYR A 127 -8.529 -3.822 6.683 1.00 21.14 O ATOM 1291 CB TYR A 127 -8.161 -1.771 4.736 1.00 40.12 C ATOM 1292 CG TYR A 127 -8.477 -1.023 3.461 1.00 63.51 C ATOM 1293 CD1 TYR A 127 -8.763 -1.703 2.285 1.00 13.42 C ATOM 1294 CD2 TYR A 127 -8.490 0.366 3.433 1.00 44.11 C ATOM 1295 CE1 TYR A 127 -9.051 -1.024 1.117 1.00 44.12 C ATOM 1296 CE2 TYR A 127 -8.779 1.055 2.271 1.00 24.01 C ATOM 1297 CZ TYR A 127 -9.059 0.355 1.116 1.00 61.55 C ATOM 1298 OH TYR A 127 -9.346 1.037 -0.044 1.00 52.33 O ATOM 0 H TYR A 127 -8.176 -0.964 7.358 1.00 31.44 H new ATOM 0 HA TYR A 127 -10.219 -1.442 5.266 1.00 71.21 H new ATOM 0 HB2 TYR A 127 -7.264 -1.345 5.184 1.00 40.12 H new ATOM 0 HB3 TYR A 127 -7.933 -2.809 4.492 1.00 40.12 H new ATOM 0 HD1 TYR A 127 -8.760 -2.783 2.283 1.00 13.42 H new ATOM 0 HD2 TYR A 127 -8.270 0.917 4.336 1.00 44.11 H new ATOM 0 HE1 TYR A 127 -9.268 -1.570 0.211 1.00 44.12 H new ATOM 0 HE2 TYR A 127 -8.786 2.135 2.267 1.00 24.01 H new ATOM 0 HH TYR A 127 -9.390 1.998 0.144 1.00 52.33 H new ATOM 1307 N PHE A 128 -10.753 -3.526 6.510 1.00 31.24 N ATOM 1308 CA PHE A 128 -11.081 -4.831 7.072 1.00 34.50 C ATOM 1309 C PHE A 128 -11.104 -5.900 5.983 1.00 31.04 C ATOM 1310 O PHE A 128 -11.409 -5.615 4.825 1.00 52.41 O ATOM 1311 CB PHE A 128 -12.435 -4.780 7.781 1.00 31.53 C ATOM 1312 CG PHE A 128 -12.547 -3.663 8.779 1.00 63.40 C ATOM 1313 CD1 PHE A 128 -12.886 -2.382 8.371 1.00 5.53 C ATOM 1314 CD2 PHE A 128 -12.313 -3.892 10.126 1.00 53.14 C ATOM 1315 CE1 PHE A 128 -12.989 -1.353 9.287 1.00 30.24 C ATOM 1316 CE2 PHE A 128 -12.414 -2.867 11.046 1.00 3.04 C ATOM 1317 CZ PHE A 128 -12.754 -1.595 10.626 1.00 11.32 C ATOM 0 H PHE A 128 -11.563 -2.964 6.248 1.00 31.24 H new ATOM 0 HA PHE A 128 -10.310 -5.091 7.797 1.00 34.50 H new ATOM 0 HB2 PHE A 128 -13.223 -4.671 7.036 1.00 31.53 H new ATOM 0 HB3 PHE A 128 -12.606 -5.729 8.289 1.00 31.53 H new ATOM 0 HD1 PHE A 128 -13.072 -2.186 7.325 1.00 5.53 H new ATOM 0 HD2 PHE A 128 -12.048 -4.884 10.460 1.00 53.14 H new ATOM 0 HE1 PHE A 128 -13.253 -0.360 8.956 1.00 30.24 H new ATOM 0 HE2 PHE A 128 -12.228 -3.059 12.092 1.00 3.04 H new ATOM 0 HZ PHE A 128 -12.836 -0.792 11.344 1.00 11.32 H new ATOM 1326 N ARG A 129 -10.780 -7.131 6.365 1.00 13.52 N ATOM 1327 CA ARG A 129 -10.762 -8.244 5.423 1.00 74.45 C ATOM 1328 C ARG A 129 -11.756 -9.324 5.837 1.00 13.43 C ATOM 1329 O ARG A 129 -11.862 -9.667 7.015 1.00 32.54 O ATOM 1330 CB ARG A 129 -9.355 -8.838 5.329 1.00 45.45 C ATOM 1331 CG ARG A 129 -8.312 -7.857 4.820 1.00 73.10 C ATOM 1332 CD ARG A 129 -8.412 -7.670 3.314 1.00 71.11 C ATOM 1333 NE ARG A 129 -7.184 -7.116 2.749 1.00 73.05 N ATOM 1334 CZ ARG A 129 -7.113 -6.571 1.540 1.00 62.44 C ATOM 1335 NH1 ARG A 129 -8.193 -6.505 0.773 1.00 31.42 N ATOM 1336 NH2 ARG A 129 -5.959 -6.089 1.095 1.00 44.11 N ATOM 0 H ARG A 129 -10.526 -7.383 7.320 1.00 13.52 H new ATOM 0 HA ARG A 129 -11.054 -7.863 4.444 1.00 74.45 H new ATOM 0 HB2 ARG A 129 -9.055 -9.196 6.314 1.00 45.45 H new ATOM 0 HB3 ARG A 129 -9.379 -9.705 4.668 1.00 45.45 H new ATOM 0 HG2 ARG A 129 -8.442 -6.895 5.317 1.00 73.10 H new ATOM 0 HG3 ARG A 129 -7.316 -8.217 5.078 1.00 73.10 H new ATOM 0 HD2 ARG A 129 -8.627 -8.629 2.843 1.00 71.11 H new ATOM 0 HD3 ARG A 129 -9.247 -7.008 3.085 1.00 71.11 H new ATOM 0 HE ARG A 129 -6.335 -7.150 3.314 1.00 73.05 H new ATOM 0 HH11 ARG A 129 -9.082 -6.874 1.111 1.00 31.42 H new ATOM 0 HH12 ARG A 129 -8.135 -6.086 -0.155 1.00 31.42 H new ATOM 0 HH21 ARG A 129 -5.126 -6.137 1.682 1.00 44.11 H new ATOM 0 HH22 ARG A 129 -5.905 -5.671 