USER MOD reduce.3.24.130724 H: found=0, std=0, add=1027, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1027 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 119 SER OG : rot 95:sc= 0.205 USER MOD Set 1.2: A 132 SER OG : rot 180:sc= 0.188 USER MOD Set 2.1: A 112 ASN : amide:sc= 0 X(o=0.27,f=0.34) USER MOD Set 2.2: A 116 TYR OH : rot -165:sc= 0.271 USER MOD Set 3.1: A 105 SER OG : rot 110:sc= 0.00306 USER MOD Set 3.2: A 108 HIS : no HD1:sc= 0 X(o=0.0031,f=-0.43) USER MOD Set 4.1: A 89 THR OG1 : rot -177:sc= -1.28 USER MOD Set 4.2: A 124 ASN : amide:sc= -0.304 K(o=-1.6,f=-3.5!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 153:sc= 1.14 (180deg=0.494) USER MOD Single : A 2 ASN : amide:sc= 0.289 K(o=0.29,f=-5.6!) USER MOD Single : A 6 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 7 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0561) USER MOD Single : A 9 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 ASN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 28 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 ASN : amide:sc= -0.0368 K(o=-0.037,f=-0.97) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 46 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl -156:sc= -0.261 (180deg=-0.895) USER MOD Single : A 52 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 HIS : no HD1:sc=-0.00598 X(o=-0.006,f=0) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 42:sc= 0.0681 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 112:sc= 0.0523 USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ -164:sc= 0.236 (180deg=-0.0703) USER MOD Single : A 85 SER OG : rot 96:sc= 0.497 USER MOD Single : A 87 ASN : amide:sc= -1.26 X(o=-1.3,f=-1.2) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 94 MET CE :methyl 163:sc= -0.0417 (180deg=-0.402) USER MOD Single : A 99 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot -16:sc= 1 USER MOD Single : A 103 SER OG : rot -107:sc= 0.419 USER MOD Single : A 109 THR OG1 : rot -56:sc= 0.729 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 126 ASN : amide:sc= -0.798 X(o=-0.8,f=-0.94) USER MOD Single : A 128 SER OG : rot 35:sc= 0.00578 USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 140 HIS : no HD1:sc= -0.0948 X(o=-0.095,f=-0.17) USER MOD Single : A 141 HIS : no HD1:sc= -0.0175 X(o=-0.018,f=-0.019) USER MOD Single : A 142 HIS : no HE2:sc= 0.618 K(o=0.62,f=-2.6!) USER MOD Single : A 143 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 144 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 145 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -170.073 66.921 -18.642 1.00 24.11 N ATOM 2 CA MET A 1 -170.414 66.989 -17.199 1.00 45.52 C ATOM 3 C MET A 1 -170.906 65.626 -16.715 1.00 60.50 C ATOM 4 O MET A 1 -172.026 65.220 -17.032 1.00 22.34 O ATOM 5 CB MET A 1 -171.505 68.047 -16.922 1.00 4.02 C ATOM 6 CG MET A 1 -171.070 69.503 -17.048 1.00 62.11 C ATOM 7 SD MET A 1 -170.740 70.014 -18.744 1.00 71.42 S ATOM 8 CE MET A 1 -170.508 71.773 -18.525 1.00 51.43 C ATOM 0 H1 MET A 1 -170.184 67.862 -19.070 1.00 24.11 H new ATOM 0 H2 MET A 1 -169.088 66.605 -18.751 1.00 24.11 H new ATOM 0 H3 MET A 1 -170.707 66.248 -19.117 1.00 24.11 H new ATOM 0 HA MET A 1 -169.511 67.275 -16.660 1.00 45.52 H new ATOM 0 HB2 MET A 1 -172.333 67.875 -17.609 1.00 4.02 H new ATOM 0 HB3 MET A 1 -171.889 67.889 -15.914 1.00 4.02 H new ATOM 0 HG2 MET A 1 -171.847 70.143 -16.629 1.00 62.11 H new ATOM 0 HG3 MET A 1 -170.172 69.658 -16.450 1.00 62.11 H new ATOM 0 HE1 MET A 1 -170.295 72.235 -19.489 1.00 51.43 H new ATOM 0 HE2 MET A 1 -171.414 72.210 -18.106 1.00 51.43 H new ATOM 0 HE3 MET A 1 -169.673 71.948 -17.846 1.00 51.43 H new ATOM 20 N ASN A 2 -170.065 64.910 -15.982 1.00 13.35 N ATOM 21 CA ASN A 2 -170.443 63.618 -15.412 1.00 32.20 C ATOM 22 C ASN A 2 -169.947 63.501 -13.971 1.00 13.42 C ATOM 23 O ASN A 2 -169.221 64.375 -13.477 1.00 70.43 O ATOM 24 CB ASN A 2 -169.953 62.436 -16.302 1.00 74.12 C ATOM 25 CG ASN A 2 -168.433 62.314 -16.498 1.00 5.20 C ATOM 26 OD1 ASN A 2 -167.626 62.605 -15.618 1.00 35.52 O ATOM 27 ND2 ASN A 2 -168.036 61.864 -17.675 1.00 33.25 N ATOM 0 H ASN A 2 -169.112 65.201 -15.766 1.00 13.35 H new ATOM 0 HA ASN A 2 -171.531 63.559 -15.390 1.00 32.20 H new ATOM 0 HB2 ASN A 2 -170.317 61.506 -15.866 1.00 74.12 H new ATOM 0 HB3 ASN A 2 -170.418 62.531 -17.283 1.00 74.12 H new ATOM 0 HD21 ASN A 2 -167.041 61.752 -17.869 1.00 33.25 H new ATOM 0 HD22 ASN A 2 -168.725 61.629 -18.390 1.00 33.25 H new ATOM 34 N ALA A 3 -170.338 62.430 -13.305 1.00 