USER MOD reduce.3.24.130724 H: found=0, std=0, add=1126, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1122 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 65 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 108 TYR OH : rot 180:sc= -0.117 USER MOD Set 2.1: A 27 THR OG1 : rot 180:sc= 0.00601 USER MOD Set 2.2: A 59 ASN : amide:sc= -2.13 K(o=-2.1,f=-3.6!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 143:sc= -0.199 (180deg=-0.985) USER MOD Single : A 4 HIS : no HD1:sc= -0.161 X(o=-0.16,f=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.102 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 71:sc= 1.19 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0.0266 USER MOD Single : A 14 ASN : amide:sc= -0.168 X(o=-0.17,f=-0.02) USER MOD Single : A 18 SER OG : rot 180:sc= -0.104 USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 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 25 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.0396) USER MOD Single : A 30 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0893) USER MOD Single : A 34 SER OG : rot -80:sc= 1.67 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 45 GLN : amide:sc= -0.122 X(o=-0.12,f=-0.4) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot -76:sc= -2.65! USER MOD Single : A 70 HIS : no HE2:sc= 0.086 X(o=0.086,f=-0.36) USER MOD Single : A 72 LYS NZ :NH3+ -133:sc= 1.3 (180deg=-0.0875) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 GLN : amide:sc= -0.56 K(o=-0.56,f=-5.3!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 TYR OH : rot 121:sc= -0.43 USER MOD Single : A 85 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0.0177 USER MOD Single : A 95 ASN : amide:sc= 0.08 K(o=0.08,f=-1.2) USER MOD Single : A 98 THR OG1 : rot 97:sc= 1.39 USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 102 SER OG : rot 85:sc= 1.17 USER MOD Single : A 104 ASN : amide:sc= -0.131 X(o=-0.13,f=-0.014) USER MOD Single : A 106 SER OG : rot 180:sc= 0.0255 USER MOD Single : A 110 SER OG : rot 91:sc= 0.378 USER MOD Single : A 116 LYS NZ :NH3+ -154:sc= -0.0756 (180deg=-0.404) USER MOD Single : A 121 GLN : amide:sc= 0 K(o=0,f=-2.5!) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 180:sc= -0.867 USER MOD Single : A 129 ASN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 132 GLN : amide:sc= 0.337 K(o=0.34,f=-3.5!) USER MOD Single : A 141 ASN : amide:sc= 0 X(o=0,f=-0.066) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -0.743 -0.126 2.920 1.00 42.40 N ATOM 2 CA MET A 1 0.066 -0.088 1.707 1.00 30.11 C ATOM 3 C MET A 1 0.679 1.294 1.505 1.00 61.10 C ATOM 4 O MET A 1 0.057 2.311 1.813 1.00 64.10 O ATOM 5 CB MET A 1 -0.782 -0.465 0.491 1.00 32.40 C ATOM 6 CG MET A 1 -2.018 0.403 0.319 1.00 44.33 C ATOM 7 SD MET A 1 -3.323 -0.422 -0.611 1.00 71.34 S ATOM 8 CE MET A 1 -3.946 0.936 -1.600 1.00 24.35 C ATOM 0 H1 MET A 1 -1.580 -0.722 2.760 1.00 42.40 H new ATOM 0 H2 MET A 1 -0.180 -0.521 3.700 1.00 42.40 H new ATOM 0 H3 MET A 1 -1.046 0.838 3.166 1.00 42.40 H new ATOM 0 HA MET A 1 0.874 -0.812 1.816 1.00 30.11 H new ATOM 0 HB2 MET A 1 -0.168 -0.391 -0.407 1.00 32.40 H new ATOM 0 HB3 MET A 1 -1.089 -1.507 0.582 1.00 32.40 H new ATOM 0 HG2 MET A 1 -2.399 0.684 1.301 1.00 44.33 H new ATOM 0 HG3 MET A 1 -1.741 1.325 -0.191 1.00 44.33 H new ATOM 0 HE1 MET A 1 -4.761 0.582 -2.231 1.00 24.35 H new ATOM 0 HE2 MET A 1 -4.311 1.726 -0.944 1.00 24.35 H new ATOM 0 HE3 MET A 1 -3.145 1.327 -2.227 1.00 24.35 H new ATOM 18 N VAL A 2 1.902 1.324 0.986 1.00 65.42 N ATOM 19 CA VAL A 2 2.599 2.581 0.742 1.00 62.00 C ATOM 20 C VAL A 2 2.326 3.586 1.856 1.00 73.35 C ATOM 21 O VAL A 2 1.683 4.616 1.652 1.00 61.01 O ATOM 22 CB VAL A 2 2.185 3.200 -0.606 1.00 72.02 C ATOM 23 CG1 VAL A 2 2.798 2.423 -1.761 1.00 54.14 C ATOM 24 CG2 VAL A 2 0.669 3.245 -0.728 1.00 2.23 C ATOM 0 H VAL A 2 2.431 0.491 0.726 1.00 65.42 H new ATOM 0 HA VAL A 2 3.664 2.352 0.716 1.00 62.00 H new ATOM 0 HB VAL A 2 2.561 4.222 -0.647 1.00 72.02 H new ATOM 0 HG11 VAL A 2 2.494 2.875 -2.705 1.00 54.14 H new ATOM 0 HG12 VAL A 2 3.885 2.447 -1.680 1.00 54.14 H new ATOM 0 HG13 VAL A 2 2.455 1.389 -1.727 1.00 54.14 H new ATOM 0 HG21 VAL A 2 0.394 3.685 -1.686 1.00 2.23 H new ATOM 0 HG22 VAL A 2 0.269 2.233 -0.665 1.00 2.23 H new ATOM 0 HG23 VAL A 2 0.257 3.849 0.080 1.00 2.23 H new ATOM 34 N PRO A 3 2.825 3.281 3.063 1.00 53.33 N ATOM 35 CA PRO A 3 2.648 4.146 4.233 1.00 31.23 C ATOM 36 C PRO A 3 3.444 5.442 4.122 1.00 30.35 C ATOM 37 O PRO A 3 4.656 5.458 4.341 1.00 51.23 O ATOM 38 CB PRO A 3 3.176 3.291 5.388 1.00 13.24 C ATOM 39 CG PRO A 3 4.140 2.350 4.753 1.00 31.23 C ATOM 40 CD PRO A 3 3.601 2.070 3.378 1.00 54.02 C ATOM 0 HA PRO A 3 1.611 4.460 4.355 1.00 31.23 H new ATOM 0 HB2 PRO A 3 3.663 3.906 6.145 1.00 13.24 H new ATOM 0 HB3 PRO A 3 2.368 2.754 5.885 1.00 13.24 H new ATOM 0 HG2 PRO A 3 5.136 2.789 4.700 1.00 31.23 H new ATOM 0 HG3 PRO A 3 4.227 1.431 5.332 1.00 31.23 H new ATOM 0 HD2 PRO A 3 4.403 1.908 2.657 1.00 54.02 H new ATOM 0 HD3 PRO A 3 2.976 1.177 3.366 1.00 54.02 H new ATOM 48 N HIS A 4 2.755 6.527 3.783 1.00 63.35 N ATOM 49 CA HIS A 4 3.399 7.828 3.644 1.00 51.32 C ATOM 50 C HIS A 4 4.116 8.220 4.932 1.00 14.15 C ATOM 51 O HIS A 4 5.286 8.602 4.913 1.00 22.05 O ATOM 52 CB HIS A 4 2.367 8.895 3.276 1.00 34.42 C ATOM 53 CG HIS A 4 2.974 10.209 2.894 1.00 54.31 C ATOM 54 ND1 HIS A 4 2.233 11.362 2.733 1.00 65.41 N ATOM 55 CD2 HIS A 4 4.259 10.551 2.642 1.00 12.21 C ATOM 56 CE1 HIS A 4 3.037 12.355 2.397 1.00 71.12 C ATOM 57 NE2 HIS A 4 4.272 11.890 2.335 1.00 34.35 N ATOM 0 H HIS A 4 1.752 6.531 3.600 1.00 63.35 H new ATOM 0 HA HIS A 4 4.137 7.757 2.845 1.00 51.32 H new ATOM 0 HB2 HIS A 4 1.759 8.530 2.448 1.00 34.42 H new ATOM 0 HB3 HIS A 4 1.696 9.046 4.121 1.00 34.42 H new ATOM 0 HD2 HIS A 4 5.115 9.893 2.676 1.00 12.21 H new ATOM 0 HE1 HIS A 4 2.736 13.374 2.205 1.00 71.12 H new ATOM 0 HE2 HIS A 4 5.100 12.436 2.098 1.00 34.35 H new ATOM 65 N THR A 5 3.405 8.124 6.052 1.00 20.21 N ATOM 66 CA THR A 5 3.972 8.470 7.349 1.00 20.13 C ATOM 67 C THR A 5 5.290 7.741 7.586 1.00 73.25 C ATOM 68 O THR A 5 6.277 8.343 8.010 1.00 40.15 O ATOM 69 CB THR A 5 2.999 8.133 8.495 1.00 5.23 C ATOM 70 OG1 THR A 5 1.663 8.037 7.991 1.00 13.01 O ATOM 71 CG2 THR A 5 3.061 9.192 9.586 1.00 54.34 C ATOM 0 H THR A 5 2.435 7.809 6.086 1.00 20.21 H new ATOM 0 HA THR A 5 4.152 9.545 7.338 1.00 20.13 H new ATOM 0 HB THR A 5 3.294 7.175 8.923 1.00 5.23 H new ATOM 0 HG1 THR A 5 1.051 7.821 8.725 1.00 13.01 H new ATOM 0 HG21 THR A 5 2.366 8.933 10.384 1.00 54.34 H new ATOM 0 HG22 THR A 5 4.073 9.241 9.988 1.00 54.34 H new ATOM 0 HG23 THR A 5 2.789 10.161 9.168 1.00 54.34 H new ATOM 79 N LEU A 6 5.299 6.442 7.308 1.00 25.34 N ATOM 80 CA LEU A 6 6.498 5.630 7.490 1.00 33.41 C ATOM 81 C LEU A 6 7.685 6.237 6.750 1.00 52.31 C ATOM 82 O LEU A 6 8.802 6.265 7.265 1.00 3.03 O ATOM 83 CB LEU A 6 6.250 4.203 6.997 1.00 64.05 C ATOM 84 CG LEU A 6 7.388 3.207 7.225 1.00 40.11 C ATOM 85 CD1 LEU A 6 7.620 2.994 8.713 1.00 44.13 C ATOM 86 CD2 LEU A 6 7.085 1.885 6.536 1.00 65.53 C ATOM 0 H LEU A 6 4.491 5.929 6.956 1.00 25.34 H new ATOM 0 HA LEU A 6 6.732 5.605 8.554 1.00 33.41 H new ATOM 0 HB2 LEU A 6 5.355 3.821 7.488 1.00 64.05 H new ATOM 0 HB3 LEU A 6 6.036 4.241 5.929 1.00 64.05 H new ATOM 0 HG LEU A 6 8.299 3.619 6.791 1.00 40.11 H new ATOM 0 HD11 LEU A 6 8.433 2.282 8.856 1.00 44.13 H new ATOM 0 HD12 LEU A 6 7.882 3.943 9.180 1.00 44.13 H new ATOM 0 HD13 LEU A 6 6.711 2.603 9.171 1.00 44.13 H new ATOM 0 HD21 LEU A 6 7.905 1.188 6.709 1.00 65.53 H new ATOM 0 HD22 LEU A 6 6.163 1.467 6.940 1.00 65.53 H new ATOM 0 HD23 LEU A 6 6.969 2.051 5.465 1.00 65.53 H new ATOM 98 N SER A 7 7.434 6.725 5.539 1.00 10.22 N ATOM 99 CA SER A 7 8.482 7.332 4.727 1.00 24.51 C ATOM 100 C SER A 7 8.768 8.758 5.186 1.00 51.45 C ATOM 101 O SER A 7 9.862 9.283 4.978 1.00 45.32 O ATOM 102 CB SER A 7 8.079 7.329 3.251 1.00 24.03 C ATOM 103 OG SER A 7 9.104 7.880 2.442 1.00 60.52 O ATOM 0 H SER A 7 6.514 6.712 5.099 1.00 10.22 H new ATOM 0 HA SER A 7 9.390 6.741 4.849 1.00 24.51 H new ATOM 0 HB2 SER A 7 7.867 6.309 2.931 1.00 24.03 H new ATOM 0 HB3 SER A 7 7.161 7.901 3.120 1.00 24.03 H new ATOM 0 HG SER A 7 8.823 7.866 1.503 1.00 60.52 H new ATOM 109 N THR A 8 7.775 9.382 5.811 1.00 15.32 N ATOM 110 CA THR A 8 7.917 10.748 6.298 1.00 15.55 C ATOM 111 C THR A 8 8.549 10.775 7.685 1.00 21.42 C ATOM 112 O THR A 8 8.673 11.833 8.302 1.00 0.44 O ATOM 113 CB THR A 8 6.556 11.470 6.353 1.00 25.44 C ATOM 114 OG1 THR A 8 5.792 11.163 5.182 1.00 34.44 O ATOM 115 CG2 THR A 8 6.746 12.975 6.461 1.00 2.11 C ATOM 0 H THR A 8 6.863 8.963 5.992 1.00 15.32 H new ATOM 0 HA THR A 8 8.568 11.267 5.595 1.00 15.55 H new ATOM 0 HB THR A 8 6.021 11.123 7.237 1.00 25.44 H new ATOM 0 HG1 THR A 8 5.488 10.232 5.225 1.00 34.44 H new ATOM 0 HG21 THR A 8 5.772 13.463 6.498 1.00 2.11 H new ATOM 0 HG22 THR A 8 7.303 13.207 7.369 1.00 2.11 H new ATOM 0 HG23 THR A 8 7.299 13.335 5.594 1.00 2.11 H new ATOM 123 N LEU A 9 8.949 9.604 8.170 1.00 14.21 N ATOM 124 CA LEU A 9 9.570 9.493 9.485 1.00 21.12 C ATOM 125 C LEU A 9 11.054 9.837 9.417 1.00 4.20 C ATOM 126 O LEU A 9 11.719 9.575 8.414 1.00 75.10 O ATOM 127 CB LEU A 9 9.388 8.079 10.039 1.00 31.31 C ATOM 128 CG LEU A 9 8.112 7.833 10.845 1.00 71.30 C ATOM 129 CD1 LEU A 9 7.957 6.353 11.161 1.00 3.24 C ATOM 130 CD2 LEU A 9 8.123 8.655 12.125 1.00 14.50 C ATOM 0 H LEU A 9 8.854 8.719 7.672 1.00 14.21 H new ATOM 0 HA LEU A 9 9.081 10.204 10.151 1.00 21.12 H new ATOM 0 HB2 LEU A 9 9.407 7.378 9.204 1.00 31.31 H new ATOM 0 HB3 LEU A 9 10.244 7.845 10.672 1.00 31.31 H new ATOM 0 HG LEU A 9 7.259 8.146 10.243 1.00 71.30 H new ATOM 0 HD11 LEU A 9 7.044 6.197 11.735 1.00 3.24 H new ATOM 0 HD12 LEU A 9 7.903 5.786 10.232 1.00 3.24 H new ATOM 0 HD13 LEU A 9 8.814 6.014 11.743 1.00 3.24 H new ATOM 0 HD21 LEU A 9 7.207 8.467 12.686 1.00 14.50 H new ATOM 0 HD22 LEU A 9 8.984 8.373 12.731 1.00 14.50 H new ATOM 0 HD23 LEU A 9 8.186 9.714 11.877 1.00 14.50 H new ATOM 142 N LYS A 10 11.570 10.425 10.491 1.00 21.34 N ATOM 143 CA LYS A 10 12.977 10.802 10.556 1.00 11.44 C ATOM 144 C LYS A 10 13.661 10.148 11.752 1.00 3.14 C ATOM 145 O LYS A 10 13.021 9.849 12.761 1.00 11.40 O ATOM 146 CB LYS A 10 13.114 12.324 10.646 1.00 21.04 C ATOM 147 CG LYS A 10 12.375 13.067 9.547 1.00 12.44 C ATOM 148 CD LYS A 10 11.343 14.025 10.119 1.00 52.21 C ATOM 149 CE LYS A 10 10.628 14.795 9.019 1.00 35.12 C ATOM 150 NZ LYS A 10 11.225 16.142 8.806 1.00 1.24 N ATOM 0 H LYS A 10 11.034 10.651 11.329 1.00 21.34 H new ATOM 0 HA LYS A 10 13.464 10.452 9.646 1.00 11.44 H new ATOM 0 HB2 LYS A 10 12.740 12.658 11.614 1.00 21.04 H new ATOM 0 HB3 LYS A 10 14.171 12.588 10.605 1.00 21.04 H new ATOM 0 HG2 LYS A 10 13.089 13.621 8.937 1.00 12.44 H new ATOM 0 HG3 LYS A 10 11.883 12.351 8.889 1.00 12.44 H new ATOM 0 HD2 LYS A 10 10.614 13.468 10.707 1.00 52.21 H new ATOM 0 HD3 LYS A 10 11.831 14.725 10.797 1.00 52.21 H new ATOM 0 HE2 LYS A 10 10.673 14.227 8.090 1.00 35.12 H new ATOM 0 HE3 LYS A 10 9.574 14.902 9.276 1.00 35.12 H new ATOM 0 HZ1 LYS A 10 10.710 16.634 8.049 1.00 1.24 H new ATOM 0 HZ2 LYS A 10 11.159 16.694 9.685 1.00 1.24 H new ATOM 0 HZ3 LYS A 10 12.224 16.040 8.535 1.00 1.24 H new ATOM 164 N THR A 11 14.967 9.929 11.634 1.00 22.33 N ATOM 165 CA THR A 11 15.738 9.310 12.705 1.00 3.43 C ATOM 166 C THR A 11 16.235 10.355 13.699 1.00 74.51 C ATOM 167 O THR A 11 16.026 11.553 13.511 1.00 72.42 O ATOM 168 CB THR A 11 16.946 8.531 12.151 1.00 53.23 C ATOM 169 OG1 THR A 11 17.827 9.422 11.458 1.00 63.00 O ATOM 170 CG2 THR A 11 16.491 7.426 11.209 1.00 13.24 C ATOM 0 H THR A 11 15.513 10.171 10.807 1.00 22.33 H new ATOM 0 HA THR A 11 15.070 8.615 13.214 1.00 3.43 H new ATOM 0 HB THR A 11 17.474 8.078 12.990 1.00 53.23 H new ATOM 0 HG1 THR A 11 18.593 8.920 11.110 1.00 63.00 H new ATOM 0 HG21 THR A 11 17.361 6.890 10.830 1.00 13.24 H new ATOM 0 HG22 THR A 11 15.843 6.733 11.747 1.00 13.24 H new ATOM 0 HG23 THR A 11 15.942 7.862 10.374 1.00 13.24 H new ATOM 178 N ALA A 12 16.893 9.892 14.757 1.00 42.14 N ATOM 179 CA ALA A 12 17.422 10.787 15.779 1.00 53.04 C ATOM 180 C ALA A 12 18.532 11.668 15.216 1.00 50.00 C ATOM 181 O ALA A 12 18.865 12.705 15.790 1.00 65.02 O ATOM 182 CB ALA A 12 17.932 9.987 16.968 1.00 33.01 C ATOM 0 H ALA A 12 17.072 8.903 14.929 1.00 42.14 H new ATOM 0 HA ALA A 12 16.613 11.437 16.112 1.00 53.04 H new ATOM 0 HB1 ALA A 12 18.324 10.668 17.723 1.00 33.01 H new ATOM 0 HB2 ALA A 12 17.114 9.406 17.393 1.00 33.01 H new ATOM 0 HB3 ALA A 12 18.724 9.313 16.641 1.00 33.01 H new ATOM 188 N ASP A 13 19.101 11.248 14.091 1.00 10.53 N ATOM 189 CA ASP A 13 20.174 12.000 13.451 1.00 61.02 C ATOM 190 C ASP A 13 19.623 12.907 12.355 1.00 2.32 C ATOM 191 O ASP A 13 20.331 13.257 11.412 1.00 52.42 O ATOM 192 CB ASP A 13 21.215 11.045 12.864 1.00 33.10 C ATOM 193 CG ASP A 13 22.092 10.418 13.930 1.00 12.41 C ATOM 194 OD1 ASP A 13 21.628 10.297 15.083 1.00 23.11 O ATOM 195 OD2 ASP A 13 23.242 10.050 13.612 1.00 42.53 O ATOM 0 H ASP A 13 18.837 10.392 13.604 1.00 10.53 H new ATOM 0 HA ASP A 13 20.650 12.623 14.208 1.00 61.02 H new ATOM 0 HB2 ASP A 13 20.708 10.258 12.306 1.00 33.10 H new ATOM 0 HB3 ASP A 13 21.841 11.586 12.155 1.00 33.10 H new ATOM 200 N ASN A 14 18.355 13.283 12.487 1.00 3.32 N ATOM 201 CA ASN A 14 17.709 14.149 11.507 1.00 33.53 C ATOM 202 C ASN A 14 17.878 13.594 10.096 1.00 34.42 C ATOM 203 O ASN A 14 17.919 14.346 9.123 1.00 3.50 O ATOM 204 CB ASN A 14 18.288 15.563 11.584 1.00 73.41 C ATOM 205 CG ASN A 14 17.321 16.612 11.070 1.00 61.13 C ATOM 206 OD1 ASN A 14 17.633 17.357 10.141 1.00 71.04 O ATOM 207 ND2 ASN A 14 16.140 16.675 11.674 1.00 61.22 N ATOM 0 H ASN A 14 17.755 13.002 13.262 1.00 3.32 H new ATOM 0 HA ASN A 14 16.645 14.187 11.738 1.00 33.53 H new ATOM 0 HB2 ASN A 14 18.550 15.790 12.617 1.00 73.41 H new ATOM 0 HB3 ASN A 14 19.210 15.607 11.004 1.00 73.41 H new ATOM 0 HD21 ASN A 14 15.449 17.361 11.372 1.00 61.22 H new ATOM 0 HD22 ASN A 14 15.924 16.037 12.440 1.00 61.22 H new ATOM 214 N ARG A 15 17.974 12.272 9.994 1.00 54.04 N ATOM 215 CA ARG A 15 18.138 11.616 8.702 1.00 25.01 C ATOM 216 C ARG A 15 16.876 10.851 8.316 1.00 50.13 C ATOM 217 O ARG A 15 16.031 10.535 9.154 1.00 40.24 O ATOM 218 CB ARG A 15 19.334 10.662 8.739 1.00 1.45 C ATOM 219 CG ARG A 15 20.610 11.263 8.172 1.00 20.24 C ATOM 220 CD ARG A 15 21.778 10.295 8.282 1.00 11.03 C ATOM 221 NE ARG A 15 22.756 10.495 7.217 1.00 65.02 N ATOM 222 CZ ARG A 15 23.585 11.532 7.165 1.00 22.23 C ATOM 223 NH1 ARG A 15 23.554 12.457 8.114 1.00 40.50 N ATOM 224 NH2 ARG A 15 24.448 11.644 6.163 1.00 11.03 N ATOM 0 H ARG A 15 17.941 11.635 10.790 1.00 54.04 H new ATOM 0 HA ARG A 15 18.319 12.386 7.952 1.00 25.01 H new ATOM 0 HB2 ARG A 15 19.513 10.357 9.770 1.00 1.45 H new ATOM 0 HB3 ARG A 15 19.087 9.761 8.178 1.00 1.45 H new ATOM 0 HG2 ARG A 15 20.455 11.530 7.127 1.00 20.24 H new ATOM 0 HG3 ARG A 15 20.848 12.184 8.704 1.00 20.24 H new ATOM 0 HD2 ARG A 15 22.264 10.422 9.249 1.00 11.03 H new ATOM 0 HD3 ARG A 15 21.405 9.271 8.244 1.00 11.03 H new ATOM 0 HE ARG A 15 22.806 9.800 6.472 1.00 65.02 H new ATOM 0 HH11 ARG A 15 22.893 12.373 8.886 1.00 40.50 H new ATOM 0 HH12 ARG A 15 24.191 13.252 8.072 1.00 40.50 H new ATOM 0 HH21 ARG A 15 24.475 10.934 5.432 1.00 11.03 H new ATOM 0 HH22 ARG A 15 25.084 12.441 6.124 1.00 11.03 H new ATOM 238 N PRO A 16 16.743 10.546 7.016 1.00 11.03 N ATOM 239 CA PRO A 16 15.587 9.815 6.489 1.00 31.22 C ATOM 240 C PRO A 16 15.572 8.356 6.934 1.00 55.31 C ATOM 241 O PRO A 16 16.528 7.617 6.702 1.00 35.12 O ATOM 242 CB PRO A 16 15.769 9.909 4.972 1.00 10.53 C ATOM 243 CG PRO A 16 17.234 10.097 4.778 1.00 60.45 C ATOM 244 CD PRO A 16 17.711 10.891 5.962 1.00 61.02 C ATOM 0 HA PRO A 16 14.645 10.231 6.846 1.00 31.22 H new ATOM 0 HB2 PRO A 16 15.416 9.006 4.474 1.00 10.53 H new ATOM 0 HB3 PRO A 16 15.204 10.743 4.556 1.00 10.53 H new ATOM 0 HG2 PRO A 16 17.746 9.137 4.721 1.00 60.45 H new ATOM 0 HG3 PRO A 16 17.440 10.624 3.846 1.00 60.45 H new ATOM 0 HD2 PRO A 16 18.728 