0.166 1.00 44.11 H new ATOM 1347 N LYS A 130 -12.484 -9.857 4.862 1.00 24.41 N ATOM 1348 CA LYS A 130 -13.470 -10.899 5.124 1.00 34.24 C ATOM 1349 C LYS A 130 -14.515 -10.420 6.127 1.00 61.40 C ATOM 1350 O LYS A 130 -14.425 -10.715 7.319 1.00 41.35 O ATOM 1351 CB LYS A 130 -12.781 -12.160 5.652 1.00 51.13 C ATOM 1352 CG LYS A 130 -11.955 -12.885 4.604 1.00 23.25 C ATOM 1353 CD LYS A 130 -10.512 -12.409 4.604 1.00 20.15 C ATOM 1354 CE LYS A 130 -9.692 -13.114 5.674 1.00 54.30 C ATOM 1355 NZ LYS A 130 -9.451 -14.545 5.334 1.00 44.14 N ATOM 0 H LYS A 130 -12.410 -9.584 3.882 1.00 24.41 H new ATOM 0 HA LYS A 130 -13.973 -11.133 4.186 1.00 34.24 H new ATOM 0 HB2 LYS A 130 -12.136 -11.889 6.487 1.00 51.13 H new ATOM 0 HB3 LYS A 130 -13.537 -12.841 6.042 1.00 51.13 H new ATOM 0 HG2 LYS A 130 -11.985 -13.958 4.794 1.00 23.25 H new ATOM 0 HG3 LYS A 130 -12.392 -12.723 3.619 1.00 23.25 H new ATOM 0 HD2 LYS A 130 -10.068 -12.591 3.625 1.00 20.15 H new ATOM 0 HD3 LYS A 130 -10.483 -11.332 4.772 1.00 20.15 H new ATOM 0 HE2 LYS A 130 -8.737 -12.603 5.795 1.00 54.30 H new ATOM 0 HE3 LYS A 130 -10.211 -13.050 6.630 1.00 54.30 H new ATOM 0 HZ1 LYS A 130 -8.659 -14.908 5.902 1.00 44.14 H new ATOM 0 HZ2 LYS A 130 -10.307 -15.099 5.539 1.00 44.14 H new ATOM 0 HZ3 LYS A 130 -9.219 -14.627 4.324 1.00 44.14 H new ATOM 1365 N ASP A 131 -15.503 -9.681 5.637 1.00 51.45 N ATOM 1366 CA ASP A 131 -16.567 -9.163 6.489 1.00 42.33 C ATOM 1367 C ASP A 131 -17.732 -10.145 6.561 1.00 2.25 C ATOM 1368 O ASP A 131 -18.278 -10.398 7.635 1.00 1.40 O ATOM 1369 CB ASP A 131 -17.055 -7.811 5.968 1.00 24.44 C ATOM 1370 CG ASP A 131 -18.270 -7.305 6.721 1.00 24.52 C ATOM 1371 OD1 ASP A 131 -19.396 -7.468 6.208 1.00 64.55 O ATOM 1372 OD2 ASP A 131 -18.094 -6.747 7.824 1.00 32.32 O ATOM 0 H ASP A 131 -15.590 -9.427 4.653 1.00 51.45 H new ATOM 0 HA ASP A 131 -16.163 -9.032 7.493 1.00 42.33 H new ATOM 0 HB2 ASP A 131 -16.250 -7.081 6.051 1.00 24.44 H new ATOM 0 HB3 ASP A 131 -17.298 -7.899 4.909 1.00 24.44 H new ATOM 1376 N TRP A 132 -18.109 -10.694 5.412 1.00 33.13 N ATOM 1377 CA TRP A 132 -19.210 -11.648 5.344 1.00 63.31 C ATOM 1378 C TRP A 132 -18.843 -12.844 4.473 1.00 23.22 C ATOM 1379 O TRP A 132 -18.746 -13.970 4.959 1.00 34.13 O ATOM 1380 CB TRP A 132 -20.466 -10.968 4.795 1.00 3.34 C ATOM 1381 CG TRP A 132 -21.739 -11.552 5.331 1.00 23.22 C ATOM 1382 CD1 TRP A 132 -22.388 -12.662 4.873 1.00 33.30 C ATOM 1383 CD2 TRP A 132 -22.516 -11.053 6.426 1.00 72.14 C ATOM 1384 NE1 TRP A 132 -23.522 -12.884 5.617 1.00 75.04 N ATOM 1385 CE2 TRP A 132 -23.623 -11.911 6.575 1.00 72.01 C ATOM 1386 CE3 TRP A 132 -22.384 -9.966 7.294 1.00 14.11 C ATOM 1387 CZ2 TRP A 132 -24.590 -11.714 7.557 1.00 25.12 C ATOM 1388 CZ3 TRP A 132 -23.345 -9.771 8.268 1.00 50.31 C ATOM 1389 CH2 TRP A 132 -24.436 -10.642 8.394 1.00 62.02 C ATOM 0 H TRP A 132 -17.668 -10.495 4.514 1.00 33.13 H new ATOM 0 HA TRP A 132 -19.410 -12.007 6.354 1.00 63.31 H new ATOM 0 HB2 TRP A 132 -20.431 -9.906 5.038 1.00 3.34 H new ATOM 0 HB3 TRP A 132 -20.468 -11.047 3.708 1.00 3.34 H new ATOM 0 HD1 TRP A 132 -22.059 -13.276 4.047 1.00 33.30 H new ATOM 0 HE1 TRP A 132 -24.182 -13.650 5.478 1.00 75.04 H new ATOM 0 HE3 TRP A 132 -21.546 -9.290 7.205 1.00 14.11 H new ATOM 0 HZ2 TRP A 132 -25.432 -12.383 7.655 1.00 25.12 H new ATOM 0 HZ3 TRP A 132 -23.254 -8.933 8.944 1.00 50.31 H new ATOM 0 HH2 TRP A 132 -25.169 -10.464 9.167 1.00 62.02 H new ATOM 1399 N SER A 133 -18.638 -12.591 3.185 1.00 52.11 N ATOM 1400 CA SER A 133 -18.285 -13.649 2.245 1.00 20.35 