USER MOD reduce.3.24.130724 H: found=0, std=0, add=797, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 794 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 79 SER OG : rot 169:sc= -1.32 USER MOD Set 1.2: A 99 TYR OH : rot 0:sc= -0.412 USER MOD Set 2.1: A 73 GLN : amide:sc= -0.0237 X(o=-0.024,f=-0.081) USER MOD Set 2.2: A 100 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 26 ASN : amide:sc= -1.84 K(o=-3.7,f=-5.2!) USER MOD Set 3.2: A 35 ASN : amide:sc= -1.82 K(o=-3.7,f=-1.5!) USER MOD Set 4.1: A 5 SER OG : rot 61:sc= 0.749 USER MOD Set 4.2: A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ -114:sc= 0.131 (180deg=0) USER MOD Single : A 2 SER OG : rot 46:sc= 1.18 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 MET CE :methyl 147:sc= -1.65 (180deg=-2.57!) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 173:sc= 0.228 (180deg=0.153) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 HIS : no HE2:sc= -2.5! C(o=-1.6!,f=-6.9!) USER MOD Single : A 37 CYS SG : rot -87:sc= -4.6! USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 162:sc= 0.651 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 50 ASN : amide:sc= 0.0146 X(o=0.015,f=0) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 ASN : amide:sc= -4.94 K(o=-4.9,f=-6.1!) USER MOD Single : A 57 GLN : amide:sc= -0.783 K(o=-0.78,f=-3.5!) USER MOD Single : A 61 MET CE :methyl -163:sc= -1.39 (180deg=-2.77) USER MOD Single : A 63 SER OG : rot 68:sc= 0.893 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 89 ASN : amide:sc= -0.461 K(o=-0.46,f=-3.5!) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 54:sc= 0.964 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -19.618 -5.800 1.741 1.00 0.00 N ATOM 2 CA GLY A 1 -19.043 -4.491 1.998 1.00 0.00 C ATOM 3 C GLY A 1 -17.649 -4.616 2.616 1.00 0.00 C ATOM 4 O GLY A 1 -17.209 -5.716 2.947 1.00 0.00 O ATOM 0 H1 GLY A 1 -19.721 -5.939 0.715 1.00 0.00 H new ATOM 0 H2 GLY A 1 -18.994 -6.536 2.129 1.00 0.00 H new ATOM 0 H3 GLY A 1 -20.552 -5.864 2.194 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -18.983 -3.927 1.067 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -19.693 -3.930 2.669 1.00 0.00 H new ATOM 8 N SER A 2 -16.992 -3.473 2.752 1.00 0.00 N ATOM 9 CA SER A 2 -15.657 -3.441 3.325 1.00 0.00 C ATOM 10 C SER A 2 -15.737 -3.145 4.824 1.00 0.00 C ATOM 11 O SER A 2 -15.651 -1.990 5.237 1.00 0.00 O ATOM 12 CB SER A 2 -14.783 -2.399 2.624 1.00 0.00 C ATOM 13 OG SER A 2 -15.248 -1.071 2.851 1.00 0.00 O ATOM 0 H SER A 2 -17.359 -2.563 2.475 1.00 0.00 H new ATOM 0 HA SER A 2 -15.198 -4.419 3.179 1.00 0.00 H new ATOM 0 HB2 SER A 2 -13.756 -2.489 2.979 1.00 0.00 H new ATOM 0 HB3 SER A 2 -14.769 -2.600 1.553 1.00 0.00 H new ATOM 0 HG SER A 2 -15.452 -0.954 3.802 1.00 0.00 H new ATOM 19 N SER A 3 -15.900 -4.209 5.596 1.00 0.00 N ATOM 20 CA SER A 3 -15.993 -4.078 7.040 1.00 0.00 C ATOM 21 C SER A 3 -14.783 -4.740 7.704 1.00 0.00 C ATOM 22 O SER A 3 -14.005 -5.425 7.042 1.00 0.00 O ATOM 23 CB SER A 3 -17.290 -4.694 7.567 1.00 0.00 C ATOM 24 OG SER A 3 -17.620 -4.213 8.868 1.00 0.00 O ATOM 0 H SER A 3 -15.970 -5.166 5.249 1.00 0.00 H new ATOM 0 HA SER A 3 -16.000 -3.016 7.287 1.00 0.00 H new ATOM 0 HB2 SER A 3 -18.105 -4.467 6.879 1.00 0.00 H new ATOM 0 HB3 SER A 3 -17.190 -5.779 7.596 1.00 0.00 H new ATOM 0 HG SER A 3 -18.455 -4.629 9.168 1.00 0.00 H new ATOM 30 N GLY A 4 -14.664 -4.512 9.004 1.00 0.00 N ATOM 31 CA GLY A 4 -13.562 -5.077 9.765 1.00 0.00 C ATOM 32 C GLY A 4 -12.260 -5.026 8.964 1.00 0.00 C ATOM 33 O GLY A 4 -11.668 -6.063 8.668 1.00 0.00 O ATOM 0 H GLY A 4 -15.312 -3.944 9.550 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -13.441 -4.528 10.699 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -13.790 -6.109 10.030 1.00 0.00 H new ATOM 37 N SER A 5 -11.851 -3.809 8.635 1.00 0.00 N ATOM 38 CA SER A 5 -10.630 -3.610 7.874 1.00 0.00 C ATOM 39 C SER A 5 -9.913 -2.348 8.357 1.00 0.00 C ATOM 40 O SER A 5 -8.793 -2.420 8.862 1.00 0.00 O ATOM 41 CB SER A 5 -10.924 -3.513 6.376 1.00 0.00 C ATOM 42 OG SER A 5 -11.900 -4.464 5.961 1.00 0.00 O ATOM 0 H SER A 5 -12.344 -2.951 8.882 1.00 0.00 H new ATOM 0 HA SER A 5 -9.983 -4.472 8.034 1.00 0.00 H new ATOM 0 HB2 SER A 5 -11.274 -2.508 6.140 1.00 0.00 H new ATOM 0 HB3 SER A 5 -10.003 -3.670 5.815 1.00 0.00 H new ATOM 0 HG SER A 5 -12.742 -4.296 6.434 1.00 0.00 H new ATOM 48 N SER A 6 -10.587 -1.220 8.186 1.00 0.00 N ATOM 49 CA SER A 6 -10.028 0.056 8.598 1.00 0.00 C ATOM 50 C SER A 6 -8.557 0.140 8.187 1.00 0.00 C ATOM 51 O SER A 6 -7.668 -0.154 8.985 1.00 0.00 O ATOM 52 CB SER A 6 -10.170 0.258 10.108 1.00 0.00 C ATOM 53 OG SER A 6 -11.349 0.985 10.441 1.00 0.00 O ATOM 0 H SER A 6 -11.515 -1.164 7.768 1.00 0.00 H new ATOM 0 HA SER A 6 -10.584 0.850 8.099 1.00 0.00 H new ATOM 0 HB2 SER A 6 -10.191 -0.713 10.603 1.00 0.00 H new ATOM 0 HB3 SER A 6 -9.297 0.790 10.486 1.00 0.00 H new ATOM 0 HG SER A 6 -11.404 1.091 11.414 1.00 0.00 H new ATOM 59 N GLY A 7 -8.345 0.544 6.943 1.00 0.00 N ATOM 60 CA GLY A 7 -6.996 0.670 6.417 1.00 0.00 C ATOM 61 C GLY A 7 -6.842 -0.110 5.110 1.00 0.00 C ATOM 62 O GLY A 7 -7.017 0.446 4.027 1.00 0.00 O ATOM 0 H GLY A 7 -9.084 0.788 6.284 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -6.765 1.722 6.246 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -6.280 0.301 7.151 1.00 0.00 H new ATOM 66 N LEU A 8 -6.516 -1.386 5.255 1.00 0.00 N ATOM 67 CA LEU A 8 -6.337 -2.248 4.100 1.00 0.00 C ATOM 68 C LEU A 8 -7.465 -1.994 3.098 1.00 0.00 C ATOM 69 O LEU A 8 -7.216 -1.564 1.973 1.00 0.00 O ATOM 70 CB LEU A 8 -6.219 -3.710 4.535 1.00 0.00 C ATOM 71 CG LEU A 8 -4.881 -4.121 5.151 1.00 0.00 C ATOM 72 CD1 LEU A 8 -4.455 -3.139 6.244 1.00 0.00 C ATOM 73 CD2 LEU A 8 -4.932 -5.562 5.664 1.00 0.00 C ATOM 0 H LEU A 8 -6.371 -1.843 6.155 1.00 0.00 H new ATOM 0 HA LEU A 8 -5.401 -2.014 3.593 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -7.008 -3.918 5.258 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -6.406 -4.343 3.667 1.00 0.00 H new ATOM 0 HG LEU A 8 -4.121 -4.084 4.370 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -3.501 -3.455 6.665 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -4.351 -2.142 5.817 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -5.210 -3.120 7.030 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -3.968 -5.828 6.097 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -5.708 -5.650 6.424 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -5.157 -6.235 4.837 1.00 0.00 H new ATOM 85 N GLY A 9 -8.682 -2.270 3.544 1.00 0.00 N ATOM 86 CA GLY A 9 -9.849 -2.076 2.701 1.00 0.00 C ATOM 87 C GLY A 9 -9.662 -0.874 1.773 1.00 0.00 C ATOM 88 O GLY A 9 -9.461 -1.038 0.571 1.00 0.00 O ATOM 0 H GLY A 9 -8.885 -2.626 4.478 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -10.027 -2.973 2.108 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -10.731 -1.925 3.324 1.00 0.00 H new ATOM 92 N ALA A 10 -9.735 0.309 2.367 1.00 0.00 N ATOM 93 CA ALA A 10 -9.577 1.538 1.609 1.00 0.00 C ATOM 94 C ALA A 10 -8.414 1.380 0.627 1.00 0.00 C ATOM 95 O ALA A 10 -8.563 1.644 -0.565 1.00 0.00 O ATOM 96 CB ALA A 10 -9.371 2.709 2.572 1.00 0.00 C ATOM 0 H ALA A 10 -9.901 0.442 3.365 1.00 0.00 H new ATOM 0 HA ALA A 10 -10.474 1.748 1.027 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -9.252 3.631 2.003 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -10.236 2.796 3.229 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -8.477 2.535 3.171 1.00 0.00 H new ATOM 102 N LEU A 11 -7.282 0.949 1.164 1.00 0.00 N ATOM 103 CA LEU A 11 -6.094 0.753 0.350 1.00 0.00 C ATOM 104 C LEU A 11 -6.423 -0.196 -0.804 1.00 0.00 C ATOM 105 O LEU A 11 -6.235 0.149 -1.969 1.00 0.00 O ATOM 106 CB LEU A 11 -4.922 0.286 1.216 1.00 0.00 C ATOM 107 CG LEU A 11 -4.128 -0.908 0.682 1.00 0.00 C ATOM 108 CD1 LEU A 11 -3.390 -0.543 -0.607 1.00 0.00 C ATOM 109 CD2 LEU A 11 -3.180 -1.457 1.750 1.00 0.00 C ATOM 0 H LEU A 11 -7.162 0.730 2.153 1.00 0.00 H new ATOM 0 HA LEU A 11 -5.776 1.696 -0.094 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -4.237 1.123 1.347 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -5.305 0.030 2.204 1.00 0.00 H new ATOM 0 HG LEU A 11 -4.831 -1.704 0.436 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -2.834 -1.409 -0.965 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -4.111 -0.236 -1.365 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -2.699 0.277 -0.411 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -2.628 -2.305 1.345 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -2.480 -0.678 2.050 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -3.756 -1.780 2.617 1.00 0.00 H new ATOM 121 N TYR A 12 -6.910 -1.374 -0.439 1.00 0.00 N ATOM 122 CA TYR A 12 -7.267 -2.375 -1.429 1.00 0.00 C ATOM 123 C TYR A 12 -8.202 -1.789 -2.489 1.00 0.00 C ATOM 124 O TYR A 12 -7.979 -1.968 -3.685 1.00 0.00 O ATOM 125 CB TYR A 12 -8.005 -3.477 -0.667 1.00 0.00 C ATOM 126 CG TYR A 12 -8.555 -4.591 -1.561 1.00 0.00 C ATOM 127 CD1 TYR A 12 -7.709 -5.276 -2.409 1.00 0.00 C ATOM 128 CD2 TYR A 12 -9.897 -4.910 -1.519 1.00 0.00 C ATOM 129 CE1 TYR A 12 -8.226 -6.324 -3.250 1.00 0.00 C ATOM 130 CE2 TYR A 12 -10.414 -5.958 -2.360 1.00 0.00 C ATOM 131 CZ TYR A 12 -9.553 -6.613 -3.184 1.00 0.00 C ATOM 132 OH TYR A 12 -10.041 -7.603 -3.978 1.00 0.00 O ATOM 0 H TYR A 12 -7.065 -1.657 0.529 1.00 0.00 H new ATOM 0 HA TYR A 12 -6.378 -2.744 -1.940 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -7.327 -3.915 0.066 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -8.830 -3.031 -0.111 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -6.659 -5.026 -2.442 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -10.559 -4.374 -0.855 1.00 0.00 H new ATOM 0 HE1 TYR A 12 -7.575 -6.868 -3.918 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -11.462 -6.218 -2.337 1.00 0.00 H new ATOM 0 HH TYR A 12 -11.004 -7.701 -3.825 1.00 0.00 H new ATOM 142 N LEU A 13 -9.228 -1.101 -2.011 1.00 0.00 N ATOM 143 CA LEU A 13 -10.198 -0.488 -2.903 1.00 0.00 C ATOM 144 C LEU A 13 -9.460 0.290 -3.994 1.00 0.00 C ATOM 145 O LEU A 13 -9.860 0.265 -5.157 1.00 0.00 O ATOM 146 CB LEU A 13 -11.194 0.360 -2.109 1.00 0.00 C ATOM 147 CG LEU A 13 -12.295 -0.409 -1.376 1.00 0.00 C ATOM 148 CD1 LEU A 13 -13.088 0.517 -0.452 1.00 0.00 C ATOM 149 CD2 LEU A 13 -13.201 -1.145 -2.366 1.00 0.00 C ATOM 0 H LEU A 13 -9.409 -0.954 -1.018 1.00 0.00 H new ATOM 0 HA LEU A 13 -10.793 -1.252 -3.403 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -10.639 0.946 -1.377 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -11.665 1.067 -2.792 1.00 0.00 H new ATOM 0 HG LEU A 13 -11.824 -1.165 -0.747 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -13.864 -0.054 0.057 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -12.417 0.956 0.287 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -13.549 1.311 -1.040 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -13.975 -1.684 -1.820 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -13.666 -0.424 -3.038 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -12.608 -1.852 -2.946 1.00 0.00 H new ATOM 161 N SER A 14 -8.396 0.963 -3.580 1.00 0.00 N ATOM 162 CA SER A 14 -7.599 1.747 -4.508 1.00 0.00 C ATOM 163 C SER A 14 -6.863 0.821 -5.478 1.00 0.00 C ATOM 164 O SER A 14 -6.898 1.030 -6.690 1.00 0.00 O ATOM 165 CB SER A 14 -6.602 2.636 -3.763 1.00 0.00 C ATOM 166 OG SER A 14 -6.930 4.018 -3.876 1.00 0.00 O ATOM 0 H SER A 14 -8.068 0.981 -2.614 1.00 0.00 H new ATOM 0 HA SER A 14 -8.270 2.394 -5.073 1.00 0.00 H new ATOM 0 HB2 SER A 14 -6.581 2.353 -2.710 1.00 0.00 H new ATOM 0 HB3 SER A 14 -5.600 2.468 -4.159 1.00 0.00 H new ATOM 0 HG SER A 14 -6.271 4.552 -3.385 1.00 0.00 H new ATOM 172 N MET A 15 -6.213 -0.184 -4.908 1.00 0.00 N ATOM 173 CA MET A 15 -5.469 -1.143 -5.707 1.00 0.00 C ATOM 174 C MET A 15 -6.311 -1.650 -6.880 1.00 0.00 C ATOM 175 O MET A 15 -5.771 -2.119 -7.880 1.00 0.00 O ATOM 176 CB MET A 15 -5.052 -2.324 -4.829 1.00 0.00 C ATOM 177 CG MET A 15 -3.971 -1.909 -3.829 1.00 0.00 C ATOM 178 SD MET A 15 -3.594 -3.270 -2.737 1.00 0.00 S ATOM 179 CE MET A 15 -1.811 -3.230 -2.796 1.00 0.00 C ATOM 0 H MET A 15 -6.186 -0.355 -3.903 1.00 0.00 H new ATOM 0 HA MET A 15 -4.585 -0.646 -6.107 1.00 0.00 H new ATOM 0 HB2 MET A 15 -5.920 -2.708 -4.293 1.00 0.00 H new ATOM 0 HB3 MET A 15 -4.681 -3.135 -5.456 1.00 0.00 H new ATOM 0 HG2 MET A 15 -3.072 -1.599 -4.361 1.00 0.00 H new ATOM 0 HG3 MET A 15 -4.310 -1.050 -3.250 1.00 0.00 H new ATOM 0 HE1 MET A 15 -1.408 -3.541 -1.832 1.00 0.00 H new ATOM 0 HE2 MET A 15 -1.457 -3.908 -3.573 1.00 0.00 H new ATOM 0 HE3 MET A 15 -1.477 -2.217 -3.019 1.00 0.00 H new ATOM 189 N LYS A 16 -7.622 -1.539 -6.717 1.00 0.00 N ATOM 190 CA LYS A 16 -8.544 -1.980 -7.749 1.00 0.00 C ATOM 191 C LYS A 16 -8.439 -1.045 -8.955 1.00 0.00 C ATOM 192 O LYS A 16 -8.425 -1.499 -10.098 1.00 0.00 O ATOM 193 CB LYS A 16 -9.962 -2.100 -7.186 1.00 0.00 C ATOM 194 CG LYS A 16 -10.020 -3.138 -6.063 1.00 0.00 C ATOM 195 CD LYS A 16 -11.277 -4.002 -6.180 1.00 0.00 C ATOM 196 CE LYS A 16 -12.413 -3.435 -5.326 1.00 0.00 C ATOM 197 NZ LYS A 16 -13.480 -2.877 -6.186 1.00 0.00 N ATOM 0 H LYS A 16 -8.067 -1.150 -5.886 1.00 0.00 H new ATOM 0 HA LYS A 16 -8.278 -2.979 -8.095 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -10.290 -1.132 -6.808 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -10.651 -2.382 -7.982 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -9.134 -3.772 -6.102 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -10.009 -2.634 -5.096 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -11.592 -4.053 -7.222 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -11.053 -5.021 -5.864 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -12.824 -4.219 -4.690 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -12.027 -2.658 -4.666 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -14.243 -2.497 -5.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -13.088 -2.115 -6.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -13.860 -3.627 -6.798 1.00 0.00 H new ATOM 211 N ASP A 17 -8.367 0.245 -8.659 1.00 0.00 N ATOM 212 CA ASP A 17 -8.263 1.248 -9.705 1.00 0.00 C ATOM 213 C ASP A 17 -7.045 0.943 -10.579 1.00 0.00 C ATOM 214 O ASP A 17 -5.909 1.007 -10.111 1.00 0.00 O ATOM 215 CB ASP A 17 -8.082 2.646 -9.111 1.00 0.00 C ATOM 216 CG ASP A 17 -8.754 3.774 -9.896 1.00 0.00 C ATOM 217 OD1 ASP A 17 -8.279 4.046 -11.019 1.00 0.00 O ATOM 218 OD2 ASP A 17 -9.729 4.339 -9.354 1.00 0.00 O ATOM 0 H ASP A 17 -8.379 0.618 -7.710 1.00 0.00 H new ATOM 0 HA ASP A 17 -9.182 1.222 -10.290 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -8.476 2.646 -8.095 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -7.015 2.859 -9.040 1.00 0.00 H new ATOM 223 N PRO A 18 -7.330 0.611 -11.867 1.00 0.00 N ATOM 224 CA PRO A 18 -6.270 0.296 -12.810 1.00 0.00 C ATOM 225 C PRO A 18 -5.544 1.565 -13.262 1.00 0.00 C ATOM 226 O PRO A 18 -4.600 1.497 -14.047 1.00 0.00 O ATOM 227 CB PRO A 18 -6.963 -0.430 -13.952 1.00 0.00 C ATOM 228 CG PRO A 18 -8.439 -0.088 -13.829 1.00 0.00 C ATOM 229 CD PRO A 18 -8.663 0.525 -12.456 1.00 0.00 C ATOM 0 HA PRO A 18 -5.490 -0.328 -12.374 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -6.567 -0.110 -14.916 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -6.805 -1.506 -13.884 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -8.735 0.610 -14.612 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -9.050 -0.983 -13.952 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -9.127 1.509 -12.532 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -9.325 -0.093 -11.849 1.00 0.00 H new ATOM 237 N GLU A 19 -6.013 2.692 -12.747 1.00 0.00 N ATOM 238 CA GLU A 19 -5.420 3.974 -13.088 1.00 0.00 C ATOM 239 C GLU A 19 -4.873 4.656 -11.832 1.00 0.00 C ATOM 240 O GLU A 19 -3.704 5.034 -11.786 1.00 0.00 O ATOM 241 CB GLU A 19 -6.430 4.872 -13.805 1.00 0.00 C ATOM 242 CG GLU A 19 -6.368 4.667 -15.320 1.00 0.00 C ATOM 243 CD GLU A 19 -6.707 5.961 -16.063 1.00 0.00 C ATOM 244 OE1 GLU A 19 -7.686 6.616 -15.644 1.00 0.00 O ATOM 245 OE2 GLU A 19 -5.980 6.266 -17.032 1.00 0.00 O ATOM 0 H GLU A 19 -6.797 2.744 -12.096 1.00 0.00 H new ATOM 0 HA GLU A 19 -4.590 3.799 -13.773 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -7.436 4.653 -13.446 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -6.227 5.916 -13.567 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -5.371 4.331 -15.605 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -7.065 3.882 -15.613 1.00 0.00 H new ATOM 252 N LYS A 20 -5.746 4.793 -10.845 1.00 0.00 N ATOM 253 CA LYS A 20 -5.366 5.424 -9.592 1.00 0.00 C ATOM 254 C LYS A 20 -4.971 4.344 -8.582 1.00 0.00 C ATOM 255 O LYS A 20 -4.885 4.612 -7.384 1.00 0.00 O ATOM 256 CB LYS A 20 -6.479 6.350 -9.099 1.00 0.00 C ATOM 257 CG LYS A 20 -6.545 7.625 -9.943 1.00 0.00 C ATOM 258 CD LYS A 20 -6.511 8.872 -9.056 1.00 0.00 C ATOM 259 CE LYS A 20 -7.356 9.996 -9.660 1.00 0.00 C ATOM 260 NZ LYS A 20 -7.824 10.918 -8.600 1.00 0.00 N ATOM 0 H LYS A 20 -6.715 4.478 -10.887 1.00 0.00 H new ATOM 0 HA LYS A 20 -4.494 6.062 -9.735 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -7.436 5.830 -9.143 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -6.305 6.609 -8.055 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -5.708 7.647 -10.640 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -7.457 7.624 -10.540 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -6.884 8.626 -8.062 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -5.482 9.210 -8.936 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -6.769 10.546 -10.396 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -8.212 9.573 -10.187 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -8.396 11.675 -9.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -8.402 10.393 -7.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -7.004 11.335 -8.115 1.00 0.00 H new ATOM 274 N GLY A 21 -4.743 3.147 -9.102 1.00 0.00 N ATOM 275 CA GLY A 21 -4.360 2.026 -8.260 1.00 0.00 C ATOM 276 C GLY A 21 -3.254 1.200 -8.918 1.00 0.00 C ATOM 277 O GLY A 21 -2.503 1.710 -9.749 1.00 0.00 O ATOM 0 H GLY A 21 -4.816 2.929 -10.096 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -4.018 2.393 -7.292 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -5.228 1.394 -8.072 1.00 0.00 H new ATOM 281 N ILE A 22 -3.187 -0.063 -8.522 1.00 0.00 N ATOM 282 CA ILE A 22 -2.184 -0.965 -9.063 1.00 0.00 C ATOM 283 C ILE A 22 -2.540 -1.306 -10.511 1.00 0.00 C ATOM 284 O ILE A 22 -3.707 -1.258 -10.895 1.00 0.00 O ATOM 285 CB ILE A 22 -2.027 -2.192 -8.163 1.00 0.00 C ATOM 286 CG1 ILE A 22 -0.640 -2.223 -7.516 1.00 0.00 C ATOM 287 CG2 ILE A 22 -2.329 -3.479 -8.933 1.00 0.00 C ATOM 288 CD1 ILE A 22 -0.568 -3.292 -6.424 1.00 0.00 C ATOM 0 H ILE A 22 -3.811 -0.483 -7.833 1.00 0.00 H new ATOM 0 HA ILE A 22 -1.206 -0.483 -9.080 1.00 0.00 H new ATOM 0 HB ILE A 22 -2.757 -2.120 -7.357 1.00 0.00 H new ATOM 0 HG12 ILE A 22 0.115 -2.423 -8.276 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -0.412 -1.246 -7.089 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -2.210 -4.336 -8.270 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -3.353 -3.448 -9.306 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -1.640 -3.571 -9.772 1.00 0.00 H new ATOM 0 HD11 ILE A 22 0.428 -3.293 -5.981 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -1.308 -3.075 -5.654 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -0.772 -4.270 -6.859 1.00 0.00 H new ATOM 300 N LYS A 23 -1.512 -1.644 -11.276 1.00 0.00 N ATOM 301 CA LYS A 23 -1.701 -1.993 -12.673 1.00 0.00 C ATOM 302 C LYS A 23 -1.911 -3.504 -12.793 1.00 0.00 C ATOM 303 O LYS A 23 -1.522 -4.261 -11.905 1.00 0.00 O ATOM 304 CB LYS A 23 -0.541 -1.465 -13.519 1.00 0.00 C ATOM 305 CG LYS A 23 -0.814 -0.037 -13.995 1.00 0.00 C ATOM 306 CD LYS A 23 -0.402 0.143 -15.457 1.00 0.00 C ATOM 307 CE LYS A 23 1.090 0.460 -15.571 1.00 0.00 C ATOM 308 NZ LYS A 23 1.314 1.557 -16.540 1.00 0.00 N ATOM 0 H LYS A 23 -0.545 -1.683 -10.954 1.00 0.00 H new ATOM 0 HA LYS A 23 -2.597 -1.514 -13.067 1.00 0.00 H new ATOM 0 HB2 LYS A 23 0.379 -1.488 -12.935 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -0.388 -2.116 -14.380 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -1.874 0.191 -13.882 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -0.267 0.669 -13.370 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -0.628 -0.765 -16.017 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -0.984 0.948 -15.906 1.00 0.00 H new ATOM 0 HE2 LYS A 23 1.483 0.743 -14.595 1.00 0.00 H new ATOM 0 HE3 LYS A 23 1.634 -0.430 -15.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 2.332 1.760 -16.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 0.957 1.273 -17.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 0.811 2.410 -16.221 1.00 0.00 H new ATOM 322 N GLU A 24 -2.527 -3.898 -13.898 1.00 0.00 N ATOM 323 CA GLU A 24 -2.794 -5.304 -14.145 1.00 0.00 C ATOM 324 C GLU A 24 -2.060 -5.771 -15.404 1.00 0.00 C ATOM 325 O GLU A 24 -2.439 -5.411 -16.518 1.00 0.00 O ATOM 326 CB GLU A 24 -4.297 -5.565 -14.259 1.00 0.00 C ATOM 327 CG GLU A 24 -4.992 -5.367 -12.910 1.00 0.00 C ATOM 328 CD GLU A 24 -6.078 -6.422 -12.692 1.00 0.00 C ATOM 329 OE1 GLU A 24 -6.918 -6.569 -13.606 1.00 0.00 O ATOM 330 OE2 GLU A 24 -6.044 -7.059 -11.617 1.00 0.00 O ATOM 0 H GLU A 24 -2.849 -3.267 -14.632 1.00 0.00 H new ATOM 0 HA GLU A 24 -2.422 -5.878 -13.297 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -4.732 -4.892 -14.998 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -4.467 -6.581 -14.614 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -4.258 -5.425 -12.107 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -5.434 -4.371 -12.867 1.00 0.00 H new ATOM 337 N LEU A 25 -1.022 -6.564 -15.185 1.00 0.00 N ATOM 338 CA LEU A 25 -0.231 -7.084 -16.288 1.00 0.00 C ATOM 339 C LEU A 25 -0.395 -8.603 -16.357 1.00 0.00 C ATOM 340 O LEU A 25 -0.961 -9.212 -15.449 1.00 0.00 O ATOM 341 CB LEU A 25 1.224 -6.627 -16.166 1.00 0.00 C ATOM 342 CG LEU A 25 1.455 -5.114 -16.170 1.00 0.00 C ATOM 343 CD1 LEU A 25 0.930 -4.483 -17.461 1.00 0.00 C ATOM 344 CD2 LEU A 25 0.846 -4.464 -14.926 1.00 0.00 C ATOM 0 H LEU A 25 -0.710 -6.859 -14.260 1.00 0.00 H new ATOM 0 HA LEU A 25 -0.589 -6.682 -17.236 1.00 0.00 H new ATOM 0 HB2 LEU A 25 1.636 -7.035 -15.243 1.00 0.00 H new ATOM 0 HB3 LEU A 25 1.791 -7.063 -16.988 1.00 0.00 H new ATOM 0 HG LEU A 25 2.529 -4.932 -16.136 1.00 0.00 H new ATOM 0 HD11 LEU A 25 1.106 -3.408 -17.438 1.00 0.00 H new ATOM 0 HD12 LEU A 25 1.448 -4.918 -18.316 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -0.140 -4.673 -17.550 1.00 0.00 H new ATOM 0 HD21 LEU A 25 1.024 -3.389 -14.953 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -0.227 -4.654 -14.905 1.00 0.00 H new ATOM 0 HD23 LEU A 25 1.307 -4.886 -14.033 1.00 0.00 H new ATOM 356 N ASN A 26 0.110 -9.173 -17.441 1.00 0.00 N ATOM 357 CA ASN A 26 0.026 -10.610 -17.639 1.00 0.00 C ATOM 358 C ASN A 26 1.425 -11.218 -17.522 1.00 0.00 C ATOM 359 O ASN A 26 2.330 -10.851 -18.270 1.00 0.00 O ATOM 360 CB ASN A 26 -0.519 -10.943 -19.029 1.00 0.00 C ATOM 361 CG ASN A 26 -1.963 -10.461 -19.182 1.00 0.00 C ATOM 362 OD1 ASN A 26 -2.915 -11.201 -18.996 1.00 0.00 O ATOM 363 ND2 ASN A 26 -2.073 -9.182 -19.529 1.00 0.00 N ATOM 0 H ASN A 26 0.579 -8.666 -18.191 1.00 0.00 H new ATOM 0 HA ASN A 26 -0.644 -11.017 -16.882 1.00 0.00 H new ATOM 0 HB2 ASN A 26 0.106 -10.476 -19.790 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -0.472 -12.019 -19.194 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -2.995 -8.765 -19.655 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -1.235 -8.618 -19.669 1.00 0.00 H new ATOM 370 N LEU A 27 1.558 -12.139 -16.578 1.00 0.00 N ATOM 371 CA LEU A 27 2.832 -12.802 -16.354 1.00 0.00 C ATOM 372 C LEU A 27 2.694 -14.288 -16.689 1.00 0.00 C ATOM 373 O LEU A 27 1.595 -14.838 -16.649 1.00 0.00 O ATOM 374 CB LEU A 27 3.331 -12.536 -14.932 1.00 0.00 C ATOM 375 CG LEU A 27 3.213 -11.092 -14.439 1.00 0.00 C ATOM 376 CD1 LEU A 27 2.640 -11.042 -13.021 1.00 0.00 C ATOM 377 CD2 LEU A 27 4.557 -10.367 -14.540 1.00 0.00 C ATOM 0 H LEU A 27 0.805 -12.441 -15.960 1.00 0.00 H new ATOM 0 HA LEU A 27 3.596 -12.395 -17.017 1.00 0.00 H new ATOM 0 HB2 LEU A 27 2.777 -13.179 -14.248 1.00 0.00 H new ATOM 0 HB3 LEU A 27 4.378 -12.835 -14.874 1.00 0.00 H new ATOM 0 HG LEU A 27 2.513 -10.565 -15.088 1.00 0.00 H new ATOM 0 HD11 LEU A 27 2.567 -10.005 -12.695 1.00 0.00 H new ATOM 0 HD12 LEU A 27 1.649 -11.496 -13.013 1.00 0.00 H new ATOM 0 HD13 LEU A 27 3.296 -11.590 -12.344 1.00 0.00 H new ATOM 0 HD21 LEU A 27 4.446 -9.343 -14.184 1.00 0.00 H new ATOM 0 HD22 LEU A 27 5.297 -10.885 -13.930 1.00 0.00 H new ATOM 0 HD23 LEU A 27 4.887 -10.356 -15.579 1.00 0.00 H new ATOM 389 N GLU A 28 3.826 -14.896 -17.014 1.00 0.00 N ATOM 390 CA GLU A 28 3.845 -16.308 -17.356 1.00 0.00 C ATOM 391 C GLU A 28 4.922 -17.035 -16.549 1.00 0.00 C ATOM 392 O GLU A 28 6.019 -16.512 -16.357 1.00 0.00 O ATOM 393 CB GLU A 28 4.059 -16.505 -18.858 1.00 0.00 C ATOM 394 CG GLU A 28 4.031 -17.990 -19.226 1.00 0.00 C ATOM 395 CD GLU A 28 3.376 -18.204 -20.592 1.00 0.00 C ATOM 396 OE1 GLU A 28 3.600 -17.344 -21.470 1.00 0.00 O ATOM 397 OE2 GLU A 28 2.665 -19.223 -20.726 1.00 0.00 O ATOM 0 H GLU A 28 4.736 -14.437 -17.048 1.00 0.00 H new ATOM 0 HA GLU A 28 2.876 -16.737 -17.101 1.00 0.00 H new ATOM 0 HB2 GLU A 28 3.284 -15.975 -19.412 1.00 0.00 H new ATOM 0 HB3 GLU A 28 5.015 -16.072 -19.153 1.00 0.00 H new ATOM 0 HG2 GLU A 28 5.047 -18.384 -19.240 1.00 0.00 H new ATOM 0 HG3 GLU A 28 3.484 -18.547 -18.465 1.00 0.00 H new ATOM 404 N LYS A 29 4.572 -18.231 -16.097 1.00 0.00 N ATOM 405 CA LYS A 29 5.495 -19.035 -15.315 1.00 0.00 C ATOM 406 C LYS A 29 5.340 -20.506 -15.704 1.00 0.00 C ATOM 407 O LYS A 29 4.328 -21.131 -15.391 1.00 0.00 O ATOM 408 CB LYS A 29 5.302 -18.771 -13.820 1.00 0.00 C ATOM 409 CG LYS A 29 6.243 -19.640 -12.984 1.00 0.00 C ATOM 410 CD LYS A 29 7.398 -18.812 -12.419 1.00 0.00 C ATOM 411 CE LYS A 29 7.463 -18.929 -10.894 1.00 0.00 C ATOM 412 NZ LYS A 29 7.018 -17.670 -10.258 1.00 0.00 N ATOM 0 H LYS A 29 3.662 -18.662 -16.258 1.00 0.00 H new ATOM 0 HA LYS A 29 6.525 -18.754 -15.535 1.00 0.00 H new ATOM 0 HB2 LYS A 29 5.487 -17.718 -13.606 1.00 0.00 H new ATOM 0 HB3 LYS A 29 4.268 -18.976 -13.541 1.00 0.00 H new ATOM 0 HG2 LYS A 29 5.688 -20.101 -12.167 1.00 0.00 H new ATOM 0 HG3 LYS A 29 6.638 -20.449 -13.598 1.00 0.00 H new ATOM 0 HD2 LYS A 29 8.339 -19.150 -12.854 1.00 0.00 H new ATOM 0 HD3 LYS A 29 7.273 -17.767 -12.702 1.00 0.00 H new ATOM 0 HE2 LYS A 29 6.834 -19.754 -10.560 1.00 0.00 H new ATOM 0 HE3 LYS A 29 8.482 -19.159 -10.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 6.955 -17.804 -9.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 7.702 -16.915 -10.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 6.084 -17.404 -10.630 1.00 0.00 H new ATOM 426 N ASP A 30 6.357 -21.017 -16.383 1.00 0.00 N ATOM 427 CA ASP A 30 6.346 -22.403 -16.818 1.00 0.00 C ATOM 428 C ASP A 30 5.271 -22.587 -17.892 1.00 0.00 C ATOM 429 O ASP A 30 5.586 -22.745 -19.070 1.00 0.00 O ATOM 430 CB ASP A 30 6.019 -23.343 -15.656 1.00 0.00 C ATOM 431 CG ASP A 30 7.126 -24.337 -15.298 1.00 0.00 C ATOM 432 OD1 ASP A 30 8.252 -24.138 -15.803 1.00 0.00 O ATOM 433 OD2 ASP A 30 6.820 -25.272 -14.528 1.00 0.00 O ATOM 0 H ASP A 30 7.194 -20.495 -16.642 1.00 0.00 H new ATOM 0 HA ASP A 30 7.336 -22.642 -17.207 1.00 0.00 H new ATOM 0 HB2 ASP A 30 5.792 -22.742 -14.775 1.00 0.00 H new ATOM 0 HB3 ASP A 30 5.116 -23.901 -15.903 1.00 0.00 H new ATOM 438 N LYS A 31 4.023 -22.559 -17.445 1.00 0.00 N ATOM 439 CA LYS A 31 2.900 -22.721 -18.353 1.00 0.00 C ATOM 440 C LYS A 31 1.623 -22.227 -17.670 1.00 0.00 C ATOM 441 O LYS A 31 0.571 -22.853 -17.787 1.00 0.00 O ATOM 442 CB LYS A 31 2.814 -24.167 -18.846 1.00 0.00 C ATOM 443 CG LYS A 31 3.350 -24.292 -20.274 1.00 0.00 C ATOM 444 CD LYS A 31 2.713 -25.481 -20.996 1.00 0.00 C ATOM 445 CE LYS A 31 3.783 -26.392 -21.601 1.00 0.00 C ATOM 446 NZ LYS A 31 3.304 -27.791 -21.652 1.00 0.00 N ATOM 0 H LYS A 31 3.766 -22.427 -16.467 1.00 0.00 H new ATOM 0 HA LYS A 31 3.041 -22.112 -19.246 1.00 0.00 H new ATOM 0 HB2 LYS A 31 3.384 -24.816 -18.182 1.00 0.00 H new ATOM 0 HB3 LYS A 31 1.779 -24.506 -18.811 1.00 0.00 H new ATOM 0 HG2 LYS A 31 3.144 -23.374 -20.825 1.00 0.00 H new ATOM 0 HG3 LYS A 31 4.433 -24.414 -20.251 1.00 0.00 H new ATOM 0 HD2 LYS A 31 2.099 -26.049 -20.297 1.00 0.00 H new ATOM 0 HD3 LYS A 31 2.050 -25.121 -21.782 1.00 0.00 H new ATOM 0 HE2 LYS A 31 4.034 -26.051 -22.605 1.00 0.00 H new ATOM 0 HE3 LYS A 31 4.695 -26.335 -21.007 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 4.042 -28.396 -22.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 3.087 -28.119 -20.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 2.446 -27.843 -22.237 1.00 0.00 H new ATOM 460 N LYS A 32 1.758 -21.109 -16.972 1.00 0.00 N ATOM 461 CA LYS A 32 0.628 -20.524 -16.271 1.00 0.00 C ATOM 462 C LYS A 32 0.580 -19.021 -16.553 1.00 0.00 C ATOM 463 O LYS A 32 1.320 -18.248 -15.946 1.00 0.00 O ATOM 464 CB LYS A 32 0.686 -20.868 -14.781 1.00 0.00 C ATOM 465 CG LYS A 32 0.626 -22.382 -14.565 1.00 0.00 C ATOM 466 CD LYS A 32 1.844 -22.872 -13.781 1.00 0.00 C ATOM 467 CE LYS A 32 1.462 -23.236 -12.345 1.00 0.00 C ATOM 468 NZ LYS A 32 2.666 -23.596 -11.563 1.00 0.00 N ATOM 0 H LYS A 32 2.633 -20.593 -16.877 1.00 0.00 H new ATOM 0 HA LYS A 32 -0.307 -20.947 -16.637 1.00 0.00 H new ATOM 0 HB2 LYS A 32 1.604 -20.471 -14.348 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -0.144 -20.390 -14.261 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -0.286 -22.640 -14.026 1.00 0.00 H new ATOM 0 HG3 LYS A 32 0.581 -22.889 -15.529 1.00 0.00 H new ATOM 0 HD2 LYS A 32 2.275 -23.741 -14.278 1.00 0.00 H new ATOM 0 HD3 LYS A 32 2.611 -22.097 -13.772 1.00 0.00 H new ATOM 0 HE2 LYS A 32 0.953 -22.395 -11.874 1.00 0.00 H new ATOM 0 HE3 LYS A 32 0.761 -24.071 -12.349 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 2.388 -23.840 -10.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 3.135 -24.412 -12.004 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 3.321 -22.789 -11.543 1.00 0.00 H new ATOM 482 N VAL A 33 -0.297 -18.652 -17.475 1.00 0.00 N ATOM 483 CA VAL A 33 -0.450 -17.256 -17.845 1.00 0.00 C ATOM 484 C VAL A 33 -1.418 -16.578 -16.873 1.00 0.00 C ATOM 485 O VAL A 33 -2.634 -16.682 -17.028 1.00 0.00 O ATOM 486 CB VAL A 33 -0.896 -17.147 -19.305 1.00 0.00 C ATOM 487 CG1 VAL A 33 -1.276 -15.707 -19.657 1.00 0.00 C ATOM 488 CG2 VAL A 33 0.186 -17.676 -20.249 1.00 0.00 C ATOM 0 H VAL A 33 -0.909 -19.296 -17.977 1.00 0.00 H new ATOM 0 HA VAL A 33 0.504 -16.735 -17.770 1.00 0.00 H new ATOM 0 HB VAL A 33 -1.784 -17.767 -19.432 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -1.589 -15.658 -20.700 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -2.095 -15.380 -19.016 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -0.415 -15.056 -19.506 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -0.156 -17.587 -21.280 1.00 0.00 H new ATOM 0 HG22 VAL A 33 1.099 -17.095 -20.118 1.00 0.00 H new ATOM 0 HG23 VAL A 33 0.387 -18.723 -20.022 1.00 0.00 H new ATOM 498 N PHE A 34 -0.842 -15.899 -15.892 1.00 0.00 N ATOM 499 CA PHE A 34 -1.638 -15.205 -14.894 1.00 0.00 C ATOM 500 C PHE A 34 -2.105 -13.844 -15.415 1.00 0.00 C ATOM 501 O PHE A 34 -1.323 -12.896 -15.474 1.00 0.00 O ATOM 502 CB PHE A 34 -0.740 -14.990 -13.675 1.00 0.00 C ATOM 503 CG PHE A 34 -0.189 -16.284 -13.072 1.00 0.00 C ATOM 504 CD1 PHE A 34 -1.041 -17.206 -12.547 1.00 0.00 C ATOM 505 CD2 PHE A 34 1.151 -16.513 -13.059 1.00 0.00 C ATOM 506 CE1 PHE A 34 -0.530 -18.407 -11.988 1.00 0.00 C ATOM 507 CE2 PHE A 34 1.662 -17.714 -12.500 1.00 0.00 C ATOM 508 CZ PHE A 34 0.810 -18.635 -11.975 1.00 0.00 C ATOM 0 H PHE A 34 0.167 -15.815 -15.767 1.00 0.00 H new ATOM 0 HA PHE A 34 -2.522 -15.793 -14.649 1.00 0.00 H new ATOM 0 HB2 PHE A 34 0.095 -14.350 -13.960 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -1.304 -14.456 -12.910 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -2.106 -17.024 -12.556 1.00 0.00 H new ATOM 0 HD2 PHE A 34 1.827 -15.781 -13.474 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -1.206 -19.140 -11.573 1.00 0.00 H new ATOM 0 HE2 PHE A 34 2.727 -17.896 -12.492 1.00 0.00 H new ATOM 0 HZ PHE A 34 1.198 -19.548 -11.548 1.00 0.00 H new ATOM 518 N ASN A 35 -3.377 -13.790 -15.780 1.00 0.00 N ATOM 519 CA ASN A 35 -3.957 -12.561 -16.294 1.00 0.00 C ATOM 520 C ASN A 35 -4.606 -11.789 -15.144 1.00 0.00 C ATOM 521 O ASN A 35 -5.117 -12.388 -14.199 1.00 0.00 O ATOM 522 CB ASN A 35 -5.038 -12.856 -17.336 1.00 0.00 C ATOM 523 CG ASN A 35 -4.498 -13.759 -18.446 1.00 0.00 C ATOM 524 OD1 ASN A 35 -4.003 -13.306 -19.465 1.00 0.00 O ATOM 525 ND2 ASN A 35 -4.621 -15.059 -18.194 1.00 0.00 N ATOM 0 H ASN A 35 -4.023 -14.578 -15.730 1.00 0.00 H new ATOM 0 HA ASN A 35 -3.160 -11.979 -16.757 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -5.891 -13.335 -16.855 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -5.398 -11.921 -17.766 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -4.291 -15.744 -18.874 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -5.045 -15.371 -17.321 1.00 0.00 H new ATOM 532 N HIS A 36 -4.566 -10.470 -15.262 1.00 0.00 N ATOM 533 CA HIS A 36 -5.144 -9.609 -14.245 1.00 0.00 C ATOM 534 C HIS A 36 -4.509 -9.921 -12.888 1.00 0.00 C ATOM 535 O HIS A 36 -5.208 -10.024 -11.881 1.00 0.00 O ATOM 536 CB HIS A 36 -6.669 -9.735 -14.229 1.00 0.00 C ATOM 537 CG HIS A 36 -7.332 -9.330 -15.524 1.00 0.00 C ATOM 538 ND1 HIS A 36 -7.882 -8.076 -15.725 1.00 0.00 N ATOM 539 CD2 HIS A 36 -7.526 -10.026 -16.681 1.00 0.00 C ATOM 540 CE1 HIS A 36 -8.382 -8.031 -16.951 1.00 0.00 C ATOM 541 NE2 HIS A 36 -8.161 -9.240 -17.541 1.00 0.00 N ATOM 0 H HIS A 36 -4.142 -9.976 -16.047 1.00 0.00 H new ATOM 0 HA HIS A 36 -4.926 -8.567 -14.479 1.00 0.00 H new ATOM 0 HB2 HIS A 36 -6.936 -10.768 -14.004 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -7.066 -9.120 -13.422 1.00 0.00 H new ATOM 0 HD1 HIS A 36 -7.899 -7.316 -15.045 1.00 0.00 H new ATOM 0 HD2 HIS A 36 -7.216 -11.044 -16.866 1.00 0.00 H new ATOM 0 HE1 HIS A 36 -8.878 -7.185 -17.404 1.00 0.00 H new ATOM 549 N CYS A 37 -3.192 -10.063 -12.905 1.00 0.00 N ATOM 550 CA CYS A 37 -2.455 -10.361 -11.689 1.00 0.00 C ATOM 551 C CYS A 37 -1.502 -9.198 -11.407 1.00 0.00 C ATOM 552 O CYS A 37 -1.320 -8.322 -12.251 1.00 0.00 O ATOM 553 CB CYS A 37 -1.714 -11.696 -11.789 1.00 0.00 C ATOM 554 SG CYS A 37 -0.468 -11.620 -13.128 1.00 0.00 S ATOM 0 H CYS A 37 -2.616 -9.977 -13.742 1.00 0.00 H new ATOM 0 HA CYS A 37 -3.150 -10.469 -10.857 1.00 0.00 H new ATOM 0 HB2 CYS A 37 -1.227 -11.923 -10.840 1.00 0.00 H new ATOM 0 HB3 CYS A 37 -2.422 -12.501 -11.985 1.00 0.00 H new ATOM 0 HG CYS A 37 -1.021 -11.956 -14.255 1.00 0.00 H new ATOM 560 N LEU A 38 -0.918 -9.228 -10.219 1.00 0.00 N ATOM 561 CA LEU A 38 0.013 -8.188 -9.815 1.00 0.00 C ATOM 562 C LEU A 38 1.404 -8.796 -9.632 1.00 0.00 C ATOM 563 O LEU A 38 1.756 -9.764 -10.305 1.00 0.00 O ATOM 564 CB LEU A 38 -0.506 -7.456 -8.576 1.00 0.00 C ATOM 565 CG LEU A 38 -2.024 -7.456 -8.383 1.00 0.00 C ATOM 566 CD1 LEU A 38 -2.391 -7.204 -6.919 1.00 0.00 C ATOM 567 CD2 LEU A 38 -2.697 -6.455 -9.324 1.00 0.00 C ATOM 0 H LEU A 38 -1.071 -9.957 -9.522 1.00 0.00 H new ATOM 0 HA LEU A 38 0.097 -7.430 -10.593 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -0.048 -7.905 -7.695 