10.619 6.245 1.00 61.02 H new ATOM 0 HD3 PRO A 16 17.714 11.961 5.754 1.00 61.02 H new ATOM 252 N ALA A 17 14.480 7.949 7.573 1.00 20.03 N ATOM 253 CA ALA A 17 14.340 6.578 8.048 1.00 12.02 C ATOM 254 C ALA A 17 13.944 5.641 6.912 1.00 41.22 C ATOM 255 O ALA A 17 13.816 4.433 7.107 1.00 35.31 O ATOM 256 CB ALA A 17 13.315 6.511 9.171 1.00 25.42 C ATOM 0 H ALA A 17 13.680 8.549 7.774 1.00 20.03 H new ATOM 0 HA ALA A 17 15.307 6.252 8.432 1.00 12.02 H new ATOM 0 HB1 ALA A 17 13.220 5.481 9.516 1.00 25.42 H new ATOM 0 HB2 ALA A 17 13.639 7.143 9.998 1.00 25.42 H new ATOM 0 HB3 ALA A 17 12.350 6.861 8.804 1.00 25.42 H new ATOM 262 N SER A 18 13.752 6.207 5.725 1.00 74.05 N ATOM 263 CA SER A 18 13.366 5.422 4.557 1.00 12.45 C ATOM 264 C SER A 18 14.497 4.491 4.131 1.00 53.43 C ATOM 265 O SER A 18 14.268 3.327 3.804 1.00 31.45 O ATOM 266 CB SER A 18 12.986 6.346 3.399 1.00 53.04 C ATOM 267 OG SER A 18 14.019 6.401 2.430 1.00 12.13 O ATOM 0 H SER A 18 13.857 7.206 5.546 1.00 74.05 H new ATOM 0 HA SER A 18 12.502 4.815 4.826 1.00 12.45 H new ATOM 0 HB2 SER A 18 12.066 5.992 2.934 1.00 53.04 H new ATOM 0 HB3 SER A 18 12.786 7.348 3.779 1.00 53.04 H new ATOM 0 HG SER A 18 13.751 6.997 1.699 1.00 12.13 H new ATOM 273 N VAL A 19 15.719 5.014 4.136 1.00 51.23 N ATOM 274 CA VAL A 19 16.887 4.231 3.750 1.00 11.25 C ATOM 275 C VAL A 19 17.079 3.037 4.679 1.00 53.22 C ATOM 276 O VAL A 19 17.789 2.087 4.347 1.00 14.53 O ATOM 277 CB VAL A 19 18.167 5.088 3.764 1.00 55.44 C ATOM 278 CG1 VAL A 19 19.353 4.286 3.251 1.00 35.43 C ATOM 279 CG2 VAL A 19 17.970 6.351 2.938 1.00 60.22 C ATOM 0 H VAL A 19 15.926 5.976 4.403 1.00 51.23 H new ATOM 0 HA VAL A 19 16.708 3.874 2.736 1.00 11.25 H new ATOM 0 HB VAL A 19 18.376 5.382 4.793 1.00 55.44 H new ATOM 0 HG11 VAL A 19 20.248 4.908 3.268 1.00 35.43 H new ATOM 0 HG12 VAL A 19 19.505 3.414 3.887 1.00 35.43 H new ATOM 0 HG13 VAL A 19 19.157 3.960 2.229 1.00 35.43 H new ATOM 0 HG21 VAL A 19 18.884 6.945 2.958 1.00 60.22 H new ATOM 0 HG22 VAL A 19 17.736 6.080 1.908 1.00 60.22 H new ATOM 0 HG23 VAL A 19 17.149 6.934 3.355 1.00 60.22 H new ATOM 289 N TYR A 20 16.441 3.092 5.843 1.00 71.32 N ATOM 290 CA TYR A 20 16.543 2.015 6.821 1.00 15.30 C ATOM 291 C TYR A 20 15.418 1.001 6.634 1.00 64.03 C ATOM 292 O TYR A 20 15.157 0.177 7.511 1.00 70.31 O ATOM 293 CB TYR A 20 16.501 2.583 8.241 1.00 61.31 C ATOM 294 CG TYR A 20 17.805 3.210 8.681 1.00 53.04 C ATOM 295 CD1 TYR A 20 18.967 2.454 8.769 1.00 30.32 C ATOM 296 CD2 TYR A 20 17.874 4.558 9.008 1.00 1.42 C ATOM 297 CE1 TYR A 20 20.160 3.022 9.171 1.00 2.31 C ATOM 298 CE2 TYR A 20 19.063 5.136 9.409 1.00 22.35 C ATOM 299 CZ TYR A 20 20.203 4.364 9.490 1.00 63.44 C ATOM 300 OH TYR A 20 21.389 4.935 9.890 1.00 24.44 O ATOM 0 H TYR A 20 15.848 3.870 6.132 1.00 71.32 H new ATOM 0 HA TYR A 20 17.495 1.507 6.667 1.00 15.30 H new ATOM 0 HB2 TYR A 20 15.710 3.330 8.301 1.00 61.31 H new ATOM 0 HB3 TYR A 20 16.239 1.785 8.935 1.00 61.31 H new ATOM 0 HD1 TYR A 20 18.937 1.404 8.519 1.00 30.32 H new ATOM 0 HD2 TYR A 20 16.983 5.165 8.948 1.00 1.42 H new ATOM 0 HE1 TYR A 20 21.054 2.419 9.235 1.00 2.31 H new ATOM 0 HE2 TYR A 20 19.100 6.186 9.658 1.00 22.35 H new ATOM 0 HH TYR A 20 21.248 5.887 10.076 1.00 24.44 H new ATOM 310 N LEU A 21 14.757 1.067 5.484 1.00 54.13 N ATOM 311 CA LEU A 21 13.660 0.155 5.178 1.00 21.34 C ATOM 312 C LEU A 21 13.834 -0.462 3.794 1.00 11.40 C ATOM 313 O LEU A 21 14.838 -0.230 3.121 1.00 43.33 O ATOM 314 CB LEU A 21 12.321 0.890 5.257 1.00 3.42 C ATOM 315 CG LEU A 21 11.654 0.924 6.632 1.00 34.44 C ATOM 316 CD1 LEU A 21 12.559 1.600 7.649 1.00 4.34 C ATOM 317 CD2 LEU A 21 10.310 1.634 6.556 1.00 41.21 C ATOM 0 H LEU A 21 14.961 1.743 4.748 1.00 54.13 H new ATOM 0 HA LEU A 21 13.671 -0.647 5.917 1.00 21.34 H new ATOM 0 HB2 LEU A 21 12.473 1.917 4.924 1.00 3.42 H new ATOM 0 HB3 LEU A 21 11.632 0.425 4.552 1.00 3.42 H new ATOM 0 HG LEU A 21 11.482 -0.103 6.956 1.00 34.44 H new ATOM 0 HD11 LEU A 21 12.067 1.614 8.621 1.00 4.34 H new ATOM 0 HD12 LEU A 21 13.496 1.049 7.725 1.00 4.34 H new ATOM 0 HD13 LEU A 21 12.764 2.622 7.331 1.00 4.34 H new ATOM 0 HD21 LEU A 21 9.850 1.649 7.544 1.00 41.21 H new ATOM 0 HD22 LEU A 21 10.458 2.657 6.209 1.00 41.21 H new ATOM 0 HD23 LEU A 21 9.658 1.106 5.860 1.00 41.21 H new ATOM 329 N LYS A 22 12.848 -1.247 3.374 1.00 51.45 N ATOM 330 CA LYS A 22 12.889 -1.894 2.068 1.00 74.22 C ATOM 331 C LYS A 22 11.496 -2.349 1.642 1.00 2.13 C ATOM 332 O LYS A 22 10.802 -3.040 2.389 1.00 40.54 O ATOM 333 CB LYS A 22 13.840 -3.092 2.099 1.00 24.12 C ATOM 334 CG LYS A 22 15.092 -2.896 1.261 1.00 22.55 C ATOM 335 CD LYS A 22 15.084 -3.786 0.030 1.00 72.41 C ATOM 336 CE LYS A 22 15.911 -3.186 -1.097 1.00 34.51 C ATOM 337 NZ LYS A 22 16.726 -4.218 -1.796 1.00 51.25 N ATOM 0 H LYS A 22 12.010 -1.451 3.919 1.00 51.45 H new ATOM 0 HA LYS A 22 13.253 -1.167 1.342 1.00 74.22 H new ATOM 0 HB2 LYS A 22 14.131 -3.288 3.131 1.00 24.12 H new ATOM 0 HB3 LYS A 22 13.310 -3.976 1.744 1.00 24.12 H new ATOM 0 HG2 LYS A 22 15.167 -1.852 0.956 1.00 22.55 H new ATOM 0 HG3 LYS A 22 15.973 -3.116 1.864 1.00 22.55 H new ATOM 0 HD2 LYS A 22 15.478 -4.769 0.288 1.00 72.41 H new ATOM 0 HD3 LYS A 22 14.058 -3.932 -0.308 1.00 72.41 H new ATOM 0 HE2 LYS A 22 15.250 -2.699 -1.813 1.00 34.51 H new ATOM 0 HE3 LYS A 22 16.568 -2.415 -0.695 1.00 34.51 H new ATOM 0 HZ1 LYS A 22 17.275 -3.770 -2.557 1.00 51.25 H new ATOM 0 HZ2 LYS A 22 17.375 -4.666 -1.118 1.00 51.25 H new ATOM 0 HZ3 LYS A 22 16.098 -4.940 -2.202 1.00 51.25 H new ATOM 351 N LYS A 23 11.094 -1.958 0.438 1.00 73.53 N ATOM 352 CA LYS A 23 9.785 -2.328 -0.089 1.00 43.23 C ATOM 353 C LYS A 23 9.797 -3.756 -0.624 1.00 24.44 C ATOM 354 O LYS A 23 8.807 -4.229 -1.183 1.00 3.54 O ATOM 355 CB LYS A 23 9.368 -1.360 -1.199 1.00 61.43 C ATOM 356 CG LYS A 23 9.755 0.083 -0.926 1.00 24.42 C ATOM 357 CD LYS A 23 8.664 1.045 -1.362 1.00 15.23 C ATOM 358 CE LYS A 23 9.239 2.393 -1.769 1.00 13.24 C ATOM 359 NZ LYS A 23 8.958 2.708 -3.197 1.00 22.51 N ATOM 0 H LYS A 23 11.655 -1.385 -0.192 1.00 73.53 H new ATOM 0 HA LYS A 23 9.063 -2.271 0.726 1.00 43.23 H new ATOM 0 HB2 LYS A 23 9.823 -1.678 -2.137 1.00 61.43 H new ATOM 0 HB3 LYS A 23 8.288 -1.418 -1.333 1.00 61.43 H new ATOM 0 HG2 LYS A 23 9.952 0.213 0.138 1.00 24.42 H new ATOM 0 HG3 LYS A 23 10.680 0.318 -1.452 1.00 24.42 H new ATOM 0 HD2 LYS A 23 8.112 0.616 -2.199 1.00 15.23 H new ATOM 0 HD3 LYS A 23 7.952 1.183 -0.548 1.00 15.23 H new ATOM 0 HE2 LYS A 23 8.818 3.174 -1.135 1.00 13.24 H new ATOM 0 HE3 LYS A 23 10.316 2.394 -1.602 1.00 13.24 H new ATOM 0 HZ1 LYS A 23 9.366 3.634 -3.435 1.00 22.51 H new ATOM 0 HZ2 LYS A 23 9.381 1.977 -3.804 1.00 22.51 H new ATOM 0 HZ3 LYS A 23 7.930 2.733 -3.351 1.00 22.51 H new ATOM 373 N ASP A 24 10.923 -4.440 -0.447 1.00 12.32 N ATOM 374 CA ASP A 24 11.062 -5.816 -0.909 1.00 4.21 C ATOM 375 C ASP A 24 11.222 -6.771 0.270 1.00 72.34 C ATOM 376 O ASP A 24 11.308 -7.986 0.091 1.00 71.44 O ATOM 377 CB ASP A 24 12.262 -5.941 -1.849 1.00 63.31 C ATOM 378 CG ASP A 24 12.067 -7.019 -2.897 1.00 34.42 C ATOM 379 OD1 ASP A 24 11.512 -8.085 -2.555 1.00 40.50 O ATOM 380 OD2 ASP A 24 12.469 -6.798 -4.059 1.00 33.25 O ATOM 0 H ASP A 24 11.752 -4.064 0.013 1.00 12.32 H new ATOM 0 HA ASP A 24 10.156 -6.085 -1.451 1.00 4.21 H new ATOM 0 HB2 ASP A 24 12.434 -4.985 -2.343 1.00 63.31 H new ATOM 0 HB3 ASP A 24 13.155 -6.163 -1.265 1.00 63.31 H new ATOM 385 N LYS A 25 11.261 -6.214 1.475 1.00 24.22 N ATOM 386 CA LYS A 25 11.410 -7.015 2.684 1.00 22.33 C ATOM 387 C LYS A 25 10.599 -6.423 3.833 1.00 64.14 C ATOM 388 O LYS A 25 10.341 -5.221 3.886 1.00 3.55 O ATOM 389 CB LYS A 25 12.885 -7.107 3.082 1.00 62.24 C ATOM 390 CG LYS A 25 13.833 -7.145 1.896 1.00 64.54 C ATOM 391 CD LYS A 25 15.160 -7.790 2.262 1.00 35.15 C ATOM 392 CE LYS A 25 15.165 -9.276 1.939 1.00 21.31 C ATOM 393 NZ LYS A 25 15.293 -9.525 0.476 1.00 20.24 N ATOM 0 H LYS A 25 11.191 -5.210 1.641 1.00 24.22 H new ATOM 0 HA LYS A 25 11.033 -8.016 2.474 1.00 22.33 H new ATOM 0 HB2 LYS A 25 13.137 -6.253 3.711 1.00 62.24 H new ATOM 0 HB3 LYS A 25 13.035 -8.002 3.685 1.00 62.24 H new ATOM 0 HG2 LYS A 25 13.372 -7.699 1.078 1.00 64.54 H new ATOM 0 HG3 LYS A 25 14.007 -6.131 1.536 1.00 64.54 H new ATOM 0 HD2 LYS A 25 15.967 -7.296 1.721 1.00 35.15 H new ATOM 0 HD3 LYS A 25 15.354 -7.647 3.325 1.00 35.15 H new ATOM 0 HE2 LYS A 25 15.990 -9.759 2.463 1.00 21.31 H new ATOM 0 HE3 LYS A 25 14.245 -9.731 2.306 1.00 21.31 H new ATOM 0 HZ1 LYS A 25 15.513 -10.528 0.313 1.00 20.24 H new ATOM 0 HZ2 LYS A 25 14.398 -9.285 0.003 1.00 20.24 H new ATOM 0 HZ3 LYS A 25 16.058 -8.936 0.089 1.00 20.24 H new ATOM 407 N PRO A 26 10.189 -7.285 4.774 1.00 33.34 N ATOM 408 CA PRO A 26 9.403 -6.869 5.940 1.00 21.20 C ATOM 409 C PRO A 26 10.219 -6.034 6.921 1.00 21.41 C ATOM 410 O PRO A 26 11.394 -6.314 7.164 1.00 53.23 O ATOM 411 CB PRO A 26 8.990 -8.196 6.582 1.00 62.25 C ATOM 412 CG PRO A 26 10.034 -9.167 6.150 1.00 44.14 C ATOM 413 CD PRO A 26 10.460 -8.733 4.774 1.00 0.43 C ATOM 0 HA PRO A 26 8.561 -6.236 5.659 1.00 21.20 H new ATOM 0 HB2 PRO A 26 8.950 -8.115 7.668 1.00 62.25 H new ATOM 0 HB3 PRO A 26 7.999 -8.506 6.249 1.00 62.25 H new ATOM 0 HG2 PRO A 26 10.879 -9.164 6.839 1.00 44.14 H new ATOM 0 HG3 PRO A 26 9.639 -10.183 6.134 1.00 44.14 H new ATOM 0 HD2 PRO A 26 11.514 -8.945 4.594 1.00 0.43 H new ATOM 0 HD3 PRO A 26 9.895 -9.248 3.997 1.00 0.43 H new ATOM 421 N THR A 27 9.589 -5.008 7.484 1.00 4.31 N ATOM 422 CA THR A 27 10.257 -4.132 8.438 1.00 3.33 C ATOM 423 C THR A 27 9.910 -4.515 9.872 1.00 5.24 C ATOM 424 O THR A 27 8.880 -5.139 10.127 1.00 32.32 O ATOM 425 CB THR A 27 9.879 -2.657 8.207 1.00 14.42 C ATOM 426 OG1 THR A 27 9.919 -2.354 6.808 1.00 12.12 O ATOM 427 CG2 THR A 27 10.824 -1.731 8.959 1.00 75.22 C ATOM 0 H THR A 27 8.617 -4.763 7.296 1.00 4.31 H new ATOM 0 HA THR A 27 11.329 -4.253 8.281 1.00 3.33 H new ATOM 0 HB THR A 27 8.868 -2.501 8.583 1.00 14.42 H new ATOM 0 HG1 THR A 27 9.676 -1.415 6.670 1.00 12.12 H new ATOM 0 HG21 THR A 27 10.537 -0.695 8.780 1.00 75.22 H new ATOM 0 HG22 THR A 27 10.769 -1.944 10.027 1.00 75.22 H new ATOM 0 HG23 THR A 27 11.844 -1.890 8.609 1.00 75.22 H new ATOM 435 N LEU A 28 10.776 -4.137 10.806 1.00 1.25 N ATOM 436 CA LEU A 28 10.561 -4.440 12.217 1.00 33.40 C ATOM 437 C LEU A 28 10.842 -3.219 13.086 1.00 10.30 C ATOM 438 O LEU A 28 11.998 -2.886 13.350 1.00 13.31 O ATOM 439 CB LEU A 28 11.453 -5.605 12.650 1.00 12.04 C ATOM 440 CG LEU A 28 10.743 -6.935 12.905 1.00 22.32 C ATOM 441 CD1 LEU A 28 11.425 -8.059 12.141 1.00 63.12 C ATOM 442 CD2 LEU A 28 10.709 -7.245 14.395 1.00 42.22 C ATOM 0 H LEU A 28 11.634 -3.620 10.612 1.00 1.25 H new ATOM 0 HA LEU A 28 9.516 -4.722 12.347 1.00 33.40 H new ATOM 0 HB2 LEU A 28 12.210 -5.762 11.882 1.00 12.04 H new ATOM 0 HB3 LEU A 28 11.978 -5.316 13.561 1.00 12.04 H new ATOM 0 HG LEU A 28 9.717 -6.851 12.548 1.00 22.32 H new ATOM 0 HD11 LEU A 28 10.906 -8.998 12.335 1.00 63.12 H new ATOM 0 HD12 LEU A 28 11.397 -7.842 11.073 1.00 63.12 H new ATOM 0 HD13 LEU A 28 12.462 -8.144 12.467 1.00 63.12 H new ATOM 0 HD21 LEU A 28 10.200 -8.195 14.557 1.00 42.22 H new ATOM 0 HD22 LEU A 28 11.728 -7.309 14.777 1.00 42.22 H new ATOM 0 HD23 LEU A 28 10.175 -6.453 14.919 1.00 42.22 H new ATOM 454 N ILE A 29 9.779 -2.557 13.529 1.00 55.31 N ATOM 455 CA ILE A 29 9.911 -1.374 14.371 1.00 64.31 C ATOM 456 C ILE A 29 9.684 -1.717 15.839 1.00 3.14 C ATOM 457 O ILE A 29 8.766 -2.462 16.180 1.00 74.52 O ATOM 458 CB ILE A 29 8.921 -0.272 13.953 1.00 13.45 C ATOM 459 CG1 ILE A 29 9.109 0.081 12.477 1.00 43.43 C ATOM 460 CG2 ILE A 29 9.102 0.962 14.826 1.00 62.52 C ATOM 461 CD1 ILE A 29 8.041 1.005 11.935 1.00 0.41 C ATOM 0 H ILE A 29 8.816 -2.820 13.319 1.00 55.31 H new ATOM 0 HA ILE A 29 10.928 -1.005 14.240 1.00 64.31 H new ATOM 0 HB ILE A 29 7.906 -0.645 14.091 1.00 13.45 H new ATOM 0 HG12 ILE A 29 10.084 0.550 12.345 1.00 43.43 H new ATOM 0 HG13 ILE A 29 9.115 -0.838 11.890 1.00 43.43 H new ATOM 0 HG21 ILE A 29 8.395 1.732 14.518 1.00 62.52 H new ATOM 0 HG22 ILE A 29 8.922 0.700 15.869 1.00 62.52 H new ATOM 0 HG23 ILE A 29 10.119 1.339 14.717 1.00 62.52 H new ATOM 0 HD11 ILE A 29 8.239 1.212 10.883 1.00 0.41 H new ATOM 0 HD12 ILE A 29 7.065 0.530 12.034 1.00 0.41 H new ATOM 0 HD13 ILE A 29 8.049 1.939 12.496 1.00 0.41 H new ATOM 473 N LYS A 30 10.527 -1.166 16.707 1.00 54.12 N ATOM 474 CA LYS A 30 10.417 -1.409 18.140 1.00 23.33 C ATOM 475 C LYS A 30 10.330 -0.095 18.910 1.00 33.41 C ATOM 476 O LYS A 30 11.121 0.821 18.686 1.00 22.33 O ATOM 477 CB LYS A 30 11.616 -2.223 18.633 1.00 2.42 C ATOM 478 CG LYS A 30 12.874 -1.394 18.828 1.00 65.33 C ATOM 479 CD LYS A 30 14.028 -2.243 19.335 1.00 61.20 C ATOM 480 CE LYS A 30 13.836 -2.631 20.793 1.00 33.01 C ATOM 481 NZ LYS A 30 14.257 -1.542 21.717 1.00 43.10 N ATOM 0 H LYS A 30 11.294 -0.548 16.442 1.00 54.12 H new ATOM 0 HA LYS A 30 9.503 -1.975 18.318 1.00 23.33 H new ATOM 0 HB2 LYS A 30 11.356 -2.702 19.577 1.00 2.42 H new ATOM 0 HB3 LYS A 30 11.823 -3.019 17.918 1.00 2.42 H new ATOM 0 HG2 LYS A 30 13.153 -0.926 17.884 1.00 65.33 H new ATOM 0 HG3 LYS A 30 12.675 -0.589 19.536 1.00 65.33 H new ATOM 0 HD2 LYS A 30 14.114 -3.143 18.726 1.00 61.20 H new ATOM 0 HD3 LYS A 30 14.962 -1.693 19.224 1.00 61.20 H new ATOM 0 HE2 LYS A 30 12.788 -2.872 20.970 1.00 33.01 H new ATOM 0 HE3 LYS A 30 14.411 -3.532 21.008 1.00 33.01 H new ATOM 0 HZ1 LYS A 30 13.942 -1.765 22.683 1.00 43.10 H new ATOM 0 HZ2 LYS A 30 15.293 -1.456 21.702 1.00 43.10 H new ATOM 0 HZ3 LYS A 30 13.830 -0.644 21.412 1.00 43.10 H new ATOM 495 N PHE A 31 9.364 -0.010 19.819 1.00 74.53 N ATOM 496 CA PHE A 31 9.173 1.191 20.622 1.00 3.52 C ATOM 497 C PHE A 31 9.879 1.063 21.969 1.00 70.30 C ATOM 498 O PHE A 31 9.666 0.098 22.703 1.00 23.22 O ATOM 499 CB PHE A 31 7.682 1.455 20.838 1.00 13.24 C ATOM 500 CG PHE A 31 6.870 1.378 19.577 1.00 44.43 C ATOM 501 CD1 PHE A 31 6.438 0.156 19.089 1.00 60.23 C ATOM 502 CD2 PHE A 31 6.540 2.529 18.878 1.00 25.25 C ATOM 503 CE1 PHE A 31 5.691 0.082 17.928 1.00 31.42 C ATOM 504 CE2 PHE A 31 5.793 2.461 17.718 1.00 63.22 C ATOM 505 CZ PHE A 31 5.369 1.236 17.241 1.00 21.34 C ATOM 0 H PHE A 31 8.701 -0.759 20.018 1.00 74.53 H new ATOM 0 HA PHE A 31 9.609 2.031 20.082 1.00 3.52 H new ATOM 0 HB2 PHE A 31 7.294 0.732 21.555 1.00 13.24 H new ATOM 0 HB3 PHE A 31 7.557 2.443 21.281 1.00 13.24 H new ATOM 0 HD1 PHE A 31 6.688 -0.750 19.622 1.00 60.23 H new ATOM 0 HD2 PHE A 31 6.871 3.490 19.245 1.00 25.25 H new ATOM 0 HE1 PHE A 31 5.360 -0.877 17.559 1.00 31.42 H new ATOM 0 HE2 PHE A 31 5.541 3.365 17.184 1.00 63.22 H new ATOM 0 HZ PHE A 31 4.787 1.181 16.333 1.00 21.34 H new ATOM 515 N TRP A 32 10.719 2.041 22.285 1.00 2.24 N ATOM 516 CA TRP A 32 11.457 2.038 23.543 1.00 22.45 C ATOM 517 C TRP A 32 11.479 3.429 24.166 1.00 51.42 C ATOM 518 O TRP A 32 10.827 4.350 23.673 1.00 32.54 O ATOM 519 CB TRP A 32 12.887 1.544 23.318 1.00 22.11 C ATOM 520 CG TRP A 32 13.643 2.354 22.309 1.00 5.33 C ATOM 521 CD1 TRP A 32 13.428 2.393 20.961 1.00 30.12 C ATOM 522 CD2 TRP A 32 14.737 3.241 22.568 1.00 25.23 C ATOM 523 NE1 TRP A 32 14.322 3.250 20.367 1.00 43.14 N ATOM 524 CE2 TRP A 32 15.136 3.784 21.331 1.00 73.40 C ATOM 525 CE3 TRP A 32 15.418 3.630 23.725 1.00 51.50 C ATOM 526 CZ2 TRP A 32 16.184 4.693 21.220 1.00 10.34 C ATOM 527 CZ3 TRP A 32 16.458 4.533 23.614 1.00 43.25 C ATOM 528 CH2 TRP A 32 16.833 5.057 22.369 1.00 13.10 C ATOM 0 H TRP A 32 10.906 2.846 21.688 1.00 2.24 H new ATOM 0 HA TRP A 32 10.950 1.361 24.231 1.00 22.45 H new ATOM 0 HB2 TRP A 32 13.424 1.565 24.266 1.00 22.11 H new ATOM 0 HB3 TRP A 32 12.858 0.505 22.991 1.00 22.11 H new ATOM 0 HD1 TRP A 32 12.667 1.832 20.439 1.00 30.12 H new ATOM 0 HE1 TRP A 32 14.372 3.456 19.369 1.00 43.14 H new ATOM 0 HE3 TRP A 32 15.136 3.232 24.689 1.00 51.50 H new ATOM 0 HZ2 TRP A 32 16.475 5.097 20.262 1.00 10.34 H new ATOM 0 HZ3 TRP A 32 16.991 4.840 24.502 1.00 43.25 H new ATOM 0 HH2 TRP A 32 17.650 5.762 22.315 1.00 13.10 H new ATOM 539 N ALA A 33 12.233 3.576 25.250 1.00 12.24 N ATOM 540 CA ALA A 33 