25.12 N ATOM 35 CA ALA A 3 -169.938 62.192 -11.929 1.00 40.41 C ATOM 36 C ALA A 3 -169.197 60.868 -11.793 1.00 13.22 C ATOM 37 O ALA A 3 -169.609 59.852 -12.364 1.00 1.32 O ATOM 38 CB ALA A 3 -171.160 62.212 -11.026 1.00 52.44 C ATOM 0 H ALA A 3 -170.938 61.705 -13.699 1.00 25.12 H new ATOM 0 HA ALA A 3 -169.257 62.987 -11.626 1.00 40.41 H new ATOM 0 HB1 ALA A 3 -170.854 62.033 -9.995 1.00 52.44 H new ATOM 0 HB2 ALA A 3 -171.648 63.184 -11.096 1.00 52.44 H new ATOM 0 HB3 ALA A 3 -171.856 61.433 -11.338 1.00 52.44 H new ATOM 44 N ARG A 4 -168.087 60.898 -11.067 1.00 41.24 N ATOM 45 CA ARG A 4 -167.374 59.690 -10.683 1.00 75.13 C ATOM 46 C ARG A 4 -166.906 59.817 -9.237 1.00 13.11 C ATOM 47 O ARG A 4 -166.376 60.859 -8.831 1.00 55.44 O ATOM 48 CB ARG A 4 -166.186 59.366 -11.622 1.00 74.12 C ATOM 49 CG ARG A 4 -165.065 60.411 -11.708 1.00 34.42 C ATOM 50 CD ARG A 4 -165.284 61.441 -12.807 1.00 24.32 C ATOM 51 NE ARG A 4 -164.121 62.326 -12.957 1.00 21.15 N ATOM 52 CZ ARG A 4 -163.961 63.191 -13.964 1.00 31.01 C ATOM 53 NH1 ARG A 4 -164.900 63.327 -14.888 1.00 44.12 N ATOM 54 NH2 ARG A 4 -162.857 63.921 -14.043 1.00 64.00 N ATOM 0 H ARG A 4 -167.658 61.759 -10.729 1.00 41.24 H new ATOM 0 HA ARG A 4 -168.067 58.854 -10.775 1.00 75.13 H new ATOM 0 HB2 ARG A 4 -165.746 58.422 -11.300 1.00 74.12 H new ATOM 0 HB3 ARG A 4 -166.580 59.208 -12.626 1.00 74.12 H new ATOM 0 HG2 ARG A 4 -164.982 60.924 -10.750 1.00 34.42 H new ATOM 0 HG3 ARG A 4 -164.116 59.903 -11.880 1.00 34.42 H new ATOM 0 HD2 ARG A 4 -165.479 60.931 -13.751 1.00 24.32 H new ATOM 0 HD3 ARG A 4 -166.168 62.036 -12.578 1.00 24.32 H new ATOM 0 HE ARG A 4 -163.389 62.278 -12.248 1.00 21.15 H new ATOM 0 HH11 ARG A 4 -165.753 62.770 -14.835 1.00 44.12 H new ATOM 0 HH12 ARG A 4 -164.771 63.989 -15.653 1.00 44.12 H new ATOM 0 HH21 ARG A 4 -162.129 63.823 -13.335 1.00 64.00 H new ATOM 0 HH22 ARG A 4 -162.736 64.581 -14.811 1.00 64.00 H new ATOM 68 N ASP A 5 -167.142 58.780 -8.446 1.00 63.44 N ATOM 69 CA ASP A 5 -166.707 58.775 -7.059 1.00 70.53 C ATOM 70 C ASP A 5 -165.667 57.681 -6.828 1.00 62.14 C ATOM 71 O ASP A 5 -165.946 56.480 -6.921 1.00 14.42 O ATOM 72 CB ASP A 5 -167.901 58.680 -6.077 1.00 70.34 C ATOM 73 CG ASP A 5 -168.723 57.404 -6.172 1.00 44.51 C ATOM 74 OD1 ASP A 5 -169.479 57.242 -7.152 1.00 44.10 O ATOM 75 OD2 ASP A 5 -168.637 56.573 -5.251 1.00 73.42 O ATOM 0 H ASP A 5 -167.631 57.935 -8.741 1.00 63.44 H new ATOM 0 HA ASP A 5 -166.227 59.731 -6.851 1.00 70.53 H new ATOM 0 HB2 ASP A 5 -167.521 58.773 -5.060 1.00 70.34 H new ATOM 0 HB3 ASP A 5 -168.560 59.531 -6.250 1.00 70.34 H new ATOM 80 N ASN A 6 -164.442 58.118 -6.597 1.00 4.30 N ATOM 81 CA ASN A 6 -163.324 57.209 -6.385 1.00 61.21 C ATOM 82 C ASN A 6 -162.325 57.806 -5.408 1.00 12.03 C ATOM 83 O ASN A 6 -162.065 59.013 -5.423 1.00 34.45 O ATOM 84 CB ASN A 6 -162.632 56.820 -7.716 1.00 63.55 C ATOM 85 CG ASN A 6 -162.388 57.989 -8.669 1.00 31.53 C ATOM 86 OD1 ASN A 6 -163.223 58.287 -9.525 1.00 34.13 O ATOM 87 ND2 ASN A 6 -161.245 58.647 -8.544 1.00 55.14 N ATOM 0 H ASN A 6 -164.192 59.106 -6.551 1.00 4.30 H new ATOM 0 HA ASN A 6 -163.726 56.293 -5.953 1.00 61.21 H new ATOM 0 HB2 ASN A 6 -161.676 56.347 -7.489 1.00 63.55 H new ATOM 0 HB3 ASN A 6 -163.244 56.075 -8.225 1.00 63.55 H new ATOM 0 HD21 ASN A 6 -161.034 59.426 -9.167 1.00 55.14 H new ATOM 0 HD22 ASN A 6 -160.576 58.374 -7.824 1.00 55.14 H new ATOM 94 N LYS A 7 -161.809 56.955 -4.526 1.00 73.41 N ATOM 95 CA LYS A 7 -160.797 57.347 -3.551 1.00 75.24 C ATOM 96 C LYS A 7 -159.638 56.368 -3.602 1.00 33.21 C ATOM 97 O LYS A 7 -159.841 55.152 -3.550 1.00 43.24 O ATOM 98 CB LYS A 7 -161.363 57.384 -2.125 1.00 51.35 C ATOM 99 CG LYS A 7 -162.550 58.322 -1.933 1.00 13.32 C ATOM 100 CD LYS A 7 -162.831 58.585 -0.460 1.00 35.11 C ATOM 101 CE LYS A 7 -162.386 59.984 -0.029 1.00 50.31 C ATOM 102 NZ LYS A 7 -160.947 60.243 -0.313 1.00 40.24 N ATOM 0 H LYS A 7 -162.081 55.974 -4.467 1.00 73.41 H new ATOM 0 HA LYS A 7 -160.459 58.351 -3.808 1.00 75.24 H new ATOM 0 HB2 LYS A 7 -161.665 56.376 -1.843 1.00 51.35 H new ATOM 0 HB3 LYS A 7 -160.568 57.682 -1.441 1.00 51.35 H new ATOM 0 HG2 LYS A 7 -162.352 59.267 -2.440 1.00 13.32 H new ATOM 0 HG3 LYS A 7 -163.435 57.889 -2.400 1.00 13.32 H new ATOM 0 HD2 LYS A 7 -163.898 58.470 -0.269 1.00 35.11 H new ATOM 0 HD3 LYS A 7 -162.316 57.839 0.145 1.00 35.11 H new ATOM 0 HE2 LYS A 7 -162.993 60.729 -0.544 1.00 50.31 H new ATOM 0 HE3 LYS A 7 -162.569 60.106 1.039 1.00 50.31 H new ATOM 0 HZ1 LYS A 7 -160.665 61.147 0.118 1.00 40.24 