C ATOM 1401 C SER A 133 -17.031 -13.279 1.457 1.00 22.22 C ATOM 1402 O SER A 133 -17.104 -12.946 0.275 1.00 51.11 O ATOM 1403 CB SER A 133 -19.444 -13.915 1.284 1.00 53.10 C ATOM 1404 OG SER A 133 -20.432 -14.731 1.891 1.00 71.54 O ATOM 0 H SER A 133 -18.710 -11.663 2.768 1.00 52.11 H new ATOM 0 HA SER A 133 -18.081 -14.555 2.816 1.00 20.35 H new ATOM 0 HB2 SER A 133 -19.889 -12.969 0.975 1.00 53.10 H new ATOM 0 HB3 SER A 133 -19.070 -14.401 0.383 1.00 53.10 H new ATOM 0 HG SER A 133 -21.163 -14.885 1.257 1.00 71.54 H new ATOM 1409 N ASP A 134 -15.883 -13.341 2.123 1.00 64.24 N ATOM 1410 CA ASP A 134 -14.612 -13.013 1.486 1.00 23.34 C ATOM 1411 C ASP A 134 -14.679 -11.647 0.810 1.00 52.14 C ATOM 1412 O ASP A 134 -14.279 -11.494 -0.344 1.00 74.15 O ATOM 1413 CB ASP A 134 -14.239 -14.086 0.461 1.00 43.52 C ATOM 1414 CG ASP A 134 -14.580 -15.484 0.938 1.00 53.35 C ATOM 1415 OD1 ASP A 134 -15.184 -16.248 0.155 1.00 5.15 O ATOM 1416 OD2 ASP A 134 -14.240 -15.816 2.093 1.00 44.31 O ATOM 0 H ASP A 134 -15.806 -13.615 3.103 1.00 64.24 H new ATOM 0 HA ASP A 134 -13.845 -12.978 2.259 1.00 23.34 H new ATOM 0 HB2 ASP A 134 -14.761 -13.887 -0.475 1.00 43.52 H new ATOM 0 HB3 ASP A 134 -13.171 -14.027 0.250 1.00 43.52 H new ATOM 1420 N LYS A 135 -15.188 -10.658 1.535 1.00 51.01 N ATOM 1421 CA LYS A 135 -15.308 -9.304 1.007 1.00 63.01 C ATOM 1422 C LYS A 135 -14.274 -8.379 1.640 1.00 11.03 C ATOM 1423 O LYS A 135 -13.632 -8.735 2.627 1.00 1.04 O ATOM 1424 CB LYS A 135 -16.716 -8.759 1.257 1.00 54.51 C ATOM 1425 CG LYS A 135 -17.821 -9.697 0.801 1.00 74.24 C ATOM 1426 CD LYS A 135 -19.197 -9.109 1.066 1.00 33.12 C ATOM 1427 CE LYS A 135 -19.422 -8.864 2.549 1.00 2.15 C ATOM 1428 NZ LYS A 135 -19.401 -7.412 2.883 1.00 34.21 N ATOM 0 H LYS A 135 -15.525 -10.768 2.491 1.00 51.01 H new ATOM 0 HA LYS A 135 -15.126 -9.343 -0.067 1.00 63.01 H new ATOM 0 HB2 LYS A 135 -16.836 -8.560 2.322 1.00 54.51 H new ATOM 0 HB3 LYS A 135 -16.824 -7.805 0.741 1.00 54.51 H new ATOM 0 HG2 LYS A 135 -17.710 -9.900 -0.264 1.00 74.24 H new ATOM 0 HG3 LYS A 135 -17.726 -10.651 1.319 1.00 74.24 H new ATOM 0 HD2 LYS A 135 -19.304 -8.171 0.521 1.00 33.12 H new ATOM 0 HD3 LYS A 135 -19.962 -9.787 0.688 1.00 33.12 H new ATOM 0 HE2 LYS A 135 -20.380 -9.291 2.846 1.00 2.15 H new ATOM 0 HE3 LYS A 135 -18.652 -9.379 3.123 1.00 2.15 H new ATOM 0 HZ1 LYS A 135 -19.405 -7.293 3.916 1.00 34.21 H new ATOM 0 HZ2 LYS A 135 -18.543 -6.977 2.488 1.00 34.21 H new ATOM 0 HZ3 LYS A 135 -20.241 -6.951 2.478 1.00 34.21 H new ATOM 1438 N ALA A 136 -14.120 -7.190 1.067 1.00 12.54 N ATOM 1439 CA ALA A 136 -13.167 -6.213 1.578 1.00 21.45 C ATOM 1440 C ALA A 136 -13.874 -4.940 2.032 1.00 13.52 C ATOM 1441 O ALA A 136 -14.588 -4.304 1.255 1.00 11.40 O ATOM 1442 CB ALA A 136 -12.123 -5.890 0.519 1.00 31.14 C ATOM 0 H ALA A 136 -14.643 -6.880 0.248 1.00 12.54 H new ATOM 0 HA ALA A 136 -12.668 -6.648 2.444 1.00 21.45 H new ATOM 0 HB1 ALA A 136 -11.418 -5.159 0.914 1.00 31.14 H new ATOM 0 HB2 ALA A 136 -11.588 -6.800 0.246 1.00 31.14 H new ATOM 0 HB3 ALA A 136 -12.614 -5.480 -0.363 1.00 31.14 H new ATOM 1448 N LEU A 137 -13.673 -4.576 3.294 1.00 45.04 N ATOM 1449 CA LEU A 137 -14.294 -3.378 3.851 1.00 11.23 C ATOM 1450 C LEU A 137 -13.289 -2.233 3.934 1.00 51.41 C ATOM 1451 O LEU A 137 -12.190 -2.393 4.465 1.00 12.32 O ATOM 1452 CB LEU A 137 -14.861 -3.674 5.240 1.00 4.43 C ATOM 1453 CG LEU A 137 -16.325 -3.291 5.463 1.00 42.13 C ATOM 1454 CD1 LEU A 137 -16.563 -1.842 5.067 1.00 40.55 C ATOM 1455 CD2 LEU A 137 -17.245 -4.218 