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -0.165 -6.422 -8.620 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.401 -8.445 -8.643 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -3.475 -7.209 -6.810 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -1.960 -7.987 -6.296 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -1.999 -6.236 -6.607 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -3.775 -6.475 -9.166 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -2.319 -5.453 -9.120 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -2.477 -6.722 -10.357 1.00 0.00 H new ATOM 579 N THR A 39 2.159 -8.204 -8.718 1.00 0.00 N ATOM 580 CA THR A 39 3.504 -8.676 -8.438 1.00 0.00 C ATOM 581 C THR A 39 3.931 -8.265 -7.027 1.00 0.00 C ATOM 582 O THR A 39 3.814 -7.098 -6.655 1.00 0.00 O ATOM 583 CB THR A 39 4.430 -8.143 -9.533 1.00 0.00 C ATOM 584 OG1 THR A 39 3.918 -6.843 -9.817 1.00 0.00 O ATOM 585 CG2 THR A 39 4.275 -8.901 -10.852 1.00 0.00 C ATOM 0 H THR A 39 1.864 -7.401 -8.162 1.00 0.00 H new ATOM 0 HA THR A 39 3.552 -9.765 -8.454 1.00 0.00 H new ATOM 0 HB THR A 39 5.465 -8.209 -9.197 1.00 0.00 H new ATOM 0 HG1 THR A 39 4.461 -6.423 -10.516 1.00 0.00 H new ATOM 0 HG21 THR A 39 4.955 -8.482 -11.594 1.00 0.00 H new ATOM 0 HG22 THR A 39 4.511 -9.954 -10.697 1.00 0.00 H new ATOM 0 HG23 THR A 39 3.249 -8.808 -11.207 1.00 0.00 H new ATOM 593 N GLY A 40 4.416 -9.246 -6.281 1.00 0.00 N ATOM 594 CA GLY A 40 4.861 -9.000 -4.920 1.00 0.00 C ATOM 595 C GLY A 40 5.579 -7.653 -4.812 1.00 0.00 C ATOM 596 O GLY A 40 5.192 -6.802 -4.012 1.00 0.00 O ATOM 0 H GLY A 40 4.511 -10.213 -6.593 1.00 0.00 H new ATOM 0 HA2 GLY A 40 4.005 -9.015 -4.246 1.00 0.00 H new ATOM 0 HA3 GLY A 40 5.531 -9.799 -4.603 1.00 0.00 H new ATOM 600 N SER A 41 6.611 -7.502 -5.628 1.00 0.00 N ATOM 601 CA SER A 41 7.386 -6.273 -5.634 1.00 0.00 C ATOM 602 C SER A 41 6.497 -5.096 -6.040 1.00 0.00 C ATOM 603 O SER A 41 6.313 -4.157 -5.268 1.00 0.00 O ATOM 604 CB SER A 41 8.585 -6.383 -6.578 1.00 0.00 C ATOM 605 OG SER A 41 9.090 -5.104 -6.952 1.00 0.00 O ATOM 0 H SER A 41 6.929 -8.210 -6.290 1.00 0.00 H new ATOM 0 HA SER A 41 7.766 -6.103 -4.626 1.00 0.00 H new ATOM 0 HB2 SER A 41 9.375 -6.957 -6.095 1.00 0.00 H new ATOM 0 HB3 SER A 41 8.293 -6.933 -7.473 1.00 0.00 H new ATOM 0 HG SER A 41 10.000 -5.201 -7.303 1.00 0.00 H new ATOM 611 N GLY A 42 5.969 -5.185 -7.252 1.00 0.00 N ATOM 612 CA GLY A 42 5.104 -4.139 -7.771 1.00 0.00 C ATOM 613 C GLY A 42 4.168 -3.612 -6.681 1.00 0.00 C ATOM 614 O GLY A 42 4.022 -2.402 -6.515 1.00 0.00 O ATOM 0 H GLY A 42 6.124 -5.966 -7.890 1.00 0.00 H new ATOM 0 HA2 GLY A 42 5.710 -3.322 -8.162 1.00 0.00 H new ATOM 0 HA3 GLY A 42 4.517 -4.527 -8.603 1.00 0.00 H new ATOM 618 N VAL A 43 3.559 -4.546 -5.966 1.00 0.00 N ATOM 619 CA VAL A 43 2.641 -4.191 -4.897 1.00 0.00 C ATOM 620 C VAL A 43 3.311 -3.173 -3.972 1.00 0.00 C ATOM 621 O VAL A 43 2.799 -2.072 -3.780 1.00 0.00 O ATOM 622 CB VAL A 43 2.179 -5.452 -4.164 1.00 0.00 C ATOM 623 CG1 VAL A 43 1.352 -5.095 -2.927 1.00 0.00 C ATOM 624 CG2 VAL A 43 1.395 -6.374 -5.100 1.00 0.00 C ATOM 0 H VAL A 43 3.683 -5.549 -6.106 1.00 0.00 H new ATOM 0 HA VAL A 43 1.745 -3.721 -5.303 1.00 0.00 H new ATOM 0 HB VAL A 43 3.066 -5.990 -3.830 1.00 0.00 H new ATOM 0 HG11 VAL A 43 1.036 -6.009 -2.424 1.00 0.00 H new ATOM 0 HG12 VAL A 43 1.957 -4.496 -2.246 1.00 0.00 H new ATOM 0 HG13 VAL A 43 0.473 -4.525 -3.229 1.00 0.00 H new ATOM 0 HG21 VAL A 43 1.078 -7.263 -4.554 1.00 0.00 H new ATOM 0 HG22 VAL A 43 0.518 -5.848 -5.478 1.00 0.00 H new ATOM 0 HG23 VAL A 43 2.029 -6.669 -5.936 1.00 0.00 H new ATOM 634 N ILE A 44 4.448 -3.578 -3.424 1.00 0.00 N ATOM 635 CA ILE A 44 5.193 -2.715 -2.524 1.00 0.00 C ATOM 636 C ILE A 44 5.670 -1.478 -3.288 1.00 0.00 C ATOM 637 O ILE A 44 5.884 -0.422 -2.695 1.00 0.00 O ATOM 638 CB ILE A 44 6.324 -3.494 -1.849 1.00 0.00 C ATOM 639 CG1 ILE A 44 5.789 -4.751 -1.160 1.00 0.00 C ATOM 640 CG2 ILE A 44 7.106 -2.601 -0.885 1.00 0.00 C ATOM 641 CD1 ILE A 44 6.933 -5.685 -0.758 1.00 0.00 C ATOM 0 H ILE A 44 4.871 -4.492 -3.586 1.00 0.00 H new ATOM 0 HA ILE A 44 4.552 -2.363 -1.716 1.00 0.00 H new ATOM 0 HB ILE A 44 7.021 -3.822 -2.621 1.00 0.00 H new ATOM 0 HG12 ILE A 44 5.217 -4.470 -0.276 1.00 0.00 H new ATOM 0 HG13 ILE A 44 5.106 -5.274 -1.829 1.00 0.00 H new ATOM 0 HG21 ILE A 44 7.904 -3.180 -0.419 1.00 0.00 H new ATOM 0 HG22 ILE A 44 7.538 -1.764 -1.434 1.00 0.00 H new ATOM 0 HG23 ILE A 44 6.435 -2.222 -0.114 1.00 0.00 H new ATOM 0 HD11 ILE A 44 6.525 -6.571 -0.270 1.00 0.00 H new ATOM 0 HD12 ILE A 44 7.488 -5.984 -1.647 1.00 0.00 H new ATOM 0 HD13 ILE A 44 7.601 -5.167 -0.070 1.00 0.00 H new ATOM 653 N ASP A 45 5.821 -1.650 -4.593 1.00 0.00 N ATOM 654 CA ASP A 45 6.268 -0.561 -5.444 1.00 0.00 C ATOM 655 C ASP A 45 5.158 0.488 -5.548 1.00 0.00 C ATOM 656 O ASP A 45 5.412 1.682 -5.398 1.00 0.00 O ATOM 657 CB ASP A 45 6.581 -1.058 -6.857 1.00 0.00 C ATOM 658 CG ASP A 45 7.855 -0.482 -7.478 1.00 0.00 C ATOM 659 OD1 ASP A 45 7.928 0.762 -7.572 1.00 0.00 O ATOM 660 OD2 ASP A 45 8.727 -1.298 -7.844 1.00 0.00 O ATOM 0 H ASP A 45 5.642 -2.527 -5.082 1.00 0.00 H new ATOM 0 HA ASP A 45 7.170 -0.137 -5.002 1.00 0.00 H new ATOM 0 HB2 ASP A 45 6.666 -2.144 -6.833 1.00 0.00 H new ATOM 0 HB3 ASP A 45 5.738 -0.818 -7.505 1.00 0.00 H new ATOM 665 N TRP A 46 3.952 0.003 -5.804 1.00 0.00 N ATOM 666 CA TRP A 46 2.803 0.884 -5.929 1.00 0.00 C ATOM 667 C TRP A 46 2.640 1.639 -4.608 1.00 0.00 C ATOM 668 O TRP A 46 2.140 2.763 -4.589 1.00 0.00 O ATOM 669 CB TRP A 46 1.552 0.099 -6.328 1.00 0.00 C ATOM 670 CG TRP A 46 0.272 0.938 -6.350 1.00 0.00 C ATOM 671 CD1 TRP A 46 -0.233 1.646 -7.369 1.00 0.00 C ATOM 672 CD2 TRP A 46 -0.651 1.127 -5.257 1.00 0.00 C ATOM 673 NE1 TRP A 46 -1.408 2.276 -7.014 1.00 0.00 N ATOM 674 CE2 TRP A 46 -1.671 1.950 -5.689 1.00 0.00 C ATOM 675 CE3 TRP A 46 -0.625 0.619 -3.946 1.00 0.00 C ATOM 676 CZ2 TRP A 46 -2.740 2.338 -4.873 1.00 0.00 C ATOM 677 CZ3 TRP A 46 -1.701 1.017 -3.143 1.00 0.00 C ATOM 678 CH2 TRP A 46 -2.736 1.845 -3.563 1.00 0.00 C ATOM 0 H TRP A 46 3.745 -0.988 -5.928 1.00 0.00 H new ATOM 0 HA TRP A 46 2.958 1.610 -6.727 1.00 0.00 H new ATOM 0 HB2 TRP A 46 1.707 -0.335 -7.316 1.00 0.00 H new ATOM 0 HB3 TRP A 46 1.419 -0.730 -5.633 1.00 0.00 H new ATOM 0 HD1 TRP A 46 0.222 1.715 -8.346 1.00 0.00 H new ATOM 0 HE1 TRP A 46 -1.979 2.872 -7.614 1.00 0.00 H new ATOM 0 HE3 TRP A 46 0.162 -0.027 -3.587 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 -3.526 2.984 -5.235 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 -1.729 0.655 -2.126 1.00 0.00 H new ATOM 0 HH2 TRP A 46 -3.533 2.106 -2.882 1.00 0.00 H new ATOM 689 N LEU A 47 3.070 0.991 -3.536 1.00 0.00 N ATOM 690 CA LEU A 47 2.978 1.587 -2.214 1.00 0.00 C ATOM 691 C LEU A 47 3.943 2.770 -2.124 1.00 0.00 C ATOM 692 O LEU A 47 3.545 3.875 -1.758 1.00 0.00 O ATOM 693 CB LEU A 47 3.201 0.528 -1.132 1.00 0.00 C ATOM 694 CG LEU A 47 2.083 -0.502 -0.962 1.00 0.00 C ATOM 695 CD1 LEU A 47 2.517 -1.632 -0.026 1.00 0.00 C ATOM 696 CD2 LEU A 47 0.789 0.165 -0.492 1.00 0.00 C ATOM 0 H LEU A 47 3.483 0.059 -3.556 1.00 0.00 H new ATOM 0 HA LEU A 47 1.976 1.979 -2.042 1.00 0.00 H new ATOM 0 HB2 LEU A 47 4.126 -0.003 -1.356 1.00 0.00 H new ATOM 0 HB3 LEU A 47 3.348 1.036 -0.179 1.00 0.00 H new ATOM 0 HG LEU A 47 1.880 -0.949 -1.935 1.00 0.00 H new ATOM 0 HD11 LEU A 47 1.704 -2.351 0.078 1.00 0.00 H new ATOM 0 HD12 LEU A 47 3.393 -2.132 -0.440 1.00 0.00 H new ATOM 0 HD13 LEU A 47 2.764 -1.220 0.952 1.00 0.00 H new ATOM 0 HD21 LEU A 47 0.011 -0.590 -0.379 1.00 0.00 H new ATOM 0 HD22 LEU A 47 0.960 0.656 0.466 1.00 0.00 H new ATOM 0 HD23 LEU A 47 0.473 0.905 -1.228 1.00 0.00 H new ATOM 708 N VAL A 48 5.195 2.499 -2.465 1.00 0.00 N ATOM 709 CA VAL A 48 6.220 3.528 -2.427 1.00 0.00 C ATOM 710 C VAL A 48 5.945 4.557 -3.525 1.00 0.00 C ATOM 711 O VAL A 48 6.157 5.752 -3.328 1.00 0.00 O ATOM 712 CB VAL A 48 7.606 2.889 -2.540 1.00 0.00 C ATOM 713 CG1 VAL A 48 8.680 3.951 -2.788 1.00 0.00 C ATOM 714 CG2 VAL A 48 7.931 2.061 -1.296 1.00 0.00 C ATOM 0 H VAL A 48 5.522 1.582 -2.769 1.00 0.00 H new ATOM 0 HA VAL A 48 6.196 4.056 -1.474 1.00 0.00 H new ATOM 0 HB VAL A 48 7.596 2.216 -3.397 1.00 0.00 H new ATOM 0 HG11 VAL A 48 9.656 3.471 -2.864 1.00 0.00 H new ATOM 0 HG12 VAL A 48 8.462 4.479 -3.716 1.00 0.00 H new ATOM 0 HG13 VAL A 48 8.688 4.660 -1.960 1.00 0.00 H new ATOM 0 HG21 VAL A 48 8.921 1.618 -1.402 1.00 0.00 H new ATOM 0 HG22 VAL A 48 7.914 2.704 -0.416 1.00 0.00 H new ATOM 0 HG23 VAL A 48 7.190 1.270 -1.182 1.00 0.00 H new ATOM 724 N SER A 49 5.476 4.055 -4.658 1.00 0.00 N ATOM 725 CA SER A 49 5.169 4.915 -5.788 1.00 0.00 C ATOM 726 C SER A 49 4.226 6.037 -5.350 1.00 0.00 C ATOM 727 O SER A 49 4.491 7.211 -5.605 1.00 0.00 O ATOM 728 CB SER A 49 4.548 4.117 -6.936 1.00 0.00 C ATOM 729 OG SER A 49 5.442 3.982 -8.038 1.00 0.00 O ATOM 0 H SER A 49 5.301 3.063 -4.818 1.00 0.00 H new ATOM 0 HA SER A 49 6.101 5.352 -6.148 1.00 0.00 H new ATOM 0 HB2 SER A 49 4.263 3.128 -6.577 1.00 0.00 H new ATOM 0 HB3 SER A 49 3.635 4.611 -7.268 1.00 0.00 H new ATOM 0 HG SER A 49 5.009 3.465 -8.749 1.00 0.00 H new ATOM 735 N ASN A 50 3.143 5.636 -4.699 1.00 0.00 N ATOM 736 CA ASN A 50 2.159 6.593 -4.223 1.00 0.00 C ATOM 737 C ASN A 50 2.644 7.206 -2.908 1.00 0.00 C ATOM 738 O ASN A 50 2.193 8.282 -2.517 1.00 0.00 O ATOM 739 CB ASN A 50 0.813 5.915 -3.961 1.00 0.00 C ATOM 740 CG ASN A 50 -0.080 5.971 -5.202 1.00 0.00 C ATOM 741 OD1 ASN A 50 -0.830 6.909 -5.417 1.00 0.00 O ATOM 742 ND2 ASN A 50 0.042 4.917 -6.005 1.00 0.00 N ATOM 0 H ASN A 50 2.926 4.661 -4.490 1.00 0.00 H new ATOM 0 HA ASN A 50 2.034 7.358 -4.990 1.00 0.00 H new ATOM 0 HB2 ASN A 50 0.975 4.877 -3.672 1.00 0.00 H new ATOM 0 HB3 ASN A 50 0.312 6.404 -3.126 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -0.512 4.860 -6.860 1.00 0.00 H new ATOM 0 HD22 ASN A 50 0.689 4.166 -5.766 1.00 0.00 H new ATOM 749 N LYS A 51 3.555 6.494 -2.261 1.00 0.00 N ATOM 750 CA LYS A 51 4.106 6.954 -0.998 1.00 0.00 C ATOM 751 C LYS A 51 3.173 6.539 0.142 1.00 0.00 C ATOM 752 O LYS A 51 2.679 7.386 0.885 1.00 0.00 O ATOM 753 CB LYS A 51 4.382 8.458 -1.049 1.00 0.00 C ATOM 754 CG LYS A 51 5.064 8.846 -2.363 1.00 0.00 C ATOM 755 CD LYS A 51 6.570 9.026 -2.165 1.00 0.00 C ATOM 756 CE LYS A 51 7.312 8.940 -3.501 1.00 0.00 C ATOM 757 NZ LYS A 51 8.650 8.335 -3.312 1.00 0.00 N ATOM 0 H LYS A 51 3.925 5.602 -2.588 1.00 0.00 H new ATOM 0 HA LYS A 51 5.071 6.483 -0.810 1.00 0.00 H new ATOM 0 HB2 LYS A 51 3.446 9.007 -0.945 1.00 0.00 H new ATOM 0 HB3 LYS A 51 5.014 8.744 -0.209 1.00 0.00 H new ATOM 0 HG2 LYS A 51 4.881 8.076 -3.113 1.00 0.00 H new ATOM 0 HG3 LYS A 51 4.630 9.771 -2.743 1.00 0.00 H new ATOM 0 HD2 LYS A 51 6.766 9.991 -1.697 1.00 0.00 H new ATOM 0 HD3 LYS A 51 6.945 8.260 -1.486 1.00 0.00 H new ATOM 0 HE2 LYS A 51 6.734 8.345 -4.207 1.00 0.00 H new ATOM 0 HE3 LYS A 51 7.414 9.936 -3.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 9.140 8.284 -4.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 9.205 8.919 -2.