12.341 4.857 25.938 1.00 73.10 C ATOM 541 C ALA A 33 13.605 4.918 26.789 1.00 53.52 C ATOM 542 O ALA A 33 14.134 3.889 27.207 1.00 73.41 O ATOM 543 CB ALA A 33 11.110 5.099 26.799 1.00 20.23 C ATOM 0 H ALA A 33 12.778 2.824 25.671 1.00 12.24 H new ATOM 0 HA ALA A 33 12.404 5.642 25.185 1.00 73.10 H new ATOM 0 HB1 ALA A 33 11.204 6.059 27.307 1.00 20.23 H new ATOM 0 HB2 ALA A 33 10.221 5.108 26.168 1.00 20.23 H new ATOM 0 HB3 ALA A 33 11.022 4.304 27.539 1.00 20.23 H new ATOM 549 N SER A 34 14.084 6.132 27.041 1.00 43.20 N ATOM 550 CA SER A 34 15.289 6.327 27.839 1.00 43.55 C ATOM 551 C SER A 34 15.031 5.991 29.304 1.00 1.52 C ATOM 552 O SER A 34 15.963 5.733 30.066 1.00 34.13 O ATOM 553 CB SER A 34 15.781 7.771 27.713 1.00 31.24 C ATOM 554 OG SER A 34 15.726 8.214 26.368 1.00 33.44 O ATOM 0 H SER A 34 13.656 6.995 26.704 1.00 43.20 H new ATOM 0 HA SER A 34 16.059 5.654 27.461 1.00 43.55 H new ATOM 0 HB2 SER A 34 15.171 8.422 28.339 1.00 31.24 H new ATOM 0 HB3 SER A 34 16.804 7.843 28.081 1.00 31.24 H new ATOM 0 HG SER A 34 16.506 7.877 25.880 1.00 33.44 H new ATOM 560 N TRP A 35 13.761 5.997 29.691 1.00 54.54 N ATOM 561 CA TRP A 35 13.379 5.694 31.065 1.00 35.40 C ATOM 562 C TRP A 35 13.031 4.217 31.220 1.00 53.24 C ATOM 563 O TRP A 35 12.290 3.835 32.126 1.00 52.21 O ATOM 564 CB TRP A 35 12.189 6.557 31.488 1.00 4.44 C ATOM 565 CG TRP A 35 10.996 6.405 30.594 1.00 21.24 C ATOM 566 CD1 TRP A 35 10.760 7.066 29.423 1.00 14.22 C ATOM 567 CD2 TRP A 35 9.876 5.537 30.801 1.00 63.24 C ATOM 568 NE1 TRP A 35 9.560 6.662 28.889 1.00 60.31 N ATOM 569 CE2 TRP A 35 8.999 5.723 29.714 1.00 1.53 C ATOM 570 CE3 TRP A 35 9.530 4.619 31.796 1.00 62.24 C ATOM 571 CZ2 TRP A 35 7.799 5.026 29.599 1.00 43.54 C ATOM 572 CZ3 TRP A 35 8.339 3.928 31.679 1.00 10.14 C ATOM 573 CH2 TRP A 35 7.486 4.134 30.587 1.00 15.13 C ATOM 0 H TRP A 35 12.978 6.208 29.073 1.00 54.54 H new ATOM 0 HA TRP A 35 14.229 5.918 31.710 1.00 35.40 H new ATOM 0 HB2 TRP A 35 11.905 6.297 32.508 1.00 4.44 H new ATOM 0 HB3 TRP A 35 12.494 7.603 31.499 1.00 4.44 H new ATOM 0 HD1 TRP A 35 11.419 7.799 28.981 1.00 14.22 H new ATOM 0 HE1 TRP A 35 9.153 7.006 28.019 1.00 60.31 H new ATOM 0 HE3 TRP A 35 10.182 4.453 32.641 1.00 62.24 H new ATOM 0 HZ2 TRP A 35 7.139 5.184 28.759 1.00 43.54 H new ATOM 0 HZ3 TRP A 35 8.061 3.217 32.443 1.00 10.14 H new ATOM 0 HH2 TRP A 35 6.563 3.577 30.524 1.00 15.13 H new ATOM 584 N CYS A 36 13.570 3.390 30.330 1.00 52.42 N ATOM 585 CA CYS A 36 13.317 1.955 30.367 1.00 15.21 C ATOM 586 C CYS A 36 14.621 1.176 30.509 1.00 50.21 C ATOM 587 O CYS A 36 15.519 1.263 29.672 1.00 44.44 O ATOM 588 CB CYS A 36 12.581 1.513 29.101 1.00 74.02 C ATOM 589 SG CYS A 36 12.301 -0.284 28.992 1.00 4.13 S ATOM 0 H CYS A 36 14.185 3.690 29.574 1.00 52.42 H new ATOM 0 HA CYS A 36 12.692 1.744 31.235 1.00 15.21 H new ATOM 0 HB2 CYS A 36 11.619 2.023 29.056 1.00 74.02 H new ATOM 0 HB3 CYS A 36 13.153 1.834 28.230 1.00 74.02 H new ATOM 594 N PRO A 37 14.729 0.395 31.594 1.00 13.21 N ATOM 595 CA PRO A 37 15.918 -0.415 31.871 1.00 24.13 C ATOM 596 C PRO A 37 16.066 -1.580 30.898 1.00 42.40 C ATOM 597 O PRO A 37 17.155 -1.838 30.384 1.00 42.25 O ATOM 598 CB PRO A 37 15.672 -0.933 33.291 1.00 43.53 C ATOM 599 CG PRO A 37 14.191 -0.922 33.446 1.00 33.40 C ATOM 600 CD PRO A 37 13.697 0.243 32.634 1.00 61.22 C ATOM 0 HA PRO A 37 16.837 0.162 31.766 1.00 24.13 H new ATOM 0 HB2 PRO A 37 16.076 -1.937 33.422 1.00 43.53 H new ATOM 0 HB3 PRO A 37 16.153 -0.296 34.034 1.00 43.53 H new ATOM 0 HG2 PRO A 37 13.755 -1.856 33.093 1.00 33.40 H new ATOM 0 HG3 PRO A 37 13.909 -0.815 34.493 1.00 33.40 H new ATOM 0 HD2 PRO A 37 12.716 0.044 32.201 1.00 61.22 H new ATOM 0 HD3 PRO A 37 13.601 1.144 33.240 1.00 61.22 H new ATOM 608 N LEU A 38 14.965 -2.280 30.649 1.00 41.31 N ATOM 609 CA LEU A 38 14.972 -3.417 29.736 1.00 71.42 C ATOM 610 C LEU A 38 15.180 -2.959 28.296 1.00 52.20 C ATOM 611 O LEU A 38 15.416 -3.772 27.402 1.00 72.11 O ATOM 612 CB LEU A 38 13.661 -4.197 29.851 1.00 54.44 C ATOM 613 CG LEU A 38 13.245 -4.607 31.264 1.00 40.51 C ATOM 614 CD1 LEU A 38 11.842 -5.193 31.259 1.00 52.13 C ATOM 615 CD2 LEU A 38 14.239 -5.602 31.845 1.00 51.15 C ATOM 0 H LEU A 38 14.056 -2.080 31.067 1.00 41.31 H new ATOM 0 HA LEU A 38 15.801 -4.068 30.013 1.00 71.42 H new ATOM 0 HB2 LEU A 38 12.863 -3.592 29.420 1.00 54.44 H new ATOM 0 HB3 LEU A 38 13.743 -5.098 29.242 1.00 54.44 H new ATOM 0 HG LEU A 38 13.242 -3.717 31.894 1.00 40.51 H new ATOM 0 HD11 LEU A 38 11.564 -5.479 32.273 1.00 52.13 H new ATOM 0 HD12 LEU A 38 11.138 -4.449 30.886 1.00 52.13 H new ATOM 0 HD13 LEU A 38 11.817 -6.072 30.615 1.00 52.13 H new ATOM 0 HD21 LEU A 38 13.927 -5.883 32.851 1.00 51.15 H new ATOM 0 HD22 LEU A 38 14.275 -6.491 31.215 1.00 51.15 H new ATOM 0 HD23 LEU A 38 15.228 -5.146 31.886 1.00 51.15 H new ATOM 627 N CYS A 39 15.093 -1.651 28.079 1.00 54.24 N ATOM 628 CA CYS A 39 15.273 -1.082 26.748 1.00 32.53 C ATOM 629 C CYS A 39 16.655 -0.451 26.609 1.00 21.21 C ATOM 630 O CYS A 39 17.422 -0.801 25.711 1.00 23.53 O ATOM 631 CB CYS A 39 14.192 -0.037 26.467 1.00 51.11 C ATOM 632 SG CYS A 39 12.509 -0.567 26.919 1.00 32.04 S ATOM 0 H CYS A 39 14.899 -0.965 28.808 1.00 54.24 H new ATOM 0 HA CYS A 39 15.187 -1.889 26.020 1.00 32.53 H new ATOM 0 HB2 CYS A 39 14.433 0.875 27.013 1.00 51.11 H new ATOM 0 HB3 CYS A 39 14.210 0.212 25.406 1.00 51.11 H new ATOM 637 N LEU A 40 16.966 0.481 27.503 1.00 23.32 N ATOM 638 CA LEU A 40 18.256 1.161 27.481 1.00 4.43 C ATOM 639 C LEU A 40 19.403 0.156 27.523 1.00 42.54 C ATOM 640 O LEU A 40 20.411 0.321 26.835 1.00 1.14 O ATOM 641 CB LEU A 40 18.366 2.126 28.663 1.00 1.41 C ATOM 642 CG LEU A 40 19.271 3.341 28.456 1.00 42.32 C ATOM 643 CD1 LEU A 40 18.496 4.481 27.812 1.00 23.33 C ATOM 644 CD2 LEU A 40 19.878 3.786 29.779 1.00 54.54 C ATOM 0 H LEU A 40 16.343 0.783 28.252 1.00 23.32 H new ATOM 0 HA LEU A 40 18.325 1.725 26.551 1.00 4.43 H new ATOM 0 HB2 LEU A 40 17.366 2.481 28.910 1.00 1.41 H new ATOM 0 HB3 LEU A 40 18.730 1.570 29.527 1.00 1.41 H new ATOM 0 HG LEU A 40 20.082 3.056 27.785 1.00 42.32 H new ATOM 0 HD11 LEU A 40 19.156 5.337 27.673 1.00 23.33 H new ATOM 0 HD12 LEU A 40 18.111 4.158 26.845 1.00 23.33 H new ATOM 0 HD13 LEU A 40 17.665 4.766 28.457 1.00 23.33 H new ATOM 0 HD21 LEU A 40 20.519 4.652 29.612 1.00 54.54 H new ATOM 0 HD22 LEU A 40 19.081 4.053 30.473 1.00 54.54 H new ATOM 0 HD23 LEU A 40 20.469 2.973 30.200 1.00 54.54 H new ATOM 656 N SER A 41 19.241 -0.886 28.331 1.00 1.24 N ATOM 657 CA SER A 41 20.263 -1.917 28.464 1.00 64.15 C ATOM 658 C SER A 41 20.237 -2.864 27.268 1.00 64.14 C ATOM 659 O SER A 41 21.150 -3.668 27.079 1.00 2.53 O ATOM 660 CB SER A 41 20.058 -2.706 29.758 1.00 74.31 C ATOM 661 OG SER A 41 21.279 -3.256 30.220 1.00 62.45 O ATOM 0 H SER A 41 18.411 -1.039 28.904 1.00 1.24 H new ATOM 0 HA SER A 41 21.236 -1.427 28.497 1.00 64.15 H new ATOM 0 HB2 SER A 41 19.638 -2.053 30.523 1.00 74.31 H new ATOM 0 HB3 SER A 41 19.336 -3.505 29.590 1.00 74.31 H new ATOM 0 HG SER A 41 21.121 -3.754 31.049 1.00 62.45 H new ATOM 667 N GLU A 42 19.184 -2.762 26.463 1.00 62.41 N ATOM 668 CA GLU A 42 19.038 -3.610 25.286 1.00 64.34 C ATOM 669 C GLU A 42 19.462 -2.866 24.023 1.00 45.31 C ATOM 670 O GLU A 42 19.469 -3.430 22.928 1.00 25.42 O ATOM 671 CB GLU A 42 17.591 -4.086 25.148 1.00 33.14 C ATOM 672 CG GLU A 42 17.358 -5.490 25.681 1.00 63.00 C ATOM 673 CD GLU A 42 17.093 -6.496 24.578 1.00 63.12 C ATOM 674 OE1 GLU A 42 17.561 -6.270 23.443 1.00 43.45 O ATOM 675 OE2 GLU A 42 16.418 -7.510 24.851 1.00 74.45 O ATOM 0 H GLU A 42 18.420 -2.101 26.604 1.00 62.41 H new ATOM 0 HA GLU A 42 19.687 -4.476 25.412 1.00 64.34 H new ATOM 0 HB2 GLU A 42 16.937 -3.393 25.677 1.00 33.14 H new ATOM 0 HB3 GLU A 42 17.306 -4.054 24.097 1.00 33.14 H new ATOM 0 HG2 GLU A 42 18.229 -5.806 26.254 1.00 63.00 H new ATOM 0 HG3 GLU A 42 16.512 -5.478 26.368 1.00 63.00 H new ATOM 682 N LEU A 43 19.815 -1.595 24.183 1.00 52.10 N ATOM 683 CA LEU A 43 20.240 -0.771 23.057 1.00 61.24 C ATOM 684 C LEU A 43 21.314 -1.481 22.238 1.00 52.32 C ATOM 685 O LEU A 43 21.267 -1.489 21.008 1.00 3.25 O ATOM 686 CB LEU A 43 20.769 0.575 23.555 1.00 52.03 C ATOM 687 CG LEU A 43 19.851 1.779 23.337 1.00 65.25 C ATOM 688 CD1 LEU A 43 18.421 1.438 23.726 1.00 65.44 C ATOM 689 CD2 LEU A 43 20.350 2.979 24.128 1.00 14.20 C ATOM 0 H LEU A 43 19.815 -1.113 25.082 1.00 52.10 H new ATOM 0 HA LEU A 43 19.375 -0.600 22.417 1.00 61.24 H new ATOM 0 HB2 LEU A 43 20.976 0.489 24.622 1.00 52.03 H new ATOM 0 HB3 LEU A 43 21.720 0.774 23.061 1.00 52.03 H new ATOM 0 HG LEU A 43 19.865 2.036 22.278 1.00 65.25 H new ATOM 0 HD11 LEU A 43 17.783 2.307 23.564 1.00 65.44 H new ATOM 0 HD12 LEU A 43 18.066 0.608 23.115 1.00 65.44 H new ATOM 0 HD13 LEU A 43 18.388 1.155 24.778 1.00 65.44 H new ATOM 0 HD21 LEU A 43 19.685 3.827 23.961 1.00 14.20 H new ATOM 0 HD22 LEU A 43 20.366 2.734 25.190 1.00 14.20 H new ATOM 0 HD23 LEU A 43 21.357 3.238 23.800 1.00 14.20 H new ATOM 701 N GLY A 44 22.280 -2.078 22.929 1.00 1.20 N ATOM 702 CA GLY A 44 23.351 -2.784 22.250 1.00 54.33 C ATOM 703 C GLY A 44 22.845 -3.956 21.432 1.00 12.31 C ATOM 704 O GLY A 44 23.193 -4.099 20.260 1.00 0.25 O ATOM 0 H GLY A 44 22.340 -2.085 23.947 1.00 1.20 H new ATOM 0 HA2 GLY A 44 23.882 -2.091 21.597 1.00 54.33 H new ATOM 0 HA3 GLY A 44 24.070 -3.142 22.987 1.00 54.33 H new ATOM 708 N GLN A 45 22.023 -4.797 22.052 1.00 52.53 N ATOM 709 CA GLN A 45 21.471 -5.963 21.373 1.00 32.34 C ATOM 710 C GLN A 45 20.823 -5.568 20.050 1.00 22.04 C ATOM 711 O GLN A 45 21.153 -6.114 18.997 1.00 23.11 O ATOM 712 CB GLN A 45 20.445 -6.662 22.268 1.00 4.21 C ATOM 713 CG GLN A 45 19.767 -7.849 21.604 1.00 23.30 C ATOM 714 CD GLN A 45 19.478 -8.975 22.577 1.00 62.41 C ATOM 715 OE1 GLN A 45 18.324 -9.351 22.785 1.00 50.33 O ATOM 716 NE2 GLN A 45 20.528 -9.522 23.179 1.00 12.45 N ATOM 0 H GLN A 45 21.725 -4.693 23.022 1.00 52.53 H new ATOM 0 HA GLN A 45 22.290 -6.651 21.164 1.00 32.34 H new ATOM 0 HB2 GLN A 45 20.940 -7.000 23.179 1.00 4.21 H new ATOM 0 HB3 GLN A 45 19.685 -5.940 22.567 1.00 4.21 H new ATOM 0 HG2 GLN A 45 18.834 -7.520 21.147 1.00 23.30 H new ATOM 0 HG3 GLN A 45 20.402 -8.222 20.800 1.00 23.30 H new ATOM 0 HE21 GLN A 45 21.467 -9.179 22.977 1.00 12.45 H new ATOM 0 HE22 GLN A 45 20.395 -10.285 23.843 1.00 12.45 H new ATOM 725 N THR A 46 19.898 -4.615 20.111 1.00 21.12 N ATOM 726 CA THR A 46 19.203 -4.148 18.919 1.00 51.43 C ATOM 727 C THR A 46 20.182 -3.577 17.899 1.00 23.13 C ATOM 728 O THR A 46 20.011 -3.756 16.694 1.00 2.20 O ATOM 729 CB THR A 46 18.155 -3.073 19.264 1.00 1.33 C ATOM 730 OG1 THR A 46 17.306 -3.537 20.320 1.00 64.41 O ATOM 731 CG2 THR A 46 17.313 -2.726 18.046 1.00 44.24 C ATOM 0 H THR A 46 19.613 -4.152 20.974 1.00 21.12 H new ATOM 0 HA THR A 46 18.698 -5.013 18.489 1.00 51.43 H new ATOM 0 HB THR A 46 18.682 -2.176 19.589 1.00 1.33 H new ATOM 0 HG1 THR A 46 16.644 -2.847 20.534 1.00 64.41 H new ATOM 0 HG21 THR A 46 16.580 -1.965 18.315 1.00 44.24 H new ATOM 0 HG22 THR A 46 17.958 -2.345 17.254 1.00 44.24 H new ATOM 0 HG23 THR A 46 16.796 -3.619 17.695 1.00 44.24 H new ATOM 739 N GLU A 47 21.209 -2.891 18.392 1.00 52.34 N ATOM 740 CA GLU A 47 22.216 -2.294 17.522 1.00 75.15 C ATOM 741 C GLU A 47 22.913 -3.362 16.684 1.00 21.44 C ATOM 742 O GLU A 47 23.320 -3.111 15.550 1.00 61.22 O ATOM 743 CB GLU A 47 23.247 -1.526 18.350 1.00 1.32 C ATOM 744 CG GLU A 47 24.439 -1.042 17.541 1.00 10.25 C ATOM 745 CD GLU A 47 24.075 0.065 16.571 1.00 11.55 C ATOM 746 OE1 GLU A 47 23.142 -0.136 15.766 1.00 50.52 O ATOM 747 OE2 GLU A 47 24.722 1.132 16.618 1.00 45.15 O ATOM 0 H GLU A 47 21.365 -2.735 19.388 1.00 52.34 H new ATOM 0 HA GLU A 47 21.712 -1.600 16.849 1.00 75.15 H new ATOM 0 HB2 GLU A 47 22.761 -0.668 18.814 1.00 1.32 H new ATOM 0 HB3 GLU A 47 23.602 -2.167 19.157 1.00 1.32 H new ATOM 0 HG2 GLU A 47 25.213 -0.685 18.220 1.00 10.25 H new ATOM 0 HG3 GLU A 47 24.862 -1.880 16.988 1.00 10.25 H new ATOM 754 N LYS A 48 23.048 -4.556 17.252 1.00 4.15 N ATOM 755 CA LYS A 48 23.696 -5.664 16.561 1.00 73.24 C ATOM 756 C LYS A 48 22.719 -6.363 15.620 1.00 23.10 C ATOM 757 O LYS A 48 23.105 -6.840 14.553 1.00 70.13 O ATOM 758 CB LYS A 48 24.253 -6.668 17.572 1.00 21.12 C ATOM 759 CG LYS A 48 25.074 -6.026 18.677 1.00 64.21 C ATOM 760 CD LYS A 48 26.475 -6.612 18.743 1.00 40.35 C ATOM 761 CE LYS A 48 26.518 -7.858 19.613 1.00 32.30 C ATOM 762 NZ LYS A 48 27.845 -8.034 20.266 1.00 52.15 N ATOM 0 H LYS A 48 22.717 -4.781 18.190 1.00 4.15 H new ATOM 0 HA LYS A 48 24.518 -5.260 15.970 1.00 73.24 H new ATOM 0 HB2 LYS A 48 23.425 -7.218 18.019 1.00 21.12 H new ATOM 0 HB3 LYS A 48 24.872 -7.395 17.046 1.00 21.12 H new ATOM 0 HG2 LYS A 48 25.136 -4.951 18.508 1.00 64.21 H new ATOM 0 HG3 LYS A 48 24.573 -6.170 19.634 1.00 64.21 H new ATOM 0 HD2 LYS A 48 26.815 -6.858 17.737 1.00 40.35 H new ATOM 0 HD3 LYS A 48 27.164 -5.866 19.140 1.00 40.35 H new ATOM 0 HE2 LYS A 48 25.743 -7.794 20.377 1.00 32.30 H new ATOM 0 HE3 LYS A 48 26.294 -8.734 19.004 1.00 32.30 H new ATOM 0 HZ1 LYS A 48 27.833 -8.894 20.850 1.00 52.15 H new ATOM 0 HZ2 LYS A 48 28.582 -8.120 19.537 1.00 52.15 H new ATOM 0 HZ3 LYS A 48 28.048 -7.210 20.867 1.00 52.15 H new ATOM 776 N TRP A 49 21.455 -6.419 16.022 1.00 11.43 N ATOM 777 CA TRP A 49 20.423 -7.058 15.214 1.00 62.33 C ATOM 778 C TRP A 49 20.290 -6.372 13.859 1.00 62.24 C ATOM 779 O TRP A 49 20.271 -7.030 12.819 1.00 70.21 O ATOM 780 CB TRP A 49 19.081 -7.031 15.947 1.00 2.51 C ATOM 781 CG TRP A 49 19.037 -7.939 17.139 1.00 54.53 C ATOM 782 CD1 TRP A 49 20.092 -8.581 17.719 1.00 25.32 C ATOM 783 CD2 TRP A 49 17.877 -8.306 17.893 1.00 14.33 C ATOM 784 NE1 TRP A 49 19.659 -9.326 18.789 1.00 33.14 N ATOM 785 CE2 TRP A 49 18.304 -9.173 18.918 1.00 74.32 C ATOM 786 CE3 TRP A 49 16.520 -7.985 17.805 1.00 55.42 C ATOM 787 CZ2 TRP A 49 17.421 -9.722 19.844 1.00 73.53 C ATOM 788 CZ3 TRP A 49 15.644 -8.531 18.724 1.00 5.24 C ATOM 789 CH2 TRP A 49 16.098 -9.391 19.733 1.00 35.14 C ATOM 0 H TRP A 49 21.120 -6.030 16.903 1.00 11.43 H new ATOM 0 HA TRP A 49 20.717 -8.094 15.049 1.00 62.33 H new ATOM 0 HB2 TRP A 49 18.871 -6.011 16.268 1.00 2.51 H new ATOM 0 HB3 TRP A 49 18.290 -7.316 15.253 1.00 2.51 H new ATOM 0 HD1 TRP A 49 21.117 -8.513 17.386 1.00 25.32 H new ATOM 0 HE1 TRP A 49 20.251 -9.900 19.390 1.00 33.14 H new ATOM 0 HE3 TRP A 49 16.162 -7.321 17.032 1.00 55.42 H new ATOM 0 HZ2 TRP A 49 17.768 -10.386 20.622 1.00 73.53 H new ATOM 0 HZ3 TRP A 49 14.593 -8.291 18.664 1.00 5.24 H new ATOM 0 HH2 TRP A 49 15.389 -9.801 20.437 1.00 35.14 H new ATOM 800 N ALA A 50 20.199 -5.046 13.878 1.00 61.53 N ATOM 801 CA ALA A 50 20.070 -4.272 12.650 1.00 42.22 C ATOM 802 C ALA A 50 21.306 -4.429 11.770 1.00 54.54 C ATOM 803 O ALA A 50 21.301 -4.036 10.603 1.00 1.34 O ATOM 804 CB ALA A 50 19.833 -2.804 12.974 1.00 65.20 C ATOM 0 H ALA A 50 20.212 -4.486 14.730 1.00 61.53 H new ATOM 0 HA ALA A 50 19.212 -4.654 12.097 1.00 42.22 H new ATOM 0 HB1 ALA A 50 19.739 -2.238 12.048 1.00 65.20 H new ATOM 0 HB2 ALA A 50 18.917 -2.703 13.556 1.00 65.20 H new ATOM 0 HB3 ALA A 50 20.674 -2.418 13.551 1.00 65.20 H new ATOM 810 N GLN A 51 22.361 -5.004 12.336 1.00 21.04 N ATOM 811 CA GLN A 51 23.604 -5.211 11.602 1.00 11.43 C ATOM 812 C GLN A 51 23.840 -6.694 11.339 1.00 64.03 C ATOM 813 O GLN A 51 24.761 -7.066 10.611 1.00 71.12 O ATOM 814 CB GLN A 51 24.784 -4.624 12.380 1.00 74.22 C ATOM 815 CG GLN A 51 24.724 -3.112 12.528 1.00 74.45 C ATOM 816 CD GLN A 51 25.402 -2.387 11.382 1.00 15.31 C ATOM 817 OE1 GLN A 51 24.739 -1.812 10.517 1.00 24.05 O ATOM 818 NE2 GLN A 51 26.729 -2.409 11.370 1.00 42.11 N ATOM 0 H GLN A 51 22.381 -5.335 13.301 1.00 21.04 H new ATOM 0 HA GLN A 51 23.520 -4.700 10.643 1.00 11.43 H new ATOM 0 HB2 GLN A 51 24.816 -5.077 13.371 1.00 74.22 H new ATOM 0 HB3 GLN A 51 25.712 -4.895 11.876 1.00 74.22 H new ATOM 0 HG2 GLN A 51 23.682 -2.797 12.586 1.00 74.45 H new ATOM 0 HG3 GLN A 51 25.197 -2.823 13.467 1.00 74.45 H new ATOM 0 HE21 GLN A 51 27.238 -2.898 12.107 1.00 42.11 H new ATOM 0 HE22 GLN A 51 27.240 -1.937 10.624 