4.680 1.00 33.35 C ATOM 0 H LEU A 137 -13.086 -5.092 3.950 1.00 45.04 H new ATOM 0 HA LEU A 137 -15.106 -3.078 3.189 1.00 11.23 H new ATOM 0 HB2 LEU A 137 -14.752 -4.741 5.435 1.00 4.43 H new ATOM 0 HB3 LEU A 137 -14.253 -3.151 5.978 1.00 4.43 H new ATOM 0 HG LEU A 137 -16.551 -3.399 6.524 1.00 42.13 H new ATOM 0 HD11 LEU A 137 -17.610 -1.587 5.232 1.00 40.55 H new ATOM 0 HD12 LEU A 137 -15.931 -1.191 5.671 1.00 40.55 H new ATOM 0 HD13 LEU A 137 -16.319 -1.708 4.013 1.00 40.55 H new ATOM 0 HD21 LEU A 137 -18.282 -3.930 4.851 1.00 33.35 H new ATOM 0 HD22 LEU A 137 -17.018 -4.143 3.617 1.00 33.35 H new ATOM 0 HD23 LEU A 137 -17.094 -5.245 5.011 1.00 33.35 H new ATOM 1466 N LYS A 138 -13.675 -1.076 3.405 1.00 3.24 N ATOM 1467 CA LYS A 138 -12.811 0.098 3.422 1.00 40.32 C ATOM 1468 C LYS A 138 -13.571 1.326 3.914 1.00 3.35 C ATOM 1469 O LYS A 138 -14.532 1.767 3.282 1.00 31.24 O ATOM 1470 CB LYS A 138 -12.248 0.361 2.024 1.00 20.52 C ATOM 1471 CG LYS A 138 -13.284 0.253 0.920 1.00 70.31 C ATOM 1472 CD LYS A 138 -13.244 1.460 -0.003 1.00 55.22 C ATOM 1473 CE LYS A 138 -12.150 1.324 -1.051 1.00 12.43 C ATOM 1474 NZ LYS A 138 -12.637 1.687 -2.411 1.00 52.52 N ATOM 0 H LYS A 138 -14.580 -0.927 2.959 1.00 3.24 H new ATOM 0 HA LYS A 138 -11.988 -0.097 4.109 1.00 40.32 H new ATOM 0 HB2 LYS A 138 -11.807 1.358 2.001 1.00 20.52 H new ATOM 0 HB3 LYS A 138 -11.444 -0.348 1.826 1.00 20.52 H new ATOM 0 HG2 LYS A 138 -13.108 -0.654 0.342 1.00 70.31 H new ATOM 0 HG3 LYS A 138 -14.277 0.163 1.360 1.00 70.31 H new ATOM 0 HD2 LYS A 138 -14.209 1.575 -0.496 1.00 55.22 H new ATOM 0 HD3 LYS A 138 -13.077 2.363 0.584 1.00 55.22 H new ATOM 0 HE2 LYS A 138 -11.309 1.964 -0.783 1.00 12.43 H new ATOM 0 HE3 LYS A 138 -11.780 0.299 -1.059 1.00 12.43 H new ATOM 0 HZ1 LYS A 138 -11.862 1.581 -3.097 1.00 52.52 H new ATOM 0 HZ2 LYS A 138 -13.423 1.060 -2.677 1.00 52.52 H new ATOM 0 HZ3 LYS A 138 -12.966 2.673 -2.410 1.00 52.52 H new ATOM 1484 N ILE A 139 -13.134 1.873 5.043 1.00 40.01 N ATOM 1485 CA ILE A 139 -13.772 3.052 5.618 1.00 12.31 C ATOM 1486 C ILE A 139 -12.735 4.025 6.169 1.00 74.22 C ATOM 1487 O ILE A 139 -11.680 3.615 6.652 1.00 2.05 O ATOM 1488 CB ILE A 139 -14.750 2.669 6.744 1.00 42.11 C ATOM 1489 CG1 ILE A 139 -15.561 3.891 7.182 1.00 52.44 C ATOM 1490 CG2 ILE A 139 -13.993 2.079 7.925 1.00 73.05 C ATOM 1491 CD1 ILE A 139 -16.581 3.585 8.256 1.00 71.32 C ATOM 0 H ILE A 139 -12.341 1.519 5.578 1.00 40.01 H new ATOM 0 HA ILE A 139 -14.327 3.535 4.814 1.00 12.31 H new ATOM 0 HB ILE A 139 -15.440 1.915 6.365 1.00 42.11 H new ATOM 0 HG12 ILE A 139 -14.878 4.658 7.548 1.00 52.44 H new ATOM 0 HG13 ILE A 139 -16.073 4.308 6.314 1.00 52.44 H new ATOM 0 HG21 ILE A 139 -14.698 1.813 8.713 1.00 73.05 H new ATOM 0 HG22 ILE A 139 -13.455 1.187 7.603 1.00 73.05 H new ATOM 0 HG23 ILE A 139 -13.283 2.813 8.306 1.00 73.05 H new ATOM 0 HD11 ILE A 139 -17.119 4.496 8.518 1.00 71.32 H new ATOM 0 HD12 ILE A 139 -17.287 2.841 7.886 1.00 71.32 H new ATOM 0 HD13 ILE A 139 -16.074 3.197 9.139 1.00 71.32 H new ATOM 1502 N ASP A 140 -13.043 5.315 6.091 1.00 12.30 N ATOM 1503 CA ASP A 140 -12.139 6.347 6.585 1.00 3.10 C ATOM 1504 C ASP A 140 -12.657 6.943 7.890 1.00 32.35 C ATOM 1505 O ASP A 140 -13.760 7.487 7.943 1.00 33.25 O ATOM 1506 CB ASP A 140 -11.971 7.450 5.538 1.00 1.31 C ATOM 1507 CG ASP A 140 -11.161 8.622 6.058 1.00 41.25 C ATOM 1508 OD1 ASP A 140 -10.441 8.446 7.062 1.00 40.15 O ATOM 1509 OD2 ASP A 140 -11.250 9.715 5.460 1.00 34.32 O ATOM 0 H ASP A 140 -13.911 5.671 5.691 1.00 12.30 H new