H new ATOM 0 HZ2 LYS A 7 -160.371 59.475 0.086 1.00 40.24 H new ATOM 0 HZ3 LYS A 7 -160.799 60.289 -1.341 1.00 40.24 H new ATOM 116 N PHE A 8 -158.429 56.894 -3.713 1.00 25.20 N ATOM 117 CA PHE A 8 -157.242 56.061 -3.839 1.00 71.43 C ATOM 118 C PHE A 8 -156.215 56.400 -2.771 1.00 21.33 C ATOM 119 O PHE A 8 -155.908 57.576 -2.537 1.00 2.35 O ATOM 120 CB PHE A 8 -156.628 56.193 -5.243 1.00 55.31 C ATOM 121 CG PHE A 8 -157.438 55.528 -6.331 1.00 21.42 C ATOM 122 CD1 PHE A 8 -157.304 54.172 -6.578 1.00 14.42 C ATOM 123 CD2 PHE A 8 -158.336 56.254 -7.098 1.00 73.54 C ATOM 124 CE1 PHE A 8 -158.045 53.556 -7.565 1.00 11.20 C ATOM 125 CE2 PHE A 8 -159.081 55.644 -8.085 1.00 62.04 C ATOM 126 CZ PHE A 8 -158.935 54.293 -8.318 1.00 50.32 C ATOM 0 H PHE A 8 -158.243 57.897 -3.718 1.00 25.20 H new ATOM 0 HA PHE A 8 -157.547 55.025 -3.694 1.00 71.43 H new ATOM 0 HB2 PHE A 8 -156.516 57.251 -5.482 1.00 55.31 H new ATOM 0 HB3 PHE A 8 -155.627 55.761 -5.233 1.00 55.31 H new ATOM 0 HD1 PHE A 8 -156.610 53.589 -5.990 1.00 14.42 H new ATOM 0 HD2 PHE A 8 -158.454 57.313 -6.920 1.00 73.54 H new ATOM 0 HE1 PHE A 8 -157.928 52.498 -7.748 1.00 11.20 H new ATOM 0 HE2 PHE A 8 -159.777 56.223 -8.674 1.00 62.04 H new ATOM 0 HZ PHE A 8 -159.517 53.812 -9.090 1.00 50.32 H new ATOM 136 N ASN A 9 -155.728 55.350 -2.110 1.00 33.14 N ATOM 137 CA ASN A 9 -154.673 55.435 -1.103 1.00 25.53 C ATOM 138 C ASN A 9 -154.089 54.033 -0.875 1.00 44.12 C ATOM 139 O ASN A 9 -154.822 53.049 -0.749 1.00 70.23 O ATOM 140 CB ASN A 9 -155.182 56.068 0.223 1.00 61.02 C ATOM 141 CG ASN A 9 -156.123 55.190 1.039 1.00 54.45 C ATOM 142 OD1 ASN A 9 -155.712 54.571 2.020 1.00 23.12 O ATOM 143 ND2 ASN A 9 -157.371 55.085 0.600 1.00 24.12 N ATOM 0 H ASN A 9 -156.063 54.399 -2.263 1.00 33.14 H new ATOM 0 HA ASN A 9 -153.888 56.097 -1.469 1.00 25.53 H new ATOM 0 HB2 ASN A 9 -154.320 56.322 0.840 1.00 61.02 H new ATOM 0 HB3 ASN A 9 -155.693 57.002 -0.011 1.00 61.02 H new ATOM 0 HD21 ASN A 9 -158.031 54.473 1.080 1.00 24.12 H new ATOM 0 HD22 ASN A 9 -157.670 55.616 -0.218 1.00 24.12 H new ATOM 150 N THR A 10 -152.770 53.941 -0.882 1.00 73.43 N ATOM 151 CA THR A 10 -152.086 52.663 -0.730 1.00 53.43 C ATOM 152 C THR A 10 -151.126 52.728 0.448 1.00 42.44 C ATOM 153 O THR A 10 -150.282 53.623 0.511 1.00 31.43 O ATOM 154 CB THR A 10 -151.313 52.300 -2.017 1.00 22.22 C ATOM 155 OG1 THR A 10 -152.147 52.543 -3.154 1.00 24.15 O ATOM 156 CG2 THR A 10 -150.882 50.836 -2.017 1.00 64.34 C ATOM 0 H THR A 10 -152.146 54.740 -0.992 1.00 73.43 H new ATOM 0 HA THR A 10 -152.833 51.891 -0.546 1.00 53.43 H new ATOM 0 HB THR A 10 -150.417 52.920 -2.060 1.00 22.22 H new ATOM 0 HG1 THR A 10 -151.659 52.315 -3.973 1.00 24.15 H new ATOM 0 HG21 THR A 10 -150.341 50.616 -2.937 1.00 64.34 H new ATOM 0 HG22 THR A 10 -150.234 50.648 -1.161 1.00 64.34 H new ATOM 0 HG23 THR A 10 -151.763 50.197 -1.953 1.00 64.34 H new ATOM 164 N TRP A 11 -151.273 51.797 1.382 1.00 74.23 N ATOM 165 CA TRP A 11 -150.462 51.802 2.587 1.00 21.24 C ATOM 166 C TRP A 11 -149.464 50.643 2.589 1.00 64.12 C ATOM 167 O TRP A 11 -149.845 49.471 2.695 1.00 73.33 O ATOM 168 CB TRP A 11 -151.351 51.747 3.838 1.00 32.42 C ATOM 169 CG TRP A 11 -150.587 51.944 5.118 1.00 11.13 C ATOM 170 CD1 TRP A 11 -150.326 51.012 6.083 1.00 74.30 C ATOM 171 CD2 TRP A 11 -149.968 53.156 5.556 1.00 25.14 C ATOM 172 NE1 TRP A 11 -149.593 51.578 7.098 1.00 65.34 N ATOM 173 CE2 TRP A 11 -149.361 52.893 6.798 1.00 21.44 C ATOM 174 CE3 TRP A 11 -149.876 54.440 5.019 1.00 4.55 C ATOM 175 CZ2 TRP A 11 -148.667 53.869 7.506 1.00 54.13 C ATOM 176 CZ3 TRP A 11 -149.190 55.402 5.719 1.00 54.42 C ATOM 177 CH2 TRP A 11 -148.596 55.115 6.952 1.00 51.24 C ATOM 0 H TRP A 11 -151.945 51.032 1.326 1.00 74.23 H new ATOM 0 HA TRP A 11 -149.896 52.733 2.603 1.00 21.24 H new ATOM 0 HB2 TRP A 11 -152.122 52.513 3.761 1.00 32.42 H new ATOM 0 HB3 TRP A 11 -151.861 50.784 3.871 1.00 32.42 H new ATOM 0 HD1 TRP A 11 -150.649 49.982 6.052 1.00 74.30 H new ATOM 0 HE1 TRP A 11 -149.274 51.096 7.939 1.00 65.34 H new ATOM 0 HE3 TRP A 11 -150.336 54.673 4.070 1.00 4.55 H new ATOM 0 HZ2 TRP A 11 -148.203 53.650 8.456 1.00 54.13 H new ATOM 0 HZ3 TRP A 11 -149.108 56.398 5.310 1.00 54.42 H new ATOM 0 HH2 TRP A 11 -148.069 55.897 7.478 1.00 51.24 H new ATOM 188 N ASN A 12 -148.192 50.988 2.463 1.00 1.34 N ATOM 189 CA ASN A 12 -147.098 50.036 2.628 1.00 32.04 C ATOM 190 C ASN A 12 -146.144 50.568 3.689 1.00 64.22 C ATOM 191 O ASN A 12 -145.659 51.700 3.589 1.00 31.41 O ATOM 192 CB ASN A 12 -146.350 49.807 