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 8.546 7.377 -2.921 1.00 0.00 H new ATOM 771 N LEU A 52 2.960 5.235 0.244 1.00 0.00 N ATOM 772 CA LEU A 52 2.095 4.697 1.280 1.00 0.00 C ATOM 773 C LEU A 52 2.939 4.324 2.500 1.00 0.00 C ATOM 774 O LEU A 52 2.423 4.237 3.613 1.00 0.00 O ATOM 775 CB LEU A 52 1.260 3.538 0.732 1.00 0.00 C ATOM 776 CG LEU A 52 -0.068 3.920 0.075 1.00 0.00 C ATOM 777 CD1 LEU A 52 -0.844 2.674 -0.358 1.00 0.00 C ATOM 778 CD2 LEU A 52 -0.897 4.820 0.995 1.00 0.00 C ATOM 0 H LEU A 52 3.372 4.536 -0.374 1.00 0.00 H new ATOM 0 HA LEU A 52 1.378 5.450 1.606 1.00 0.00 H new ATOM 0 HB2 LEU A 52 1.861 2.997 0.002 1.00 0.00 H new ATOM 0 HB3 LEU A 52 1.053 2.847 1.549 1.00 0.00 H new ATOM 0 HG LEU A 52 0.150 4.494 -0.826 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -1.784 2.974 -0.822 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -0.250 2.106 -1.075 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -1.051 2.053 0.514 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -1.836 5.077 0.504 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -1.107 4.294 1.926 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -0.340 5.731 1.211 1.00 0.00 H new ATOM 790 N VAL A 53 4.223 4.115 2.249 1.00 0.00 N ATOM 791 CA VAL A 53 5.144 3.753 3.314 1.00 0.00 C ATOM 792 C VAL A 53 6.390 4.636 3.226 1.00 0.00 C ATOM 793 O VAL A 53 6.474 5.514 2.368 1.00 0.00 O ATOM 794 CB VAL A 53 5.464 2.259 3.243 1.00 0.00 C ATOM 795 CG1 VAL A 53 4.198 1.418 3.416 1.00 0.00 C ATOM 796 CG2 VAL A 53 6.179 1.912 1.935 1.00 0.00 C ATOM 0 H VAL A 53 4.647 4.189 1.325 1.00 0.00 H new ATOM 0 HA VAL A 53 4.689 3.928 4.289 1.00 0.00 H new ATOM 0 HB VAL A 53 6.138 2.022 4.066 1.00 0.00 H new ATOM 0 HG11 VAL A 53 4.454 0.360 3.361 1.00 0.00 H new ATOM 0 HG12 VAL A 53 3.748 1.633 4.385 1.00 0.00 H new ATOM 0 HG13 VAL A 53 3.489 1.661 2.625 1.00 0.00 H new ATOM 0 HG21 VAL A 53 6.395 0.844 1.911 1.00 0.00 H new ATOM 0 HG22 VAL A 53 5.540 2.173 1.091 1.00 0.00 H new ATOM 0 HG23 VAL A 53 7.112 2.472 1.871 1.00 0.00 H new ATOM 806 N ARG A 54 7.327 4.374 4.125 1.00 0.00 N ATOM 807 CA ARG A 54 8.565 5.134 4.160 1.00 0.00 C ATOM 808 C ARG A 54 9.668 4.387 3.408 1.00 0.00 C ATOM 809 O ARG A 54 10.574 5.006 2.852 1.00 0.00 O ATOM 810 CB ARG A 54 9.018 5.383 5.600 1.00 0.00 C ATOM 811 CG ARG A 54 8.217 6.521 6.238 1.00 0.00 C ATOM 812 CD ARG A 54 8.958 7.853 6.105 1.00 0.00 C ATOM 813 NE ARG A 54 8.019 8.978 6.314 1.00 0.00 N ATOM 814 CZ ARG A 54 8.394 10.214 6.669 1.00 0.00 C ATOM 815 NH1 ARG A 54 9.691 10.493 6.857 1.00 0.00 N ATOM 816 NH2 ARG A 54 7.471 11.172 6.836 1.00 0.00 N ATOM 0 H ARG A 54 7.254 3.646 4.835 1.00 0.00 H new ATOM 0 HA ARG A 54 8.378 6.094 3.679 1.00 0.00 H new ATOM 0 HB2 ARG A 54 8.894 4.473 6.187 1.00 0.00 H new ATOM 0 HB3 ARG A 54 10.080 5.629 5.614 1.00 0.00 H new ATOM 0 HG2 ARG A 54 7.240 6.595 5.761 1.00 0.00 H new ATOM 0 HG3 ARG A 54 8.042 6.302 7.291 1.00 0.00 H new ATOM 0 HD2 ARG A 54 9.767 7.903 6.834 1.00 0.00 H new ATOM 0 HD3 ARG A 54 9.414 7.928 5.118 1.00 0.00 H new ATOM 0 HE ARG A 54 7.024 8.801 6.179 1.00 0.00 H new ATOM 0 HH11 ARG A 54 10.393 9.764 6.730 1.00 0.00 H new ATOM 0 HH12 ARG A 54 9.976 11.434 7.127 1.00 0.00 H new ATOM 0 HH21 ARG A 54 6.484 10.960 6.693 1.00 0.00 H new ATOM 0 HH22 ARG A 54 7.756 12.113 7.106 1.00 0.00 H new ATOM 830 N ASN A 55 9.555 3.067 3.415 1.00 0.00 N ATOM 831 CA ASN A 55 10.532 2.229 2.740 1.00 0.00 C ATOM 832 C ASN A 55 9.868 0.916 2.322 1.00 0.00 C ATOM 833 O ASN A 55 8.878 0.498 2.921 1.00 0.00 O ATOM 834 CB ASN A 55 11.703 1.893 3.666 1.00 0.00 C ATOM 835 CG ASN A 55 11.209 1.557 5.075 1.00 0.00 C ATOM 836 OD1 ASN A 55 11.185 0.412 5.496 1.00 0.00 O ATOM 837 ND2 ASN A 55 10.817 2.616 5.777 1.00 0.00 N ATOM 0 H ASN A 55 8.802 2.557 3.877 1.00 0.00 H new ATOM 0 HA ASN A 55 10.903 2.775 1.873 1.00 0.00 H new ATOM 0 HB2 ASN A 55 12.261 1.048 3.261 1.00 0.00 H new ATOM 0 HB3 ASN A 55 12.391 2.738 3.710 1.00 0.00 H new ATOM 0 HD21 ASN A 55 10.470 2.497 6.729 1.00 0.00 H new ATOM 0 HD22 ASN A 55 10.863 3.547 5.364 1.00 0.00 H new ATOM 844 N ARG A 56 10.440 0.301 1.296 1.00 0.00 N ATOM 845 CA ARG A 56 9.916 -0.956 0.791 1.00 0.00 C ATOM 846 C ARG A 56 9.552 -1.885 1.951 1.00 0.00 C ATOM 847 O ARG A 56 8.504 -2.529 1.931 1.00 0.00 O ATOM 848 CB ARG A 56 10.935 -1.654 -0.112 1.00 0.00 C ATOM 849 CG ARG A 56 10.996 -0.988 -1.488 1.00 0.00 C ATOM 850 CD ARG A 56 11.115 -2.033 -2.599 1.00 0.00 C ATOM 851 NE ARG A 56 9.845 -2.116 -3.354 1.00 0.00 N ATOM 852 CZ ARG A 56 9.656 -2.904 -4.422 1.00 0.00 C ATOM 853 NH1 ARG A 56 10.653 -3.680 -4.866 1.00 0.00 N ATOM 854 NH2 ARG A 56 8.469 -2.914 -5.045 1.00 0.00 N ATOM 0 H ARG A 56 11.261 0.650 0.802 1.00 0.00 H new ATOM 0 HA ARG A 56 9.023 -0.732 0.207 1.00 0.00 H new ATOM 0 HB2 ARG A 56 11.920 -1.624 0.354 1.00 0.00 H new ATOM 0 HB3 ARG A 56 10.667 -2.705 -0.224 1.00 0.00 H new ATOM 0 HG2 ARG A 56 10.101 -0.386 -1.645 1.00 0.00 H new ATOM 0 HG3 ARG A 56 11.848 -0.309 -1.530 1.00 0.00 H new ATOM 0 HD2 ARG A 56 11.931 -1.769 -3.272 1.00 0.00 H new ATOM 0 HD3 ARG A 56 11.357 -3.006 -2.170 1.00 0.00 H new ATOM 0 HE ARG A 56 9.065 -1.538 -3.042 1.00 0.00 H new ATOM 0 HH11 ARG A 56 11.556 -3.671 -4.392 1.00 0.00 H new ATOM 0 HH12 ARG A 56 10.509 -4.280 -5.679 1.00 0.00 H new ATOM 0 HH21 ARG A 56 7.710 -2.322 -4.706 1.00 0.00 H new ATOM 0 HH22 ARG A 56 8.325 -3.513 -5.858 1.00 0.00 H new ATOM 868 N GLN A 57 10.438 -1.925 2.935 1.00 0.00 N ATOM 869 CA GLN A 57 10.224 -2.764 4.102 1.00 0.00 C ATOM 870 C GLN A 57 8.783 -2.625 4.598 1.00 0.00 C ATOM 871 O GLN A 57 8.024 -3.593 4.591 1.00 0.00 O ATOM 872 CB GLN A 57 11.221 -2.425 5.212 1.00 0.00 C ATOM 873 CG GLN A 57 11.634 -3.682 5.980 1.00 0.00 C ATOM 874 CD GLN A 57 10.555 -4.089 6.986 1.00 0.00 C ATOM 875 OE1 GLN A 57 9.605 -3.368 7.241 1.00 0.00 O ATOM 876 NE2 GLN A 57 10.755 -5.281 7.540 1.00 0.00 N ATOM 0 H GLN A 57 11.306 -1.390 2.948 1.00 0.00 H new ATOM 0 HA GLN A 57 10.391 -3.802 3.814 1.00 0.00 H new ATOM 0 HB2 GLN A 57 12.103 -1.951 4.781 1.00 0.00 H new ATOM 0 HB3 GLN A 57 10.776 -1.705 5.898 1.00 0.00 H new ATOM 0 HG2 GLN A 57 11.810 -4.499 5.280 1.00 0.00 H new ATOM 0 HG3 GLN A 57 12.574 -3.501 6.502 1.00 0.00 H new ATOM 0 HE21 GLN A 57 11.572 -5.833 7.281 1.00 0.00 H new ATOM 0 HE22 GLN A 57 10.091 -5.643 8.224 1.00 0.00 H new ATOM 885 N GLU A 58 8.450 -1.413 5.017 1.00 0.00 N ATOM 886 CA GLU A 58 7.114 -1.134 5.516 1.00 0.00 C ATOM 887 C GLU A 58 6.062 -1.734 4.579 1.00 0.00 C ATOM 888 O GLU A 58 5.151 -2.428 5.027 1.00 0.00 O ATOM 889 CB GLU A 58 6.897 0.370 5.693 1.00 0.00 C ATOM 890 CG GLU A 58 7.213 0.804 7.125 1.00 0.00 C ATOM 891 CD GLU A 58 8.358 -0.025 7.710 1.00 0.00 C ATOM 892 OE1 GLU A 58 9.431 -0.043 7.068 1.00 0.00 O ATOM 893 OE2 GLU A 58 8.135 -0.622 8.785 1.00 0.00 O ATOM 0 H GLU A 58 9.082 -0.613 5.021 1.00 0.00 H new ATOM 0 HA GLU A 58 7.008 -1.600 6.496 1.00 0.00 H new ATOM 0 HB2 GLU A 58 7.531 0.917 4.995 1.00 0.00 H new ATOM 0 HB3 GLU A 58 5.865 0.623 5.452 1.00 0.00 H new ATOM 0 HG2 GLU A 58 7.481 1.860 7.138 1.00 0.00 H new ATOM 0 HG3 GLU A 58 6.325 0.693 7.747 1.00 0.00 H new ATOM 900 N GLY A 59 6.224 -1.443 3.297 1.00 0.00 N ATOM 901 CA GLY A 59 5.300 -1.945 2.294 1.00 0.00 C ATOM 902 C GLY A 59 5.175 -3.468 2.376 1.00 0.00 C ATOM 903 O GLY A 59 4.072 -4.008 2.316 1.00 0.00 O ATOM 0 H GLY A 59 6.981 -0.866 2.930 1.00 0.00 H new ATOM 0 HA2 GLY A 59 4.321 -1.488 2.436 1.00 0.00 H new ATOM 0 HA3 GLY A 59 5.645 -1.658 1.301 1.00 0.00 H new ATOM 907 N LEU A 60 6.322 -4.117 2.511 1.00 0.00 N ATOM 908 CA LEU A 60 6.355 -5.567 2.602 1.00 0.00 C ATOM 909 C LEU A 60 5.445 -6.023 3.744 1.00 0.00 C ATOM 910 O LEU A 60 4.452 -6.711 3.514 1.00 0.00 O ATOM 911 CB LEU A 60 7.797 -6.063 2.729 1.00 0.00 C ATOM 912 CG LEU A 60 7.969 -7.521 3.161 1.00 0.00 C ATOM 913 CD1 LEU A 60 7.165 -8.458 2.258 1.00 0.00 C ATOM 914 CD2 LEU A 60 9.449 -7.906 3.214 1.00 0.00 C ATOM 0 H LEU A 60 7.235 -3.666 2.560 1.00 0.00 H new ATOM 0 HA LEU A 60 5.967 -6.015 1.687 1.00 0.00 H new ATOM 0 HB2 LEU A 60 8.292 -5.929 1.767 1.00 0.00 H new ATOM 0 HB3 LEU A 60 8.317 -5.428 3.447 1.00 0.00 H new ATOM 0 HG LEU A 60 7.572 -7.628 4.171 1.00 0.00 H new ATOM 0 HD11 LEU A 60 7.304 -9.488 2.586 1.00 0.00 H new ATOM 0 HD12 LEU A 60 6.108 -8.199 2.314 1.00 0.00 H new ATOM 0 HD13 LEU A 60 7.509 -8.355 1.229 1.00 0.00 H new ATOM 0 HD21 LEU A 60 9.543 -8.947 3.524 1.00 0.00 H new ATOM 0 HD22 LEU A 60 9.893 -7.779 2.227 1.00 0.00 H new ATOM 0 HD23 LEU A 60 9.966 -7.266 3.929 1.00 0.00 H new ATOM 926 N MET A 61 5.816 -5.621 4.951 1.00 0.00 N ATOM 927 CA MET A 61 5.046 -5.980 6.129 1.00 0.00 C ATOM 928 C MET A 61 3.550 -5.766 5.892 1.00 0.00 C ATOM 929 O MET A 61 2.744 -6.663 6.135 1.00 0.00 O ATOM 930 CB MET A 61 5.501 -5.128 7.316 1.00 0.00 C ATOM 931 CG MET A 61 7.012 -5.247 7.528 1.00 0.00 C ATOM 932 SD MET A 61 7.443 -4.697 9.171 1.00 0.00 S ATOM 933 CE MET A 61 6.643 -3.101 9.184 1.00 0.00 C ATOM 0 H MET A 61 6.640 -5.050 5.138 1.00 0.00 H new ATOM 0 HA MET A 61 5.214 -7.036 6.342 1.00 0.00 H new ATOM 0 HB2 MET A 61 5.235 -4.085 7.143 1.00 0.00 H new ATOM 0 HB3 MET A 61 4.977 -5.445 8.218 1.00 0.00 H new ATOM 0 HG2 MET A 61 7.327 -6.281 7.387 1.00 0.00 H new ATOM 0 HG3 MET A 61 7.540 -4.649 6.785 1.00 0.00 H new ATOM 0 HE1 MET A 61 7.049 -2.497 9.996 1.00 0.00 H new ATOM 0 HE2 MET A 61 6.820 -2.598 8.234 1.00 0.00 H new ATOM 0 HE3 MET A 61 5.571 -3.233 9.331 1.00 0.00 H new ATOM 943 N ILE A 62 3.222 -4.572 5.420 1.00 0.00 N ATOM 944 CA ILE A 62 1.837 -4.229 5.147 1.00 0.00 C ATOM 945 C ILE A 62 1.253 -5.236 4.154 1.00 0.00 C ATOM 946 O ILE A 62 0.237 -5.871 4.434 1.00 0.00 O ATOM 947 CB ILE A 62 1.726 -2.775 4.684 1.00 0.00 C ATOM 948 CG1 ILE A 62 2.326 -1.822 5.721 1.00 0.00 C ATOM 949 CG2 ILE A 62 0.278 -2.416 4.346 1.00 0.00 C ATOM 950 CD1 ILE A 62 1.355 -1.593 6.881 1.00 0.00 C ATOM 0 H ILE A 62 3.892 -3.830 5.220 1.00 0.00 H new ATOM 0 HA ILE A 62 1.242 -4.296 6.058 1.00 0.00 H new ATOM 0 HB ILE A 62 2.307 -2.663 3.769 1.00 0.00 H new ATOM 0 HG12 ILE A 62 3.261 -2.234 6.101 1.00 0.00 H new ATOM 0 HG13 ILE A 62 2.566 -0.869 5.249 1.00 0.00 H new ATOM 0 HG21 ILE A 62 0.227 -1.377 4.020 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -0.081 -3.065 3.547 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -0.346 -2.550 5.230 1.00 0.00 H new ATOM 0 HD11 ILE A 62 1.805 -0.912 7.604 1.00 0.00 H new ATOM 0 HD12 ILE A 62 0.430 -1.159 6.501 1.00 0.00 H new ATOM 0 HD13 ILE A 62 1.137 -2.544 7.366 1.00 0.00 H new ATOM 962 N SER A 63 1.920 -5.351 3.015 1.00 0.00 N ATOM 963 CA SER A 63 1.479 -6.270 1.980 1.00 0.00 C ATOM 964 C SER A 63 0.956 -7.561 2.614 1.00 0.00 C ATOM 965 O SER A 63 -0.167 -7.980 2.340 1.00 0.00 O ATOM 966 CB SER A 63 2.613 -6.582 1.001 1.00 0.00 C ATOM 967 OG SER A 63 2.953 -5.453 0.200 1.00 0.00 O ATOM 0 H SER A 63 2.762 -4.823 2.786 1.00 0.00 H new ATOM 0 HA SER A 63 0.673 -5.794 1.421 1.00 0.00 H new ATOM 0 HB2 SER A 63 3.492 -6.910 1.557 1.00 0.00 H new ATOM 0 HB3 SER A 63 2.317 -7.409 0.355 1.00 0.00 H new ATOM 0 HG SER A 63 3.354 -4.760 0.765 1.00 0.00 H new ATOM 973 N ALA A 64 1.796 -8.155 3.449 1.00 0.00 N ATOM 974 CA ALA A 64 1.432 -9.389 4.124 1.00 0.00 C ATOM 975 C ALA A 64 0.035 -9.241 4.731 1.00 0.00 C ATOM 976 O ALA A 64 -0.813 -10.116 4.567 1.00 0.00 O ATOM 977 CB ALA A 64 2.491 -9.728 5.174 1.00 0.00 C ATOM 0 H ALA A 64 2.727 -7.805 3.673 1.00 0.00 H new ATOM 0 HA ALA A 64 1.398 -10.217 3.417 1.00 0.00 H new ATOM 0 HB1 ALA A 64 2.218 -10.654 5.680 1.00 0.00 H new ATOM 0 HB2 ALA A 64 3.459 -9.852 4.688 1.00 0.00 H new ATOM 0 HB3 ALA A 64 2.552 -8.920 5.903 1.00 0.00 H new ATOM 983 N SER A 65 -0.161 -8.126 5.420 1.00 0.00 N ATOM 984 CA SER A 65 -1.440 -7.852 6.052 1.00 0.00 C ATOM 985 C SER A 65 -2.557 -7.883 5.007 1.00 0.00 C ATOM 986 O SER A 65 -3.663 -8.343 5.290 1.00 0.00 O ATOM 987 CB SER A 65 -1.421 -6.500 6.769 1.00 0.00 C ATOM 988 OG SER A 65 -2.019 -6.573 8.060 1.00 0.00 O ATOM 0 H SER A 65 0.545 -7.402 5.554 1.00 0.00 H new ATOM 0 HA SER A 65 -1.627 -8.626 6.797 1.00 0.00 H new ATOM 0 HB2 SER A 65 -0.392 -6.155 6.865 1.00 0.00 H new ATOM 0 HB3 SER A 65 -1.950 -5.762 6.166 1.00 0.00 H new ATOM 0 HG SER A 65 -1.986 -5.691 8.486 1.00 0.00 H new ATOM 994 N LEU A 66 -2.230 -7.389 3.823 1.00 0.00 N ATOM 995 CA LEU A 66 -3.193 -7.354 2.735 1.00 0.00 C ATOM 996 C LEU A 66 -3.466 -8.782 2.256 1.00 0.00 C ATOM 997 O LEU A 66 -4.609 -9.237 2.270 1.00 0.00 O ATOM 998 CB LEU A 66 -2.714 -6.415 1.626 1.00 0.00 C ATOM 999 CG LEU A 66 -2.968 -4.924 1.854 1.00 0.00 C ATOM 1000 CD1 LEU A 66 -2.046 -4.070 0.981 1.00 0.00 C ATOM 1001 CD2 LEU A 66 -4.443 -4.579 1.637 1.00 0.00 C ATOM 0 H LEU A 66 -1.312 -7.009 3.592 1.00 0.00 H new ATOM 