ATOM 0 HA ASP A 140 -11.170 5.886 6.776 1.00 3.10 H new ATOM 0 HB2 ASP A 140 -11.483 7.038 4.655 1.00 1.31 H new ATOM 0 HB3 ASP A 140 -12.954 7.802 5.224 1.00 1.31 H new ATOM 1513 N LEU A 141 -11.852 6.835 8.943 1.00 72.14 N ATOM 1514 CA LEU A 141 -12.228 7.362 10.250 1.00 1.55 C ATOM 1515 C LEU A 141 -11.309 8.508 10.660 1.00 24.22 C ATOM 1516 O LEU A 141 -10.127 8.521 10.319 1.00 54.13 O ATOM 1517 CB LEU A 141 -12.180 6.253 11.303 1.00 74.54 C ATOM 1518 CG LEU A 141 -12.296 6.703 12.759 1.00 23.10 C ATOM 1519 CD1 LEU A 141 -13.020 5.653 13.586 1.00 30.13 C ATOM 1520 CD2 LEU A 141 -10.920 6.989 13.340 1.00 23.53 C ATOM 0 H LEU A 141 -10.936 6.388 8.916 1.00 72.14 H new ATOM 0 HA LEU A 141 -13.246 7.744 10.180 1.00 1.55 H new ATOM 0 HB2 LEU A 141 -12.986 5.549 11.096 1.00 74.54 H new ATOM 0 HB3 LEU A 141 -11.243 5.709 11.186 1.00 74.54 H new ATOM 0 HG LEU A 141 -12.879 7.624 12.790 1.00 23.10 H new ATOM 0 HD11 LEU A 141 -13.093 5.991 14.620 1.00 30.13 H new ATOM 0 HD12 LEU A 141 -14.021 5.499 13.183 1.00 30.13 H new ATOM 0 HD13 LEU A 141 -12.466 4.715 13.549 1.00 30.13 H new ATOM 0 HD21 LEU A 141 -11.022 7.308 14.377 1.00 23.53 H new ATOM 0 HD22 LEU A 141 -10.312 6.086 13.297 1.00 23.53 H new ATOM 0 HD23 LEU A 141 -10.438 7.779 12.763 1.00 23.53 H new ATOM 1531 N MET A 142 -11.860 9.467 11.396 1.00 65.32 N ATOM 1532 CA MET A 142 -11.089 10.617 11.856 1.00 15.23 C ATOM 1533 C MET A 142 -10.978 10.623 13.377 1.00 20.11 C ATOM 1534 O MET A 142 -11.828 10.087 14.088 1.00 14.05 O ATOM 1535 CB MET A 142 -11.734 11.917 11.374 1.00 0.22 C ATOM 1536 CG MET A 142 -12.175 11.875 9.920 1.00 12.42 C ATOM 1537 SD MET A 142 -12.526 13.512 9.253 1.00 42.15 S ATOM 1538 CE MET A 142 -13.495 14.220 10.583 1.00 32.54 C ATOM 0 H MET A 142 -12.838 9.471 11.687 1.00 65.32 H new ATOM 0 HA MET A 142 -10.086 10.542 11.437 1.00 15.23 H new ATOM 0 HB2 MET A 142 -12.598 12.138 12.001 1.00 0.22 H new ATOM 0 HB3 MET A 142 -11.026 12.735 11.507 1.00 0.22 H new ATOM 0 HG2 MET A 142 -11.396 11.403 9.322 1.00 12.42 H new ATOM 0 HG3 MET A 142 -13.066 11.253 9.832 1.00 12.42 H new ATOM 0 HE1 MET A 142 -14.049 15.082 10.211 1.00 32.54 H new ATOM 0 HE2 MET A 142 -14.195 13.474 10.960 1.00 32.54 H new ATOM 0 HE3 MET A 142 -12.832 14.536 11.388 1.00 32.54 H new ATOM 1546 N PRO A 143 -9.906 11.244 13.890 1.00 31.33 N ATOM 1547 CA PRO A 143 -9.658 11.336 15.332 1.00 3.32 C ATOM 1548 C PRO A 143 -10.650 12.259 16.033 1.00 13.33 C ATOM 1549 O PRO A 143 -11.246 13.136 15.407 1.00 1.33 O ATOM 1550 CB PRO A 143 -8.242 11.912 15.414 1.00 42.32 C ATOM 1551 CG PRO A 143 -8.064 12.660 14.138 1.00 74.52 C ATOM 1552 CD PRO A 143 -8.852 11.906 13.102 1.00 71.11 C ATOM 0 HA PRO A 143 -9.769 10.371 15.826 1.00 3.32 H new ATOM 0 HB2 PRO A 143 -8.131 12.569 16.277 1.00 42.32 H new ATOM 0 HB3 PRO A 143 -7.498 11.122 15.517 1.00 42.32 H new ATOM 0 HG2 PRO A 143 -8.424 13.684 14.233 1.00 74.52 H new ATOM 0 HG3 PRO A 143 -7.011 12.716 13.862 1.00 74.52 H new ATOM 0 HD2 PRO A 143 -9.272 12.575 12.351 1.00 71.11 H new ATOM 0 HD3 PRO A 143 -8.231 11.183 12.573 1.00 71.11 H new ATOM 1557 N HIS A 144 -10.822 12.055 17.336 1.00 52.03 N ATOM 1558 CA HIS A 144 -11.741 12.870 18.122 1.00 73.02 C ATOM 1559 C HIS A 144 -11.213 14.293 18.274 1.00 13.13 C ATOM 1560 O HIS A 144 -10.004 14.520 18.258 1.00 74.23 O ATOM 1561 CB HIS A 144 -11.960 12.245 19.500 1.00 55.20 C ATOM 1562 CG HIS A 144 -10.689 12.001 20.254 1.00 2.13 C ATOM 1563 ND1 HIS A 144 -9.952 13.012 20.833 1.00 1.12 N ATOM 1564 CD2 HIS A 144 -10.027 10.851 20.526 