1.304 1.00 52.31 C ATOM 193 CG ASN A 12 -145.203 48.809 1.411 1.00 5.40 C ATOM 194 OD1 ASN A 12 -145.265 47.821 2.150 1.00 72.41 O ATOM 195 ND2 ASN A 12 -144.134 49.085 0.690 1.00 20.00 N ATOM 0 H ASN A 12 -147.886 51.936 2.243 1.00 1.34 H new ATOM 0 HA ASN A 12 -147.507 49.075 2.940 1.00 32.04 H new ATOM 0 HB2 ASN A 12 -147.058 49.454 0.554 1.00 52.31 H new ATOM 0 HB3 ASN A 12 -145.958 50.760 0.949 1.00 52.31 H new ATOM 0 HD21 ASN A 12 -143.319 48.473 0.731 1.00 20.00 H new ATOM 0 HD22 ASN A 12 -144.122 49.911 0.092 1.00 20.00 H new ATOM 202 N ASP A 13 -145.889 49.747 4.701 1.00 11.34 N ATOM 203 CA ASP A 13 -145.062 50.145 5.827 1.00 2.22 C ATOM 204 C ASP A 13 -144.311 48.944 6.398 1.00 42.35 C ATOM 205 O ASP A 13 -144.920 47.940 6.771 1.00 34.52 O ATOM 206 CB ASP A 13 -145.950 50.793 6.901 1.00 2.12 C ATOM 207 CG ASP A 13 -145.178 51.253 8.122 1.00 74.44 C ATOM 208 OD1 ASP A 13 -144.653 52.379 8.115 1.00 3.02 O ATOM 209 OD2 ASP A 13 -145.109 50.493 9.104 1.00 13.40 O ATOM 0 H ASP A 13 -146.248 48.794 4.762 1.00 11.34 H new ATOM 0 HA ASP A 13 -144.320 50.868 5.490 1.00 2.22 H new ATOM 0 HB2 ASP A 13 -146.470 51.647 6.466 1.00 2.12 H new ATOM 0 HB3 ASP A 13 -146.713 50.079 7.210 1.00 2.12 H new ATOM 214 N SER A 14 -142.992 49.045 6.441 1.00 14.32 N ATOM 215 CA SER A 14 -142.152 47.995 6.999 1.00 71.23 C ATOM 216 C SER A 14 -141.323 48.555 8.151 1.00 33.43 C ATOM 217 O SER A 14 -140.693 49.610 8.019 1.00 54.03 O ATOM 218 CB SER A 14 -141.236 47.411 5.918 1.00 51.31 C ATOM 219 OG SER A 14 -141.989 46.900 4.825 1.00 20.13 O ATOM 0 H SER A 14 -142.475 49.852 6.092 1.00 14.32 H new ATOM 0 HA SER A 14 -142.790 47.195 7.376 1.00 71.23 H new ATOM 0 HB2 SER A 14 -140.552 48.181 5.563 1.00 51.31 H new ATOM 0 HB3 SER A 14 -140.626 46.616 6.346 1.00 51.31 H new ATOM 0 HG SER A 14 -141.379 46.535 4.150 1.00 20.13 H new ATOM 225 N ARG A 15 -141.346 47.864 9.285 1.00 54.02 N ATOM 226 CA ARG A 15 -140.619 48.305 10.471 1.00 15.20 C ATOM 227 C ARG A 15 -139.933 47.136 11.172 1.00 71.44 C ATOM 228 O ARG A 15 -140.510 46.056 11.330 1.00 72.55 O ATOM 229 CB ARG A 15 -141.557 49.053 11.434 1.00 44.13 C ATOM 230 CG ARG A 15 -142.797 48.277 11.864 1.00 3.32 C ATOM 231 CD ARG A 15 -143.728 49.147 12.688 1.00 44.04 C ATOM 232 NE ARG A 15 -144.320 50.232 11.893 1.00 30.11 N ATOM 233 CZ ARG A 15 -144.737 51.404 12.386 1.00 31.40 C ATOM 234 NH1 ARG A 15 -144.616 51.689 13.681 1.00 33.40 N ATOM 235 NH2 ARG A 15 -145.273 52.297 11.566 1.00 21.14 N ATOM 0 H ARG A 15 -141.862 46.993 9.409 1.00 54.02 H new ATOM 0 HA ARG A 15 -139.839 48.995 10.148 1.00 15.20 H new ATOM 0 HB2 ARG A 15 -140.993 49.328 12.325 1.00 44.13 H new ATOM 0 HB3 ARG A 15 -141.875 49.981 10.959 1.00 44.13 H new ATOM 0 HG2 ARG A 15 -143.323 47.909 10.983 1.00 3.32 H new ATOM 0 HG3 ARG A 15 -142.500 47.404 12.446 1.00 3.32 H new ATOM 0 HD2 ARG A 15 -144.523 48.530 13.107 1.00 44.04 H new ATOM 0 HD3 ARG A 15 -143.178 49.572 13.527 1.00 44.04 H new ATOM 0 HE ARG A 15 -144.421 50.080 10.889 1.00 30.11 H new ATOM 0 HH11 ARG A 15 -144.199 51.008 14.316 1.00 33.40 H new ATOM 0 HH12 ARG A 15 -144.940 52.588 14.038 1.00 33.40 H new ATOM 0 HH21 ARG A 15 -145.364 52.087 10.572 1.00 21.14 H new ATOM 0 HH22 ARG A 15 -145.595 53.194 11.929 1.00 21.14 H new ATOM 249 N GLY A 16 -138.695 47.367 11.586 1.00 21.11 N ATOM 250 CA GLY A 16 -137.910 46.344 12.246 1.00 53.25 C ATOM 251 C GLY A 16 -136.546 46.864 12.640 1.00 1.33 C ATOM 252 O GLY A 16 -135.946 47.645 11.901 1.00 3.35 O ATOM 0 H GLY A 16 -138.214 48.260 11.474 1.00 21.11 H new ATOM 0 HA2 GLY A 16 -138.438 45.994 13.133 1.00 53.25 H new ATOM 0 HA3 GLY A 16 -137.797 45.486 11.583 1.00 53.25 H new ATOM 256 N ASN A 17 -136.079 46.464 13.815 1.00 41.30 N ATOM 257 CA ASN A 17 -134.755 46.852 14.309 1.00 63.24 C ATOM 258 C ASN A 17 -134.023 45.612 14.784 1.00 32.41 C ATOM 259 O ASN A 17 -134.331 45.066 15.847 1.00 24.15 O ATOM 260 CB ASN A 17 -134.844 47.881 15.450 1.00 2.21 C ATOM 261 CG ASN A 17 -135.309 49.248 14.994 1.00 71.41 C ATOM 262 OD1 ASN A 17 -136.505 49.521 14.935 1.00 10.23 O ATOM 263 ND2 ASN A 17 -134.365 50.119 14.697 1.00 12.44 N ATOM 0 H ASN A 17 -136.601 45.864 14.454 1.00 41.30 H new ATOM 0 HA ASN A 17 -134.210 47.324 13.491 1.00 63.24 H new ATOM 0 HB2 ASN A 17 -135.528 47.509 16.212 1.00 2.21 H new ATOM 0 HB3 ASN A 17 -133.865 47.977 15.920 1.00 2.21 H new ATOM 0 HD21 ASN A 17 -134.616 51.063 14.404 1.00 12.44 H new ATOM 0 HD22 ASN A 17 -133.384 49.849 14.760 1.00 12.44 H new ATOM 270 N TYR A 18 -133.093 45.137 13.970 1.00 0.41 N ATOM 271 CA TYR A 18 -132.417 43.871 14.232 1.00 5.52 C ATOM 272 C TYR A 18 -130.909 44.060 14.352 1.00 1.42 C ATOM 273 O TYR A 18 -130.308 44.845 13.611 1.00 53.40 O ATOM 274 CB TYR A 18 -132.739 42.857 13.125 1.00 62.10 C ATOM 275 CG TYR A 18 -134.225 42.628 12.941 1.00 12.21 C ATOM 276 CD1 TYR A 18 -134.973 41.989 13.923 1.00 62.42 C ATOM 277 CD2 TYR A 18 -134.882 43.076 11.802 1.00 64.41 C ATOM 278 CE1 TYR A 18 -136.329 41.800 13.773 1.00 0.33 C ATOM 279 CE2 TYR A 18 -136.243 42.895 11.649 1.00 22.35 C ATOM 280 CZ TYR A 18 -136.960 42.254 12.639 1.00 14.53 C ATOM 281 OH TYR A 18 -138.317 42.080 12.506 1.00 11.20 O ATOM 0 H TYR A 18 -132.787 45.609 13.119 1.00 0.41 H new ATOM 0 HA TYR A 18 -132.783 43.487 15.184 1.00 5.52 H new ATOM 0 HB2 TYR A 18 -132.313 43.207 12.185 1.00 62.10 H new ATOM 0 HB3 TYR A 18 -132.258 41.908 13.359 1.00 62.10 H new ATOM 0 HD1 TYR A 18 -134.483 41.635 14.818 1.00 62.42 H new ATOM 0 HD2 TYR A 18 -134.321 43.573 11.025 1.00 64.41 H new ATOM 0 HE1 TYR A 18 -136.895 41.297 14.543 1.00 0.33 H new ATOM 0 HE2 TYR A 18 -136.743 43.253 10.761 1.00 22.35 H new ATOM 0 HH TYR A 18 -138.613 42.456 11.651 1.00 11.20 H new ATOM 291 N TRP A 19 -130.311 43.342 15.298 1.00 11.42 N ATOM 292 CA TRP A 19 -128.882 43.428 15.555 1.00 13.24 C ATOM 293 C TRP A 19 -128.375 42.128 16.160 1.00 23.44 C ATOM 294 O TRP A 19 -129.138 41.365 16.760 1.00 42.03 O ATOM 295 CB TRP A 19 -128.541 44.632 16.469 1.00 22.40 C ATOM 296 CG TRP A 19 -129.161 44.602 17.836 1.00 32.15 C ATOM 297 CD1 TRP A 19 -130.461 44.869 18.157 1.00 31.01 C ATOM 298 CD2 TRP A 19 -128.495 44.317 19.072 1.00 75.34 C ATOM 299 NE1 TRP A 19 -130.647 44.748 19.508 1.00 44.15 N ATOM 300 CE2 TRP A 19 -129.453 44.419 20.093 1.00 32.43 C ATOM 301 CE3 TRP A 19 -127.180 43.986 19.409 1.00 2.22 C ATOM 302 CZ2 TRP A 19 -129.143 44.193 21.430 1.00 42.30 C ATOM 303 CZ3 TRP A 19 -126.871 43.767 20.736 1.00 12.33 C ATOM 304 CH2 TRP A 19 -127.848 43.875 21.733 1.00 64.21 C ATOM 0 H TRP A 19 -130.804 42.687 15.905 1.00 11.42 H new ATOM 0 HA TRP A 19 -128.378 43.589 14.602 1.00 13.24 H new ATOM 0 HB2 TRP A 19 -127.458 44.685 16.581 1.00 22.40 H new ATOM 0 HB3 TRP A 19 -128.855 45.547 15.967 1.00 22.40 H new ATOM 0 HD1 TRP A 19 -131.231 45.137 17.448 1.00 31.01 H new ATOM 0 HE1 TRP A 19 -131.531 44.881 19.999 1.00 44.15 H new ATOM 0 HE3 TRP A 19 -126.420 43.903 18.646 1.00 2.22 H new ATOM 0 HZ2 TRP A 19 -129.897 44.266 22.200 1.00 42.30 H new ATOM 0 HZ3 TRP A 19 -125.859 43.508 21.010 1.00 12.33 H new ATOM 0 HH2 TRP A 19 -127.573 43.704 22.763 1.00 64.21 H new ATOM 315 N SER A 20 -127.096 41.876 15.977 1.00 40.03 N ATOM 316 CA SER A 20 -126.448 40.718 16.555 1.00 2.54 C ATOM 317 C SER A 20 -125.245 41.156 17.382 1.00 10.10 C ATOM 318 O SER A 20 -124.730 42.261 17.195 1.00 63.12 O ATOM 319 CB SER A 20 -126.030 39.755 15.440 1.00 24.22 C ATOM 320 OG SER A 20 -125.287 40.421 14.433 1.00 25.44 O ATOM 0 H SER A 20 -126.477 42.468 15.424 1.00 40.03 H new ATOM 0 HA SER A 20 -127.143 40.200 17.216 1.00 2.54 H new ATOM 0 HB2 SER A 20 -125.432 38.946 15.861 1.00 24.22 H new ATOM 0 HB3 SER A 20 -126.917 39.300 14.999 1.00 24.22 H new ATOM 0 HG SER A 20 -125.033 39.780 13.736 1.00 25.44 H new ATOM 326 N ASP A 21 -124.795 40.306 18.290 1.00 64.45 N ATOM 327 CA ASP A 21 -123.634 40.627 19.106 1.00 2.24 C ATOM 328 C ASP A 21 -122.588 39.531 19.018 1.00 24.50 C ATOM 329 O ASP A 21 -122.899 38.339 19.161 1.00 43.31 O ATOM 330 CB ASP A 21 -124.049 40.861 20.557 1.00 34.44 C ATOM 331 CG ASP A 21 -122.902 41.304 21.448 1.00 2.20 C ATOM 332 OD1 ASP A 21 -122.220 42.291 21.103 1.00 22.32 O ATOM 333 OD2 ASP A 21 -122.685 40.672 22.501 1.00 34.43 O ATOM 0 H ASP A 21 -125.212 39.395 18.481 1.00 64.45 H new ATOM 0 HA ASP A 21 -123.191 41.546 18.721 1.00 2.24 H new ATOM 0 HB2 ASP A 21 -124.834 41.617 20.585 1.00 34.44 H new ATOM 0 HB3 ASP A 21 -124.477 39.942 20.958 1.00 34.44 H new ATOM 338 N TYR A 22 -121.355 39.952 18.764 1.00 32.00 N ATOM 339 CA TYR A 22 -120.215 39.052 18.719 1.00 50.14 C ATOM 340 C TYR A 22 -119.813 38.658 20.133 1.00 12.41 C ATOM 341 O TYR A 22 -119.421 39.501 20.945 1.00 33.21 O ATOM 342 CB TYR A 22 -119.023 39.692 17.976 1.00 62.24 C ATOM 343 CG TYR A 22 -117.738 38.867 18.019 1.00 23.43 C ATOM 344 CD1 TYR A 22 -117.600 37.714 17.257 1.00 52.14 C ATOM 345 CD2 TYR A 22 -116.675 39.233 18.842 1.00 52.13 C ATOM 346 CE1 TYR A 22 -116.448 36.954 17.313 1.00 11.25 C ATOM 347 CE2 TYR A 22 -115.523 38.474 18.905 1.00 73.14 C ATOM 348 CZ TYR A 22 -115.416 37.336 18.138 1.00 64.24 C ATOM 