1.00 42.11 H new ATOM 827 N ASP A 52 23.004 -7.536 11.935 1.00 22.34 N ATOM 828 CA ASP A 52 23.122 -8.980 11.765 1.00 52.24 C ATOM 829 C ASP A 52 22.767 -9.389 10.339 1.00 73.04 C ATOM 830 O ASP A 52 21.655 -9.145 9.871 1.00 50.31 O ATOM 831 CB ASP A 52 22.215 -9.708 12.758 1.00 1.12 C ATOM 832 CG ASP A 52 22.820 -11.009 13.248 1.00 74.25 C ATOM 833 OD1 ASP A 52 24.010 -11.005 13.625 1.00 71.15 O ATOM 834 OD2 ASP A 52 22.103 -12.032 13.253 1.00 73.04 O ATOM 0 H ASP A 52 22.237 -7.244 12.540 1.00 22.34 H new ATOM 0 HA ASP A 52 24.157 -9.261 11.958 1.00 52.24 H new ATOM 0 HB2 ASP A 52 22.019 -9.058 13.611 1.00 1.12 H new ATOM 0 HB3 ASP A 52 21.254 -9.913 12.286 1.00 1.12 H new ATOM 839 N ALA A 53 23.719 -10.012 9.653 1.00 44.14 N ATOM 840 CA ALA A 53 23.507 -10.456 8.280 1.00 11.45 C ATOM 841 C ALA A 53 22.265 -11.334 8.174 1.00 53.44 C ATOM 842 O ALA A 53 21.559 -11.309 7.165 1.00 60.11 O ATOM 843 CB ALA A 53 24.730 -11.204 7.773 1.00 61.45 C ATOM 0 H ALA A 53 24.645 -10.221 10.025 1.00 44.14 H new ATOM 0 HA ALA A 53 23.351 -9.574 7.658 1.00 11.45 H new ATOM 0 HB1 ALA A 53 24.558 -11.530 6.747 1.00 61.45 H new ATOM 0 HB2 ALA A 53 25.598 -10.545 7.804 1.00 61.45 H new ATOM 0 HB3 ALA A 53 24.912 -12.074 8.404 1.00 61.45 H new ATOM 849 N LYS A 54 22.003 -12.110 9.220 1.00 54.33 N ATOM 850 CA LYS A 54 20.845 -12.996 9.245 1.00 40.13 C ATOM 851 C LYS A 54 19.549 -12.196 9.321 1.00 13.32 C ATOM 852 O LYS A 54 18.497 -12.654 8.874 1.00 21.34 O ATOM 853 CB LYS A 54 20.936 -13.954 10.434 1.00 22.42 C ATOM 854 CG LYS A 54 21.615 -15.272 10.103 1.00 4.01 C ATOM 855 CD LYS A 54 22.884 -15.465 10.917 1.00 60.33 C ATOM 856 CE LYS A 54 22.580 -16.023 12.299 1.00 63.33 C ATOM 857 NZ LYS A 54 23.792 -16.053 13.164 1.00 62.15 N ATOM 0 H LYS A 54 22.577 -12.143 10.062 1.00 54.33 H new ATOM 0 HA LYS A 54 20.841 -13.573 8.320 1.00 40.13 H new ATOM 0 HB2 LYS A 54 21.482 -13.466 11.242 1.00 22.42 H new ATOM 0 HB3 LYS A 54 19.931 -14.156 10.805 1.00 22.42 H new ATOM 0 HG2 LYS A 54 20.928 -16.095 10.298 1.00 4.01 H new ATOM 0 HG3 LYS A 54 21.855 -15.302 9.040 1.00 4.01 H new ATOM 0 HD2 LYS A 54 23.556 -16.142 10.390 1.00 60.33 H new ATOM 0 HD3 LYS A 54 23.404 -14.512 11.014 1.00 60.33 H new ATOM 0 HE2 LYS A 54 21.810 -15.416 12.774 1.00 63.33 H new ATOM 0 HE3 LYS A 54 22.177 -17.031 12.203 1.00 63.33 H new ATOM 0 HZ1 LYS A 54 23.543 -16.440 14.097 1.00 62.15 H new ATOM 0 HZ2 LYS A 54 24.518 -16.653 12.723 1.00 62.15 H new ATOM 0 HZ3 LYS A 54 24.162 -15.088 13.277 1.00 62.15 H new ATOM 871 N PHE A 55 19.631 -10.997 9.889 1.00 63.01 N ATOM 872 CA PHE A 55 18.464 -10.133 10.023 1.00 5.33 C ATOM 873 C PHE A 55 18.162 -9.419 8.709 1.00 60.11 C ATOM 874 O PHE A 55 17.110 -8.800 8.554 1.00 15.22 O ATOM 875 CB PHE A 55 18.690 -9.105 11.134 1.00 33.24 C ATOM 876 CG PHE A 55 17.982 -9.443 12.415 1.00 12.54 C ATOM 877 CD1 PHE A 55 16.605 -9.593 12.442 1.00 33.23 C ATOM 878 CD2 PHE A 55 18.693 -9.610 13.592 1.00 4.44 C ATOM 879 CE1 PHE A 55 15.951 -9.903 13.620 1.00 51.21 C ATOM 880 CE2 PHE A 55 18.045 -9.920 14.773 1.00 0.31 C ATOM 881 CZ PHE A 55 16.672 -10.067 14.786 1.00 30.55 C ATOM 0 H PHE A 55 20.493 -10.602 10.264 1.00 63.01 H new ATOM 0 HA PHE A 55 17.609 -10.757 10.282 1.00 5.33 H new ATOM 0 HB2 PHE A 55 19.759 -9.022 11.330 1.00 33.24 H new ATOM 0 HB3 PHE A 55 18.353 -8.128 10.788 1.00 33.24 H new ATOM 0 HD1 PHE A 55 16.036 -9.466 11.533 1.00 33.23 H new ATOM 0 HD2 PHE A 55 19.767 -9.497 13.587 1.00 4.44 H new ATOM 0 HE1 PHE A 55 14.877 -10.017 13.628 1.00 51.21 H new ATOM 0 HE2 PHE A 55 18.611 -10.047 15.684 1.00 0.31 H new ATOM 0 HZ PHE A 55 16.163 -10.310 15.707 1.00 30.55 H new ATOM 891 N SER A 56 19.093 -9.511 7.765 1.00 43.51 N ATOM 892 CA SER A 56 18.929 -8.870 6.465 1.00 65.51 C ATOM 893 C SER A 56 17.626 -9.308 5.804 1.00 14.05 C ATOM 894 O SER A 56 17.088 -8.611 4.944 1.00 1.53 O ATOM 895 CB SER A 56 20.113 -9.206 5.555 1.00 12.30 C ATOM 896 OG SER A 56 20.108 -8.396 4.392 1.00 14.33 O ATOM 0 H SER A 56 19.968 -10.023 7.876 1.00 43.51 H new ATOM 0 HA SER A 56 18.893 -7.792 6.621 1.00 65.51 H new ATOM 0 HB2 SER A 56 21.046 -9.061 6.099 1.00 12.30 H new ATOM 0 HB3 SER A 56 20.070 -10.257 5.270 1.00 12.30 H new ATOM 0 HG SER A 56 20.875 -8.629 3.828 1.00 14.33 H new ATOM 902 N SER A 57 17.123 -10.468 6.214 1.00 75.23 N ATOM 903 CA SER A 57 15.884 -11.002 5.660 1.00 72.22 C ATOM 904 C SER A 57 14.703 -10.098 6.000 1.00 74.40 C ATOM 905 O SER A 57 13.632 -10.206 5.403 1.00 63.35 O ATOM 906 CB SER A 57 15.630 -12.414 6.191 1.00 33.21 C ATOM 907 OG SER A 57 16.142 -13.393 5.303 1.00 14.14 O ATOM 0 H SER A 57 17.554 -11.056 6.927 1.00 75.23 H new ATOM 0 HA SER A 57 15.987 -11.043 4.576 1.00 72.22 H new ATOM 0 HB2 SER A 57 16.096 -12.527 7.170 1.00 33.21 H new ATOM 0 HB3 SER A 57 14.560 -12.567 6.328 1.00 33.21 H new ATOM 0 HG SER A 57 15.968 -14.287 5.666 1.00 14.14 H new ATOM 913 N ALA A 58 14.906 -9.207 6.965 1.00 63.14 N ATOM 914 CA ALA A 58 13.860 -8.283 7.384 1.00 41.22 C ATOM 915 C ALA A 58 14.455 -7.037 8.031 1.00 4.10 C ATOM 916 O ALA A 58 15.238 -7.131 8.975 1.00 1.44 O ATOM 917 CB ALA A 58 12.901 -8.971 8.343 1.00 31.44 C ATOM 0 H ALA A 58 15.786 -9.106 7.471 1.00 63.14 H new ATOM 0 HA ALA A 58 13.308 -7.972 6.497 1.00 41.22 H new ATOM 0 HB1 ALA A 58 12.125 -8.269 8.648 1.00 31.44 H new ATOM 0 HB2 ALA A 58 12.442 -9.826 7.847 1.00 31.44 H new ATOM 0 HB3 ALA A 58 13.448 -9.312 9.222 1.00 31.44 H new ATOM 923 N ASN A 59 14.079 -5.871 7.516 1.00 43.12 N ATOM 924 CA ASN A 59 14.578 -4.606 8.043 1.00 15.15 C ATOM 925 C ASN A 59 14.309 -4.498 9.541 1.00 14.34 C ATOM 926 O ASN A 59 13.226 -4.843 10.015 1.00 35.45 O ATOM 927 CB ASN A 59 13.925 -3.432 7.311 1.00 45.43 C ATOM 928 CG ASN A 59 13.862 -3.649 5.811 1.00 20.23 C ATOM 929 OD1 ASN A 59 14.865 -3.977 5.177 1.00 22.14 O ATOM 930 ND2 ASN A 59 12.679 -3.467 5.237 1.00 52.13 N ATOM 0 H ASN A 59 13.431 -5.776 6.734 1.00 43.12 H new ATOM 0 HA ASN A 59 15.655 -4.573 7.881 1.00 15.15 H new ATOM 0 HB2 ASN A 59 12.916 -3.283 7.696 1.00 45.43 H new ATOM 0 HB3 ASN A 59 14.484 -2.520 7.520 1.00 45.43 H new ATOM 0 HD21 ASN A 59 12.575 -3.599 4.231 1.00 52.13 H new ATOM 0 HD22 ASN A 59 11.874 -3.195 5.802 1.00 52.13 H new ATOM 937 N LEU A 60 15.301 -4.015 10.281 1.00 34.25 N ATOM 938 CA LEU A 60 15.172 -3.860 11.726 1.00 32.23 C ATOM 939 C LEU A 60 15.524 -2.439 12.155 1.00 34.20 C ATOM 940 O LEU A 60 16.630 -1.961 11.904 1.00 51.44 O ATOM 941 CB LEU A 60 16.075 -4.861 12.449 1.00 72.41 C ATOM 942 CG LEU A 60 15.601 -5.318 13.829 1.00 2.44 C ATOM 943 CD1 LEU A 60 16.051 -6.744 14.104 1.00 62.14 C ATOM 944 CD2 LEU A 60 16.118 -4.377 14.908 1.00 14.22 C ATOM 0 H LEU A 60 16.203 -3.724 9.905 1.00 34.25 H new ATOM 0 HA LEU A 60 14.134 -4.055 11.996 1.00 32.23 H new ATOM 0 HB2 LEU A 60 16.188 -5.741 11.816 1.00 72.41 H new ATOM 0 HB3 LEU A 60 17.064 -4.416 12.556 1.00 72.41 H new ATOM 0 HG LEU A 60 14.511 -5.294 13.844 1.00 2.44 H new ATOM 0 HD11 LEU A 60 15.704 -7.051 15.091 1.00 62.14 H new ATOM 0 HD12 LEU A 60 15.633 -7.410 13.349 1.00 62.14 H new ATOM 0 HD13 LEU A 60 17.139 -6.795 14.070 1.00 62.14 H new ATOM 0 HD21 LEU A 60 15.771 -4.717 15.884 1.00 14.22 H new ATOM 0 HD22 LEU A 60 17.208 -4.369 14.893 1.00 14.22 H new ATOM 0 HD23 LEU A 60 15.746 -3.370 14.721 1.00 14.22 H new ATOM 956 N ILE A 61 14.576 -1.771 12.805 1.00 64.32 N ATOM 957 CA ILE A 61 14.788 -0.407 13.271 1.00 11.33 C ATOM 958 C ILE A 61 13.991 -0.130 14.541 1.00 34.14 C ATOM 959 O ILE A 61 13.070 -0.873 14.885 1.00 41.33 O ATOM 960 CB ILE A 61 14.393 0.623 12.196 1.00 2.34 C ATOM 961 CG1 ILE A 61 12.875 0.639 12.007 1.00 60.43 C ATOM 962 CG2 ILE A 61 15.094 0.312 10.882 1.00 14.12 C ATOM 963 CD1 ILE A 61 12.410 1.597 10.933 1.00 51.20 C ATOM 0 H ILE A 61 13.655 -2.152 13.020 1.00 64.32 H new ATOM 0 HA ILE A 61 15.852 -0.308 13.484 1.00 11.33 H new ATOM 0 HB ILE A 61 14.708 1.612 12.528 1.00 2.34 H new ATOM 0 HG12 ILE A 61 12.538 -0.367 11.756 1.00 60.43 H new ATOM 0 HG13 ILE A 61 12.402 0.908 12.952 1.00 60.43 H new ATOM 0 HG21 ILE A 61 14.805 1.048 10.132 1.00 14.12 H new ATOM 0 HG22 ILE A 61 16.174 0.348 11.028 1.00 14.12 H new ATOM 0 HG23 ILE A 61 14.806 -0.683 10.543 1.00 14.12 H new ATOM 0 HD11 ILE A 61 11.324 1.556 10.854 1.00 51.20 H new ATOM 0 HD12 ILE A 61 12.717 2.610 11.192 1.00 51.20 H new ATOM 0 HD13 ILE A 61 12.854 1.316 9.978 1.00 51.20 H new ATOM 975 N THR A 62 14.349 0.945 15.236 1.00 11.23 N ATOM 976 CA THR A 62 13.667 1.321 16.468 1.00 1.23 C ATOM 977 C THR A 62 12.972 2.670 16.322 1.00 1.14 C ATOM 978 O THR A 62 13.139 3.360 15.317 1.00 53.14 O ATOM 979 CB THR A 62 14.647 1.387 17.655 1.00 31.00 C ATOM 980 OG1 THR A 62 15.351 2.634 17.640 1.00 22.43 O ATOM 981 CG2 THR A 62 15.641 0.237 17.601 1.00 73.44 C ATOM 0 H THR A 62 15.108 1.571 14.966 1.00 11.23 H new ATOM 0 HA THR A 62 12.921 0.551 16.664 1.00 1.23 H new ATOM 0 HB THR A 62 14.072 1.306 18.577 1.00 31.00 H new ATOM 0 HG1 THR A 62 16.047 2.609 16.950 1.00 22.43 H new ATOM 0 HG21 THR A 62 16.322 0.305 18.449 1.00 73.44 H new ATOM 0 HG22 THR A 62 15.104 -0.711 17.642 1.00 73.44 H new ATOM 0 HG23 THR A 62 16.210 0.291 16.673 1.00 73.44 H new ATOM 989 N VAL A 63 12.193 3.041 17.333 1.00 14.41 N ATOM 990 CA VAL A 63 11.473 4.310 17.318 1.00 24.40 C ATOM 991 C VAL A 63 11.236 4.824 18.734 1.00 71.55 C ATOM 992 O VAL A 63 10.826 4.071 19.617 1.00 2.52 O ATOM 993 CB VAL A 63 10.119 4.178 16.597 1.00 14.13 C ATOM 994 CG1 VAL A 63 9.230 3.170 17.310 1.00 63.32 C ATOM 995 CG2 VAL A 63 9.432 5.532 16.503 1.00 43.34 C ATOM 0 H VAL A 63 12.044 2.481 18.173 1.00 14.41 H new ATOM 0 HA VAL A 63 12.096 5.022 16.776 1.00 24.40 H new ATOM 0 HB VAL A 63 10.300 3.816 15.585 1.00 14.13 H new ATOM 0 HG11 VAL A 63 8.278 3.090 16.786 1.00 63.32 H new ATOM 0 HG12 VAL A 63 9.720 2.197 17.322 1.00 63.32 H new ATOM 0 HG13 VAL A 63 9.054 3.500 18.334 1.00 63.32 H new ATOM 0 HG21 VAL A 63 8.476 5.420 15.991 1.00 43.34 H new ATOM 0 HG22 VAL A 63 9.262 5.924 17.506 1.00 43.34 H new ATOM 0 HG23 VAL A 63 10.064 6.223 15.945 1.00 43.34 H new ATOM 1005 N ALA A 64 11.496 6.110 18.941 1.00 14.23 N ATOM 1006 CA ALA A 64 11.308 6.726 20.249 1.00 34.01 C ATOM 1007 C ALA A 64 10.208 7.782 20.206 1.00 61.22 C ATOM 1008 O ALA A 64 9.840 8.265 19.135 1.00 22.11 O ATOM 1009 CB ALA A 64 12.612 7.339 20.736 1.00 1.31 C ATOM 0 H ALA A 64 11.837 6.746 18.220 1.00 14.23 H new ATOM 0 HA ALA A 64 11.001 5.948 20.949 1.00 34.01 H new ATOM 0 HB1 ALA A 64 12.457 7.795 21.714 1.00 1.31 H new ATOM 0 HB2 ALA A 64 13.372 6.562 20.815 1.00 1.31 H new ATOM 0 HB3 ALA A 64 12.943 8.100 20.029 1.00 1.31 H new ATOM 1015 N SER A 65 9.687 8.135 21.376 1.00 32.03 N ATOM 1016 CA SER A 65 8.626 9.131 21.471 1.00 33.33 C ATOM 1017 C SER A 65 9.027 10.264 22.410 1.00 1.41 C ATOM 1018 O SER A 65 8.705 10.264 23.598 1.00 21.05 O ATOM 1019 CB SER A 65 7.330 8.481 21.962 1.00 4.30 C ATOM 1020 OG SER A 65 7.382 7.072 21.824 1.00 25.13 O ATOM 0 H SER A 65 9.982 7.746 22.272 1.00 32.03 H new ATOM 0 HA SER A 65 8.462 9.547 20.477 1.00 33.33 H new ATOM 0 HB2 SER A 65 7.162 8.741 23.007 1.00 4.30 H new ATOM 0 HB3 SER A 65 6.485 8.874 21.396 1.00 4.30 H new ATOM 0 HG SER A 65 6.543 6.681 22.146 1.00 25.13 H new ATOM 1026 N PRO A 66 9.748 11.256 21.865 1.00 31.42 N ATOM 1027 CA PRO A 66 10.209 12.415 22.635 1.00 21.32 C ATOM 1028 C PRO A 66 9.063 13.337 23.037 1.00 22.10 C ATOM 1029 O PRO A 66 8.290 13.787 22.192 1.00 4.13 O ATOM 1030 CB PRO A 66 11.156 13.129 21.668 1.00 63.02 C ATOM 1031 CG PRO A 66 10.689 12.725 20.312 1.00 31.33 C ATOM 1032 CD PRO A 66 10.168 11.321 20.455 1.00 13.53 C ATOM 0 HA PRO A 66 10.679 12.120 23.573 1.00 21.32 H new ATOM 0 HB2 PRO A 66 11.111 14.211 21.796 1.00 63.02 H new ATOM 0 HB3 PRO A 66 12.191 12.831 21.835 1.00 63.02 H new ATOM 0 HG2 PRO A 66 9.909 13.396 19.952 1.00 31.33 H new ATOM 0 HG3 PRO A 66 11.504 12.767 19.590 1.00 31.33 H new ATOM 0 HD2 PRO A 66 9.335 11.130 19.778 1.00 13.53 H new ATOM 0 HD3 PRO A 66 10.937 10.582 20.230 1.00 13.53 H new ATOM 1040 N GLY A 67 8.960 13.615 24.333 1.00 34.43 N ATOM 1041 CA GLY A 67 7.905 14.482 24.824 1.00 50.40 C ATOM 1042 C GLY A 67 6.594 13.747 25.022 1.00 4.14 C ATOM 1043 O GLY A 67 5.548 14.368 25.211 1.00 41.13 O ATOM 0 H GLY A 67 9.588 13.255 25.052 1.00 34.43 H new ATOM 0 HA2 GLY A 67 8.215 14.926 25.770 1.00 50.40 H new ATOM 0 HA3 GLY A 67 7.756 15.301 24.121 1.00 50.40 H new ATOM 1047 N PHE A 68 6.650 12.420 24.979 1.00 53.15 N ATOM 1048 CA PHE A 68 5.457 11.599 25.152 1.00 2.13 C ATOM 1049 C PHE A 68 5.636 10.617 26.306 1.00 3.14 C ATOM 1050 O PHE A 68 6.733 10.107 26.538 1.00 23.11 O ATOM 1051 CB PHE A 68 5.145 10.837 23.863 1.00 73.30 C ATOM 1052 CG PHE A 68 3.829 10.113 23.898 1.00 21.13 C ATOM 1053 CD1 PHE A 68 2.699 10.727 24.415 1.00 64.41 C ATOM 1054 CD2 PHE A 68 3.722 8.819 23.415 1.00 23.45 C ATOM 1055 CE1 PHE A 68 1.487 10.064 24.449 1.00 60.44 C ATOM 1056 CE2 PHE A 68 2.513 8.151 23.446 1.00 34.21 C ATOM 1057 CZ PHE A 68 1.394 8.774 23.964 1.00 30.55 C ATOM 0 H PHE A 68 7.508 11.890 24.826 1.00 53.15 H new ATOM 0 HA PHE A 68 4.622 12.260 25.386 1.00 2.13 H new ATOM 0 HB2 PHE A 68 5.143 11.537 23.028 1.00 73.30 H new ATOM 0 HB3 PHE A 68 5.942 10.117 23.674 1.00 73.30 H new ATOM 0 HD1 PHE A 68 2.767 11.735 24.796 1.00 64.41 H new ATOM 0 HD2 PHE A 68 4.594 8.327 23.010 1.00 23.45 H new ATOM 0 HE1 PHE A 68 0.614 10.554 24.854 1.00 60.44 H new ATOM 0 HE2 PHE A 68 2.443 7.143 23.066 1.00 34.21 H new ATOM 0 HZ PHE A 68 0.448 8.253 23.990 1.00 30.55 H new ATOM 1067 N LEU A 69 4.552 10.357 27.028 1.00 55.23 N ATOM 1068 CA LEU A 69 4.587 9.437 28.159 1.00 63.31 C ATOM 1069 C LEU A 69 5.502 9.963 29.260 1.00 23.32 C ATOM 1070 O LEU A 69 5.045 10.595 30.213 1.00 72.11 O ATOM 1071 CB LEU A 69 5.061 8.055 27.703 1.00 11.51 C ATOM 1072 CG LEU A 69 3.963 7.033 27.408 1.00 11.02 C ATOM 1073 CD1 LEU A 69 3.411 6.455 28.702 1.00 74.22 C ATOM 1074 CD2 LEU A 69 2.850 7.668 26.587 1.00 34.34 C ATOM 0 H LEU A 69 3.637 10.771 26.850 1.00 55.23 H new ATOM 0 HA LEU A 69 3.577 9.354 28.560 1.00 63.31 H new ATOM 0 HB2 LEU A 69 5.666 8.178 26.805 1.00 11.51 H new ATOM 0 HB3 LEU A 69 5.714 7.645 28.473 1.00 11.51 H new ATOM 0 HG LEU A 69 4.397 6.219 26.827 1.00 11.02 H new ATOM 0 HD11 LEU A 69 2.631 5.729 28.473 1.00 74.22 H new ATOM 0 HD12 LEU A 69 4.213 5.963 29.252 1.00 74.22 H new ATOM 0 HD13 LEU A 69 2.993 7.257 29.310 1.00 74.22 H new ATOM 0 HD21 LEU A 69 2.077 6.926 26.386 1.00 34.34 H new ATOM 0 HD22 LEU A 69 2.418 8.501 27.142 1.00 34.34 H new ATOM 0 HD23 LEU A 69 3.256 8.033 25.644 1.00 34.34 H new ATOM 1086 N HIS A 70 6.798 9.699 29.122 1.00 11.32 N ATOM 1087 CA HIS A 70 7.778 10.149 30.104 1.00 23.33 C ATOM 1088 C HIS A 70 9.168 10.241 29.482 1.00 40.25 C ATOM 1089 O HIS A 70 10.177 10.196 30.184 1.00 31.14 O ATOM 1090 CB HIS A 70 7.805 9.198 31.301 1.00 23.22 C ATOM 1091 CG HIS A 70 7.530 9.873 32.609 1.00 11.33 C ATOM 1092 ND1 HIS A 70 6.282 10.337 32.969 1.00 42.43 N ATOM 1093 CD2 HIS A 70 8.350 10.161 33.647 1.00 31.31 C ATOM 1094 CE1 HIS A 70 6.347 10.883 34.170 1.00 31.53 C ATOM 1095 NE2 HIS A 70 7.591 10.788 34.604 1.00 32.23 N ATOM 0 H HIS A 70 7.193 9.176 28.340 1.00 11.32 H new ATOM 0 HA HIS A 70 7.485 11.142 30.444 1.00 23.33 H new ATOM 0 HB2 HIS A 70 7.067 8.411 31.146 1.00 23.22 H new ATOM 0 HB3 HIS A 70 8.781 8.715 31.349 1.00 23.22 H new ATOM 0 HD1 HIS A 70 5.440 10.269 32.397 1.00 42.43 H new ATOM 0 HD2 HIS A 70 9.405 9.939 33.710 1.00 31.31 H new ATOM 0 HE1 HIS A 70 5.523 11.331 34.706 1.00 31.53 H new ATOM 1103 N GLU A 71 9.211 10.370 28.159 1.00 4.11 N ATOM 1104 CA GLU A 71 10.478 10.467 27.443 1.00 51.01 C ATOM 1105 C GLU A 71 10.964 11.912 27.391 1.00 4.51 C ATOM 1106 O GLU A 71 10.168 12.850 27.443 1.00 2.24 O ATOM 1107 CB GLU A 71 10.330 9.916 26.023 1.00 12.11 C ATOM 1108 CG GLU A 71 10.951 8.542 25.836 1.00 53.04 C ATOM 1109 CD GLU A 71 12.407 8.612 25.417 1.00 34.15 C ATOM 1110 OE1 GLU A 71 13.132 9.485 25.937 1.00 44.24 O ATOM 1111 OE2 GLU A 71 12.820 7.792 24.571 1.00 51.13 O ATOM 0 H GLU A 71 8.385 10.410 27.562 1.00 4.11 H new ATOM 0 HA GLU A 71 11.216 9.872 27.981 1.00 