1.00 44.10 C ATOM 1565 CE1 HIS A 144 -8.890 12.495 21.426 1.00 23.31 C ATOM 1566 NE2 HIS A 144 -8.912 11.186 21.255 1.00 51.45 N ATOM 0 H HIS A 144 -10.337 11.333 17.869 1.00 52.03 H new ATOM 0 HA HIS A 144 -12.694 12.910 17.594 1.00 73.02 H new ATOM 0 HB2 HIS A 144 -12.603 12.899 20.089 1.00 55.20 H new ATOM 0 HB3 HIS A 144 -12.490 11.300 19.382 1.00 55.20 H new ATOM 0 HD2 HIS A 144 -10.321 9.856 20.226 1.00 44.10 H new ATOM 0 HE1 HIS A 144 -8.132 13.049 21.960 1.00 23.31 H new ATOM 0 HE2 HIS A 144 -8.215 10.530 21.607 1.00 51.45 H new ATOM 1930 N THR A 169 -16.462 10.831 8.106 1.00 1.32 N ATOM 1931 CA THR A 169 -16.292 11.258 6.723 1.00 23.14 C ATOM 1932 C THR A 169 -17.057 10.348 5.768 1.00 12.14 C ATOM 1933 O THR A 169 -16.607 10.081 4.655 1.00 61.32 O ATOM 1934 CB THR A 169 -14.806 11.273 6.319 1.00 62.23 C ATOM 1935 OG1 THR A 169 -14.662 11.820 5.003 1.00 50.41 O ATOM 1936 CG2 THR A 169 -14.220 9.870 6.357 1.00 22.53 C ATOM 0 HA THR A 169 -16.691 12.270 6.654 1.00 23.14 H new ATOM 0 HB THR A 169 -14.265 11.895 7.032 1.00 62.23 H new ATOM 0 HG1 THR A 169 -15.273 11.361 4.389 1.00 50.41 H new ATOM 0 HG21 THR A 169 -13.170 9.906 6.068 1.00 22.53 H new ATOM 0 HG22 THR A 169 -14.305 9.468 7.366 1.00 22.53 H new ATOM 0 HG23 THR A 169 -14.765 9.229 5.664 1.00 22.53 H new ATOM 1944 N GLY A 170 -18.218 9.875 6.212 1.00 74.20 N ATOM 1945 CA GLY A 170 -19.027 9.000 5.384 1.00 23.01 C ATOM 1946 C GLY A 170 -19.057 7.575 5.901 1.00 64.25 C ATOM 1947 O GLY A 170 -18.253 7.183 6.746 1.00 1.53 O ATOM 0 H GLY A 170 -18.612 10.082 7.130 1.00 74.20 H new ATOM 0 HA2 GLY A 170 -20.045 9.388 5.338 1.00 23.01 H new ATOM 0 HA3 GLY A 170 -18.637 9.006 4.366 1.00 23.01 H new ATOM 1951 N PRO A 171 -20.003 6.776 5.389 1.00 1.40 N ATOM 1952 CA PRO A 171 -20.159 5.374 5.791 1.00 34.31 C ATOM 1953 C PRO A 171 -19.013 4.498 5.295 1.00 22.40 C ATOM 1954 O PRO A 171 -18.018 4.999 4.771 1.00 25.43 O ATOM 1955 CB PRO A 171 -21.474 4.958 5.127 1.00 23.24 C ATOM 1956 CG PRO A 171 -21.615 5.872 3.959 1.00 31.04 C ATOM 1957 CD PRO A 171 -20.996 7.177 4.377 1.00 12.24 C ATOM 0 HA PRO A 171 -20.158 5.259 6.875 1.00 34.31 H new ATOM 0 HB2 PRO A 171 -21.446 3.915 4.812 1.00 23.24 H new ATOM 0 HB3 PRO A 171 -22.314 5.061 5.814 1.00 23.24 H new ATOM 0 HG2 PRO A 171 -21.112 5.465 3.082 1.00 31.04 H new ATOM 0 HG3 PRO A 171 -22.663 6.005 3.692 1.00 31.04 H new ATOM 0 HD2 PRO A 171 -20.528 7.687 3.535 1.00 12.24 H new ATOM 0 HD3 PRO A 171 -21.738 7.859 4.791 1.00 12.24 H new ATOM 1962 N ALA A 172 -19.159 3.189 5.464 1.00 10.12 N ATOM 1963 CA ALA A 172 -18.137 2.244 5.031 1.00 22.11 C ATOM 1964 C ALA A 172 -18.466 1.671 3.657 1.00 32.42 C ATOM 1965 O ALA A 172 -19.633 1.533 3.294 1.00 52.32 O ATOM 1966 CB ALA A 172 -17.987 1.124 6.051 1.00 51.54 C ATOM 0 H ALA A 172 -19.975 2.758 5.898 1.00 10.12 H new ATOM 0 HA ALA A 172 -17.191 2.780 4.955 1.00 22.11 H new ATOM 0 HB1 ALA A 172 -17.221 0.426 5.715 1.00 51.54 H new ATOM 0 HB2 ALA A 172 -17.697 1.545 7.014 1.00 51.54 H new ATOM 0 HB3 ALA A 172 -18.936 0.598 6.156 1.00 51.54 H new ATOM 1972 N VAL A 173 -17.427 1.340 2.895 1.00 50.42 N ATOM 1973 CA VAL A 173 -17.606 0.781 1.561 1.00 72.55 C ATOM 1974 C VAL A 173 -17.241 -0.699 1.531 1.00 35.41 C ATOM 1975 O VAL A 173 -16.121 -1.078 1.873 1.00 70.53 O ATOM 1976 CB VAL A 173 -16.753 1.530 0.520 1.00 21.32 C ATOM 1977 CG1 VAL A 173 -16.923 0.909 -0.858 1.00 53.31 C ATOM 1978 CG2 VAL A 173 -17.118 3.007 0.497 1.00 74.24 C ATOM 0 H VAL A 173 -16.454 1.450 3.179 1.00 50.42 H new ATOM 0 HA VAL A 173 -18.660 