0 HA LEU A 66 -4.143 -6.945 3.079 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -1.643 -6.564 1.488 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.199 -6.708 0.695 1.00 0.00 H new ATOM 0 HG LEU A 66 -2.732 -4.693 2.893 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -2.248 -3.014 1.163 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -1.007 -4.289 1.227 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -2.226 -4.298 -0.070 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -4.596 -3.513 1.805 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -4.729 -4.830 0.615 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -5.056 -5.148 2.335 1.00 0.00 H new ATOM 1013 N LEU A 67 -2.398 -9.448 1.844 1.00 0.00 N ATOM 1014 CA LEU A 67 -2.508 -10.815 1.362 1.00 0.00 C ATOM 1015 C LEU A 67 -3.298 -11.646 2.375 1.00 0.00 C ATOM 1016 O LEU A 67 -4.343 -12.206 2.044 1.00 0.00 O ATOM 1017 CB LEU A 67 -1.124 -11.384 1.045 1.00 0.00 C ATOM 1018 CG LEU A 67 -1.037 -12.908 0.929 1.00 0.00 C ATOM 1019 CD1 LEU A 67 -0.736 -13.332 -0.510 1.00 0.00 C ATOM 1020 CD2 LEU A 67 -0.017 -13.475 1.918 1.00 0.00 C ATOM 0 H LEU A 67 -1.452 -9.067 1.834 1.00 0.00 H new ATOM 0 HA LEU A 67 -3.062 -10.845 0.424 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -0.779 -10.948 0.108 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -0.432 -11.058 1.822 1.00 0.00 H new ATOM 0 HG LEU A 67 -2.008 -13.327 1.192 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -0.679 -14.419 -0.565 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -1.529 -12.976 -1.168 1.00 0.00 H new ATOM 0 HD13 LEU A 67 0.215 -12.903 -0.824 1.00 0.00 H new ATOM 0 HD21 LEU A 67 0.026 -14.559 1.815 1.00 0.00 H new ATOM 0 HD22 LEU A 67 0.966 -13.052 1.710 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -0.314 -13.218 2.935 1.00 0.00 H new ATOM 1032 N SER A 68 -2.770 -11.700 3.589 1.00 0.00 N ATOM 1033 CA SER A 68 -3.412 -12.453 4.652 1.00 0.00 C ATOM 1034 C SER A 68 -4.930 -12.274 4.577 1.00 0.00 C ATOM 1035 O SER A 68 -5.656 -13.218 4.271 1.00 0.00 O ATOM 1036 CB SER A 68 -2.894 -12.020 6.025 1.00 0.00 C ATOM 1037 OG SER A 68 -2.314 -13.106 6.743 1.00 0.00 O ATOM 0 H SER A 68 -1.904 -11.234 3.860 1.00 0.00 H new ATOM 0 HA SER A 68 -3.169 -13.507 4.518 1.00 0.00 H new ATOM 0 HB2 SER A 68 -2.153 -11.231 5.901 1.00 0.00 H new ATOM 0 HB3 SER A 68 -3.714 -11.598 6.606 1.00 0.00 H new ATOM 0 HG SER A 68 -1.994 -12.789 7.613 1.00 0.00 H new ATOM 1043 N GLU A 69 -5.364 -11.055 4.862 1.00 0.00 N ATOM 1044 CA GLU A 69 -6.783 -10.740 4.830 1.00 0.00 C ATOM 1045 C GLU A 69 -7.461 -11.459 3.662 1.00 0.00 C ATOM 1046 O GLU A 69 -8.629 -11.831 3.752 1.00 0.00 O ATOM 1047 CB GLU A 69 -7.007 -9.228 4.748 1.00 0.00 C ATOM 1048 CG GLU A 69 -6.736 -8.560 6.098 1.00 0.00 C ATOM 1049 CD GLU A 69 -7.995 -8.548 6.966 1.00 0.00 C ATOM 1050 OE1 GLU A 69 -9.057 -8.177 6.421 1.00 0.00 O ATOM 1051 OE2 GLU A 69 -7.868 -8.910 8.156 1.00 0.00 O ATOM 0 H GLU A 69 -4.759 -10.274 5.116 1.00 0.00 H new ATOM 0 HA GLU A 69 -7.234 -11.092 5.758 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -6.352 -8.800 3.989 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -8.032 -9.025 4.437 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -5.937 -9.091 6.617 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -6.390 -7.539 5.939 1.00 0.00 H new ATOM 1058 N GLY A 70 -6.698 -11.632 2.593 1.00 0.00 N ATOM 1059 CA GLY A 70 -7.210 -12.300 1.409 1.00 0.00 C ATOM 1060 C GLY A 70 -7.447 -11.300 0.275 1.00 0.00 C ATOM 1061 O GLY A 70 -8.282 -11.532 -0.598 1.00 0.00 O ATOM 0 H GLY A 70 -5.729 -11.321 2.522 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -6.503 -13.064 1.084 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -8.143 -12.810 1.650 1.00 0.00 H new ATOM 1065 N TYR A 71 -6.696 -10.209 0.324 1.00 0.00 N ATOM 1066 CA TYR A 71 -6.813 -9.174 -0.688 1.00 0.00 C ATOM 1067 C TYR A 71 -5.950 -9.499 -1.908 1.00 0.00 C ATOM 1068 O TYR A 71 -6.221 -9.024 -3.010 1.00 0.00 O ATOM 1069 CB TYR A 71 -6.294 -7.889 -0.039 1.00 0.00 C ATOM 1070 CG TYR A 71 -7.295 -7.220 0.905 1.00 0.00 C ATOM 1071 CD1 TYR A 71 -8.532 -6.829 0.435 1.00 0.00 C ATOM 1072 CD2 TYR A 71 -6.961 -7.009 2.227 1.00 0.00 C ATOM 1073 CE1 TYR A 71 -9.474 -6.199 1.323 1.00 0.00 C ATOM 1074 CE2 TYR A 71 -7.904 -6.379 3.116 1.00 0.00 C ATOM 1075 CZ TYR A 71 -9.114 -6.006 2.620 1.00 0.00 C ATOM 1076 OH TYR A 71 -10.003 -5.412 3.460 1.00 0.00 O ATOM 0 H TYR A 71 -6.004 -10.020 1.049 1.00 0.00 H new ATOM 0 HA TYR A 71 -7.845 -9.084 -1.027 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -5.384 -8.116 0.515 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -6.022 -7.183 -0.823 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -8.794 -6.996 -0.599 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -5.993 -7.316 2.595 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -10.445 -5.887 0.967 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -7.655 -6.207 4.153 1.00 0.00 H new ATOM 0 HH TYR A 71 -9.610 -5.341 4.355 1.00 0.00 H new ATOM 1086 N LEU A 72 -4.927 -10.308 -1.671 1.00 0.00 N ATOM 1087 CA LEU A 72 -4.022 -10.702 -2.737 1.00 0.00 C ATOM 1088 C LEU A 72 -3.873 -12.225 -2.736 1.00 0.00 C ATOM 1089 O LEU A 72 -3.274 -12.793 -1.823 1.00 0.00 O ATOM 1090 CB LEU A 72 -2.693 -9.954 -2.617 1.00 0.00 C ATOM 1091 CG LEU A 72 -2.792 -8.444 -2.390 1.00 0.00 C ATOM 1092 CD1 LEU A 72 -1.487 -7.889 -1.816 1.00 0.00 C ATOM 1093 CD2 LEU A 72 -3.206 -7.723 -3.674 1.00 0.00 C ATOM 0 H LEU A 72 -4.705 -10.701 -0.756 1.00 0.00 H new ATOM 0 HA LEU A 72 -4.432 -10.421 -3.707 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -2.127 -10.389 -1.793 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -2.117 -10.128 -3.526 1.00 0.00 H new ATOM 0 HG LEU A 72 -3.572 -8.260 -1.651 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -1.584 -6.814 -1.664 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -1.274 -8.372 -0.862 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -0.671 -8.085 -2.512 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -3.269 -6.651 -3.485 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -2.466 -7.912 -4.452 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -4.178 -8.092 -4.001 1.00 0.00 H new ATOM 1105 N GLN A 73 -4.428 -12.843 -3.768 1.00 0.00 N ATOM 1106 CA GLN A 73 -4.364 -14.289 -3.898 1.00 0.00 C ATOM 1107 C GLN A 73 -2.953 -14.724 -4.300 1.00 0.00 C ATOM 1108 O GLN A 73 -2.377 -14.181 -5.241 1.00 0.00 O ATOM 1109 CB GLN A 73 -5.401 -14.796 -4.902 1.00 0.00 C ATOM 1110 CG GLN A 73 -6.809 -14.755 -4.304 1.00 0.00 C ATOM 1111 CD GLN A 73 -7.149 -16.077 -3.612 1.00 0.00 C ATOM 1112 OE1 GLN A 73 -7.081 -17.147 -4.194 1.00 0.00 O ATOM 1113 NE2 GLN A 73 -7.519 -15.943 -2.342 1.00 0.00 N ATOM 0 H GLN A 73 -4.924 -12.369 -4.522 1.00 0.00 H new ATOM 0 HA GLN A 73 -4.598 -14.732 -2.930 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -5.367 -14.186 -5.804 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -5.157 -15.816 -5.198 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -6.880 -13.937 -3.588 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -7.536 -14.554 -5.091 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -7.554 -15.017 -1.916 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -7.767 -16.766 -1.794 1.00 0.00 H new ATOM 1122 N PRO A 74 -2.424 -15.725 -3.546 1.00 0.00 N ATOM 1123 CA PRO A 74 -1.091 -16.239 -3.814 1.00 0.00 C ATOM 1124 C PRO A 74 -1.087 -17.127 -5.060 1.00 0.00 C ATOM 1125 O PRO A 74 -1.900 -18.043 -5.177 1.00 0.00 O ATOM 1126 CB PRO A 74 -0.696 -16.986 -2.551 1.00 0.00 C ATOM 1127 CG PRO A 74 -1.993 -17.258 -1.805 1.00 0.00 C ATOM 1128 CD PRO A 74 -3.077 -16.391 -2.424 1.00 0.00 C ATOM 0 HA PRO A 74 -0.372 -15.450 -4.035 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -0.182 -17.916 -2.792 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -0.013 -16.392 -1.943 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -2.260 -18.312 -1.876 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -1.879 -17.029 -0.745 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -3.922 -16.993 -2.758 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -3.464 -15.668 -1.706 1.00 0.00 H new ATOM 1136 N ALA A 75 -0.162 -16.826 -5.959 1.00 0.00 N ATOM 1137 CA ALA A 75 -0.040 -17.586 -7.192 1.00 0.00 C ATOM 1138 C ALA A 75 1.431 -17.928 -7.433 1.00 0.00 C ATOM 1139 O ALA A 75 2.319 -17.326 -6.830 1.00 0.00 O ATOM 1140 CB ALA A 75 -0.650 -16.787 -8.346 1.00 0.00 C ATOM 0 H ALA A 75 0.511 -16.066 -5.858 1.00 0.00 H new ATOM 0 HA ALA A 75 -0.588 -18.525 -7.120 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -0.559 -17.356 -9.271 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -1.703 -16.596 -8.140 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -0.123 -15.839 -8.450 1.00 0.00 H new ATOM 1146 N GLY A 76 1.645 -18.893 -8.315 1.00 0.00 N ATOM 1147 CA GLY A 76 2.994 -19.322 -8.643 1.00 0.00 C ATOM 1148 C GLY A 76 3.463 -20.427 -7.695 1.00 0.00 C ATOM 1149 O GLY A 76 2.810 -21.463 -7.572 1.00 0.00 O ATOM 0 H GLY A 76 0.907 -19.390 -8.813 1.00 0.00 H new ATOM 0 HA2 GLY A 76 3.025 -19.683 -9.671 1.00 0.00 H new ATOM 0 HA3 GLY A 76 3.675 -18.473 -8.582 1.00 0.00 H new ATOM 1153 N ASP A 77 4.591 -20.170 -7.050 1.00 0.00 N ATOM 1154 CA ASP A 77 5.155 -21.131 -6.117 1.00 0.00 C ATOM 1155 C ASP A 77 5.740 -20.385 -4.916 1.00 0.00 C ATOM 1156 O ASP A 77 5.367 -20.650 -3.774 1.00 0.00 O ATOM 1157 CB ASP A 77 6.281 -21.936 -6.769 1.00 0.00 C ATOM 1158 CG ASP A 77 6.477 -23.345 -6.207 1.00 0.00 C ATOM 1159 OD1 ASP A 77 5.511 -23.852 -5.596 1.00 0.00 O ATOM 1160 OD2 ASP A 77 7.587 -23.885 -6.402 1.00 0.00 O ATOM 0 H ASP A 77 5.130 -19.310 -7.155 1.00 0.00 H new ATOM 0 HA ASP A 77 4.360 -21.809 -5.808 1.00 0.00 H new ATOM 0 HB2 ASP A 77 6.081 -22.012 -7.838 1.00 0.00 H new ATOM 0 HB3 ASP A 77 7.214 -21.384 -6.658 1.00 0.00 H new ATOM 1165 N LEU A 78 6.648 -19.467 -5.215 1.00 0.00 N ATOM 1166 CA LEU A 78 7.289 -18.682 -4.174 1.00 0.00 C ATOM 1167 C LEU A 78 6.245 -18.278 -3.130 1.00 0.00 C ATOM 1168 O LEU A 78 6.160 -18.885 -2.064 1.00 0.00 O ATOM 1169 CB LEU A 78 8.040 -17.497 -4.783 1.00 0.00 C ATOM 1170 CG LEU A 78 9.336 -17.833 -5.525 1.00 0.00 C ATOM 1171 CD1 LEU A 78 9.472 -16.995 -6.797 1.00 0.00 C ATOM 1172 CD2 LEU A 78 10.549 -17.682 -4.605 1.00 0.00 C ATOM 0 H LEU A 78 6.955 -19.250 -6.163 1.00 0.00 H new ATOM 0 HA LEU A 78 8.043 -19.276 -3.658 1.00 0.00 H new ATOM 0 HB2 LEU A 78 7.371 -16.985 -5.475 1.00 0.00 H new ATOM 0 HB3 LEU A 78 8.274 -16.792 -3.985 1.00 0.00 H new ATOM 0 HG LEU A 78 9.294 -18.878 -5.832 1.00 0.00 H new ATOM 0 HD11 LEU A 78 10.401 -17.253 -7.305 1.00 0.00 H new ATOM 0 HD12 LEU A 78 8.629 -17.197 -7.458 1.00 0.00 H new ATOM 0 HD13 LEU A 78 9.483 -15.937 -6.536 1.00 0.00 H new ATOM 0 HD21 LEU A 78 11.457 -17.927 -5.157 1.00 0.00 H new ATOM 0 HD22 LEU A 78 10.608 -16.654 -4.246 1.00 0.00 H new ATOM 0 HD23 LEU A 78 10.448 -18.357 -3.755 1.00 0.00 H new ATOM 1184 N SER A 79 5.477 -17.255 -3.475 1.00 0.00 N ATOM 1185 CA SER A 79 4.442 -16.762 -2.581 1.00 0.00 C ATOM 1186 C SER A 79 3.769 -17.934 -1.863 1.00 0.00 C ATOM 1187 O SER A 79 3.860 -18.053 -0.643 1.00 0.00 O ATOM 1188 CB SER A 79 3.402 -15.939 -3.344 1.00 0.00 C ATOM 1189 OG SER A 79 2.070 -16.332 -3.023 1.00 0.00 O ATOM 0 H SER A 79 5.550 -16.754 -4.360 1.00 0.00 H new ATOM 0 HA SER A 79 4.909 -16.112 -1.842 1.00 0.00 H new ATOM 0 HB2 SER A 79 3.534 -14.882 -3.111 1.00 0.00 H new ATOM 0 HB3 SER A 79 3.565 -16.052 -4.416 1.00 0.00 H new ATOM 0 HG SER A 79 1.439 -15.676 -3.385 1.00 0.00 H new ATOM 1195 N LYS A 80 3.109 -18.769 -2.652 1.00 0.00 N ATOM 1196 CA LYS A 80 2.421 -19.927 -2.107 1.00 0.00 C ATOM 1197 C LYS A 80 3.307 -20.591 -1.051 1.00 0.00 C ATOM 1198 O LYS A 80 2.945 -20.644 0.123 1.00 0.00 O ATOM 1199 CB LYS A 80 1.991 -20.872 -3.231 1.00 0.00 C ATOM 1200 CG LYS A 80 0.673 -20.413 -3.859 1.00 0.00 C ATOM 1201 CD LYS A 80 0.342 -21.239 -5.104 1.00 0.00 C ATOM 1202 CE LYS A 80 -0.771 -22.248 -4.812 1.00 0.00 C ATOM 1203 NZ LYS A 80 -1.975 -21.937 -5.614 1.00 0.00 N ATOM 0 H LYS A 80 3.036 -18.667 -3.664 1.00 0.00 H new ATOM 0 HA LYS A 80 1.501 -19.623 -1.607 1.00 0.00 H new ATOM 0 HB2 LYS A 80 2.768 -20.912 -3.995 1.00 0.00 H new ATOM 0 HB3 LYS A 80 1.878 -21.883 -2.838 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -0.133 -20.507 -3.131 1.00 0.00 H new ATOM 0 HG3 LYS A 80 0.741 -19.358 -4.125 1.00 0.00 H new ATOM 0 HD2 LYS A 80 0.034 -20.577 -5.913 1.00 0.00 H new ATOM 0 HD3 LYS A 80 1.234 -21.765 -5.444 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -0.425 -23.256 -5.040 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -1.019 -22.228 -3.751 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -2.721 -22.631 -5.404 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -2.313 -20.983 -5.377 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -1.738 -21.979 -6.626 1.00 0.00 H new ATOM 1217 N ASN A 81 4.451 -21.080 -1.507 1.00 0.00 N ATOM 1218 CA ASN A 81 5.391 -21.739 -0.615 1.00 0.00 C ATOM 1219 C ASN A 81 5.421 -20.999 0.723 1.00 0.00 C ATOM 1220 O ASN A 81 5.617 -21.612 1.771 1.00 0.00 O ATOM 1221 CB ASN A 81 6.806 -21.721 -1.197 1.00 0.00 C ATOM 1222 CG ASN A 81 7.408 -23.127 -1.216 1.00 0.00 C ATOM 1223 OD1 ASN A 81 8.183 -23.510 -0.355 1.00 0.00 O ATOM 1224 ND2 ASN A 81 7.011 -23.872 -2.244 1.00 0.00 N ATOM 0 H ASN A 81 4.748 -21.033 -2.482 1.00 0.00 H new ATOM 0 HA ASN A 81 5.067 -22.772 -0.485 1.00 0.00 H new ATOM 0 HB2 ASN A 81 6.782 -21.318 -2.210 1.00 0.00 H new ATOM 0 HB3 ASN A 81 7.438 -21.059 -0.606 1.00 0.00 H new ATOM 0 HD21 ASN A 81 7.358 -24.826 -2.347 1.00 0.00 H new ATOM 0 HD22 ASN A 81 6.360 -23.490 -2.930 1.00 0.00 H new ATOM 1231 N ALA A 82 5.223 -19.691 0.645 1.00 0.00 N ATOM 1232 CA ALA A 82 5.225 -18.861 1.838 1.00 0.00 C ATOM 1233 C ALA A 82 3.914 -19.067 2.599 1.00 0.00 C ATOM 1234 O ALA A 82 3.922 -19.488 3.755 1.00 0.00 O ATOM 1235 CB ALA A 82 5.448 -17.400 1.443 1.00 0.00 C ATOM 0 H ALA A 82 5.060 -19.186 -0.226 1.00 0.00 H new ATOM 0 HA ALA A 82 6.040 -19.146 2.503 1.00 0.00 H new ATOM 0 HB1 ALA A 82 5.449 -16.777 2.338 1.00 0.00 H new ATOM 0 HB2 ALA A 82 6.406 -17.303 0.932 1.00 0.00 H new ATOM 0 HB3 ALA A 82 4.648 -17.077 0.777 1.00 0.00 H new ATOM 1241 N ALA A 83 2.819 -18.759 1.920 1.00 0.00 N ATOM 1242 CA ALA A 83 1.502 -18.905 2.518 1.00 0.00 C ATOM 1243 C ALA A 83 1.424 -20.247 3.248 1.00 0.00 C ATOM 1244 O ALA A 83 0.659 -20.397 4.199 1.00 0.00 O ATOM 1245 CB ALA A 83 0.431 -18.767 1.434 1.00 0.00 C ATOM 0 H ALA A 83 2.816 -18.409 0.962 1.00 0.00 H new ATOM 0 HA ALA A 83 1.325 -18.120 3.253 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -0.557 -18.876 1.882 1.00 0.00 H new ATOM 0 HB2 ALA A 83 0.511 -17.785 0.967 1.00 0.00 H new ATOM 0 HB3 ALA A 83 0.575 -19.541 0.680 1.00 0.00 H new ATOM 1251 N ASP A 84 2.226 -21.189 2.775 1.00 0.00 N ATOM 1252 CA ASP A 84 2.258 -22.514 3.371 1.00 0.00 C ATOM 1253 C ASP A 84 2.580 -22.391 4.862 1.00 0.00 C ATOM 1254 O ASP A 84 1.786 -22.797 5.708 1.00 0.00 O ATOM 1255 CB ASP A 84 3.337 -23.384 2.724 1.00 0.00 C ATOM 1256 CG ASP A 84 2.854 -24.743 2.215 1.00 0.00 C ATOM 1257 OD1 ASP A 84 2.097 -25.394 2.967 1.00 0.00 O ATOM 1258 OD2 ASP A 84 3.252 -25.101 1.085 1.00 0.00 O ATOM 0 H ASP A 84 2.859 -21.061 1.985 1.00 0.00 H new ATOM 0 HA ASP A 84 1.283 -22.976 3.217 1.00 0.00 H new ATOM 0 HB2 ASP A 84 3.773 -22.835 1.890 1.00 0.00 H new ATOM 0 HB3 ASP A 84 4.134 -23.547 3.449 1.00 0.00 H new ATOM 1263 N GLY A 85 3.748 -21.828 5.137 1.00 0.00 N ATOM 1264 CA GLY A 85 4.185 -21.646 6.511 1.00 0.00 C ATOM 1265 C GLY A 85 5.696 -21.417 6.579 1.00 0.00 C ATOM 1266 O GLY A 85 6.424 -22.216 7.167 1.00 0.00 O ATOM 0 H GLY A 85 4.404 -21.492 4.432 1.00 0.00 H new ATOM 0 HA2 GLY A 85 3.664 -20.796 6.953 1.00 0.00 H new ATOM 0 HA3 GLY A 85 3.920 -22.524 7.100 1.00 0.00 H new ATOM 1270 N ILE A 86 6.124 -20.321 5.969 1.00 0.00 N ATOM 1271 CA ILE A 86 7.536 -19.976 5.953 1.00 0.00 C ATOM 1272 C ILE A 86 7.904 -19.291 7.271 1.00 0.00 C ATOM 1273 O ILE A 86 8.531 -19.899 8.136 1.00 0.00 O ATOM 1274 CB ILE A 86 7.870 -19.144 4.713 1.00 0.00 C ATOM 1275 CG1 ILE A 86 8.106 -20.042 3.497 1.00 0.00 C ATOM 1276 CG2 ILE A 86 9.057 -18.216 4.979 1.00 0.00 C ATOM 1277 CD1 ILE A 86 9.464 -20.741 3.587 1.00 0.00 C ATOM 0 H ILE A 86 5.518 -19.660 5.482 1.00 0.00 H new ATOM 0 HA ILE A 86 8.147 -20.875 5.879 1.00 0.00 H new ATOM 0 HB ILE A 86 7.012 -18.512 4.485 1.00 0.00 H new ATOM 0 HG12 ILE A 86 7.313 -20.787 3.431 1.00 0.00 H new ATOM 0 HG13 ILE A 86 8.060 -19.446 2.586 1.00 0.00 H new ATOM 0 HG21 ILE A 86 9.274 -17.636 4.082 1.00 0.00 H new ATOM 0 HG22 ILE A 86 8.814 -17.540 5.798 1.00 0.00 H new ATOM 0 HG23 ILE A 86 9.931 -18.810 5.247 1.00 0.00 H new ATOM 0 HD11 ILE A 86 9.607 -21.373 2.710 1.00 0.00 H new ATOM 0 HD12 ILE A 86 10.256 -19.993 3.628 1.00 0.00 H new ATOM 0 HD13 ILE A 86 9.498 -21.355 4.487 1.00 0.00 H new ATOM 1289 N ALA A 87 7.497 -18.035 7.382 1.00 0.00 N ATOM 1290 CA ALA A 87 7.776 -17.261 8.579 1.00 0.00 C ATOM 1291 C ALA A 87 6.571 -16.376 8.902 1.00 0.00 C ATOM 1292 O ALA A 87 5.428 -16.773 8.681 1.00 0.00 O ATOM 1293 CB ALA A 87 9.057 -16.449 8.376 1.00 0.00 C ATOM 0 H ALA A 87 6.976 -17.534 6.662 1.00 0.00 H new ATOM 0 HA ALA A 87 7.939 -17.920 9.432 1.00 0.00 H new ATOM 0 HB1 ALA A 87 9.266 -15.868 9.274 1.00 0.00 H new ATOM 0 HB2 ALA A 87 9.889 -17.125 8.179 1.00 0.00 H new ATOM 0 HB3 ALA A 87 8.930 -15.774 7.529 1.00 0.00 H new ATOM 1299 N GLU A 88 6.867 -15.192 9.418 1.00 0.00 N ATOM 1300 CA GLU A 88 5.822 -14.248 9.773 1.00 0.00 C ATOM 1301 C GLU A 88 5.586 -13.261 8.627 1.00 0.00 C ATOM 1302 O GLU A 88 4.915 -12.246 8.806 1.00 0.00 O ATOM 1303 CB GLU A 88 6.166 -13.510 11.069 1.00 0.00 C ATOM 1304 CG GLU A 88 5.037 -13.646 12.093 1.00 0.00 C ATOM 1305 CD GLU A 88 4.201 -12.366 12.160 1.00 0.00 C ATOM 1306 OE1 GLU A 88 3.421 -12.148 11.209 1.00 0.00 O ATOM 1307 OE2 GLU A 88 4.361 -11.636 13.162 1.00 0.00 O ATOM 0 H GLU A 88 7.816 -14.865 9.599 1.00 0.00 H new ATOM 0 HA GLU A 88 4.900 -14.804 9.944 1.00 0.00 H new ATOM 0 HB2 GLU A 88 7.090 -13.911 11.486 1.00 0.00 H new ATOM 0 HB3 GLU A 88 6.343 -12.456 10.856 1.00 0.00 H new ATOM 0 HG2 GLU A 88 4.399 -14.488 11.826 1.00 0.00 H new ATOM 0 HG3 GLU A 88 5.456 -13.863 13.075 1.00 0.00 H new ATOM 1314 N ASN A 89 6.151 -13.595 7.476 1.00 0.00 N ATOM 1315 CA ASN A 89 6.010 -12.752 6.302 1.00 0.00 C ATOM 1316 C ASN A 89 5.720 -13.628 5.082 1.00 0.00 C ATOM 1317 O ASN A 89 6.641 -14.126 4.437 1.00 0.00 O ATOM 1318 CB ASN A 89 7.297 -11.971 6.027 1.00 0.00 C ATOM 1319 CG ASN A 89 7.509 -10.877 7.076 1.00 0.00 C ATOM 1320 OD1 ASN A 89 7.515 -11.121 8.272 1.00 0.00 O ATOM 1321 ND2 ASN A 89 7.683 -9.663 6.563 1.00 0.00 N ATOM 0 H ASN A 89 6.707 -14.438 7.332 1.00 0.00 H new ATOM 0 HA ASN A 89 5.195 -12.052 6.486 1.00 0.00 H new ATOM 0 HB2 ASN A 89 8.148 -12.652 6.030 1.00 0.00 H new ATOM 0 HB3 ASN A 89 7.250 -11.524 5.034 1.00 0.00 H new ATOM 0 HD21 ASN A 89 7.833 -8.865 7.180 1.00 0.00 H new ATOM 0 HD22 ASN A 89 7.666 -9.529 5.552 1.00 0.00 H new ATOM 1328 N PRO A 90 4.401 -13.793 4.794 1.00 0.00 N ATOM 1329 CA PRO A 90 3.977 -14.601 3.662 1.00 0.00 C ATOM 1330 C PRO A 90 4.208 -13.860 2.343 1.00 0.00 C ATOM 1331 O PRO A 90 4.338 -14.484 1.292 1.00 0.00 O ATOM 1332 CB PRO A 90 2.511 -14.906 3.924 1.00 0.00 C ATOM 1333 CG PRO A 90 2.047 -13.879 4.944 1.00 0.00 C ATOM 1334 CD PRO A 90 3.282 -13.218 5.535 1.00 0.00 C ATOM 0 HA PRO A 90 4.550 -15.523 3.564 1.00 0.00 H new ATOM 0 HB2 PRO A 90 1.927 -14.836 3.006 1.00 0.00 H new ATOM 0 HB3 PRO A 90 2.385 -15.919 4.305 1.00 0.00 H new ATOM 0 HG2 PRO A 90 1.405 -13.135 4.472 1.00 0.00 H new ATOM 0 HG3 PRO A 90 1.458 -14.357 5.727 1.00 0.00 H new ATOM 0 HD2 PRO A 90 3.245 -12.135 5.419 1.00 0.00 H new ATOM 0 HD3 PRO A 90 3.368 -13.422 6.602 1.00 0.00 H new ATOM 1342 N PHE A 91 4.251 -12.540 2.443 1.00 0.00 N ATOM 1343 CA PHE A 91 4.464 -11.708 1.271 1.00 0.00 C ATOM 1344 C PHE A 91 5.955 -11.568 0.961 1.00 0.00 C ATOM 1345 O PHE A 91 6.742 -11.199 1.831 1.00 0.00 O ATOM 1346 CB PHE A 91 3.891 -10.326 1.593 1.00 0.00 C ATOM 1347 CG PHE A 91 3.375 -9.566 0.370 1.00 0.00 C ATOM 1348 CD1 PHE A 91 2.096 -9.747 -0.054 1.00 0.00 C ATOM 1349 CD2 PHE A 91 4.196 -8.708 -0.293 1.00 0.00 C ATOM 1350 CE1 PHE A 91 1.617 -9.041 -1.190 1.00 0.00 C ATOM 1351 CE2 PHE A 91 3.717 -8.002 -1.429 1.00 0.00 C ATOM 1352 CZ PHE A 91 2.438 -8.183 -1.853 1.00 0.00 C ATOM 0 H PHE A 91 4.142 -12.026 3.317 1.00 0.00 H new ATOM 0 HA PHE A 91 3.981 -12.157 0.404 1.00 0.00 H new ATOM 0 HB2 PHE A 91 3.076 -10.439 2.308 1.00 0.00 H new ATOM 0 HB3 PHE A 91 4.662 -9.729 2.080 1.00 0.00 H new ATOM 0 HD1 PHE A 91 1.444 -10.428 0.473 1.00 0.00 H new ATOM 0 HD2 PHE A 91 5.212 -8.563 0.044 1.00 0.00 H new ATOM 0 HE1 PHE A 91 0.601 -9.186 -1.527 1.00 0.00 H new ATOM 0 HE2 PHE A 91 4.369 -7.321 -1.956 1.00 0.00 H new ATOM 0 HZ PHE A 91 2.074 -7.646 -2.716 1.00 0.00 H new ATOM 1362 N LEU A 92 6.299 -11.871 -0.282 1.00 0.00 N ATOM 1363 CA LEU A 92 7.683 -11.784 -0.718 1.00 0.00 C ATOM 1364 C LEU A 92 7.865 -10.532 -1.578 1.00 0.00 C ATOM 1365 O LEU A 92 7.148 -10.338 -2.558 1.00 0.00 O ATOM 1366 CB LEU A 92 8.106 -13.077 -1.419 1.00 0.00 C ATOM 1367 CG LEU A 92 8.071 -14.346 -0.564 1.00 0.00 C ATOM 1368 CD1 LEU A 92 6.678 -14.569 0.028 1.00 0.00 C ATOM 1369 CD2 LEU A 92 8.556 -15.558 -1.361 1.00 0.00 C ATOM 0 H LEU A 92 5.644 -12.177 -1.001 1.00 0.00 H new ATOM 0 HA LEU A 92 8.347 -11.681 0.141 1.00 0.00 H new ATOM 0 HB2 LEU A 92 7.459 -13.227 -2.283 1.00 0.00 H new ATOM 0 HB3 LEU A 92 9.119 -12.946 -1.799 1.00 0.00 H new ATOM 0 HG LEU A 92 8.759 -14.215 0.271 1.00 0.00 H new ATOM 0 HD11 LEU A 92 6.680 -15.477 0.631 1.00 0.00 H new ATOM 0 HD12 LEU A 92 6.408 -13.718 0.654 1.00 0.00 H new ATOM 0 HD13 LEU A 92 5.952 -14.671 -0.779 1.00 0.00 H new ATOM 0 HD21 LEU A 92 8.521 -16.446 -0.730 1.00 0.00 H new ATOM 0 HD22 LEU A 92 7.913 -15.704 -2.229 1.00 0.00 H new ATOM 0 HD23 LEU A 92 9.580 -15.389 -1.693 1.00 0.00 H new ATOM 1381 N ASP A 93 8.827 -9.714 -1.178 1.00 0.00 N ATOM 1382 CA ASP A 93 9.112 -8.485 -1.900 1.00 0.00 C ATOM 1383 C ASP A 93 9.737 -8.827 -3.253 1.00 0.00 C ATOM 1384 O ASP A 93 10.856 -8.408 -3.548 1.00 0.00 O ATOM 1385 CB ASP A 93 10.103 -7.611 -1.128 1.00 0.00 C ATOM 1386 CG ASP A 93 10.659 -6.419 -1.911 1.00 0.00 C ATOM 1387 OD1 ASP A 93 10.096 -6.136 -2.990 1.00 0.00 O ATOM 1388 OD2 ASP A 93 11.635 -5.818 -1.411 1.00 0.00 O ATOM 0 H ASP A 93 9.419 -9.878 -0.364 1.00 0.00 H new ATOM 0 HA ASP A 93 8.175 -7.943 -2.027 1.00 0.00 H new ATOM 0 HB2 ASP A 93 9.612 -7.239 -0.229 1.00 0.00 H new ATOM 0 HB3 ASP A 93 10.936 -8.233 -0.802 1.00 0.00 H new ATOM 1393 N SER A 94 8.988 -9.584 -4.041 1.00 0.00 N ATOM 1394 CA SER A 94 9.455 -9.987 -5.357 1.00 0.00 C ATOM 1395 C SER A 94 8.269 -10.119 -6.315 1.00 0.00 C ATOM 1396 O SER A 94 7.197 -10.576 -5.922 1.00 0.00 O ATOM 1397 CB SER A 94 10.230 -11.304 -5.287 1.00 0.00 C ATOM 1398 OG SER A 94 11.468 -11.233 -5.987 1.00 0.00 O ATOM 0 H SER A 94 8.061 -9.929 -3.794 1.00 0.00 H new ATOM 0 HA SER A 94 10.132 -9.218 -5.730 1.00 0.00 H new ATOM 0 HB2 SER A 94 10.418 -11.559 -4.244 1.00 0.00 H new ATOM 0 HB3 SER A 94 9.622 -12.105 -5.707 1.00 0.00 H new ATOM 0 HG SER A 94 11.933 -12.093 -5.917 1.00 0.00 H new ATOM 1404 N PRO A 95 8.508 -9.699 -7.586 1.00 0.00 N ATOM 1405 CA PRO A 95 7.473 -9.766 -8.603 1.00 0.00 C ATOM 1406 C PRO A 95 7.265 -11.205 -9.080 1.00 0.00 C ATOM 1407 O PRO A 95 6.442 -11.458 -9.959 1.00 0.00 O ATOM 1408 CB PRO A 95 7.947 -8.836 -9.709 1.00 0.00 C ATOM 1409 CG PRO A 95 9.438 -8.645 -9.482 1.00 0.00 C ATOM 1410 CD PRO A 95 9.766 -9.152 -8.087 1.00 0.00 C ATOM 0 HA PRO A 95 6.497 -9.455 -8.231 1.00 0.00 H new ATOM 0 HB2 PRO A 95 7.753 -9.267 -10.691 1.00 0.00 H new ATOM 0 HB3 PRO A 95 7.421 -7.882 -9.670 1.00 0.00 H new ATOM 0 HG2 PRO A 95 10.011 -9.191 -10.231 1.00 0.00 H new ATOM 0 HG3 PRO A 95 9.707 -7.593 -9.579 1.00 0.00 H new ATOM 0 HD2 PRO A 95 10.545 -9.913 -8.116 1.00 0.00 H new ATOM 0 HD3 PRO A 95 10.130 -8.347 -7.449 1.00 0.00 H new ATOM 1418 N ASP A 96 8.024 -12.109 -8.480 1.00 0.00 N ATOM 1419 CA ASP A 96 7.933 -13.516 -8.832 1.00 0.00 C ATOM 1420 C ASP A 96 6.768 -14.153 -8.073 1.00 0.00 C ATOM 1421 O ASP A 96 5.880 -14.751 -8.680 1.00 0.00 O ATOM 1422 CB ASP A 96 9.212 -14.263 -8.449 1.00 0.00 C ATOM 1423 CG ASP A 96 10.413 -13.999 -9.360 1.00 0.00 C ATOM 1424 OD1 ASP A 96 10.517 -12.851 -9.844 1.00 0.00 O ATOM 1425 OD2 ASP A 96 11.199 -14.951 -9.552 1.00 0.00 O ATOM 0 H ASP A 96 8.705 -11.895 -7.752 1.00 0.00 H new ATOM 0 HA ASP A 96 7.784 -13.585 -9.910 1.00 0.00 H new ATOM 0 HB2 ASP A 96 9.482 -13.991 -7.429 1.00 0.00 H new ATOM 0 HB3 ASP A 96 9.004 -15.333 -8.449 1.00 0.00 H new ATOM 1430 N ALA A 97 6.808 -14.004 -6.757 1.00 0.00 N ATOM 1431 CA ALA A 97 5.767 -14.557 -5.909 1.00 0.00 C ATOM 1432 C ALA A 97 4.403 -14.312 -6.557 1.00 0.00 C ATOM 1433 O ALA A 97 3.486 -15.119 -6.408 1.00 0.00 O ATOM 1434 CB ALA A 97 5.866 -13.943 -4.511 1.00 0.00 C ATOM 0 H ALA A 97 7.546 -13.508 -6.257 1.00 0.00 H new ATOM 0 HA ALA A 97 5.893 -15.634 -5.802 1.00 0.00 H new ATOM 0 HB1 ALA A 97 5.084 -14.358 -3.875 1.00 0.00 H new ATOM 0 HB2 ALA A 97 6.842 -14.170 -4.082 1.00 0.00 H new ATOM 0 HB3 ALA A 97 5.742 -12.862 -4.579 1.00 0.00 H new ATOM 1440 N PHE A 98 4.311 -13.195 -7.264 1.00 0.00 N ATOM 1441 CA PHE A 98 3.075 -12.834 -7.936 1.00 0.00 C ATOM 1442 C PHE A 98 1.912 -12.762 -6.944 1.00 0.00 C ATOM 1443 O PHE A 98 1.956 -13.387 -5.885 1.00 0.00 O ATOM 1444 CB PHE A 98 2.787 -13.930 -8.963 1.00 0.00 C ATOM 1445 CG PHE A 98 3.829 -14.027 -10.079 1.00 0.00 C ATOM 1446 CD1 PHE A 98 4.360 -12.895 -10.613 1.00 0.00 C ATOM 1447 CD2 PHE A 98 4.224 -15.245 -10.537 1.00 0.00 C ATOM 1448 CE1 PHE A 98 5.327 -12.985 -11.649 1.00 0.00 C ATOM 1449 CE2 PHE A 98 5.191 -15.335 -11.573 1.00 0.00 C ATOM 1450 CZ PHE A 98 5.722 -14.203 -12.107 1.00 0.00 C ATOM 0 H PHE A 98 5.073 -12.528 -7.386 1.00 0.00 H new ATOM 0 HA PHE A 98 3.179 -11.855 -8.404 1.00 0.00 H new ATOM 0 HB2 PHE A 98 2.730 -14.889 -8.449 1.00 0.00 H new ATOM 0 HB3 PHE A 98 1.809 -13.748 -9.408 1.00 0.00 H new ATOM 0 HD1 PHE A 98 4.046 -11.928 -10.249 1.00 0.00 H new ATOM 0 HD2 PHE A 98 3.802 -16.144 -10.113 1.00 0.00 H new ATOM 0 HE1 PHE A 98 5.749 -12.086 -12.073 1.00 0.00 H new ATOM 0 HE2 PHE A 98 5.505 -16.302 -11.937 1.00 0.00 H new ATOM 0 HZ PHE A 98 6.457 -14.271 -12.895 1.00 0.00 H new ATOM 1460 N TYR A 99 0.900 -11.995 -7.322 1.00 0.00 N ATOM 1461 CA TYR A 99 -0.272 -11.834 -6.478 1.00 0.00 C ATOM 1462 C TYR A 99 -1.401 -11.134 -7.237 1.00 0.00 C ATOM 1463 O TYR A 99 -1.180 -10.106 -7.876 1.00 0.00 O ATOM 1464 CB TYR A 99 0.167 -10.949 -5.310 1.00 0.00 C ATOM 1465 CG TYR A 99 0.917 -11.700 -4.208 1.00 0.00 C ATOM 1466 CD1 TYR A 99 0.470 -12.936 -3.789 1.00 0.00 C ATOM 1467 CD2 TYR A 99 2.040 -11.141 -3.633 1.00 0.00 C ATOM 1468 CE1 TYR A 99 1.175 -13.643 -2.751 1.00 0.00 C ATOM 1469 CE2 TYR A 99 2.745 -11.848 -2.595 1.00 0.00 C ATOM 1470 CZ TYR A 99 2.278 -13.064 -2.206 1.00 0.00 C ATOM 1471 OH TYR A 99 2.944 -13.732 -1.226 1.00 0.00 O ATOM 0 H TYR A 99 0.867 -11.478 -8.201 1.00 0.00 H new ATOM 0 HA TYR A 99 -0.645 -12.804 -6.149 1.00 0.00 H new ATOM 0 HB2 TYR A 99 0.805 -10.152 -5.691 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -0.713 -10.473 -4.877 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -0.409 -13.374 -4.239 1.00 0.00 H new ATOM 0 HD2 TYR A 99 2.390 -10.174 -3.961 1.00 0.00 H new ATOM 0 HE1 TYR A 99 0.835 -14.611 -2.413 1.00 0.00 H new ATOM 0 HE2 TYR A 99 3.625 -11.422 -2.136 1.00 0.00 H new ATOM 0 HH TYR A 99 2.497 -14.586 -1.050 1.00 0.00 H new ATOM 1481 N TYR A 100 -2.587 -11.718 -7.141 1.00 0.00 N ATOM 1482 CA TYR A 100 -3.751 -11.163 -7.810 1.00 0.00 C ATOM 1483 C TYR A 100 -4.967 -11.159 -6.882 1.00 0.00 C ATOM 1484 O TYR A 100 -5.089 -12.017 -6.009 1.00 0.00 O ATOM 1485 CB TYR A 100 -4.034 -12.084 -8.998 1.00 0.00 C ATOM 1486 CG TYR A 100 -4.440 -13.505 -8.600 1.00 0.00 C ATOM 1487 CD1 TYR A 100 -5.746 -13.775 -8.243 1.00 0.00 C ATOM 1488 CD2 TYR A 100 -3.501 -14.516 -8.599 1.00 0.00 C ATOM 1489 CE1 TYR A 100 -6.128 -15.112 -7.868 1.00 0.00 C ATOM 1490 CE2 TYR A 100 -3.884 -15.853 -8.225 1.00 0.00 C ATOM 1491 CZ TYR A 100 -5.178 -16.085 -7.878 1.00 0.00 C ATOM 1492 OH TYR A 100 -5.539 -17.348 -7.525 1.00 0.00 O ATOM 0 H TYR A 100 -2.766 -12.570 -6.610 1.00 0.00 H new ATOM 0 HA TYR A 100 -3.564 -10.133 -8.115 1.00 0.00 H new ATOM 0 HB2 TYR A 100 -4.828 -11.646 -9.603 1.00 0.00 H new ATOM 0 HB3 TYR A 100 -3.145 -12.134 -9.626 1.00 0.00 H new ATOM 0 HD1 TYR A 100 -6.481 -12.984 -8.245 1.00 0.00 H new ATOM 0 HD2 TYR A 100 -2.479 -14.305 -8.879 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -7.146 -15.337 -7.585 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -3.159 -16.654 -8.220 1.00 0.00 H new ATOM 0 HH TYR A 100 -4.759 -17.938 -7.579 1.00 0.00 H new ATOM 1502 N PHE A 101 -5.836 -10.183 -7.101 1.00 0.00 N ATOM 1503 CA PHE A 101 -7.038 -10.056 -6.295 1.00 0.00 C ATOM 1504 C PHE A 101 -8.009 -11.206 -6.574 1.00 0.00 C ATOM 1505 O PHE A 101 -8.153 -11.639 -7.716 1.00 0.00 O ATOM 1506 CB PHE A 101 -7.703 -8.736 -6.689 1.00 0.00 C ATOM 1507 CG PHE A 101 -6.730 -7.562 -6.815 1.00 0.00 C ATOM 1508 CD1 PHE A 101 -5.951 -7.208 -5.758 1.00 0.00 C ATOM 1509 CD2 PHE A 101 -6.645 -6.872 -7.984 1.00 0.00 C ATOM 1510 CE1 PHE A 101 -5.047 -6.119 -5.876 1.00 0.00 C ATOM 1511 CE2 PHE A 101 -5.741 -5.783 -8.101 1.00 0.00 C ATOM 1512 CZ PHE A 101 -4.962 -5.429 -7.045 1.00 0.00 C ATOM 0 H PHE A 101 -5.731 -9.473 -7.825 1.00 0.00 H new ATOM 0 HA PHE A 101 -6.781 -10.082 -5.236 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -8.219 -8.871 -7.640 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -8.462 -8.488 -5.947 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -6.020 -7.755 -4.829 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -7.265 -7.152 -8.823 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -4.427 -5.839 -5.037 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -5.672 -5.236 -9.030 1.00 0.00 H new ATOM 0 HZ PHE A 101 -4.276 -4.600 -7.134 1.00 0.00 H new ATOM 1522 N PRO A 102 -8.667 -11.679 -5.482 1.00 0.00 N ATOM 1523 CA PRO A 102 -9.620 -12.770 -5.598 1.00 0.00 C ATOM 1524 C PRO A 102 -10.931 -12.289 -6.222 1.00 0.00 C ATOM 1525 O PRO A 102 -11.929 -12.116 -5.524 1.00 0.00 O ATOM 1526 CB PRO A 102 -9.794 -13.292 -4.181 1.00 0.00 C ATOM 1527 CG PRO A 102 -9.296 -12.186 -3.265 1.00 0.00 C ATOM 1528 CD PRO A 102 -8.522 -11.191 -4.114 1.00 0.00 C ATOM 0 HA PRO A 102 -9.273 -13.562 -6.261 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -10.839 -13.527 -3.977 1.00 0.00 H new ATOM 0 HB3 PRO A 102 -9.225 -14.210 -4.030 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -10.133 -11.695 -2.769 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -8.659 -12.597 -2.482 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -8.924 -10.183 -4.008 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -7.474 -11.149 -3.818 1.00 0.00 H new ATOM 1536 N ASP A 103 -10.887 -12.086 -7.531 1.00 0.00 N ATOM 1537 CA ASP A 103 -12.059 -11.628 -8.257 1.00 0.00 C ATOM 1538 C ASP A 103 -11.701 -11.452 -9.735 1.00 0.00 C ATOM 1539 O ASP A 103 -12.514 -11.740 -10.612 1.00 0.00 O ATOM 1540 CB ASP A 103 -12.544 -10.278 -7.725 1.00 0.00 C ATOM 1541 CG ASP A 103 -13.736 -9.678 -8.474 1.00 0.00 C ATOM 1542 OD1 ASP A 103 -13.547 -9.339 -9.662 1.00 0.00 O ATOM 1543 OD2 ASP A 103 -14.809 -9.572 -7.841 1.00 0.00 O ATOM 0 H ASP A 103 -10.058 -12.230 -8.107 1.00 0.00 H new ATOM 0 HA ASP A 103 -12.847 -12.370 -8.129 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -12.815 -10.394 -6.676 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -11.716 -9.570 -7.764 1.00 0.00 H new ATOM 1548 N SER A 104 -10.484 -10.981 -9.964 1.00 0.00 N ATOM 1549 CA SER A 104 -10.009 -10.763 -11.320 1.00 0.00 C ATOM 1550 C SER A 104 -9.169 -11.957 -11.778 1.00 0.00 C ATOM 1551 O SER A 104 -9.677 -12.863 -12.437 1.00 0.00 O ATOM 1552 CB SER A 104 -9.195 -9.472 -11.418 1.00 0.00 C ATOM 1553 OG SER A 104 -9.887 -8.458 -12.141 1.00 0.00 O ATOM 0 H SER A 104 -9.813 -10.744 -9.234 1.00 0.00 H new ATOM 0 HA SER A 104 -10.875 -10.664 -11.974 1.00 0.00 H new ATOM 0 HB2 SER A 104 -8.967 -9.111 -10.415 1.00 0.00 H new ATOM 0 HB3 SER A 104 -8.243 -9.680 -11.906 1.00 0.00 H new ATOM 0 HG SER A 104 -9.335 -7.649 -12.180 1.00 0.00 H new ATOM 1559 N GLY A 105 -7.897 -11.920 -11.410 1.00 0.00 N ATOM 1560 CA GLY A 105 -6.981 -12.988 -11.774 1.00 0.00 C ATOM 1561 C GLY A 105 -7.251 -13.480 -13.197 1.00 0.00 C ATOM 1562 O GLY A 105 -7.851 -12.768 -14.001 1.00 0.00 O ATOM 0 H GLY A 105 -7.479 -11.167 -10.863 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -5.953 -12.633 -11.697 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -7.085 -13.816 -11.073 1.00 0.00 H new ATOM 1566 N PRO A 106 -6.784 -14.727 -13.472 1.00 0.00 N ATOM 1567 CA PRO A 106 -6.969 -15.323 -14.784 1.00 0.00 C ATOM 1568 C PRO A 106 -8.415 -15.785 -14.978 1.00 0.00 C ATOM 1569 O PRO A 106 -8.691 -16.984 -14.994 1.00 0.00 O ATOM 1570 CB PRO A 106 -5.968 -16.466 -14.842 1.00 0.00 C ATOM 1571 CG PRO A 106 -5.588 -16.760 -13.401 1.00 0.00 C ATOM 1572 CD PRO A 106 -6.069 -15.600 -12.545 1.00 0.00 C ATOM 0 HA PRO A 106 -6.794 -14.616 -15.595 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -6.405 -17.344 -15.318 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -5.092 -16.189 -15.428 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -6.043 -17.693 -13.069 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -4.509 -16.881 -13.308 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -6.721 -15.944 -11.742 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -5.233 -15.080 -12.076 1.00 0.00 H new ATOM 1580 N SER A 107 -9.300 -14.809 -15.120 1.00 0.00 N ATOM 1581 CA SER A 107 -10.711 -15.100 -15.311 1.00 0.00 C ATOM 1582 C SER A 107 -11.193 -14.504 -16.635 1.00 0.00 C ATOM 1583 O SER A 107 -11.828 -15.190 -17.435 1.00 0.00 O ATOM 1584 CB SER A 107 -11.547 -14.561 -14.150 1.00 0.00 C ATOM 1585 OG SER A 107 -12.931 -14.867 -14.301 1.00 0.00 O ATOM 0 H SER A 107 -9.067 -13.816 -15.107 1.00 0.00 H new ATOM 0 HA SER A 107 -10.836 -16.182 -15.340 1.00 0.00 H new ATOM 0 HB2 SER A 107 -11.182 -14.984 -13.214 1.00 0.00 H new ATOM 0 HB3 SER A 107 -11.420 -13.481 -14.083 1.00 0.00 H new ATOM 0 HG SER A 107 -13.431 -14.507 -13.539 1.00 0.00 H new ATOM 1591 N SER A 108 -10.874 -13.232 -16.825 1.00 0.00 N ATOM 1592 CA SER A 108 -11.267 -12.535 -18.038 1.00 0.00 C ATOM 1593 C SER A 108 -10.996 -11.036 -17.891 1.00 0.00 C ATOM 1594 O SER A 108 -10.146 -10.484 -18.588 1.00 0.00 O ATOM 1595 CB SER A 108 -12.743 -12.778 -18.360 1.00 0.00 C ATOM 1596 OG SER A 108 -12.928 -13.932 -19.175 1.00 0.00 O ATOM 0 H SER A 108 -10.348 -12.666 -16.159 1.00 0.00 H new ATOM 0 HA SER A 108 -10.674 -12.926 -18.864 1.00 0.00 H new ATOM 0 HB2 SER A 108 -13.302 -12.896 -17.432 1.00 0.00 H new ATOM 0 HB3 SER A 108 -13.152 -11.905 -18.869 1.00 0.00 H new ATOM 0 HG SER A 108 -12.497 -14.704 -18.752 1.00 0.00 H new ATOM 1602 N GLY A 109 -11.735 -10.420 -16.981 1.00 0.00 N ATOM 1603 CA GLY A 109 -11.585 -8.996 -16.734 1.00 0.00 C ATOM 1604 C GLY A 109 -12.653 -8.493 -15.761 1.00 0.00 C ATOM 1605 O GLY A 109 -12.495 -8.607 -14.546 1.00 0.00 O ATOM 0 H GLY A 109 -12.440 -10.881 -16.405 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -10.594 -8.796 -16.327 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -11.659 -8.450 -17.675 1.00 0.00 H new TER 1609 GLY A 109