51.01 H new ATOM 0 HB2 GLU A 71 9.271 9.864 25.771 1.00 12.11 H new ATOM 0 HB3 GLU A 71 10.791 10.612 25.322 1.00 12.11 H new ATOM 0 HG2 GLU A 71 10.871 7.982 26.768 1.00 53.04 H new ATOM 0 HG3 GLU A 71 10.386 7.991 25.084 1.00 53.04 H new ATOM 1118 N LYS A 72 12.278 12.085 27.289 1.00 52.04 N ATOM 1119 CA LYS A 72 12.873 13.415 27.229 1.00 30.21 C ATOM 1120 C LYS A 72 12.211 14.259 26.145 1.00 12.21 C ATOM 1121 O LYS A 72 11.502 13.738 25.284 1.00 40.12 O ATOM 1122 CB LYS A 72 14.376 13.312 26.963 1.00 65.31 C ATOM 1123 CG LYS A 72 15.118 12.463 27.982 1.00 53.15 C ATOM 1124 CD LYS A 72 16.455 11.985 27.441 1.00 21.14 C ATOM 1125 CE LYS A 72 17.614 12.522 28.267 1.00 11.12 C ATOM 1126 NZ LYS A 72 18.070 11.539 29.289 1.00 55.11 N ATOM 0 H LYS A 72 12.951 11.320 27.246 1.00 52.04 H new ATOM 0 HA LYS A 72 12.713 13.901 28.191 1.00 30.21 H new ATOM 0 HB2 LYS A 72 14.533 12.892 25.970 1.00 65.31 H new ATOM 0 HB3 LYS A 72 14.805 14.314 26.956 1.00 65.31 H new ATOM 0 HG2 LYS A 72 15.278 13.042 28.892 1.00 53.15 H new ATOM 0 HG3 LYS A 72 14.506 11.603 28.255 1.00 53.15 H new ATOM 0 HD2 LYS A 72 16.480 10.895 27.442 1.00 21.14 H new ATOM 0 HD3 LYS A 72 16.565 12.306 26.405 1.00 21.14 H new ATOM 0 HE2 LYS A 72 18.445 12.772 27.607 1.00 11.12 H new ATOM 0 HE3 LYS A 72 17.311 13.445 28.761 1.00 11.12 H new ATOM 0 HZ1 LYS A 72 18.179 12.017 30.206 1.00 55.11 H new ATOM 0 HZ2 LYS A 72 17.367 10.778 29.377 1.00 55.11 H new ATOM 0 HZ3 LYS A 72 18.983 11.135 28.999 1.00 55.11 H new ATOM 1140 N LYS A 73 12.447 15.566 26.192 1.00 23.14 N ATOM 1141 CA LYS A 73 11.877 16.483 25.213 1.00 14.12 C ATOM 1142 C LYS A 73 12.726 16.525 23.947 1.00 72.52 C ATOM 1143 O LYS A 73 13.925 16.250 23.983 1.00 23.22 O ATOM 1144 CB LYS A 73 11.760 17.888 25.808 1.00 52.42 C ATOM 1145 CG LYS A 73 13.074 18.437 26.335 1.00 44.24 C ATOM 1146 CD LYS A 73 12.958 18.864 27.788 1.00 20.13 C ATOM 1147 CE LYS A 73 13.410 17.759 28.731 1.00 10.43 C ATOM 1148 NZ LYS A 73 13.951 18.306 30.006 1.00 24.34 N ATOM 0 H LYS A 73 13.030 16.014 26.899 1.00 23.14 H new ATOM 0 HA LYS A 73 10.883 16.122 24.950 1.00 14.12 H new ATOM 0 HB2 LYS A 73 11.373 18.565 25.046 1.00 52.42 H new ATOM 0 HB3 LYS A 73 11.032 17.870 26.619 1.00 52.42 H new ATOM 0 HG2 LYS A 73 13.851 17.678 26.239 1.00 44.24 H new ATOM 0 HG3 LYS A 73 13.383 19.288 25.728 1.00 44.24 H new ATOM 0 HD2 LYS A 73 13.561 19.756 27.955 1.00 20.13 H new ATOM 0 HD3 LYS A 73 11.925 19.132 28.008 1.00 20.13 H new ATOM 0 HE2 LYS A 73 12.570 17.099 28.946 1.00 10.43 H new ATOM 0 HE3 LYS A 73 14.174 17.154 28.242 1.00 10.43 H new ATOM 0 HZ1 LYS A 73 14.248 17.522 30.622 1.00 24.34 H new ATOM 0 HZ2 LYS A 73 14.769 18.916 29.803 1.00 24.34 H new ATOM 0 HZ3 LYS A 73 13.215 18.862 30.485 1.00 24.34 H new ATOM 1162 N ASP A 74 12.097 16.871 22.829 1.00 35.52 N ATOM 1163 CA ASP A 74 12.795 16.950 21.552 1.00 43.43 C ATOM 1164 C ASP A 74 14.083 17.758 21.686 1.00 75.10 C ATOM 1165 O ASP A 74 14.148 18.718 22.452 1.00 10.04 O ATOM 1166 CB ASP A 74 11.892 17.580 20.490 1.00 12.35 C ATOM 1167 CG ASP A 74 12.554 17.641 19.128 1.00 2.12 C ATOM 1168 OD1 ASP A 74 13.389 18.545 18.915 1.00 53.04 O ATOM 1169 OD2 ASP A 74 12.238 16.785 18.275 1.00 15.33 O ATOM 0 H ASP A 74 11.104 17.101 22.782 1.00 35.52 H new ATOM 0 HA ASP A 74 13.052 15.937 21.244 1.00 43.43 H new ATOM 0 HB2 ASP A 74 10.968 17.006 20.416 1.00 12.35 H new ATOM 0 HB3 ASP A 74 11.617 18.587 20.802 1.00 12.35 H new ATOM 1174 N GLY A 75 15.106 17.361 20.935 1.00 34.43 N ATOM 1175 CA GLY A 75 16.378 18.057 20.986 1.00 13.33 C ATOM 1176 C GLY A 75 17.308 17.489 22.039 1.00 22.02 C ATOM 1177 O GLY A 75 18.491 17.270 21.779 1.00 63.45 O ATOM 0 H GLY A 75 15.076 16.570 20.292 1.00 34.43 H new ATOM 0 HA2 GLY A 75 16.860 17.998 20.010 1.00 13.33 H new ATOM 0 HA3 GLY A 75 16.203 19.113 21.192 1.00 13.33 H new ATOM 1181 N ASP A 76 16.774 17.251 23.232 1.00 3.42 N ATOM 1182 CA ASP A 76 17.565 16.706 24.329 1.00 63.30 C ATOM 1183 C ASP A 76 17.804 15.211 24.136 1.00 52.40 C ATOM 1184 O ASP A 76 18.927 14.728 24.279 1.00 31.34 O ATOM 1185 CB ASP A 76 16.864 16.954 25.665 1.00 13.51 C ATOM 1186 CG ASP A 76 17.728 17.733 26.637 1.00 42.52 C ATOM 1187 OD1 ASP A 76 18.585 17.111 27.298 1.00 3.31 O ATOM 1188 OD2 ASP A 76 17.547 18.965 26.737 1.00 42.35 O ATOM 0 H ASP A 76 15.796 17.427 23.464 1.00 3.42 H new ATOM 0 HA ASP A 76 18.530 17.213 24.335 1.00 63.30 H new ATOM 0 HB2 ASP A 76 15.937 17.500 25.490 1.00 13.51 H new ATOM 0 HB3 ASP A 76 16.591 15.998 26.112 1.00 13.51 H new ATOM 1193 N PHE A 77 16.740 14.485 23.811 1.00 73.30 N ATOM 1194 CA PHE A 77 16.833 13.045 23.600 1.00 34.35 C ATOM 1195 C PHE A 77 17.860 12.718 22.521 1.00 42.12 C ATOM 1196 O PHE A 77 18.594 11.736 22.626 1.00 70.34 O ATOM 1197 CB PHE A 77 15.467 12.476 23.209 1.00 20.15 C ATOM 1198 CG PHE A 77 15.510 11.024 22.827 1.00 34.03 C ATOM 1199 CD1 PHE A 77 15.785 10.645 21.523 1.00 1.03 C ATOM 1200 CD2 PHE A 77 15.275 10.038 23.772 1.00 14.11 C ATOM 1201 CE1 PHE A 77 15.824 9.310 21.169 1.00 20.30 C ATOM 1202 CE2 PHE A 77 15.313 8.701 23.424 1.00 54.03 C ATOM 1203 CZ PHE A 77 15.589 8.337 22.121 1.00 73.55 C ATOM 0 H PHE A 77 15.803 14.870 23.688 1.00 73.30 H new ATOM 0 HA PHE A 77 17.156 12.587 24.535 1.00 34.35 H new ATOM 0 HB2 PHE A 77 14.777 12.604 24.043 1.00 20.15 H new ATOM 0 HB3 PHE A 77 15.068 13.052 22.374 1.00 20.15 H new ATOM 0 HD1 PHE A 77 15.971 11.401 20.775 1.00 1.03 H new ATOM 0 HD2 PHE A 77 15.060 10.318 24.793 1.00 14.11 H new ATOM 0 HE1 PHE A 77 16.038 9.027 20.149 1.00 20.30 H new ATOM 0 HE2 PHE A 77 15.127 7.942 24.170 1.00 54.03 H new ATOM 0 HZ PHE A 77 15.621 7.293 21.846 1.00 73.55 H new ATOM 1213 N GLN A 78 17.905 13.549 21.484 1.00 21.14 N ATOM 1214 CA GLN A 78 18.841 13.348 20.385 1.00 64.22 C ATOM 1215 C GLN A 78 20.280 13.540 20.853 1.00 41.52 C ATOM 1216 O GLN A 78 21.145 12.702 20.599 1.00 72.44 O ATOM 1217 CB GLN A 78 18.531 14.314 19.240 1.00 64.20 C ATOM 1218 CG GLN A 78 17.277 13.952 18.461 1.00 32.25 C ATOM 1219 CD GLN A 78 16.031 14.604 19.027 1.00 34.32 C ATOM 1220 OE1 GLN A 78 15.627 14.323 20.156 1.00 2.12 O ATOM 1221 NE2 GLN A 78 15.413 15.480 18.244 1.00 72.14 N ATOM 0 H GLN A 78 17.304 14.367 21.383 1.00 21.14 H new ATOM 0 HA GLN A 78 18.728 12.324 20.028 1.00 64.22 H new ATOM 0 HB2 GLN A 78 18.420 15.320 19.645 1.00 64.20 H new ATOM 0 HB3 GLN A 78 19.379 14.338 18.556 1.00 64.20 H new ATOM 0 HG2 GLN A 78 17.400 14.254 17.421 1.00 32.25 H new ATOM 0 HG3 GLN A 78 17.150 12.869 18.466 1.00 32.25 H new ATOM 0 HE21 GLN A 78 15.782 15.683 17.315 1.00 72.14 H new ATOM 0 HE22 GLN A 78 14.569 15.950 18.571 1.00 72.14 H new ATOM 1230 N LYS A 79 20.530 14.651 21.538 1.00 45.01 N ATOM 1231 CA LYS A 79 21.864 14.955 22.043 1.00 61.20 C ATOM 1232 C LYS A 79 22.270 13.970 23.135 1.00 14.33 C ATOM 1233 O LYS A 79 23.456 13.716 23.346 1.00 54.44 O ATOM 1234 CB LYS A 79 21.913 16.385 22.587 1.00 74.54 C ATOM 1235 CG LYS A 79 21.687 16.473 24.086 1.00 12.10 C ATOM 1236 CD LYS A 79 21.237 17.864 24.501 1.00 71.10 C ATOM 1237 CE LYS A 79 22.398 18.847 24.506 1.00 33.31 C ATOM 1238 NZ LYS A 79 21.959 20.221 24.876 1.00 42.01 N ATOM 0 H LYS A 79 19.826 15.356 21.756 1.00 45.01 H new ATOM 0 HA LYS A 79 22.568 14.864 21.216 1.00 61.20 H new ATOM 0 HB2 LYS A 79 22.882 16.823 22.348 1.00 74.54 H new ATOM 0 HB3 LYS A 79 21.158 16.984 22.078 1.00 74.54 H new ATOM 0 HG2 LYS A 79 20.936 15.742 24.385 1.00 12.10 H new ATOM 0 HG3 LYS A 79 22.608 16.216 24.610 1.00 12.10 H new ATOM 0 HD2 LYS A 79 20.464 18.216 23.818 1.00 71.10 H new ATOM 0 HD3 LYS A 79 20.790 17.822 25.494 1.00 71.10 H new ATOM 0 HE2 LYS A 79 23.159 18.507 25.209 1.00 33.31 H new ATOM 0 HE3 LYS A 79 22.861 18.867 23.520 1.00 33.31 H new ATOM 0 HZ1 LYS A 79 22.779 20.861 24.868 1.00 42.01 H new ATOM 0 HZ2 LYS A 79 21.252 20.556 24.191 1.00 42.01 H new ATOM 0 HZ3 LYS A 79 21.540 20.207 25.828 1.00 42.01 H new ATOM 1252 N TRP A 80 21.278 13.419 23.826 1.00 62.35 N ATOM 1253 CA TRP A 80 21.533 12.461 24.895 1.00 34.44 C ATOM 1254 C TRP A 80 21.787 11.068 24.330 1.00 71.23 C ATOM 1255 O TRP A 80 22.689 10.360 24.779 1.00 13.20 O ATOM 1256 CB TRP A 80 20.351 12.423 25.866 1.00 72.44 C ATOM 1257 CG TRP A 80 20.275 11.154 26.660 1.00 71.11 C ATOM 1258 CD1 TRP A 80 20.834 10.918 27.884 1.00 52.35 C ATOM 1259 CD2 TRP A 80 19.603 9.947 26.285 1.00 72.35 C ATOM 1260 NE1 TRP A 80 20.550 9.637 28.291 1.00 13.34 N ATOM 1261 CE2 TRP A 80 19.795 9.021 27.329 1.00 60.14 C ATOM 1262 CE3 TRP A 80 18.856 9.558 25.169 1.00 14.43 C ATOM 1263 CZ2 TRP A 80 19.268 7.733 27.287 1.00 31.14 C ATOM 1264 CZ3 TRP A 80 18.333 8.280 25.130 1.00 64.42 C ATOM 1265 CH2 TRP A 80 18.541 7.379 26.183 1.00 13.54 C ATOM 0 H TRP A 80 20.291 13.619 23.665 1.00 62.35 H new ATOM 0 HA TRP A 80 22.426 12.783 25.431 1.00 34.44 H new ATOM 0 HB2 TRP A 80 20.425 13.268 26.551 1.00 72.44 H new ATOM 0 HB3 TRP A 80 19.425 12.548 25.305 1.00 72.44 H new ATOM 0 HD1 TRP A 80 21.414 11.633 28.449 1.00 52.35 H new ATOM 0 HE1 TRP A 80 20.853 9.213 29.168 1.00 13.34 H new ATOM 0 HE3 TRP A 80 18.691 10.245 24.352 1.00 14.43 H new ATOM 0 HZ2 TRP A 80 19.427 7.037 28.098 1.00 31.14 H new ATOM 0 HZ3 TRP A 80 17.754 7.970 24.273 1.00 64.42 H new ATOM 0 HH2 TRP A 80 18.120 6.386 26.122 1.00 13.54 H new ATOM 1276 N TYR A 81 20.987 10.680 23.342 1.00 5.12 N ATOM 1277 CA TYR A 81 21.125 9.370 22.717 1.00 42.22 C ATOM 1278 C TYR A 81 22.343 9.330 21.799 1.00 41.22 C ATOM 1279 O TYR A 81 22.982 8.290 21.642 1.00 51.25 O ATOM 1280 CB TYR A 81 19.863 9.025 21.924 1.00 5.10 C ATOM 1281 CG TYR A 81 20.110 8.067 20.780 1.00 0.33 C ATOM 1282 CD1 TYR A 81 20.266 6.706 21.010 1.00 23.21 C ATOM 1283 CD2 TYR A 81 20.188 8.524 19.470 1.00 32.43 C ATOM 1284 CE1 TYR A 81 20.492 5.827 19.968 1.00 24.05 C ATOM 1285 CE2 TYR A 81 20.412 7.652 18.422 1.00 21.15 C ATOM 1286 CZ TYR A 81 20.564 6.305 18.677 1.00 70.35 C ATOM 1287 OH TYR A 81 20.789 5.433 17.636 1.00 50.34 O ATOM 0 H TYR A 81 20.237 11.254 22.957 1.00 5.12 H new ATOM 0 HA TYR A 81 21.263 8.631 23.507 1.00 42.22 H new ATOM 0 HB2 TYR A 81 19.127 8.589 22.600 1.00 5.10 H new ATOM 0 HB3 TYR A 81 19.429 9.944 21.530 1.00 5.10 H new ATOM 0 HD1 TYR A 81 20.210 6.328 22.020 1.00 23.21 H new ATOM 0 HD2 TYR A 81 20.072 9.578 19.268 1.00 32.43 H new ATOM 0 HE1 TYR A 81 20.612 4.772 20.164 1.00 24.05 H new ATOM 0 HE2 TYR A 81 20.468 8.023 17.409 1.00 21.15 H new ATOM 0 HH TYR A 81 20.048 5.488 16.997 1.00 50.34 H new ATOM 1297 N ALA A 82 22.659 10.471 21.195 1.00 13.53 N ATOM 1298 CA ALA A 82 23.801 10.569 20.295 1.00 52.11 C ATOM 1299 C ALA A 82 25.115 10.474 21.063 1.00 72.22 C ATOM 1300 O ALA A 82 26.186 10.365 20.468 1.00 61.41 O ATOM 1301 CB ALA A 82 23.741 11.869 19.506 1.00 23.20 C ATOM 0 H ALA A 82 22.140 11.341 21.313 1.00 13.53 H new ATOM 0 HA ALA A 82 23.756 9.732 19.599 1.00 52.11 H new ATOM 0 HB1 ALA A 82 24.600 11.929 18.838 1.00 23.20 H new ATOM 0 HB2 ALA A 82 22.823 11.897 18.920 1.00 23.20 H new ATOM 0 HB3 ALA A 82 23.757 12.714 20.195 1.00 23.20 H new ATOM 1307 N GLY A 83 25.025 10.517 22.389 1.00 72.33 N ATOM 1308 CA GLY A 83 26.214 10.435 23.216 1.00 3.00 C ATOM 1309 C GLY A 83 26.260 9.165 24.042 1.00 31.11 C ATOM 1310 O GLY A 83 26.868 9.133 25.113 1.00 15.31 O ATOM 0 H GLY A 83 24.150 10.607 22.905 1.00 72.33 H new ATOM 0 HA2 GLY A 83 27.098 10.484 22.581 1.00 3.00 H new ATOM 0 HA3 GLY A 83 26.251 11.298 23.880 1.00 3.00 H new ATOM 1314 N LEU A 84 25.615 8.115 23.546 1.00 71.02 N ATOM 1315 CA LEU A 84 25.583 6.836 24.246 1.00 34.32 C ATOM 1316 C LEU A 84 26.707 5.924 23.766 1.00 31.51 C ATOM 1317 O LEU A 84 27.791 5.900 24.347 1.00 43.44 O ATOM 1318 CB LEU A 84 24.231 6.151 24.037 1.00 53.30 C ATOM 1319 CG LEU A 84 23.046 6.761 24.787 1.00 3.35 C ATOM 1320 CD1 LEU A 84 21.734 6.214 24.249 1.00 73.14 C ATOM 1321 CD2 LEU A 84 23.165 6.493 26.281 1.00 64.34 C ATOM 0 H LEU A 84 25.107 8.124 22.662 1.00 71.02 H new ATOM 0 HA LEU A 84 25.725 7.029 25.309 1.00 34.32 H new ATOM 0 HB2 LEU A 84 24.003 6.159 22.971 1.00 53.30 H new ATOM 0 HB3 LEU A 84 24.325 5.107 24.335 1.00 53.30 H new ATOM 0 HG LEU A 84 23.058 7.839 24.629 1.00 3.35 H new ATOM 0 HD11 LEU A 84 20.903 6.660 24.795 1.00 73.14 H new ATOM 0 HD12 LEU A 84 21.645 6.458 23.190 1.00 73.14 H new ATOM 0 HD13 LEU A 84 21.712 5.132 24.375 1.00 73.14 H new ATOM 0 HD21 LEU A 84 22.313 6.934 26.799 1.00 64.34 H new ATOM 0 HD22 LEU A 84 23.180 5.418 26.458 1.00 64.34 H new ATOM 0 HD23 LEU A 84 24.087 6.935 26.658 1.00 64.34 H new ATOM 1333 N ASN A 85 26.440 5.175 22.701 1.00 63.31 N ATOM 1334 CA ASN A 85 27.430 4.262 22.141 1.00 24.22 C ATOM 1335 C ASN A 85 26.826 3.427 21.016 1.00 20.24 C ATOM 1336 O ASN A 85 27.200 2.271 20.818 1.00 71.43 O ATOM 1337 CB ASN A 85 27.983 3.343 23.233 1.00 14.42 C ATOM 1338 CG ASN A 85 29.494 3.416 23.340 1.00 33.30 C ATOM 1339 OD1 ASN A 85 30.037 3.759 24.390 1.00 21.41 O ATOM 1340 ND2 ASN A 85 30.180 3.092 22.250 1.00 12.21 N ATOM 0 H ASN A 85 25.547 5.182 22.209 1.00 63.31 H new ATOM 0 HA ASN A 85 28.245 4.858 21.730 1.00 24.22 H new ATOM 0 HB2 ASN A 85 27.540 3.615 24.191 1.00 14.42 H new ATOM 0 HB3 ASN A 85 27.686 2.315 23.024 1.00 14.42 H new ATOM 0 HD21 ASN A 85 31.200 3.122 22.261 1.00 12.21 H new ATOM 0 HD22 ASN A 85 29.687 2.813 21.401 1.00 12.21 H new ATOM 1347 N TYR A 86 25.891 4.020 20.283 1.00 12.55 N ATOM 1348 CA TYR A 86 25.233 3.331 19.180 1.00 50.44 C ATOM 1349 C TYR A 86 24.936 4.296 18.035 1.00 31.42 C ATOM 1350 O TYR A 86 23.783 4.595 17.725 1.00 53.01 O ATOM 1351 CB TYR A 86 23.936 2.677 19.660 1.00 64.05 C ATOM 1352 CG TYR A 86 24.038 2.075 21.043 1.00 61.54 C ATOM 1353 CD1 TYR A 86 24.504 0.778 21.224 1.00 32.02 C ATOM 1354 CD2 TYR A 86 23.668 2.801 22.167 1.00 33.04 C ATOM 1355 CE1 TYR A 86 24.598 0.223 22.486 1.00 72.12 C ATOM 1356 CE2 TYR A 86 23.760 2.255 23.433 1.00 73.42 C ATOM 1357 CZ TYR A 86 24.225 0.965 23.587 1.00 41.41 C ATOM 1358 OH TYR A 86 24.317 0.417 24.846 1.00 51.13 O ATOM 0 H TYR A 86 25.571 4.977 20.433 1.00 12.55 H new ATOM 0 HA TYR A 86 25.908 2.557 18.814 1.00 50.44 H new ATOM 0 HB2 TYR A 86 23.140 3.421 19.655 1.00 64.05 H new ATOM 0 HB3 TYR A 86 23.649 1.898 18.954 1.00 64.05 H new ATOM 0 HD1 TYR A 86 24.797 0.194 20.364 1.00 32.02 H new ATOM 0 HD2 TYR A 86 23.302 3.810 22.050 1.00 33.04 H new ATOM 0 HE1 TYR A 86 24.962 -0.786 22.609 1.00 72.12 H new ATOM 0 HE2 TYR A 86 23.470 2.834 24.297 1.00 73.42 H new ATOM 0 HH TYR A 86 24.016 1.072 25.510 1.00 51.13 H new ATOM 1368 N PRO A 87 26.002 4.794 17.391 1.00 73.30 N ATOM 1369 CA PRO A 87 25.882 5.731 16.270 1.00 63.52 C ATOM 1370 C PRO A 87 25.313 5.069 15.019 1.00 21.35 C ATOM 1371 O PRO A 87 24.917 5.747 14.071 1.00 34.52 O ATOM 1372 CB PRO A 87 27.326 6.179 16.027 1.00 14.33 C ATOM 1373 CG PRO A 87 28.162 5.060 16.544 1.00 1.23 C ATOM 1374 CD PRO A 87 27.405 4.480 17.707 1.00 3.41 C ATOM 0 HA PRO A 87 25.198 6.550 16.495 1.00 63.52 H new ATOM 0 HB2 PRO A 87 27.513 6.356 14.968 1.00 14.33 H new ATOM 0 HB3 PRO A 87 27.545 7.110 16.549 1.00 14.33 H new ATOM 0 HG2 PRO A 87 28.328 4.308 15.772 1.00 1.23 H new ATOM 0 HG3 PRO A 87 29.143 5.418 16.856 1.00 1.23 H new ATOM 0 HD2 PRO A 87 27.566 3.406 17.796 1.00 3.41 H new ATOM 0 HD3 PRO A 87 27.714 4.928 18.651 1.00 3.41 H new ATOM 1382 N LYS A 88 25.275 3.741 15.024 1.00 70.40 N ATOM 1383 CA LYS A 88 24.753 2.986 13.891 1.00 35.11 C ATOM 1384 C LYS A 88 23.432 2.312 14.249 1.00 53.01 C ATOM 1385 O LYS A 88 23.036 1.328 13.623 1.00 33.43 O ATOM 1386 CB LYS A 88 25.768 1.934 13.441 1.00 64.33 C ATOM 1387 CG LYS A 88 26.286 2.153 12.030 1.00 62.03 C ATOM 1388 CD LYS A 88 27.406 3.179 12.000 1.00 42.51 C ATOM 1389 CE LYS A 88 27.583 3.771 10.610 1.00 41.11 C ATOM 1390 NZ LYS A 88 29.004 3.731 10.167 1.00 63.02 N ATOM 0 H LYS A 88 25.600 3.165 15.801 1.00 70.40 H new ATOM 0 HA LYS A 88 24.575 3.684 13.073 1.00 35.11 H new ATOM 0 HB2 LYS A 88 26.611 1.935 14.133 1.00 64.33 H new ATOM 0 HB3 LYS A 88 25.307 0.948 13.501 1.00 64.33 H new ATOM 0 HG2 LYS A 88 26.646 1.208 11.623 1.00 62.03 H new ATOM 0 HG3 LYS A 88 25.469 2.486 11.389 1.00 62.03 H new ATOM 0 HD2 LYS A 88 27.190 3.976 12.711 