0.897 1.308 1.00 72.55 H new ATOM 0 HB VAL A 173 -15.704 1.442 0.804 1.00 21.32 H new ATOM 0 HG11 VAL A 173 -16.313 1.452 -1.580 1.00 53.31 H new ATOM 0 HG12 VAL A 173 -16.608 -0.134 -0.828 1.00 53.31 H new ATOM 0 HG13 VAL A 173 -17.970 0.963 -1.155 1.00 53.31 H new ATOM 0 HG21 VAL A 173 -16.506 3.522 -0.244 1.00 74.24 H new ATOM 0 HG22 VAL A 173 -18.171 3.118 0.238 1.00 74.24 H new ATOM 0 HG23 VAL A 173 -16.939 3.441 1.480 1.00 74.24 H new ATOM 1988 N GLU A 174 -18.192 -1.530 1.118 1.00 42.03 N ATOM 1989 CA GLU A 174 -17.969 -2.969 1.044 1.00 54.13 C ATOM 1990 C GLU A 174 -17.872 -3.431 -0.408 1.00 22.30 C ATOM 1991 O GLU A 174 -18.764 -3.170 -1.215 1.00 65.04 O ATOM 1992 CB GLU A 174 -19.098 -3.720 1.754 1.00 21.31 C ATOM 1993 CG GLU A 174 -20.484 -3.208 1.403 1.00 62.02 C ATOM 1994 CD GLU A 174 -21.526 -4.309 1.391 1.00 0.52 C ATOM 1995 OE1 GLU A 174 -21.849 -4.835 2.477 1.00 71.40 O ATOM 1996 OE2 GLU A 174 -22.020 -4.647 0.294 1.00 70.23 O ATOM 0 H GLU A 174 -19.124 -1.232 0.830 1.00 42.03 H new ATOM 0 HA GLU A 174 -17.025 -3.190 1.542 1.00 54.13 H new ATOM 0 HB2 GLU A 174 -19.035 -4.778 1.499 1.00 21.31 H new ATOM 0 HB3 GLU A 174 -18.953 -3.642 2.832 1.00 21.31 H new ATOM 0 HG2 GLU A 174 -20.777 -2.443 2.122 1.00 62.02 H new ATOM 0 HG3 GLU A 174 -20.454 -2.731 0.424 1.00 62.02 H new ATOM 2001 N VAL A 175 -16.782 -4.117 -0.733 1.00 30.45 N ATOM 2002 CA VAL A 175 -16.567 -4.615 -2.086 1.00 14.30 C ATOM 2003 C VAL A 175 -15.743 -5.898 -2.075 1.00 13.12 C ATOM 2004 O VAL A 175 -14.761 -6.011 -1.340 1.00 71.34 O ATOM 2005 CB VAL A 175 -15.856 -3.569 -2.963 1.00 64.32 C ATOM 2006 CG1 VAL A 175 -15.611 -4.120 -4.359 1.00 73.13 C ATOM 2007 CG2 VAL A 175 -16.668 -2.284 -3.024 1.00 23.21 C ATOM 0 H VAL A 175 -16.033 -4.341 -0.077 1.00 30.45 H new ATOM 0 HA VAL A 175 -17.551 -4.822 -2.507 1.00 14.30 H new ATOM 0 HB VAL A 175 -14.890 -3.341 -2.513 1.00 64.32 H new ATOM 0 HG11 VAL A 175 -15.108 -3.366 -4.964 1.00 73.13 H new ATOM 0 HG12 VAL A 175 -14.986 -5.010 -4.294 1.00 73.13 H new ATOM 0 HG13 VAL A 175 -16.564 -4.379 -4.820 1.00 73.13 H new ATOM 0 HG21 VAL A 175 -16.150 -1.556 -3.648 1.00 23.21 H new ATOM 0 HG22 VAL A 175 -17.650 -2.494 -3.449 1.00 23.21 H new ATOM 0 HG23 VAL A 175 -16.787 -1.881 -2.018 1.00 23.21 H new ATOM 2017 N ASP A 176 -16.148 -6.863 -2.893 1.00 50.02 N ATOM 2018 CA ASP A 176 -15.446 -8.138 -2.979 1.00 73.22 C ATOM 2019 C ASP A 176 -13.959 -7.922 -3.245 1.00 54.54 C ATOM 2020 O ASP A 176 -13.580 -7.095 -4.073 1.00 62.54 O ATOM 2021 CB ASP A 176 -16.054 -9.006 -4.082 1.00 33.13 C ATOM 2022 CG ASP A 176 -17.481 -9.414 -3.776 1.00 43.42 C ATOM 2023 OD1 ASP A 176 -18.371 -8.539 -3.817 1.00 74.25 O ATOM 2024 OD2 ASP A 176 -17.710 -10.609 -3.495 1.00 13.01 O ATOM 0 H ASP A 176 -16.959 -6.786 -3.506 1.00 50.02 H new ATOM 0 HA ASP A 176 -15.555 -8.651 -2.023 1.00 73.22 H new ATOM 0 HB2 ASP A 176 -16.029 -8.460 -5.025 1.00 33.13 H new ATOM 0 HB3 ASP A 176 -15.444 -9.900 -4.215 1.00 33.13 H new ATOM 2028 N VAL A 177 -13.122 -8.674 -2.538 1.00 20.05 N ATOM 2029 CA VAL A 177 -11.676 -8.565 -2.697 1.00 41.25 C ATOM 2030 C VAL A 177 -11.276 -8.669 -4.165 1.00 14.15 C ATOM 2031 O VAL A 177 -10.335 -8.013 -4.611 1.00 55.34 O ATOM 2032 CB VAL A 177 -10.940 -9.656 -1.897 1.00 1.13 C ATOM 2033 CG1 VAL A 177 -11.090 -9.414 -0.402 1.00 55.34 C ATOM 2034 CG2 VAL A 177 -11.457 -11.035 -2.277 1.00 35.41 C ATOM 0 H VAL A 177 -13.420 -9.365 -1.850 1.00 20.05 H new ATOM 0 HA VAL A 177 -11.387 -7.587 -2.313 1.00 41.25 H new ATOM 0 HB VAL A 177 -9.879 -9.611 -2.144 