349 OH TYR A 22 -114.275 36.571 18.197 1.00 75.20 O ATOM 0 H TYR A 22 -121.120 40.928 18.584 1.00 32.00 H new ATOM 0 HA TYR A 22 -120.505 38.158 18.167 1.00 50.14 H new ATOM 0 HB2 TYR A 22 -119.303 39.852 16.935 1.00 62.24 H new ATOM 0 HB3 TYR A 22 -118.825 40.673 18.408 1.00 62.24 H new ATOM 0 HD1 TYR A 22 -118.408 37.406 16.609 1.00 52.14 H new ATOM 0 HD2 TYR A 22 -116.753 40.127 19.442 1.00 52.13 H new ATOM 0 HE1 TYR A 22 -116.358 36.062 16.711 1.00 11.25 H new ATOM 0 HE2 TYR A 22 -114.711 38.771 19.552 1.00 73.14 H new ATOM 0 HH TYR A 22 -113.641 36.977 18.825 1.00 75.20 H new ATOM 359 N GLU A 23 -119.931 37.375 20.418 1.00 41.21 N ATOM 360 CA GLU A 23 -119.514 36.827 21.693 1.00 2.10 C ATOM 361 C GLU A 23 -118.386 35.835 21.459 1.00 61.40 C ATOM 362 O GLU A 23 -118.624 34.706 21.023 1.00 72.15 O ATOM 363 CB GLU A 23 -120.684 36.145 22.413 1.00 51.32 C ATOM 364 CG GLU A 23 -121.893 37.046 22.596 1.00 74.33 C ATOM 365 CD GLU A 23 -122.982 36.398 23.412 1.00 63.21 C ATOM 366 OE1 GLU A 23 -123.567 35.405 22.946 1.00 4.41 O ATOM 367 OE2 GLU A 23 -123.271 36.889 24.519 1.00 32.53 O ATOM 0 H GLU A 23 -120.318 36.685 19.773 1.00 41.21 H new ATOM 0 HA GLU A 23 -119.165 37.639 22.331 1.00 2.10 H new ATOM 0 HB2 GLU A 23 -120.982 35.261 21.848 1.00 51.32 H new ATOM 0 HB3 GLU A 23 -120.347 35.800 23.391 1.00 51.32 H new ATOM 0 HG2 GLU A 23 -121.582 37.971 23.082 1.00 74.33 H new ATOM 0 HG3 GLU A 23 -122.290 37.318 21.618 1.00 74.33 H new ATOM 374 N GLY A 24 -117.161 36.275 21.721 1.00 42.40 N ATOM 375 CA GLY A 24 -115.999 35.434 21.518 1.00 55.51 C ATOM 376 C GLY A 24 -114.928 35.704 22.550 1.00 21.40 C ATOM 377 O GLY A 24 -114.171 36.663 22.421 1.00 55.21 O ATOM 0 H GLY A 24 -116.952 37.209 22.074 1.00 42.40 H new ATOM 0 HA2 GLY A 24 -116.295 34.386 21.566 1.00 55.51 H new ATOM 0 HA3 GLY A 24 -115.595 35.606 20.520 1.00 55.51 H new ATOM 381 N SER A 25 -114.908 34.898 23.608 1.00 15.43 N ATOM 382 CA SER A 25 -113.898 35.017 24.656 1.00 62.42 C ATOM 383 C SER A 25 -113.412 33.635 25.079 1.00 75.24 C ATOM 384 O SER A 25 -114.132 32.894 25.759 1.00 2.12 O ATOM 385 CB SER A 25 -114.460 35.775 25.870 1.00 43.43 C ATOM 386 OG SER A 25 -114.940 37.057 25.496 1.00 2.13 O ATOM 0 H SER A 25 -115.585 34.151 23.763 1.00 15.43 H new ATOM 0 HA SER A 25 -113.055 35.582 24.257 1.00 62.42 H new ATOM 0 HB2 SER A 25 -115.268 35.198 26.320 1.00 43.43 H new ATOM 0 HB3 SER A 25 -113.683 35.881 26.627 1.00 43.43 H new ATOM 0 HG SER A 25 -115.293 37.517 26.286 1.00 2.13 H new ATOM 392 N ASP A 26 -112.208 33.277 24.648 1.00 73.34 N ATOM 393 CA ASP A 26 -111.626 31.981 24.977 1.00 64.01 C ATOM 394 C ASP A 26 -110.124 32.116 25.228 1.00 63.22 C ATOM 395 O ASP A 26 -109.435 32.879 24.541 1.00 41.31 O ATOM 396 CB ASP A 26 -111.893 30.973 23.847 1.00 60.21 C ATOM 397 CG ASP A 26 -111.430 29.566 24.186 1.00 64.43 C ATOM 398 OD1 ASP A 26 -112.043 28.929 25.062 1.00 4.00 O ATOM 399 OD2 ASP A 26 -110.438 29.100 23.595 1.00 31.55 O ATOM 0 H ASP A 26 -111.614 33.869 24.068 1.00 73.34 H new ATOM 0 HA ASP A 26 -112.095 31.613 25.889 1.00 64.01 H new ATOM 0 HB2 ASP A 26 -112.961 30.955 23.628 1.00 60.21 H new ATOM 0 HB3 ASP A 26 -111.387 31.308 22.941 1.00 60.21 H new ATOM 404 N GLU A 27 -109.628 31.388 26.225 1.00 23.02 N ATOM 405 CA GLU A 27 -108.219 31.429 26.598 1.00 35.25 C ATOM 406 C GLU A 27 -107.609 30.034 26.578 1.00 2.24 C ATOM 407 O GLU A 27 -108.204 29.076 27.085 1.00 42.04 O ATOM 408 CB GLU A 27 -108.052 32.024 27.997 1.00 32.50 C ATOM 409 CG GLU A 27 -108.607 33.432 28.144 1.00 32.03 C ATOM 410 CD GLU A 27 -108.667 33.873 29.580 1.00 43.11 C ATOM 411 OE1 GLU A 27 -109.577 33.426 30.301 1.00 34.04 O ATOM 412 OE2 GLU A 27 -107.819 34.673 29.997 1.00 4.11 O ATOM 0 H GLU A 27 -110.190 30.756 26.795 1.00 23.02 H new ATOM 0 HA GLU A 27 -107.704 32.055 25.870 1.00 35.25 H new ATOM 0 HB2 GLU A 27 -108.546 31.373 28.718 1.00 32.50 H new ATOM 0 HB3 GLU A 27 -106.992 32.035 28.251 1.00 32.50 H new ATOM 0 HG2 GLU A 27 -107.986 34.126 27.578 1.00 32.03 H new ATOM 0 HG3 GLU A 27 -109.606 33.474 27.711 1.00 32.03 H new ATOM 419 N ASN A 28 -106.426 29.934 25.984 1.00 45.31 N ATOM 420 CA ASN A 28 -105.648 28.703 25.991 1.00 53.13 C ATOM 421 C ASN A 28 -104.159 29.042 26.050 1.00 22.23 C ATOM 422 O ASN A 28 -103.593 29.586 25.093 1.00 70.43 O ATOM 423 CB ASN A 28 -105.971 27.828 24.766 1.00 20.45 C ATOM 424 CG ASN A 28 -105.332 26.460 24.873 1.00 44.02 C ATOM 425 OD1 ASN A 28 -104.249 26.218 24.351 1.00 55.34 O ATOM 426 ND2 ASN A 28 -105.995 25.565 25.576 1.00 41.04 N ATOM 