1.00 42.51 H new ATOM 0 HD3 LYS A 88 28.338 2.712 12.319 1.00 42.51 H new ATOM 0 HE2 LYS A 88 26.966 3.221 9.900 1.00 41.11 H new ATOM 0 HE3 LYS A 88 27.231 4.802 10.607 1.00 41.11 H new ATOM 0 HZ1 LYS A 88 29.083 4.143 9.215 1.00 63.02 H new ATOM 0 HZ2 LYS A 88 29.590 4.277 10.831 1.00 63.02 H new ATOM 0 HZ3 LYS A 88 29.333 2.745 10.145 1.00 63.02 H new ATOM 1404 N LEU A 89 22.753 2.849 15.257 1.00 22.51 N ATOM 1405 CA LEU A 89 21.475 2.300 15.697 1.00 22.22 C ATOM 1406 C LEU A 89 20.312 3.120 15.148 1.00 3.22 C ATOM 1407 O LEU A 89 20.178 4.313 15.423 1.00 75.30 O ATOM 1408 CB LEU A 89 21.412 2.264 17.225 1.00 23.31 C ATOM 1409 CG LEU A 89 20.132 1.688 17.831 1.00 54.32 C ATOM 1410 CD1 LEU A 89 19.956 0.233 17.425 1.00 3.13 C ATOM 1411 CD2 LEU A 89 20.151 1.823 19.346 1.00 21.04 C ATOM 0 H LEU A 89 23.066 3.664 15.785 1.00 22.51 H new ATOM 0 HA LEU A 89 21.392 1.284 15.312 1.00 22.22 H new ATOM 0 HB2 LEU A 89 22.257 1.680 17.590 1.00 23.31 H new ATOM 0 HB3 LEU A 89 21.541 3.280 17.598 1.00 23.31 H new ATOM 0 HG LEU A 89 19.284 2.255 17.447 1.00 54.32 H new ATOM 0 HD11 LEU A 89 19.040 -0.159 17.866 1.00 3.13 H new ATOM 0 HD12 LEU A 89 19.895 0.163 16.339 1.00 3.13 H new ATOM 0 HD13 LEU A 89 20.807 -0.349 17.779 1.00 3.13 H new ATOM 0 HD21 LEU A 89 19.232 1.408 19.760 1.00 21.04 H new ATOM 0 HD22 LEU A 89 21.007 1.282 19.749 1.00 21.04 H new ATOM 0 HD23 LEU A 89 20.227 2.876 19.617 1.00 21.04 H new ATOM 1423 N PRO A 90 19.450 2.468 14.355 1.00 70.52 N ATOM 1424 CA PRO A 90 18.281 3.116 13.753 1.00 44.51 C ATOM 1425 C PRO A 90 17.217 3.467 14.787 1.00 53.45 C ATOM 1426 O PRO A 90 16.623 2.584 15.406 1.00 42.33 O ATOM 1427 CB PRO A 90 17.753 2.062 12.778 1.00 71.52 C ATOM 1428 CG PRO A 90 18.223 0.762 13.334 1.00 3.00 C ATOM 1429 CD PRO A 90 19.549 1.046 13.985 1.00 71.33 C ATOM 0 HA PRO A 90 18.539 4.063 13.278 1.00 44.51 H new ATOM 0 HB2 PRO A 90 16.666 2.094 12.711 1.00 71.52 H new ATOM 0 HB3 PRO A 90 18.139 2.225 11.772 1.00 71.52 H new ATOM 0 HG2 PRO A 90 17.510 0.366 14.057 1.00 3.00 H new ATOM 0 HG3 PRO A 90 18.327 0.015 12.547 1.00 3.00 H new ATOM 0 HD2 PRO A 90 19.712 0.414 14.858 1.00 71.33 H new ATOM 0 HD3 PRO A 90 20.379 0.865 13.302 1.00 71.33 H new ATOM 1437 N VAL A 91 16.979 4.763 14.968 1.00 30.42 N ATOM 1438 CA VAL A 91 15.984 5.230 15.926 1.00 1.30 C ATOM 1439 C VAL A 91 15.118 6.332 15.325 1.00 4.14 C ATOM 1440 O VAL A 91 15.581 7.452 15.109 1.00 5.24 O ATOM 1441 CB VAL A 91 16.648 5.758 17.212 1.00 33.51 C ATOM 1442 CG1 VAL A 91 15.600 6.318 18.162 1.00 5.03 C ATOM 1443 CG2 VAL A 91 17.455 4.657 17.884 1.00 10.22 C ATOM 0 H VAL A 91 17.461 5.507 14.464 1.00 30.42 H new ATOM 0 HA VAL A 91 15.357 4.374 16.175 1.00 1.30 H new ATOM 0 HB VAL A 91 17.330 6.565 16.944 1.00 33.51 H new ATOM 0 HG11 VAL A 91 16.087 6.686 19.065 1.00 5.03 H new ATOM 0 HG12 VAL A 91 15.069 7.137 17.676 1.00 5.03 H new ATOM 0 HG13 VAL A 91 14.892 5.533 18.426 1.00 5.03 H new ATOM 0 HG21 VAL A 91 17.917 5.047 18.791 1.00 10.22 H new ATOM 0 HG22 VAL A 91 16.796 3.828 18.140 1.00 10.22 H new ATOM 0 HG23 VAL A 91 18.231 4.307 17.203 1.00 10.22 H new ATOM 1453 N VAL A 92 13.858 6.007 15.058 1.00 74.12 N ATOM 1454 CA VAL A 92 12.925 6.969 14.483 1.00 3.43 C ATOM 1455 C VAL A 92 12.266 7.812 15.570 1.00 63.14 C ATOM 1456 O VAL A 92 11.722 7.281 16.539 1.00 45.41 O ATOM 1457 CB VAL A 92 11.830 6.267 13.659 1.00 63.12 C ATOM 1458 CG1 VAL A 92 10.828 7.280 13.129 1.00 54.52 C ATOM 1459 CG2 VAL A 92 12.450 5.471 12.520 1.00 54.44 C ATOM 0 H VAL A 92 13.459 5.084 15.231 1.00 74.12 H new ATOM 0 HA VAL A 92 13.504 7.617 13.825 1.00 3.43 H new ATOM 0 HB VAL A 92 11.298 5.573 14.310 1.00 63.12 H new ATOM 0 HG11 VAL A 92 10.062 6.765 12.549 1.00 54.52 H new ATOM 0 HG12 VAL A 92 10.361 7.802 13.965 1.00 54.52 H new ATOM 0 HG13 VAL A 92 11.341 8.001 12.493 1.00 54.52 H new ATOM 0 HG21 VAL A 92 11.662 4.981 11.948 1.00 54.44 H new ATOM 0 HG22 VAL A 92 13.008 6.143 11.868 1.00 54.44 H new ATOM 0 HG23 VAL A 92 13.124 4.718 12.927 1.00 54.44 H new ATOM 1469 N THR A 93 12.318 9.130 15.402 1.00 73.23 N ATOM 1470 CA THR A 93 11.727 10.047 16.368 1.00 75.02 C ATOM 1471 C THR A 93 10.228 10.201 16.134 1.00 20.33 C ATOM 1472 O THR A 93 9.760 10.156 14.997 1.00 74.14 O ATOM 1473 CB THR A 93 12.390 11.436 16.303 1.00 71.32 C ATOM 1474 OG1 THR A 93 12.555 11.836 14.938 1.00 52.40 O ATOM 1475 CG2 THR A 93 13.742 11.423 17.000 1.00 60.33 C ATOM 0 H THR A 93 12.764 9.586 14.606 1.00 73.23 H new ATOM 0 HA THR A 93 11.896 9.618 17.355 1.00 75.02 H new ATOM 0 HB THR A 93 11.742 12.148 16.814 1.00 71.32 H new ATOM 0 HG1 THR A 93 12.976 12.721 14.905 1.00 52.40 H new ATOM 0 HG21 THR A 93 14.191 12.414 16.941 1.00 60.33 H new ATOM 0 HG22 THR A 93 13.610 11.146 18.046 1.00 60.33 H new ATOM 0 HG23 THR A 93 14.395 10.699 16.513 1.00 60.33 H new ATOM 1483 N ASP A 94 9.481 10.383 17.218 1.00 71.25 N ATOM 1484 CA ASP A 94 8.034 10.545 17.130 1.00 3.32 C ATOM 1485 C ASP A 94 7.554 11.651 18.065 1.00 22.23 C ATOM 1486 O ASP A 94 7.199 11.394 19.215 1.00 42.02 O ATOM 1487 CB ASP A 94 7.331 9.231 17.471 1.00 74.32 C ATOM 1488 CG ASP A 94 6.490 8.709 16.322 1.00 44.14 C ATOM 1489 OD1 ASP A 94 5.715 9.501 15.746 1.00 40.22 O ATOM 1490 OD2 ASP A 94 6.609 7.509 15.997 1.00 10.25 O ATOM 0 H ASP A 94 9.853 10.422 18.167 1.00 71.25 H new ATOM 0 HA ASP A 94 7.786 10.826 16.106 1.00 3.32 H new ATOM 0 HB2 ASP A 94 8.076 8.483 17.741 1.00 74.32 H new ATOM 0 HB3 ASP A 94 6.696 9.378 18.345 1.00 74.32 H new ATOM 1495 N ASN A 95 7.548 12.882 17.564 1.00 75.42 N ATOM 1496 CA ASN A 95 7.113 14.027 18.355 1.00 32.01 C ATOM 1497 C ASN A 95 5.676 13.843 18.834 1.00 11.31 C ATOM 1498 O ASN A 95 4.728 14.228 18.150 1.00 65.20 O ATOM 1499 CB ASN A 95 7.228 15.313 17.535 1.00 43.31 C ATOM 1500 CG ASN A 95 8.668 15.675 17.227 1.00 44.21 C ATOM 1501 OD1 ASN A 95 9.349 14.975 16.478 1.00 44.05 O ATOM 1502 ND2 ASN A 95 9.139 16.774 17.806 1.00 60.23 N ATOM 0 H ASN A 95 7.839 13.112 16.614 1.00 75.42 H new ATOM 0 HA ASN A 95 7.762 14.101 19.228 1.00 32.01 H new ATOM 0 HB2 ASN A 95 6.678 15.196 16.601 1.00 43.31 H new ATOM 0 HB3 ASN A 95 6.759 16.132 18.081 1.00 43.31 H new ATOM 0 HD21 ASN A 95 10.101 17.067 17.636 1.00 60.23 H new ATOM 0 HD22 ASN A 95 8.539 17.324 18.420 1.00 60.23 H new ATOM 1509 N GLY A 96 5.522 13.253 20.016 1.00 64.14 N ATOM 1510 CA GLY A 96 4.199 13.029 20.566 1.00 34.15 C ATOM 1511 C GLY A 96 3.732 11.597 20.391 1.00 42.30 C ATOM 1512 O GLY A 96 2.569 11.282 20.636 1.00 32.43 O ATOM 0 H GLY A 96 6.291 12.926 20.602 1.00 64.14 H new ATOM 0 HA2 GLY A 96 4.203 13.279 21.627 1.00 34.15 H new ATOM 0 HA3 GLY A 96 3.490 13.701 20.083 1.00 34.15 H new ATOM 1516 N GLY A 97 4.643 10.728 19.963 1.00 72.10 N ATOM 1517 CA GLY A 97 4.299 9.333 19.760 1.00 34.21 C ATOM 1518 C GLY A 97 3.250 9.145 18.682 1.00 41.13 C ATOM 1519 O GLY A 97 2.288 8.397 18.863 1.00 44.34 O ATOM 0 H GLY A 97 5.613 10.965 19.753 1.00 72.10 H new ATOM 0 HA2 GLY A 97 5.196 8.776 19.490 1.00 34.21 H new ATOM 0 HA3 GLY A 97 3.933 8.912 20.696 1.00 34.21 H new ATOM 1523 N THR A 98 3.433 9.827 17.555 1.00 2.12 N ATOM 1524 CA THR A 98 2.494 9.734 16.444 1.00 2.44 C ATOM 1525 C THR A 98 2.235 8.281 16.063 1.00 3.41 C ATOM 1526 O THR A 98 1.087 7.866 15.906 1.00 14.45 O ATOM 1527 CB THR A 98 3.010 10.494 15.208 1.00 64.24 C ATOM 1528 OG1 THR A 98 4.030 11.423 15.593 1.00 32.52 O ATOM 1529 CG2 THR A 98 1.877 11.236 14.516 1.00 73.30 C ATOM 0 H THR A 98 4.223 10.450 17.388 1.00 2.12 H new ATOM 0 HA THR A 98 1.562 10.190 16.778 1.00 2.44 H new ATOM 0 HB THR A 98 3.426 9.767 14.511 1.00 64.24 H new ATOM 0 HG1 THR A 98 4.911 11.021 15.446 1.00 32.52 H new ATOM 0 HG21 THR A 98 2.266 11.765 13.646 1.00 73.30 H new ATOM 0 HG22 THR A 98 1.117 10.523 14.197 1.00 73.30 H new ATOM 0 HG23 THR A 98 1.435 11.952 15.208 1.00 73.30 H new ATOM 1537 N ILE A 99 3.309 7.513 15.916 1.00 62.12 N ATOM 1538 CA ILE A 99 3.197 6.105 15.554 1.00 12.35 C ATOM 1539 C ILE A 99 2.641 5.283 16.712 1.00 1.23 C ATOM 1540 O ILE A 99 1.690 4.521 16.545 1.00 33.22 O ATOM 1541 CB ILE A 99 4.558 5.522 15.132 1.00 3.04 C ATOM 1542 CG1 ILE A 99 5.091 6.254 13.899 1.00 72.33 C ATOM 1543 CG2 ILE A 99 4.433 4.031 14.858 1.00 65.21 C ATOM 1544 CD1 ILE A 99 4.218 6.088 12.674 1.00 11.24 C ATOM 0 H ILE A 99 4.266 7.842 16.042 1.00 62.12 H new ATOM 0 HA ILE A 99 2.510 6.050 14.709 1.00 12.35 H new ATOM 0 HB ILE A 99 5.266 5.663 15.948 1.00 3.04 H new ATOM 0 HG12 ILE A 99 5.184 7.316 14.128 1.00 72.33 H new ATOM 0 HG13 ILE A 99 6.093 5.888 13.674 1.00 72.33 H new ATOM 0 HG21 ILE A 99 5.403 3.633 14.561 1.00 65.21 H new ATOM 0 HG22 ILE A 99 4.093 3.522 15.760 1.00 65.21 H new ATOM 0 HG23 ILE A 99 3.713 3.868 14.056 1.00 65.21 H new ATOM 0 HD11 ILE A 99 4.656 6.633 11.838 1.00 11.24 H new ATOM 0 HD12 ILE A 99 4.146 5.031 12.419 1.00 11.24 H new ATOM 0 HD13 ILE A 99 3.222 6.480 12.881 1.00 11.24 H new ATOM 1556 N ALA A 100 3.241 5.445 17.887 1.00 12.22 N ATOM 1557 CA ALA A 100 2.804 4.721 19.074 1.00 14.23 C ATOM 1558 C ALA A 100 1.298 4.856 19.276 1.00 70.42 C ATOM 1559 O ALA A 100 0.595 3.860 19.444 1.00 34.03 O ATOM 1560 CB ALA A 100 3.549 5.222 20.302 1.00 1.05 C ATOM 0 H ALA A 100 4.031 6.071 18.042 1.00 12.22 H new ATOM 0 HA ALA A 100 3.032 3.665 18.929 1.00 14.23 H new ATOM 0 HB1 ALA A 100 3.212 4.672 21.181 1.00 1.05 H new ATOM 0 HB2 ALA A 100 4.620 5.068 20.166 1.00 1.05 H new ATOM 0 HB3 ALA A 100 3.350 6.285 20.440 1.00 1.05 H new ATOM 1566 N GLN A 101 0.811 6.092 19.258 1.00 43.22 N ATOM 1567 CA GLN A 101 -0.611 6.355 19.440 1.00 13.42 C ATOM 1568 C GLN A 101 -1.431 5.715 18.325 1.00 22.50 C ATOM 1569 O GLN A 101 -2.536 5.225 18.556 1.00 13.24 O ATOM 1570 CB GLN A 101 -0.872 7.862 19.479 1.00 3.32 C ATOM 1571 CG GLN A 101 -1.477 8.341 20.789 1.00 41.31 C ATOM 1572 CD GLN A 101 -2.992 8.374 20.754 1.00 32.53 C ATOM 1573 OE1 GLN A 101 -3.592 8.999 19.879 1.00 25.11 O ATOM 1574 NE2 GLN A 101 -3.621 7.698 21.709 1.00 61.42 N ATOM 0 H GLN A 101 1.380 6.927 19.119 1.00 43.22 H new ATOM 0 HA GLN A 101 -0.916 5.915 20.389 1.00 13.42 H new ATOM 0 HB2 GLN A 101 0.066 8.389 19.307 1.00 3.32 H new ATOM 0 HB3 GLN A 101 -1.541 8.128 18.661 1.00 3.32 H new ATOM 0 HG2 GLN A 101 -1.150 7.686 21.597 1.00 41.31 H new ATOM 0 HG3 GLN A 101 -1.101 9.339 21.015 1.00 41.31 H new ATOM 0 HE21 GLN A 101 -3.084 7.194 22.415 1.00 61.42 H new ATOM 0 HE22 GLN A 101 -4.641 7.683 21.736 1.00 61.42 H new ATOM 1583 N SER A 102 -0.881 5.721 17.115 1.00 53.33 N ATOM 1584 CA SER A 102 -1.563 5.144 15.962 1.00 15.23 C ATOM 1585 C SER A 102 -1.602 3.622 16.060 1.00 40.20 C ATOM 1586 O SER A 102 -2.499 2.976 15.517 1.00 60.11 O ATOM 1587 CB SER A 102 -0.867 5.566 14.667 1.00 53.00 C ATOM 1588 OG SER A 102 -1.039 6.952 14.424 1.00 65.52 O ATOM 0 H SER A 102 0.035 6.119 16.907 1.00 53.33 H new ATOM 0 HA SER A 102 -2.587 5.516 15.953 1.00 15.23 H new ATOM 0 HB2 SER A 102 0.196 5.334 14.729 1.00 53.00 H new ATOM 0 HB3 SER A 102 -1.270 4.994 13.831 1.00 53.00 H new ATOM 0 HG SER A 102 -0.352 7.457 14.907 1.00 65.52 H new ATOM 1594 N LEU A 103 -0.623 3.056 16.756 1.00 65.51 N ATOM 1595 CA LEU A 103 -0.543 1.609 16.926 1.00 23.20 C ATOM 1596 C LEU A 103 -1.112 1.187 18.277 1.00 52.23 C ATOM 1597 O LEU A 103 -1.165 0.000 18.596 1.00 40.32 O ATOM 1598 CB LEU A 103 0.908 1.140 16.803 1.00 42.33 C ATOM 1599 CG LEU A 103 1.411 0.881 15.382 1.00 24.13 C ATOM 1600 CD1 LEU A 103 0.574 -0.194 14.707 1.00 13.03 C ATOM 1601 CD2 LEU A 103 1.392 2.165 14.567 1.00 50.43 C ATOM 0 H LEU A 103 0.127 3.576 17.212 1.00 65.51 H new ATOM 0 HA LEU A 103 -1.137 1.143 16.140 1.00 23.20 H new ATOM 0 HB2 LEU A 103 1.551 1.889 17.264 1.00 42.33 H new ATOM 0 HB3 LEU A 103 1.023 0.223 17.381 1.00 42.33 H new ATOM 0 HG LEU A 103 2.440 0.527 15.441 1.00 24.13 H new ATOM 0 HD11 LEU A 103 0.947 -0.365 13.697 1.00 13.03 H new ATOM 0 HD12 LEU A 103 0.640 -1.119 15.279 1.00 13.03 H new ATOM 0 HD13 LEU A 103 -0.466 0.130 14.660 1.00 13.03 H new ATOM 0 HD21 LEU A 103 1.753 1.961 13.559 1.00 50.43 H new ATOM 0 HD22 LEU A 103 0.373 2.549 14.517 1.00 50.43 H new ATOM 0 HD23 LEU A 103 2.036 2.906 15.040 1.00 50.43 H new ATOM 1613 N ASN A 104 -1.539 2.168 19.065 1.00 12.14 N ATOM 1614 CA ASN A 104 -2.107 1.898 20.381 1.00 2.55 C ATOM 1615 C ASN A 104 -1.064 1.281 21.308 1.00 45.12 C ATOM 1616 O ASN A 104 -1.375 0.400 22.109 1.00 23.25 O ATOM 1617 CB ASN A 104 -3.312 0.964 20.258 1.00 14.43 C ATOM 1618 CG ASN A 104 -4.347 1.211 21.339 1.00 33.41 C ATOM 1619 OD1 ASN A 104 -4.686 0.310 22.107 1.00 61.44 O ATOM 1620 ND2 ASN A 104 -4.855 2.436 21.403 1.00 33.15 N ATOM 0 H ASN A 104 -1.503 3.156 18.816 1.00 12.14 H new ATOM 0 HA ASN A 104 -2.433 2.846 20.809 1.00 2.55 H new ATOM 0 HB2 ASN A 104 -3.773 1.097 19.280 1.00 14.43 H new ATOM 0 HB3 ASN A 104 -2.973 -0.071 20.312 1.00 14.43 H new ATOM 0 HD21 ASN A 104 -5.556 2.661 22.109 1.00 33.15 H new ATOM 0 HD22 ASN A 104 -4.545 3.152 20.746 1.00 33.15 H new ATOM 1627 N ILE A 105 0.174 1.750 21.192 1.00 42.22 N ATOM 1628 CA ILE A 105 1.263 1.246 22.020 1.00 75.53 C ATOM 1629 C ILE A 105 1.388 2.047 23.311 1.00 43.12 C ATOM 1630 O ILE A 105 2.004 3.113 23.335 1.00 62.44 O ATOM 1631 CB ILE A 105 2.607 1.288 21.269 1.00 31.14 C ATOM 1632 CG1 ILE A 105 2.474 0.614 19.902 1.00 22.22 C ATOM 1633 CG2 ILE A 105 3.695 0.616 22.094 1.00 51.42 C ATOM 1634 CD1 ILE A 105 2.235 -0.878 19.985 1.00 40.44 C ATOM 0 H ILE A 105 0.448 2.478 20.533 1.00 42.22 H new ATOM 0 HA ILE A 105 1.024 0.210 22.261 1.00 75.53 H new ATOM 0 HB ILE A 105 2.887 2.330 21.113 1.00 31.14 H new ATOM 0 HG12 ILE A 105 1.651 1.076 19.357 1.00 22.22 H new ATOM 0 HG13 ILE A 105 3.381 0.797 19.326 1.00 22.22 H new ATOM 0 HG21 ILE A 105 4.639 0.653 21.551 1.00 51.42 H new ATOM 0 HG22 ILE A 105 3.803 1.136 23.046 1.00 51.42 H new ATOM 0 HG23 ILE A 105 3.423 -0.423 22.277 1.00 51.42 H new ATOM 0 HD11 ILE A 105 2.151 -1.289 18.979 1.00 40.44 H new ATOM 0 HD12 ILE A 105 3.069 -1.352 20.502 1.00 40.44 H new ATOM 0 HD13 ILE A 105 1.313 -1.069 20.533 1.00 40.44 H new ATOM 1646 N SER A 106 0.802 1.526 24.384 1.00 53.22 N ATOM 1647 CA SER A 106 0.846 2.194 25.679 1.00 2.13 C ATOM 1648 C SER A 106 1.861 1.525 26.601 1.00 21.30 C ATOM 1649 O SER A 106 2.261 2.091 27.618 1.00 21.24 O ATOM 1650 CB SER A 106 -0.538 2.181 26.331 1.00 2.41 C ATOM 1651 OG SER A 106 -1.392 1.246 25.696 1.00 31.11 O ATOM 0 H SER A 106 0.291 0.643 24.382 1.00 53.22 H new ATOM 0 HA SER A 106 1.154 3.227 25.517 1.00 2.13 H new ATOM 0 HB2 SER A 106 -0.443 1.932 27.388 1.00 2.41 H new ATOM 0 HB3 SER A 106 -0.979 3.176 26.276 1.00 2.41 H new ATOM 0 HG SER A 106 -2.270 1.256 26.132 1.00 31.11 H new ATOM 1657 N VAL A 107 2.274 0.315 26.237 1.00 71.21 N ATOM 1658 CA VAL A 107 3.243 -0.433 27.029 1.00 11.12 C ATOM 1659 C VAL A 107 4.559 -0.597 26.277 1.00 53.32 C ATOM 1660 O VAL A 107 4.572 -0.951 25.098 1.00 73.03 O ATOM 1661 CB VAL A 107 2.704 -1.825 27.408 1.00 72.25 C ATOM 1662 CG1 VAL A 107 1.661 -1.713 28.510 1.00 64.15 C ATOM 1663 CG2 VAL A 107 2.126 -2.523 26.185 1.00 4.31 C ATOM 0 H VAL A 107 1.952 -0.168 25.398 1.00 71.21 H new ATOM 0 HA VAL A 107 3.417 0.141 27.939 1.00 11.12 H new ATOM 0 HB VAL A 107 3.532 -2.426 27.784 1.00 72.25 H new ATOM 0 HG11 VAL A 107 1.292 -2.707 28.764 1.00 64.15 H new ATOM 0 HG12 VAL A 107 2.111 -1.257 29.392 1.00 64.15 H new ATOM 0 HG13 VAL A 107 0.832 -1.095 28.165 1.00 64.15 H new ATOM 0 HG21 VAL A 107 1.750 -3.505 26.471 1.00 4.31 H new ATOM 0 HG22 VAL A 107 1.310 -1.926 25.777 1.00 4.31 H new ATOM 0 HG23 VAL A 107 2.904 -2.638 25.430 1.00 4.31 H new ATOM 1673 N TYR A 108 5.664 -0.337 26.966 1.00 1.01 N ATOM 1674 CA TYR A 108 6.986 -0.454 26.363 1.00 43.24 C ATOM 1675 C TYR A 108 7.872 -1.398 27.170 1.00 71.24 C ATOM 1676 O TYR A 108 7.702 -1.570 28.377 1.00 64.12 O ATOM 1677 CB TYR A 108 7.647 0.922 26.262 1.00 63.10 C ATOM 1678 CG TYR A 108 6.868 1.908 25.422 1.00 14.42 C ATOM 1679 CD1 TYR A 108 6.610 1.658 24.080 1.00 30.42 C ATOM 1680 CD2 TYR A 108 6.388 3.091 25.972 1.00 53.15 C ATOM 1681 CE1 TYR A 108 5.899 2.557 23.309 1.00 32.43 C ATOM 1682 CE2 TYR A 108 5.674 3.995 25.209 1.00 42.25 C ATOM 1683 CZ TYR A 108 5.433 3.724 23.878 1.00 72.31 C ATOM 1684 OH TYR A 108 4.723 4.621 23.114 1.00 73.03 O ATOM 0 H TYR A 108 5.671 -0.044 27.943 1.00 1.01 H new ATOM 0 HA TYR A 108 6.865 -0.866 25.361 1.00 43.24 H new ATOM 0 HB2 TYR A 108 7.771 1.331 27.265 1.00 63.10 H new ATOM 0 HB3 TYR A 108 8.645 0.806 25.839 1.00 63.10 H new ATOM 0 HD1 TYR A 108 6.972 0.745 23.632 1.00 30.42 H new ATOM 0 HD2 TYR A 108 6.576 3.307 27.013 1.00 53.15 H new ATOM 0 HE1 TYR A 108 5.709 2.347 22.267 1.00 32.43 H new ATOM 0 HE2 TYR A 108 5.307 4.909 25.652 1.00 42.25 H new ATOM 0 HH TYR A 108 4.467 5.389 23.666 1.00 73.03 H new ATOM 1694 N PRO A 109 8.841 -2.026 26.487 1.00 4.24 N ATOM 1695 CA PRO A 109 9.052 -1.829 25.050 1.00 25.41 C ATOM 1696 C PRO A 109 7.934 -2.438 24.211 1.00 14.35 C ATOM 1697 O PRO A 109 6.976 -2.996 24.748 1.00 65.04 O ATOM 1698 CB PRO A 109 10.375 -2.553 24.784 1.00 74.44 C ATOM 1699 CG PRO A 109 10.468 -3.580 25.859 1.00 11.02 C ATOM 1700 CD PRO A 109 9.806 -2.976 27.067 1.00 51.13 C ATOM 0 HA PRO A 109 9.066 -0.773 24.781 1.00 25.41 H new ATOM 0 HB2 PRO A 109 10.383 -3.013 23.796 1.00 74.44 H new ATOM 0 HB3 PRO A 109 11.218 -1.863 24.821 1.00 74.44 H new ATOM 0 HG2 PRO A 109 9.970 -4.503 25.561 1.00 11.02 H new ATOM 0 HG3 PRO A 109 11.507 -3.832 26.069 1.00 11.02 H new ATOM 0 HD2 PRO A 109 9.310 -3.733 27.674 1.00 51.13 H new ATOM 0 HD3 PRO A 109 10.527 -2.473 27.711 1.00 51.13 H new ATOM 1708 N SER A 110 8.061 -2.326 22.893 1.00 31.21 N ATOM 1709 CA SER A 110 7.058 -2.863 21.980 1.00 3.33 C ATOM 1710 C SER A 110 7.671 -3.162 20.615 1.00 11.14 C ATOM 1711 O SER A 110 8.805 -2.776 20.334 1.00 4.42 O ATOM 1712 CB SER A 110 5.899 -1.877 21.826 1.00 14.23 C ATOM 1713 OG SER A 110 4.858 -2.166 22.744 1.00 61.12 O ATOM 0 H SER A 110 8.848 -1.868 22.433 1.00 31.21 H new ATOM 0 HA SER A 110 6.680 -3.795 22.401 1.00 3.33 H new ATOM 0 HB2 SER A 110 6.258 -0.861 21.987 1.00 14.23 H new ATOM 0 HB3 SER A 110 5.513 -1.921 20.808 1.00 14.23 H new ATOM 0 HG SER A 110 5.000 -1.658 23.570 1.00 61.12 H new ATOM 1719 N TRP A 111 6.912 -3.852 19.772 1.00 20.32 N ATOM 1720 CA TRP A 111 7.379 -4.204 18.436 1.00 25.21 C ATOM 1721 C TRP A 111 6.232 -4.173 17.432 1.00 3.43 C ATOM 1722 O TRP A 111 5.064 -4.264 17.808 1.00 61.10 O ATOM 1723 CB TRP A 111 8.025 -5.591 18.448 1.00 2.31 C ATOM 1724 CG TRP A 111 9.394 -5.603 19.058 1.00 63.14 C ATOM 1725 CD1 TRP A 111 9.700 -5.704 20.385 1.00 73.41 C ATOM 1726 CD2 TRP A 111 10.643 -5.509 18.363 1.00 54.12 C ATOM 1727 NE1 TRP A 111 11.063 -5.679 20.557 1.00 53.20 N ATOM 1728 CE2 TRP A 111 11.664 -5.560 19.332 1.00 73.42 C ATOM 1729 CE3 TRP A 111 10.997 -5.388 17.017 1.00 63.25 C ATOM 1730 CZ2 TRP A 111 13.013 -5.494 18.995 1.00 20.01 C ATOM 1731 CZ3 TRP A 111 12.337 -5.322 16.684 1.00 71.10 C ATOM 1732 CH2 TRP A 111 13.332 -5.376 17.669 1.00 14.15 C ATOM 0 H TRP A 111 5.971 -4.179 19.990 1.00 20.32 H new ATOM 0 HA TRP A 111 8.122 -3.467 18.133 1.00 25.21 H new ATOM 0 HB2 TRP A 111 7.383 -6.278 18.999 1.00 2.31 H new ATOM 0 HB3 TRP A 111 8.087 -5.964 17.426 1.00 2.31 H new ATOM 0 HD1 TRP A 111 8.977 -5.791 21.182 1.00 73.41 H new ATOM 0 HE1 TRP A 111 11.549 -5.739 21.452 1.00 53.20 H new ATOM 0 HE3 TRP A 111 10.237 -5.347 16.250 1.00 63.25 H new ATOM 0 HZ2 TRP A 111 13.781 -5.534 19.753 1.00 20.01 H new ATOM 0 HZ3 TRP A 111 12.622 -5.227 15.647 1.00 71.10 H new ATOM 0 HH2 TRP A 111 14.370 -5.324 17.377 1.00 14.15 H new ATOM 1743 N ALA A 112 6.573 -4.043 16.154 1.00 4.13 N ATOM 1744 CA ALA A 112 5.571 -4.002 15.097 1.00 43.24 C ATOM 1745 C ALA A 112 6.197 -4.290 13.736 1.00 11.21 C ATOM 1746 O ALA A 112 7.005 -3.507 13.235 1.00 62.12 O ATOM 1747 CB ALA A 112 4.873 -2.650 15.083 1.00 3.12 C ATOM 0 H ALA A 112 7.536 -3.964 15.826 1.00 4.13 H new ATOM 0 HA ALA A 112 4.833 -4.778 15.300 1.00 43.24 H new ATOM 0 HB1 ALA A 112 4.127 -2.634 14.288 1.00 3.12 H new ATOM 0 HB2 ALA A 112 4.384 -2.483 16.043 1.00 3.12 H new ATOM 0 HB3 ALA A 112 5.607 -1.863 14.908 1.00 3.12 H new ATOM 1753 N LEU A 113 5.819 -5.417 13.143 1.00 3.03 N ATOM 1754 CA LEU A 113 6.344 -5.809 11.840 1.00 63.01 C ATOM 1755 C LEU A 113 5.535 -5.174 10.714 1.00 71.24 C ATOM 1756 O LEU A 113 4.349 -4.884 10.875 1.00 22.34 O ATOM 1757 CB LEU A 113 6.329 -7.332 11.699 1.00 75.11 C ATOM 1758 CG LEU A 113 7.176 -7.910 10.565 1.00 2.00 C ATOM 1759 CD1 LEU A 113 8.425 -8.577 11.119 1.00 23.42 C ATOM 1760 CD2 LEU A 113 6.363 -8.897 9.741 1.00 73.22 C ATOM 0 H LEU A 113 5.151 -6.075 13.544 1.00 3.03 H new ATOM 0 HA LEU A 113 7.372 -5.454 11.768 1.00 63.01 H new ATOM 0 HB2 LEU A 113 6.670 -7.767 12.638 1.00 75.11 H new ATOM 0 HB3 LEU A 113 5.297 -7.653 11.555 1.00 75.11 H new ATOM 0 HG LEU A 113 7.484 -7.092 9.914 1.00 2.00 H new ATOM 0 HD11 LEU A 113 9.016 -8.983 10.298 1.00 23.42 H new ATOM 0 HD12 LEU A 113 9.018 -7.843 11.664 1.00 23.42 H new ATOM 0 HD13 LEU A 113 8.138 -9.384 11.793 1.00 23.42 H new ATOM 0 HD21 LEU A 113 6.982 -9.298 8.939 1.00 73.22 H new ATOM 0 HD22 LEU A 113 6.024 -9.712 10.380 1.00 73.22 H new ATOM 0 HD23 LEU A 113 5.499 -8.389 9.313 1.00 73.22 H new ATOM 1772 N ILE A 114 6.183 -4.963 9.573 1.00 72.11 N ATOM 1773 CA ILE A 114 5.522 -4.366 8.419 1.00 60.11 C ATOM 1774 C ILE A 114 5.903 -5.090 7.132 1.00 40.21 C ATOM 1775 O ILE A 114 6.989 -4.887 6.591 1.00 4.24 O ATOM 1776 CB ILE A 114 5.874 -2.873 8.279 1.00 70.34 C ATOM 1777 CG1 ILE A 114 5.571 -2.131 9.582 1.00 53.24 C ATOM 1778 CG2 ILE A 114 5.107 -2.255 7.119 1.00 11.04 C ATOM 1779 CD1 ILE A 114 4.099 -2.094 9.928 1.00 74.13 C ATOM 0 H ILE A 114 7.165 -5.197 9.423 1.00 72.11 H new ATOM 0 HA ILE A 114 4.449 -4.464 8.584 1.00 60.11 H new ATOM 0 HB ILE A 114 6.940 -2.783 8.072 1.00 70.34 H new ATOM 0 HG12 ILE A 114 6.116 -2.608 10.397 1.00 53.24 H new ATOM 0 HG13 ILE A 114 5.943 -1.110 9.504 1.00 53.24 H new ATOM 0 HG21 ILE A 114 5.366 -1.200 7.033 1.00 11.04 H new ATOM 0 HG22 ILE A 114 5.369 -2.770 6.195 1.00 11.04 H new ATOM 0 HG23 ILE A 114 4.036 -2.352 7.298 1.00 11.04 H new ATOM 0 HD11 ILE A 114 3.959 -1.552 10.863 1.00 74.13 H new ATOM 0 HD12 ILE A 114 3.551 -1.591 9.132 1.00 74.13 H new ATOM 0 HD13 ILE A 114 3.726 -3.112 10.039 1.00 74.13 H new ATOM 1791 N GLY A 115 4.999 -5.935 6.645 1.00 44.14 N ATOM 1792 CA GLY A 115 5.258 -6.675 5.423 1.00 4.15 C ATOM 1793 C GLY A 115 5.774 -5.789 4.307 1.00 40.11 C ATOM 1794 O GLY A 115 5.622 -4.568 4.352 1.00 4.13 O ATOM 0 H GLY A 115 4.093 -6.120 7.074 1.00 44.14 H new ATOM 0 HA2 GLY A 115 5.986 -7.461 5.625 1.00 4.15 H new ATOM 0 HA3 GLY A 115 4.341 -7.166 5.098 1.00 4.15 H new ATOM 1798 N LYS A 116 6.387 -6.404 3.301 1.00 2.31 N ATOM 1799 CA LYS A 116 6.928 -5.664 2.167 1.00 10.21 C ATOM 1800 C LYS A 116 5.863 -4.766 1.545 1.00 30.23 C ATOM 1801 O LYS A 116 6.169 -3.693 1.025 1.00 13.02 O ATOM 1802 CB LYS A 116 7.473 -6.631 1.114 1.00 62.11 C ATOM 1803 CG LYS A 116 6.390 -7.310 0.293 1.00 24.24 C ATOM 1804 CD LYS A 116 6.941 -8.493 -0.486 1.00 35.24 C ATOM 1805 CE LYS A 116 7.083 -8.169 -1.965 1.00 2.23 C ATOM 1806 NZ LYS A 116 5.763 -7.924 -2.609 1.00 0.33 N ATOM 0 H LYS A 116 6.522 -7.414 3.248 1.00 2.31 H new ATOM 0 HA LYS A 116 7.741 -5.036 2.530 1.00 10.21 H new ATOM 0 HB2 LYS A 116 8.138 -6.087 0.443 1.00 62.11 H new ATOM 0 HB3 LYS A 116 8.074 -7.394 1.610 1.00 62.11 H new ATOM 0 HG2 LYS A 116 5.590 -7.648 0.952 1.00 24.24 H new ATOM 0 HG3 LYS A 116 5.951 -6.591 -0.398 1.00 24.24 H new ATOM 0 HD2 LYS A 116 7.912 -8.777 -0.080 1.00 35.24 H new ATOM 0 HD3 LYS A 116 6.280 -9.351 -0.362 1.00 35.24 H new ATOM 0 HE2 LYS A 116 7.714 -7.289 -2.085 1.00 2.23 H new ATOM 0 HE3 LYS A 116 7.586 -8.993 -2.471 1.00 2.23 H new ATOM 0 HZ1 LYS A 116 5.826 -8.141 -3.624 1.00 0.33 H new ATOM 0 HZ2 LYS A 116 5.044 -8.533 -2.169 1.00 0.33 H new ATOM 0 HZ3 LYS A 116 5.496 -6.927 -2.484 1.00 0.33 H new ATOM 1820 N ASP A 117 4.613 -5.211 1.604 1.00 72.51 N ATOM 1821 CA ASP A 117 3.502 -4.447 1.049 1.00 40.13 C ATOM 1822 C ASP A 117 3.375 -3.093 1.740 1.00 32.13 C ATOM 1823 O ASP A 117 2.770 -2.166 1.205 1.00 55.52 O ATOM 1824 CB ASP A 117 2.196 -5.230 1.189 1.00 54.13 C ATOM 1825 CG ASP A 117 1.707 -5.288 2.622 1.00 35.35 C ATOM 1826 OD1 ASP A 117 2.547 -5.460 3.530 1.00 23.40 O ATOM 1827 OD2 ASP A 117 0.483 -5.161 2.837 1.00 21.22 O ATOM 0 H ASP A 117 4.343 -6.097 2.031 1.00 72.51 H new ATOM 0 HA ASP A 117 3.703 -4.277 -0.009 1.00 40.13 H new ATOM 0 HB2 ASP A 117 1.430 -4.768 0.565 1.00 54.13 H new ATOM 0 HB3 ASP A 117 2.342 -6.244 0.817 1.00 54.13 H new ATOM 1832 N GLY A 118 3.949 -2.988 2.935 1.00 62.01 N ATOM 1833 CA GLY A 118 3.888 -1.745 3.681 1.00 54.32 C ATOM 1834 C GLY A 118 2.844 -1.779 4.779 1.00 12.25 C ATOM 1835 O GLY A 118 2.616 -0.778 5.460 1.00 72.33 O ATOM 0 H GLY A 118 4.455 -3.742 3.400 1.00 62.01 H new ATOM 0 HA2 GLY A 118 4.865 -1.539 4.119 1.00 54.32 H new ATOM 0 HA3 GLY A 118 3.666 -0.925 2.998 1.00 54.32 H new ATOM 1839 N ASP A 119 2.207 -2.932 4.953 1.00 41.24 N ATOM 1840 CA ASP A 119 1.181 -3.092 5.976 1.00 32.32 C ATOM 1841 C ASP A 119 1.727 -3.858 7.178 1.00 53.44 C ATOM 1842 O ASP A 119 2.723 -4.573 7.071 1.00 73.22 O ATOM 1843 CB ASP A 119 -0.034 -3.821 5.401 1.00 73.34 C ATOM 1844 CG ASP A 119 -1.283 -3.612 6.234 1.00 54.22 C ATOM 1845 OD1 ASP A 119 -1.704 -2.446 6.389 1.00 22.53 O ATOM 1846 OD2 ASP A 119 -1.840 -4.613 6.731 1.00 31.32 O ATOM 0 H ASP A 119 2.384 -3.770 4.398 1.00 41.24 H new ATOM 0 HA ASP A 119 0.876 -2.099 6.308 1.00 32.32 H new ATOM 0 HB2 ASP A 119 -0.216 -3.472 4.385 1.00 73.34 H new ATOM 0 HB3 ASP A 119 0.182 -4.887 5.337 1.00 73.34 H new ATOM 1851 N VAL A 120 1.068 -3.701 8.322 1.00 42.03 N ATOM 1852 CA VAL A 120 1.487 -4.377 9.544 1.00 61.03 C ATOM 1853 C VAL A 120 1.232 -5.878 9.457 1.00 41.44 C ATOM 1854 O VAL A 120 0.236 -6.315 8.882 1.00 53.22 O ATOM 1855 CB VAL A 120 0.755 -3.814 10.776 1.00 12.41 C ATOM 1856 CG1 VAL A 120 1.092 -2.343 10.972 1.00 60.42 C ATOM 1857 CG2 VAL A 120 -0.747 -4.011 10.639 1.00 13.01 C ATOM 0 H VAL A 120 0.242 -3.112 8.428 1.00 42.03 H new ATOM 0 HA VAL A 120 2.557 -4.199 9.653 1.00 61.03 H new ATOM 0 HB VAL A 120 1.091 -4.360 11.657 1.00 12.41 H new ATOM 0 HG11 VAL A 120 0.565 -1.963 11.847 1.00 60.42 H new ATOM 0 HG12 VAL A 120 2.166 -2.232 11.118 1.00 60.42 H new ATOM 0 HG13 VAL A 120 0.786 -1.779 10.091 1.00 60.42 H new ATOM 0 HG21 VAL A 120 -1.249 -3.607 11.519 1.00 13.01 H new ATOM 0 HG22 VAL A 120 -1.102 -3.492 9.749 1.00 13.01 H new ATOM 0 HG23 VAL A 120 -0.968 -5.075 10.552 1.00 13.01 H new ATOM 1867 N GLN A 121 2.139 -6.661 10.032 1.00 41.35 N ATOM 1868 CA GLN A 121 2.012 -8.113 10.018 1.00 30.24 C ATOM 1869 C GLN A 121 1.871 -8.660 11.435 1.00 30.11 C ATOM 1870 O GLN A 121 1.465 -9.806 11.631 1.00 5.11 O ATOM 1871 CB GLN A 121 3.224 -8.746 9.333 1.00 61.21 C ATOM 1872 CG GLN A 121 2.903 -9.373 7.986 1.00 34.51 C ATOM 1873 CD GLN A 121 4.079 -10.127 7.397 1.00 2.33 C ATOM 1874 OE1 GLN A 121 4.925 -9.546 6.717 1.00 42.12 O ATOM 1875 NE2 GLN A 121 4.139 -11.428 7.657 1.00 42.43 N ATOM 0 H GLN A 121 2.969 -6.314 10.513 1.00 41.35 H new ATOM 0 HA GLN A 121 1.113 -8.369 9.458 1.00 30.24 H new ATOM 0 HB2 GLN A 121 3.992 -7.985 9.196 1.00 61.21 H new ATOM 0 HB3 GLN A 121 3.644 -9.509 9.989 1.00 61.21 H new ATOM 0 HG2 GLN A 121 2.059 -10.054 8.099 1.00 34.51 H new ATOM 0 HG3 GLN A 121 2.592 -8.593 7.291 1.00 34.51 H new ATOM 0 HE21 GLN A 121 3.416 -11.868 8.226 1.00 42.43 H new ATOM 0 HE22 GLN A 121 4.908 -11.987 7.288 1.00 42.43 H new ATOM 1884 N ARG A 122 2.209 -7.834 12.420 1.00 54.55 N ATOM 1885 CA ARG A 122 2.121 -8.235 13.818 1.00 22.23 C ATOM 1886 C ARG A 122 2.611 -7.119 14.736 1.00 12.11 C ATOM 1887 O ARG A 122 3.446 -6.302 14.346 1.00 72.53 O ATOM 1888 CB ARG A 122 2.941 -9.504 14.059 1.00 60.22 C ATOM 1889 CG ARG A 122 2.121 -10.666 14.596 1.00 64.25 C ATOM 1890 CD ARG A 122 1.845 -10.513 16.083 1.00 2.11 C ATOM 1891 NE ARG A 122 0.420 -10.357 16.362 1.00 42.30 N ATOM 1892 CZ ARG A 122 -0.079 -10.230 17.586 1.00 14.22 C ATOM 1893 NH1 ARG A 122 0.726 -10.240 18.639 1.00 24.30 N ATOM 1894 NH2 ARG A 122 -1.388 -10.092 17.759 1.00 2.41 N ATOM 0 H ARG A 122 2.546 -6.882 12.275 1.00 54.55 H new ATOM 0 HA ARG A 122 1.075 -8.437 14.047 1.00 22.23 H new ATOM 0 HB2 ARG A 122 3.413 -9.805 13.124 1.00 60.22 H new ATOM 0 HB3 ARG A 122 3.743 -9.280 14.763 1.00 60.22 H new ATOM 0 HG2 ARG A 122 1.177 -10.728 14.054 1.00 64.25 H new ATOM 0 HG3 ARG A 122 2.653 -11.601 14.418 1.00 64.25 H new ATOM 0 HD2 ARG A 122 2.225 -11.386 16.614 1.00 2.11 H new ATOM 0 HD3 ARG A 122 2.386 -9.647 16.465 1.00 2.11 H new ATOM 0 HE ARG A 122 -0.227 -10.345 15.574 1.00 42.30 H new ATOM 0 HH11 ARG A 122 1.732 -10.345 18.511 1.00 24.30 H new ATOM 0 HH12 ARG A 122 0.339 -10.142 19.578 1.00 24.30 H new ATOM 0 HH21 ARG A 122 -2.011 -10.084 16.951 1.00 2.41 H new ATOM 0 HH22 ARG A 122 -1.771 -9.995 18.699 1.00 2.41 H new ATOM 1908 N ILE A 123 2.085 -7.090 15.956 1.00 2.11 N ATOM 1909 CA ILE A 123 2.469 -6.075 16.929 1.00 42.41 C ATOM 1910 C ILE A 123 2.577 -6.668 18.329 1.00 12.15 C ATOM 1911 O ILE A 123 1.582 -7.102 18.910 1.00 54.32 O ATOM 1912 CB ILE A 123 1.463 -4.909 16.953 1.00 32.12 C ATOM 1913 CG1 ILE A 123 1.495 -4.151 15.625 1.00 51.14 C ATOM 1914 CG2 ILE A 123 1.766 -3.971 18.112 1.00 65.20 C ATOM 1915 CD1 ILE A 123 0.265 -3.305 15.382 1.00 51.50 C ATOM 0 H ILE A 123 1.392 -7.758 16.294 1.00 2.11 H new ATOM 0 HA ILE A 123 3.444 -5.696 16.622 1.00 42.41 H new ATOM 0 HB ILE A 123 0.462 -5.316 17.093 1.00 32.12 H new ATOM 0 HG12 ILE A 123 2.377 -3.511 15.603 1.00 51.14 H new ATOM 0 HG13 ILE A 123 1.600 -4.867 14.810 1.00 51.14 H new ATOM 0 HG21 ILE A 123 1.046 -3.152 18.115 1.00 65.20 H new ATOM 0 HG22 ILE A 123 1.696 -4.519 19.052 1.00 65.20 H new ATOM 0 HG23 ILE A 123 2.773 -3.569 18.001 1.00 65.20 H new ATOM 0 HD11 ILE A 123 0.357 -2.797 14.422 1.00 51.50 H new ATOM 0 HD12 ILE A 123 -0.619 -3.943 15.372 1.00 51.50 H new ATOM 0 HD13 ILE A 123 0.169 -2.565 16.177 1.00 51.50 H new ATOM 1927 N VAL A 124 3.792 -6.682 18.868 1.00 31.25 N ATOM 1928 CA VAL A 124 4.030 -7.219 20.203 1.00 70.31 C ATOM 1929 C VAL A 124 4.190 -6.100 21.225 1.00 12.14 C ATOM 1930 O VAL A 124 4.749 -5.045 20.925 1.00 12.35 O ATOM 1931 CB VAL A 124 5.286 -8.111 20.233 1.00 12.42 C ATOM 1932 CG1 VAL A 124 5.614 -8.523 21.660 1.00 11.32 C ATOM 1933 CG2 VAL A 124 5.093 -9.332 19.348 1.00 70.43 C ATOM 0 H VAL A 124 4.627 -6.328 18.401 1.00 31.25 H new ATOM 0 HA VAL A 124 3.159 -7.821 20.462 1.00 70.31 H new ATOM 0 HB VAL A 124 6.127 -7.538 19.843 1.00 12.42 H new ATOM 0 HG11 VAL A 124 6.504 -9.153 21.662 1.00 11.32 H new ATOM 0 HG12 VAL A 124 5.798 -7.633 22.262 1.00 11.32 H new ATOM 0 HG13 VAL A 124 4.776 -9.079 22.080 1.00 11.32 H new ATOM 0 HG21 VAL A 124 5.990 -9.951 19.381 1.00 70.43 H new ATOM 0 HG22 VAL A 124 4.240 -9.909 19.705 1.00 70.43 H new ATOM 0 HG23 VAL A 124 4.910 -9.013 18.322 1.00 70.43 H new ATOM 1943 N LYS A 125 3.696 -6.337 22.436 1.00 55.22 N ATOM 1944 CA LYS A 125 3.784 -5.350 23.506 1.00 62.04 C ATOM 1945 C LYS A 125 4.865 -5.733 24.511 1.00 23.30 C ATOM 1946 O LYS A 125 4.575 -6.009 25.674 1.00 21.23 O ATOM 1947 CB LYS A 125 2.436 -5.216 24.217 1.00 72.02 C ATOM 1948 CG LYS A 125 1.494 -4.226 23.554 1.00 41.14 C ATOM 1949 CD LYS A 125 0.726 -4.867 22.410 1.00 44.24 C ATOM 1950 CE LYS A 125 -0.362 -3.944 21.883 1.00 60.13 C ATOM 1951 NZ LYS A 125 -1.724 -4.486 22.145 1.00 21.24 N ATOM 0 H LYS A 125 3.230 -7.205 22.701 1.00 55.22 H new ATOM 0 HA LYS A 125 4.049 -4.391 23.061 1.00 62.04 H new ATOM 0 HB2 LYS A 125 1.955 -6.194 24.253 1.00 72.02 H new ATOM 0 HB3 LYS A 125 2.608 -4.907 25.248 1.00 72.02 H new ATOM 0 HG2 LYS A 125 0.792 -3.839 24.293 1.00 41.14 H new ATOM 0 HG3 LYS A 125 2.063 -3.375 23.180 1.00 41.14 H new ATOM 0 HD2 LYS A 125 1.415 -5.117 21.603 1.00 44.24 H new ATOM 0 HD3 LYS A 125 0.279 -5.802 22.749 1.00 44.24 H new ATOM 0 HE2 LYS A 125 -0.265 -2.964 22.351 1.00 60.13 H new ATOM 0 HE3 LYS A 125 -0.228 -3.800 20.811 1.00 60.13 H new ATOM 0 HZ1 LYS A 125 -2.437 -3.828 21.771 1.00 21.24 H new ATOM 0 HZ2 LYS A 125 -1.826 -5.410 21.678 1.00 21.24 H new ATOM 0 HZ3 LYS A 125 -1.861 -4.599 23.170 1.00 21.24 H new ATOM 1965 N