1.00 1.13 H new ATOM 0 HG11 VAL A 177 -10.564 -10.194 0.148 1.00 55.34 H new ATOM 0 HG12 VAL A 177 -10.667 -8.442 -0.147 1.00 55.34 H new ATOM 0 HG13 VAL A 177 -12.147 -9.432 -0.135 1.00 55.34 H new ATOM 0 HG21 VAL A 177 -10.926 -11.794 -1.702 1.00 35.41 H new ATOM 0 HG22 VAL A 177 -12.524 -11.096 -2.060 1.00 35.41 H new ATOM 0 HG23 VAL A 177 -11.293 -11.205 -3.341 1.00 35.41 H new ATOM 2044 N LYS A 178 -11.998 -9.499 -4.911 1.00 20.42 N ATOM 2045 CA LYS A 178 -11.720 -9.690 -6.330 1.00 44.02 C ATOM 2046 C LYS A 178 -12.238 -8.510 -7.149 1.00 14.24 C ATOM 2047 O LYS A 178 -11.627 -8.117 -8.142 1.00 23.43 O ATOM 2048 CB LYS A 178 -12.359 -10.988 -6.826 1.00 4.22 C ATOM 2049 CG LYS A 178 -13.868 -11.031 -6.649 1.00 23.43 C ATOM 2050 CD LYS A 178 -14.368 -12.453 -6.467 1.00 41.43 C ATOM 2051 CE LYS A 178 -15.823 -12.590 -6.891 1.00 2.34 C ATOM 2052 NZ LYS A 178 -16.757 -12.271 -5.775 1.00 61.03 N ATOM 0 H LYS A 178 -12.780 -10.050 -4.557 1.00 20.42 H new ATOM 0 HA LYS A 178 -10.639 -9.753 -6.458 1.00 44.02 H new ATOM 0 HB2 LYS A 178 -12.122 -11.119 -7.882 1.00 4.22 H new ATOM 0 HB3 LYS A 178 -11.915 -11.828 -6.292 1.00 4.22 H new ATOM 0 HG2 LYS A 178 -14.151 -10.432 -5.784 1.00 23.43 H new ATOM 0 HG3 LYS A 178 -14.350 -10.583 -7.518 1.00 23.43 H new ATOM 0 HD2 LYS A 178 -13.751 -13.135 -7.053 1.00 41.43 H new ATOM 0 HD3 LYS A 178 -14.263 -12.746 -5.422 1.00 41.43 H new ATOM 0 HE2 LYS A 178 -16.021 -11.925 -7.732 1.00 2.34 H new ATOM 0 HE3 LYS A 178 -16.006 -13.607 -7.239 1.00 2.34 H new ATOM 0 HZ1 LYS A 178 -17.738 -12.326 -6.117 1.00 61.03 H new ATOM 0 HZ2 LYS A 178 -16.621 -12.954 -5.002 1.00 61.03 H new ATOM 0 HZ3 LYS A 178 -16.566 -11.310 -5.426 1.00 61.03 H new ATOM 2062 N ASP A 179 -13.366 -7.952 -6.724 1.00 60.34 N ATOM 2063 CA ASP A 179 -13.964 -6.816 -7.416 1.00 53.32 C ATOM 2064 C ASP A 179 -13.034 -5.608 -7.383 1.00 31.14 C ATOM 2065 O ASP A 179 -12.773 -4.985 -8.413 1.00 63.11 O ATOM 2066 CB ASP A 179 -15.309 -6.457 -6.784 1.00 22.14 C ATOM 2067 CG ASP A 179 -16.436 -7.344 -7.277 1.00 34.00 C ATOM 2068 OD1 ASP A 179 -16.292 -7.936 -8.367 1.00 22.51 O ATOM 2069 OD2 ASP A 179 -17.461 -7.446 -6.572 1.00 54.41 O ATOM 0 H ASP A 179 -13.885 -8.267 -5.904 1.00 60.34 H new ATOM 0 HA ASP A 179 -14.124 -7.100 -8.456 1.00 53.32 H new ATOM 0 HB2 ASP A 179 -15.232 -6.541 -5.700 1.00 22.14 H new ATOM 0 HB3 ASP A 179 -15.546 -5.417 -7.007 1.00 22.14 H new ATOM 2073 N ILE A 180 -12.537 -5.283 -6.195 1.00 25.14 N ATOM 2074 CA ILE A 180 -11.635 -4.149 -6.027 1.00 51.34 C ATOM 2075 C ILE A 180 -10.353 -4.345 -6.827 1.00 73.44 C ATOM 2076 O ILE A 180 -9.939 -5.467 -7.121 1.00 12.11 O ATOM 2077 CB ILE A 180 -11.275 -3.929 -4.546 1.00 55.55 C ATOM 2078 CG1 ILE A 180 -10.805 -5.241 -3.913 1.00 63.44 C ATOM 2079 CG2 ILE A 180 -12.470 -3.367 -3.789 1.00 31.22 C ATOM 2080 CD1 ILE A 180 -10.110 -5.054 -2.583 1.00 62.51 C ATOM 0 H ILE A 180 -12.743 -5.789 -5.334 1.00 25.14 H new ATOM 0 HA ILE A 180 -12.161 -3.269 -6.398 1.00 51.34 H new ATOM 0 HB ILE A 180 -10.460 -3.207 -4.488 1.00 55.55 H new ATOM 0 HG12 ILE A 180 -11.664 -5.897 -3.776 1.00 63.44 H new ATOM 0 HG13 ILE A 180 -10.126 -5.744 -4.601 1.00 63.44 H new ATOM 0 HG21 ILE A 180 -12.201 -3.217 -2.744 1.00 31.22 H new ATOM 0 HG22 ILE A 180 -12.764 -2.414 -4.229 1.00 31.22 H new ATOM 0 HG23 ILE A 180 -13.303 -4.067 -3.852 1.00 31.22 H new ATOM 0 HD11 ILE A 180 -9.804 -6.025 -2.193 1.00 62.51 H new ATOM 0 HD12 ILE A 180 -9.231 -4.424 -2.717 1.00 62.51 H new ATOM 0 HD13 ILE A 180 -10.793 -4.579 -1.879 1.00 62.51 H new