0 H ASN A 28 -105.980 30.704 25.485 1.00 45.31 H new ATOM 0 HA ASN A 28 -105.915 28.124 26.875 1.00 53.13 H new ATOM 0 HB2 ASN A 28 -107.051 27.719 24.671 1.00 20.45 H new ATOM 0 HB3 ASN A 28 -105.620 28.324 23.861 1.00 20.45 H new ATOM 0 HD21 ASN A 28 -105.610 24.629 25.703 1.00 41.04 H new ATOM 0 HD22 ASN A 28 -106.893 25.808 25.994 1.00 41.04 H new ATOM 433 N GLY A 29 -103.544 28.738 27.184 1.00 71.43 N ATOM 434 CA GLY A 29 -102.134 29.017 27.378 1.00 14.33 C ATOM 435 C GLY A 29 -101.307 27.756 27.375 1.00 35.04 C ATOM 436 O GLY A 29 -101.855 26.650 27.369 1.00 65.44 O ATOM 0 H GLY A 29 -104.002 28.298 27.982 1.00 71.43 H new ATOM 0 HA2 GLY A 29 -101.784 29.683 26.590 1.00 14.33 H new ATOM 0 HA3 GLY A 29 -101.994 29.541 28.323 1.00 14.33 H new ATOM 440 N ASP A 30 -99.992 27.919 27.381 1.00 21.10 N ATOM 441 CA ASP A 30 -99.072 26.793 27.370 1.00 4.01 C ATOM 442 C ASP A 30 -97.826 27.139 28.171 1.00 71.41 C ATOM 443 O ASP A 30 -97.554 28.317 28.425 1.00 20.04 O ATOM 444 CB ASP A 30 -98.694 26.396 25.924 1.00 63.15 C ATOM 445 CG ASP A 30 -97.798 27.399 25.215 1.00 55.32 C ATOM 446 OD1 ASP A 30 -98.279 28.477 24.825 1.00 61.31 O ATOM 447 OD2 ASP A 30 -96.606 27.099 25.027 1.00 63.54 O ATOM 0 H ASP A 30 -99.535 28.831 27.394 1.00 21.10 H new ATOM 0 HA ASP A 30 -99.567 25.938 27.830 1.00 4.01 H new ATOM 0 HB2 ASP A 30 -98.192 25.429 25.944 1.00 63.15 H new ATOM 0 HB3 ASP A 30 -99.608 26.269 25.344 1.00 63.15 H new ATOM 452 N GLY A 31 -97.082 26.119 28.567 1.00 21.14 N ATOM 453 CA GLY A 31 -95.838 26.336 29.278 1.00 61.22 C ATOM 454 C GLY A 31 -95.315 25.069 29.908 1.00 33.00 C ATOM 455 O GLY A 31 -96.096 24.203 30.315 1.00 35.31 O ATOM 0 H GLY A 31 -97.318 25.139 28.408 1.00 21.14 H new ATOM 0 HA2 GLY A 31 -95.092 26.732 28.589 1.00 61.22 H new ATOM 0 HA3 GLY A 31 -95.990 27.089 30.051 1.00 61.22 H new ATOM 459 N ILE A 32 -93.997 24.954 29.957 1.00 74.02 N ATOM 460 CA ILE A 32 -93.329 23.816 30.566 1.00 30.24 C ATOM 461 C ILE A 32 -91.904 24.213 30.995 1.00 73.31 C ATOM 462 O ILE A 32 -91.118 24.745 30.203 1.00 74.03 O ATOM 463 CB ILE A 32 -93.330 22.555 29.626 1.00 2.15 C ATOM 464 CG1 ILE A 32 -92.570 21.387 30.278 1.00 14.32 C ATOM 465 CG2 ILE A 32 -92.763 22.871 28.235 1.00 71.42 C ATOM 466 CD1 ILE A 32 -92.749 20.057 29.570 1.00 0.42 C ATOM 0 H ILE A 32 -93.358 25.651 29.574 1.00 74.02 H new ATOM 0 HA ILE A 32 -93.889 23.528 31.456 1.00 30.24 H new ATOM 0 HB ILE A 32 -94.369 22.256 29.487 1.00 2.15 H new ATOM 0 HG12 ILE A 32 -91.508 21.630 30.307 1.00 14.32 H new ATOM 0 HG13 ILE A 32 -92.902 21.284 31.311 1.00 14.32 H new ATOM 0 HG21 ILE A 32 -92.783 21.971 27.621 1.00 71.42 H new ATOM 0 HG22 ILE A 32 -93.367 23.646 27.763 1.00 71.42 H new ATOM 0 HG23 ILE A 32 -91.735 23.221 28.332 1.00 71.42 H new ATOM 0 HD11 ILE A 32 -92.181 19.287 30.093 1.00 0.42 H new ATOM 0 HD12 ILE A 32 -93.805 19.787 29.564 1.00 0.42 H new ATOM 0 HD13 ILE A 32 -92.389 20.140 28.544 1.00 0.42 H new ATOM 478 N GLY A 33 -91.610 23.999 32.270 1.00 3.24 N ATOM 479 CA GLY A 33 -90.282 24.236 32.791 1.00 54.42 C ATOM 480 C GLY A 33 -89.561 22.938 33.059 1.00 53.20 C ATOM 481 O GLY A 33 -89.982 22.156 33.914 1.00 13.35 O ATOM 0 H GLY A 33 -92.280 23.660 32.961 1.00 3.24 H new ATOM 0 HA2 GLY A 33 -89.711 24.832 32.080 1.00 54.42 H new ATOM 0 HA3 GLY A 33 -90.348 24.815 33.712 1.00 54.42 H new ATOM 485 N ASP A 34 -88.488 22.698 32.316 1.00 63.11 N ATOM 486 CA ASP A 34 -87.704 21.478 32.459 1.00 51.33 C ATOM 487 C ASP A 34 -86.268 21.813 32.864 1.00 51.12 C ATOM 488 O ASP A 34 -85.627 22.678 32.264 1.00 63.23 O ATOM 489 CB ASP A 34 -87.724 20.683 31.143 1.00 52.12 C ATOM 490 CG ASP A 34 -87.001 19.351 31.241 1.00 32.32 C ATOM 491 OD1 ASP A 34 -87.581 18.396 31.798 1.00 44.31 O ATOM 492 OD2 ASP A 34 -85.850 19.259 30.776 1.00 21.52 O ATOM 0 H ASP A 34 -88.139 23.338 31.603 1.00 63.11 H new ATOM 0 HA ASP A 34 -88.146 20.864 33.244 1.00 51.33 H new ATOM 0 HB2 ASP A 34 -88.758 20.507 30.847 1.00 52.12 H new ATOM 0 HB3 ASP A 34 -87.265 21.282 30.357 1.00 52.12 H new ATOM 497 N SER A 35 -85.782 21.137 33.894 1.00 12.34 N ATOM 498 CA SER A 35 -84.406 21.285 34.340 1.00 54.10 C ATOM 499 C SER A 35 -83.676 19.954 34.202 1.00 52.51 C ATOM 500 O SER A 35 -84.233 18.897 34.513 1.00 31.11 O ATOM 501 CB SER A 35 -84.366 21.754 35.798 1.00 61.45 C ATOM 502 OG SER A 35 -85.024 23.002 35.960 1.00 3.21 O ATOM 0 H SER A 35 -86.329 20.473 34.442 1.00 12.34 H new ATOM 0 HA SER A 35 -83.912 22.033 33.720 1.00 54.10 H new ATOM 0 HB2 SER A 35 -84.839 21.007 36.435 1.00 61.45 H new