GLY A 126 6.114 -5.747 24.054 1.00 1.25 N ATOM 1966 CA GLY A 126 7.219 -6.096 24.928 1.00 64.14 C ATOM 1967 C GLY A 126 8.561 -6.012 24.227 1.00 52.22 C ATOM 1968 O GLY A 126 8.761 -5.167 23.354 1.00 10.23 O ATOM 0 H GLY A 126 6.380 -5.523 23.095 1.00 1.25 H new ATOM 0 HA2 GLY A 126 7.221 -5.430 25.791 1.00 64.14 H new ATOM 0 HA3 GLY A 126 7.073 -7.108 25.307 1.00 64.14 H new ATOM 1972 N SER A 127 9.483 -6.889 24.610 1.00 2.20 N ATOM 1973 CA SER A 127 10.815 -6.906 24.016 1.00 32.41 C ATOM 1974 C SER A 127 11.228 -8.329 23.650 1.00 13.21 C ATOM 1975 O SER A 127 11.784 -9.056 24.473 1.00 33.54 O ATOM 1976 CB SER A 127 11.835 -6.300 24.981 1.00 11.54 C ATOM 1977 OG SER A 127 12.441 -5.146 24.424 1.00 30.21 O ATOM 0 H SER A 127 9.333 -7.597 25.329 1.00 2.20 H new ATOM 0 HA SER A 127 10.787 -6.308 23.105 1.00 32.41 H new ATOM 0 HB2 SER A 127 11.344 -6.040 25.918 1.00 11.54 H new ATOM 0 HB3 SER A 127 12.601 -7.039 25.217 1.00 11.54 H new ATOM 0 HG SER A 127 13.088 -4.776 25.061 1.00 30.21 H new ATOM 1983 N ILE A 128 10.951 -8.718 22.410 1.00 5.30 N ATOM 1984 CA ILE A 128 11.295 -10.052 21.934 1.00 13.10 C ATOM 1985 C ILE A 128 12.797 -10.299 22.025 1.00 53.51 C ATOM 1986 O ILE A 128 13.593 -9.361 21.993 1.00 32.22 O ATOM 1987 CB ILE A 128 10.838 -10.265 20.479 1.00 71.33 C ATOM 1988 CG1 ILE A 128 11.305 -9.104 19.599 1.00 3.11 C ATOM 1989 CG2 ILE A 128 9.325 -10.410 20.414 1.00 32.04 C ATOM 1990 CD1 ILE A 128 11.838 -9.542 18.253 1.00 53.03 C ATOM 0 H ILE A 128 10.490 -8.129 21.717 1.00 5.30 H new ATOM 0 HA ILE A 128 10.774 -10.761 22.578 1.00 13.10 H new ATOM 0 HB ILE A 128 11.288 -11.184 20.104 1.00 71.33 H new ATOM 0 HG12 ILE A 128 10.472 -8.418 19.445 1.00 3.11 H new ATOM 0 HG13 ILE A 128 12.082 -8.550 20.125 1.00 3.11 H new ATOM 0 HG21 ILE A 128 9.018 -10.560 19.379 1.00 32.04 H new ATOM 0 HG22 ILE A 128 9.016 -11.267 21.012 1.00 32.04 H new ATOM 0 HG23 ILE A 128 8.856 -9.507 20.804 1.00 32.04 H new ATOM 0 HD11 ILE A 128 12.150 -8.667 17.683 1.00 53.03 H new ATOM 0 HD12 ILE A 128 12.691 -10.205 18.398 1.00 53.03 H new ATOM 0 HD13 ILE A 128 11.057 -10.071 17.707 1.00 53.03 H new ATOM 2002 N ASN A 129 13.177 -11.567 22.136 1.00 31.22 N ATOM 2003 CA ASN A 129 14.584 -11.938 22.230 1.00 3.13 C ATOM 2004 C ASN A 129 15.136 -12.329 20.863 1.00 44.12 C ATOM 2005 O ASN A 129 14.413 -12.327 19.867 1.00 1.23 O ATOM 2006 CB ASN A 129 14.764 -13.095 23.215 1.00 74.10 C ATOM 2007 CG ASN A 129 14.817 -12.625 24.656 1.00 64.22 C ATOM 2008 OD1 ASN A 129 13.895 -11.970 25.141 1.00 3.15 O ATOM 2009 ND2 ASN A 129 15.901 -12.959 25.347 1.00 44.34 N ATOM 0 H ASN A 129 12.530 -12.355 22.163 1.00 31.22 H new ATOM 0 HA ASN A 129 15.138 -11.072 22.592 1.00 3.13 H new ATOM 0 HB2 ASN A 129 13.942 -13.801 23.096 1.00 74.10 H new ATOM 0 HB3 ASN A 129 15.682 -13.632 22.977 1.00 74.10 H new ATOM 0 HD21 ASN A 129 15.994 -12.671 26.321 1.00 44.34 H new ATOM 0 HD22 ASN A 129 16.641 -13.503 24.904 1.00 44.34 H new ATOM 2016 N GLU A 130 16.422 -12.664 20.824 1.00 62.34 N ATOM 2017 CA GLU A 130 17.071 -13.057 19.578 1.00 33.51 C ATOM 2018 C GLU A 130 16.295 -14.178 18.891 1.00 4.11 C ATOM 2019 O GLU A 130 15.635 -13.958 17.876 1.00 32.23 O ATOM 2020 CB GLU A 130 18.509 -13.507 19.846 1.00 74.12 C ATOM 2021 CG GLU A 130 19.557 -12.570 19.270 1.00 14.42 C ATOM 2022 CD GLU A 130 20.591 -12.151 20.297 1.00 42.44 C ATOM 2023 OE1 GLU A 130 20.199 -11.827 21.437 1.00 22.01 O ATOM 2024 OE2 GLU A 130 21.794 -12.147 19.959 1.00 54.35 O ATOM 0 H GLU A 130 17.034 -12.671 21.640 1.00 62.34 H new ATOM 0 HA GLU A 130 17.086 -12.191 18.917 1.00 33.51 H new ATOM 0 HB2 GLU A 130 18.660 -13.590 20.922 1.00 74.12 H new ATOM 0 HB3 GLU A 130 18.654 -14.502 19.426 1.00 74.12 H new ATOM 0 HG2 GLU A 130 20.057 -13.060 18.435 1.00 14.42 H new ATOM 0 HG3 GLU A 130 19.066 -11.682 18.871 1.00 14.42 H new ATOM 2031 N ALA A 131 16.382 -15.380 19.452 1.00 10.40 N ATOM 2032 CA ALA A 131 15.688 -16.534 18.895 1.00 21.33 C ATOM 2033 C ALA A 131 14.216 -16.223 18.647 1.00 20.23 C ATOM 2034 O ALA A 131 13.605 -16.764 17.726 1.00 22.52 O ATOM 2035 CB ALA A 131 15.827 -17.732 19.824 1.00 44.24 C ATOM 0 H ALA A 131 16.926 -15.579 20.291 1.00 10.40 H new ATOM 0 HA ALA A 131 16.148 -16.775 17.937 1.00 21.33 H new ATOM 0 HB1 ALA A 131 15.304 -18.587 19.396 1.00 44.24 H new ATOM 0 HB2 ALA A 131 16.882 -17.976 19.947 1.00 44.24 H new ATOM 0 HB3 ALA A 131 15.395 -17.491 20.795 1.00 44.24 H new ATOM 2041 N GLN A 132 13.653 -15.349 19.475 1.00 21.02 N ATOM 2042 CA GLN A 132 12.252 -14.968 19.345 1.00 13.14 C ATOM 2043 C GLN A 132 12.014 -14.203 18.048 1.00 53.52 C ATOM 2044 O GLN A 132 11.093 -14.513 17.293 1.00 53.21 O ATOM 2045 CB GLN A 132 11.820 -14.116 20.540 1.00 2.03 C ATOM 2046 CG GLN A 132 10.735 -14.761 21.387 1.00 31.01 C ATOM 2047 CD GLN A 132 10.875 -14.437 22.861 1.00 12.43 C ATOM 2048 OE1 GLN A 132 11.021 -13.275 23.242 1.00 43.31 O ATOM 2049 NE2 GLN A 132 10.830 -15.464 23.701 1.00 63.52 N ATOM 0 H GLN A 132 14.145 -14.892 20.242 1.00 21.02 H new ATOM 0 HA GLN A 132 11.655 -15.879 19.323 1.00 13.14 H new ATOM 0 HB2 GLN A 132 12.689 -13.918 21.167 1.00 2.03 H new ATOM 0 HB3 GLN A 132 11.462 -13.152 20.178 1.00 2.03 H new ATOM 0 HG2 GLN A 132 9.759 -14.426 21.037 1.00 31.01 H new ATOM 0 HG3 GLN A 132 10.769 -15.842 21.252 1.00 31.01 H new ATOM 0 HE21 GLN A 132 10.708 -16.411 23.343 1.00 63.52 H new ATOM 0 HE22 GLN A 132 10.918 -15.306 24.705 1.00 63.52 H new ATOM 2058 N ALA A 133 12.850 -13.201 17.796 1.00 51.15 N ATOM 2059 CA ALA A 133 12.731 -12.392 16.589 1.00 62.35 C ATOM 2060 C ALA A 133 12.779 -13.263 15.338 1.00 62.04 C ATOM 2061 O ALA A 133 11.996 -13.073 14.406 1.00 42.21 O ATOM 2062 CB ALA A 133 13.832 -11.343 16.546 1.00 1.10 C ATOM 0 H ALA A 133 13.617 -12.930 18.412 1.00 51.15 H new ATOM 0 HA ALA A 133 11.765 -11.888 16.613 1.00 62.35 H new ATOM 0 HB1 ALA A 133 13.731 -10.746 15.639 1.00 1.10 H new ATOM 0 HB2 ALA A 133 13.751 -10.694 17.418 1.00 1.10 H new ATOM 0 HB3 ALA A 133 14.804 -11.836 16.549 1.00 1.10 H new ATOM 2068 N LEU A 134 13.703 -14.218 15.322 1.00 14.12 N ATOM 2069 CA LEU A 134 13.853 -15.118 14.184 1.00 22.34 C ATOM 2070 C LEU A 134 12.539 -15.827 13.873 1.00 53.32 C ATOM 2071 O LEU A 134 12.084 -15.838 12.729 1.00 24.42 O ATOM 2072 CB LEU A 134 14.947 -16.150 14.466 1.00 1.33 C ATOM 2073 CG LEU A 134 16.326 -15.588 14.812 1.00 4.43 C ATOM 2074 CD1 LEU A 134 17.156 -16.626 15.552 1.00 52.12 C ATOM 2075 CD2 LEU A 134 17.045 -15.126 13.553 1.00 25.20 C ATOM 0 H LEU A 134 14.359 -14.389 16.084 1.00 14.12 H new ATOM 0 HA LEU A 134 14.137 -14.522 13.317 1.00 22.34 H new ATOM 0 HB2 LEU A 134 14.618 -16.783 15.290 1.00 1.33 H new ATOM 0 HB3 LEU A 134 15.047 -16.792 13.591 1.00 1.33 H new ATOM 0 HG LEU A 134 16.192 -14.727 15.467 1.00 4.43 H new ATOM 0 HD11 LEU A 134 18.134 -16.208 15.790 1.00 52.12 H new ATOM 0 HD12 LEU A 134 16.648 -16.908 16.474 1.00 52.12 H new ATOM 0 HD13 LEU A 134 17.282 -17.507 14.923 1.00 52.12 H new ATOM 0 HD21 LEU A 134 18.025 -14.729 13.818 1.00 25.20 H new ATOM 0 HD22 LEU A 134 17.167 -15.969 12.874 1.00 25.20 H new ATOM 0 HD23 LEU A 134 16.459 -14.348 13.064 1.00 25.20 H new ATOM 2087 N ALA A 135 11.932 -16.414 14.899 1.00 74.44 N ATOM 2088 CA ALA A 135 10.667 -17.121 14.735 1.00 23.02 C ATOM 2089 C ALA A 135 9.529 -16.149 14.441 1.00 23.45 C ATOM 2090 O ALA A 135 8.520 -16.522 13.842 1.00 33.43 O ATOM 2091 CB ALA A 135 10.356 -17.941 15.979 1.00 42.23 C ATOM 0 H ALA A 135 12.295 -16.414 15.852 1.00 74.44 H new ATOM 0 HA ALA A 135 10.763 -17.795 13.884 1.00 23.02 H new ATOM 0 HB1 ALA A 135 9.409 -18.464 15.843 1.00 42.23 H new ATOM 0 HB2 ALA A 135 11.151 -18.668 16.144 1.00 42.23 H new ATOM 0 HB3 ALA A 135 10.285 -17.279 16.842 1.00 42.23 H new ATOM 2097 N LEU A 136 9.698 -14.902 14.867 1.00 31.31 N ATOM 2098 CA LEU A 136 8.684 -13.876 14.650 1.00 31.21 C ATOM 2099 C LEU A 136 8.587 -13.510 13.172 1.00 33.55 C ATOM 2100 O LEU A 136 7.512 -13.170 12.677 1.00 62.23 O ATOM 2101 CB LEU A 136 9.007 -12.630 15.476 1.00 51.44 C ATOM 2102 CG LEU A 136 7.966 -11.510 15.436 1.00 31.22 C ATOM 2103 CD1 LEU A 136 8.037 -10.670 16.702 1.00 44.13 C ATOM 2104 CD2 LEU A 136 8.165 -10.640 14.204 1.00 43.21 C ATOM 0 H LEU A 136 10.527 -14.577 15.364 1.00 31.31 H new ATOM 0 HA LEU A 136 7.722 -14.277 14.969 1.00 31.21 H new ATOM 0 HB2 LEU A 136 9.146 -12.933 16.514 1.00 51.44 H new ATOM 0 HB3 LEU A 136 9.959 -12.227 15.131 1.00 51.44 H new ATOM 0 HG LEU A 136 6.976 -11.962 15.380 1.00 31.22 H new ATOM 0 HD11 LEU A 136 7.289 -9.878 16.656 1.00 44.13 H new ATOM 0 HD12 LEU A 136 7.844 -11.302 17.569 1.00 44.13 H new ATOM 0 HD13 LEU A 136 9.029 -10.227 16.790 1.00 44.13 H new ATOM 0 HD21 LEU A 136 7.415 -9.849 14.192 1.00 43.21 H new ATOM 0 HD22 LEU A 136 9.160 -10.197 14.229 1.00 43.21 H new ATOM 0 HD23 LEU A 136 8.062 -11.251 13.307 1.00 43.21 H new ATOM 2116 N ILE A 137 9.715 -13.585 12.474 1.00 31.15 N ATOM 2117 CA ILE A 137 9.756 -13.265 11.053 1.00 13.01 C ATOM 2118 C ILE A 137 9.505 -14.506 10.203 1.00 51.33 C ATOM 2119 O ILE A 137 8.708 -14.477 9.265 1.00 34.31 O ATOM 2120 CB ILE A 137 11.109 -12.648 10.654 1.00 51.43 C ATOM 2121 CG1 ILE A 137 11.365 -11.367 11.451 1.00 24.33 C ATOM 2122 CG2 ILE A 137 11.141 -12.363 9.160 1.00 53.44 C ATOM 2123 CD1 ILE A 137 12.741 -11.311 12.078 1.00 61.13 C ATOM 0 H ILE A 137 10.613 -13.865 12.870 1.00 31.15 H new ATOM 0 HA ILE A 137 8.966 -12.537 10.870 1.00 13.01 H new ATOM 0 HB ILE A 137 11.899 -13.362 10.885 1.00 51.43 H new ATOM 0 HG12 ILE A 137 11.239 -10.508 10.792 1.00 24.33 H new ATOM 0 HG13 ILE A 137 10.613 -11.280 12.235 1.00 24.33 H new ATOM 0 HG21 ILE A 137 12.104 -11.927 8.893 1.00 53.44 H new ATOM 0 HG22 ILE A 137 10.999 -13.293 8.609 1.00 53.44 H new ATOM 0 HG23 ILE A 137 10.344 -11.665 8.906 1.00 53.44 H new ATOM 0 HD11 ILE A 137 12.853 -10.376 12.627 1.00 61.13 H new ATOM 0 HD12 ILE A 137 12.864 -12.151 12.762 1.00 61.13 H new ATOM 0 HD13 ILE A 137 13.499 -11.366 11.297 1.00 61.13 H new ATOM 2135 N ARG A 138 10.190 -15.594 10.538 1.00 73.31 N ATOM 2136 CA ARG A 138 10.041 -16.846 9.805 1.00 31.14 C ATOM 2137 C ARG A 138 8.600 -17.345 9.868 1.00 2.15 C ATOM 2138 O ARG A 138 8.145 -18.070 8.984 1.00 32.42 O ATOM 2139 CB ARG A 138 10.985 -17.908 10.372 1.00 71.32 C ATOM 2140 CG ARG A 138 10.959 -19.219 9.602 1.00 12.23 C ATOM 2141 CD ARG A 138 12.230 -20.023 9.828 1.00 51.43 C ATOM 2142 NE ARG A 138 11.981 -21.233 10.606 1.00 3.13 N ATOM 2143 CZ ARG A 138 12.947 -22.000 11.101 1.00 14.53 C ATOM 2144 NH1 ARG A 138 14.218 -21.683 10.900 1.00 2.31 N ATOM 2145 NH2 ARG A 138 12.641 -23.085 11.800 1.00 73.42 N ATOM 0 H ARG A 138 10.853 -15.634 11.312 1.00 73.31 H new ATOM 0 HA ARG A 138 10.298 -16.660 8.762 1.00 31.14 H new ATOM 0 HB2 ARG A 138 12.002 -17.516 10.371 1.00 71.32 H new ATOM 0 HB3 ARG A 138 10.719 -18.101 11.411 1.00 71.32 H new ATOM 0 HG2 ARG A 138 10.095 -19.807 9.912 1.00 12.23 H new ATOM 0 HG3 ARG A 138 10.841 -19.015 8.538 1.00 12.23 H new ATOM 0 HD2 ARG A 138 12.664 -20.294 8.865 1.00 51.43 H new ATOM 0 HD3 ARG A 138 12.963 -19.404 10.345 1.00 51.43 H new ATOM 0 HE ARG A 138 11.013 -21.504 10.779 1.00 3.13 H new ATOM 0 HH11 ARG A 138 14.457 -20.849 10.364 1.00 2.31 H new ATOM 0 HH12 ARG A 138 14.957 -22.273 11.281 1.00 2.31 H new ATOM 0 HH21 ARG A 138 11.664 -23.331 11.958 1.00 73.42 H new ATOM 0 HH22 ARG A 138 13.383 -23.673 12.180 1.00 73.42 H new ATOM 2159 N ASP A 139 7.889 -16.952 10.919 1.00 0.42 N ATOM 2160 CA ASP A 139 6.500 -17.358 11.098 1.00 71.12 C ATOM 2161 C ASP A 139 5.551 -16.207 10.777 1.00 64.33 C ATOM 2162 O ASP A 139 5.579 -15.152 11.411 1.00 70.32 O ATOM 2163 CB ASP A 139 6.268 -17.842 12.530 1.00 71.10 C ATOM 2164 CG ASP A 139 4.987 -18.640 12.671 1.00 72.41 C ATOM 2165 OD1 ASP A 139 4.004 -18.314 11.973 1.00 51.31 O ATOM 2166 OD2 ASP A 139 4.967 -19.592 13.479 1.00 63.34 O ATOM 0 H ASP A 139 8.252 -16.352 11.660 1.00 0.42 H new ATOM 0 HA ASP A 139 6.295 -18.177 10.408 1.00 71.12 H new ATOM 0 HB2 ASP A 139 7.112 -18.456 12.844 1.00 71.10 H new ATOM 0 HB3 ASP A 139 6.233 -16.983 13.200 1.00 71.10 H new ATOM 2171 N PRO A 140 4.692 -16.412 9.768 1.00 71.44 N ATOM 2172 CA PRO A 140 3.719 -15.403 9.339 1.00 61.12 C ATOM 2173 C PRO A 140 2.613 -15.190 10.367 1.00 23.21 C ATOM 2174 O PRO A 140 2.032 -14.110 10.452 1.00 55.43 O ATOM 2175 CB PRO A 140 3.143 -15.991 8.048 1.00 22.33 C ATOM 2176 CG PRO A 140 3.332 -17.463 8.185 1.00 5.41 C ATOM 2177 CD PRO A 140 4.603 -17.646 8.968 1.00 43.42 C ATOM 0 HA PRO A 140 4.179 -14.423 9.209 1.00 61.12 H new ATOM 0 HB2 PRO A 140 2.090 -15.736 7.932 1.00 22.33 H new ATOM 0 HB3 PRO A 140 3.662 -15.605 7.171 1.00 22.33 H new ATOM 0 HG2 PRO A 140 2.487 -17.919 8.701 1.00 5.41 H new ATOM 0 HG3 PRO A 140 3.404 -17.940 7.208 1.00 5.41 H new ATOM 0 HD2 PRO A 140 4.561 -18.533 9.600 1.00 43.42 H new ATOM 0 HD3 PRO A 140 5.466 -17.763 8.312 1.00 43.42 H new ATOM 2185 N ASN A 141 2.329 -16.228 11.147 1.00 70.20 N ATOM 2186 CA ASN A 141 1.292 -16.154 12.170 1.00 23.11 C ATOM 2187 C ASN A 141 1.908 -16.052 13.562 1.00 2.12 C ATOM 2188 O ASN A 141 1.270 -16.384 14.560 1.00 33.04 O ATOM 2189 CB ASN A 141 0.381 -17.381 12.092 1.00 0.41 C ATOM 2190 CG ASN A 141 -0.702 -17.230 11.042 1.00 73.14 C ATOM 2191 OD1 ASN A 141 -1.502 -16.295 11.088 1.00 62.01 O ATOM 2192 ND2 ASN A 141 -0.733 -18.153 10.087 1.00 33.25 N ATOM 0 H ASN A 141 2.802 -17.130 11.090 1.00 70.20 H new ATOM 0 HA ASN A 141 0.699 -15.258 11.987 1.00 23.11 H new ATOM 0 HB2 ASN A 141 0.981 -18.262 11.867 1.00 0.41 H new ATOM 0 HB3 ASN A 141 -0.081 -17.550 13.065 1.00 0.41 H new ATOM 0 HD21 ASN A 141 -1.440 -18.104 9.353 1.00 33.25 H new ATOM 0 HD22 ASN A 141 -0.050 -18.911 10.088 1.00 33.25 H new ATOM 2199 N ALA A 142 3.153 -15.590 13.620 1.00 12.41 N ATOM 2200 CA ALA A 142 3.854 -15.441 14.889 1.00 2.12 C ATOM 2201 C ALA A 142 3.020 -14.646 15.888 1.00 74.40 C ATOM 2202 O ALA A 142 2.913 -13.424 15.789 1.00 42.12 O ATOM 2203 CB ALA A 142 5.202 -14.769 14.672 1.00 52.21 C ATOM 0 H ALA A 142 3.697 -15.313 12.803 1.00 12.41 H new ATOM 0 HA ALA A 142 4.018 -16.436 15.303 1.00 2.12 H new ATOM 0 HB1 ALA A 142 5.714 -14.664 15.628 1.00 52.21 H new ATOM 0 HB2 ALA A 142 5.808 -15.377 14.000 1.00 52.21 H new ATOM 0 HB3 ALA A 142 5.051 -13.783 14.232 1.00 52.21 H new ATOM 2209 N ASP A 143 2.429 -15.348 16.849 1.00 70.32 N ATOM 2210 CA ASP A 143 1.603 -14.708 17.866 1.00 25.02 C ATOM 2211 C ASP A 143 1.955 -15.227 19.257 1.00 70.21 C ATOM 2212 O ASP A 143 1.985 -16.436 19.491 1.00 63.23 O ATOM 2213 CB ASP A 143 0.121 -14.950 17.577 1.00 21.34 C ATOM 2214 CG ASP A 143 -0.281 -16.397 17.787 1.00 3.13 C ATOM 2215 OD1 ASP A 143 0.323 -17.279 17.143 1.00 64.50 O ATOM 2216 OD2 ASP A 143 -1.200 -16.647 18.595 1.00 0.43 O ATOM 0 H ASP A 143 2.507 -16.361 16.945 1.00 70.32 H new ATOM 0 HA ASP A 143 1.800 -13.636 17.837 1.00 25.02 H new ATOM 0 HB2 ASP A 143 -0.481 -14.311 18.223 1.00 21.34 H new ATOM 0 HB3 ASP A 143 -0.098 -14.661 16.549 1.00 21.34 H new ATOM 2221 N LEU A 144 2.221 -14.306 20.177 1.00 71.33 N ATOM 2222 CA LEU A 144 2.572 -14.671 21.545 1.00 14.51 C ATOM 2223 C LEU A 144 1.341 -15.137 22.317 1.00 43.22 C ATOM 2224 O LEU A 144 1.455 -15.850 23.314 1.00 53.23 O ATOM 2225 CB LEU A 144 3.217 -13.482 22.261 1.00 74.43 C ATOM 2226 CG LEU A 144 4.586 -13.740 22.889 1.00 24.54 C ATOM 2227 CD1 LEU A 144 5.662 -13.806 21.817 1.00 43.13 C ATOM 2228 CD2 LEU A 144 4.915 -12.663 23.912 1.00 3.13 C ATOM 0 H LEU A 144 2.200 -13.302 20.001 1.00 71.33 H new ATOM 0 HA LEU A 144 3.286 -15.494 21.504 1.00 14.51 H new ATOM 0 HB2 LEU A 144 3.315 -12.664 21.548 1.00 74.43 H new ATOM 0 HB3 LEU A 144 2.538 -13.143 23.044 1.00 74.43 H new ATOM 0 HG LEU A 144 4.554 -14.702 23.401 1.00 24.54 H new ATOM 0 HD11 LEU A 144 6.630 -13.990 22.284 1.00 43.13 H new ATOM 0 HD12 LEU A 144 5.434 -14.614 21.122 1.00 43.13 H new ATOM 0 HD13 LEU A 144 5.695 -12.861 21.275 1.00 43.13 H new ATOM 0 HD21 LEU A 144 5.893 -12.863 24.349 1.00 3.13 H new ATOM 0 HD22 LEU A 144 4.928 -11.689 23.423 1.00 3.13 H new ATOM 0 HD23 LEU A 144 4.160 -12.665 24.698 1.00 3.13 H new TER 2240 LEU A 144