ATOM 0 HB3 SER A 35 -83.330 21.842 36.125 1.00 61.45 H new ATOM 0 HG SER A 35 -84.983 23.274 36.901 1.00 3.21 H new ATOM 508 N ALA A 36 -82.440 20.003 33.724 1.00 60.13 N ATOM 509 CA ALA A 36 -81.631 18.804 33.568 1.00 1.14 C ATOM 510 C ALA A 36 -80.228 19.030 34.108 1.00 51.20 C ATOM 511 O ALA A 36 -79.538 19.972 33.710 1.00 71.04 O ATOM 512 CB ALA A 36 -81.579 18.372 32.108 1.00 60.35 C ATOM 0 H ALA A 36 -81.975 20.864 33.437 1.00 60.13 H new ATOM 0 HA ALA A 36 -82.096 18.004 34.144 1.00 1.14 H new ATOM 0 HB1 ALA A 36 -80.969 17.474 32.016 1.00 60.35 H new ATOM 0 HB2 ALA A 36 -82.589 18.163 31.754 1.00 60.35 H new ATOM 0 HB3 ALA A 36 -81.143 19.170 31.508 1.00 60.35 H new ATOM 518 N TYR A 37 -79.818 18.166 35.020 1.00 12.22 N ATOM 519 CA TYR A 37 -78.488 18.222 35.592 1.00 23.25 C ATOM 520 C TYR A 37 -77.852 16.842 35.524 1.00 72.00 C ATOM 521 O TYR A 37 -78.391 15.874 36.062 1.00 0.24 O ATOM 522 CB TYR A 37 -78.564 18.727 37.046 1.00 72.24 C ATOM 523 CG TYR A 37 -77.220 18.866 37.737 1.00 12.52 C ATOM 524 CD1 TYR A 37 -76.430 19.986 37.531 1.00 41.35 C ATOM 525 CD2 TYR A 37 -76.747 17.877 38.597 1.00 70.15 C ATOM 526 CE1 TYR A 37 -75.206 20.118 38.158 1.00 3.45 C ATOM 527 CE2 TYR A 37 -75.527 18.003 39.226 1.00 42.31 C ATOM 528 CZ TYR A 37 -74.758 19.125 39.003 1.00 52.32 C ATOM 529 OH TYR A 37 -73.541 19.256 39.628 1.00 72.12 O ATOM 0 H TYR A 37 -80.397 17.409 35.383 1.00 12.22 H new ATOM 0 HA TYR A 37 -77.870 18.918 35.025 1.00 23.25 H new ATOM 0 HB2 TYR A 37 -79.064 19.695 37.055 1.00 72.24 H new ATOM 0 HB3 TYR A 37 -79.185 18.042 37.623 1.00 72.24 H new ATOM 0 HD1 TYR A 37 -76.776 20.767 36.871 1.00 41.35 H new ATOM 0 HD2 TYR A 37 -77.347 16.996 38.774 1.00 70.15 H new ATOM 0 HE1 TYR A 37 -74.602 20.997 37.987 1.00 3.45 H new ATOM 0 HE2 TYR A 37 -75.176 17.227 39.890 1.00 42.31 H new ATOM 0 HH TYR A 37 -73.375 18.470 40.189 1.00 72.12 H new ATOM 539 N ALA A 38 -76.724 16.747 34.842 1.00 15.12 N ATOM 540 CA ALA A 38 -75.957 15.517 34.830 1.00 32.45 C ATOM 541 C ALA A 38 -74.817 15.622 35.820 1.00 54.13 C ATOM 542 O ALA A 38 -74.216 16.692 35.976 1.00 34.23 O ATOM 543 CB ALA A 38 -75.428 15.214 33.444 1.00 15.44 C ATOM 0 H ALA A 38 -76.321 17.505 34.291 1.00 15.12 H new ATOM 0 HA ALA A 38 -76.613 14.696 35.119 1.00 32.45 H new ATOM 0 HB1 ALA A 38 -74.857 14.286 33.467 1.00 15.44 H new ATOM 0 HB2 ALA A 38 -76.263 15.109 32.751 1.00 15.44 H new ATOM 0 HB3 ALA A 38 -74.783 16.029 33.115 1.00 15.44 H new ATOM 549 N VAL A 39 -74.533 14.522 36.495 1.00 51.23 N ATOM 550 CA VAL A 39 -73.496 14.497 37.512 1.00 34.01 C ATOM 551 C VAL A 39 -72.149 14.158 36.873 1.00 45.11 C ATOM 552 O VAL A 39 -71.810 12.991 36.674 1.00 44.23 O ATOM 553 CB VAL A 39 -73.825 13.491 38.650 1.00 42.11 C ATOM 554 CG1 VAL A 39 -72.858 13.653 39.815 1.00 15.54 C ATOM 555 CG2 VAL A 39 -75.266 13.656 39.126 1.00 13.53 C ATOM 0 H VAL A 39 -75.008 13.630 36.356 1.00 51.23 H new ATOM 0 HA VAL A 39 -73.444 15.489 37.961 1.00 34.01 H new ATOM 0 HB VAL A 39 -73.711 12.484 38.247 1.00 42.11 H new ATOM 0 HG11 VAL A 39 -73.109 12.938 40.598 1.00 15.54 H new ATOM 0 HG12 VAL A 39 -71.840 13.471 39.471 1.00 15.54 H new ATOM 0 HG13 VAL A 39 -72.932 14.666 40.211 1.00 15.54 H new ATOM 0 HG21 VAL A 39 -75.470 12.940 39.922 1.00 13.53 H new ATOM 0 HG22 VAL A 39 -75.411 14.669 39.502 1.00 13.53 H new ATOM 0 HG23 VAL A 39 -75.947 13.477 38.294 1.00 13.53 H new ATOM 565 N ASN A 40 -71.421 15.194 36.496 1.00 13.00 N ATOM 566 CA ASN A 40 -70.070 15.040 35.982 1.00 41.32 C ATOM 567 C ASN A 40 -69.079 15.465 37.060 1.00 33.31 C ATOM 568 O ASN A 40 -69.058 16.635 37.451 1.00 13.40 O ATOM 569 CB ASN A 40 -69.866 15.861 34.701 1.00 25.42 C ATOM 570 CG ASN A 40 -70.536 15.241 33.487 1.00 23.43 C ATOM 571 OD1 ASN A 40 -70.608 14.018 33.357 1.00 34.04 O ATOM 572 ND2 ASN A 40 -71.042 16.079 32.599 1.00 43.31 N ATOM 0 H ASN A 40 -71.746 16.160 36.537 1.00 13.00 H new ATOM 0 HA ASN A 40 -69.903 13.994 35.725 1.00 41.32 H new ATOM 0 HB2 ASN A 40 -70.260 16.866 34.853 1.00 25.42 H new ATOM 0 HB3 ASN A 40 -68.798 15.963 34.507 1.00 25.42 H new ATOM 0 HD21 ASN A 40 -71.513 15.719 31.769 1.00 43.31 H new ATOM 0 HD22 ASN A 40 -70.961 17.085 32.744 1.00 43.31 H new ATOM 579 N PRO A 41 -68.279 14.508 37.589 1.00 21.34 N ATOM 580 CA PRO A 41 -67.341 14.755 38.703 1.00 60.13 C ATOM 581 C PRO A 41 -66.192 15.702 38.331 1.00 65.13 C ATOM 582 O PRO A 41 -66.184 16.862 38.749 1.00 75.31 O ATOM 583 CB PRO A 41 -66.809 13.351 39.051 1.00 3.14 C ATOM 584 CG PRO A 41 -67.745 12.398 38.388 1.00 11.33 C ATOM 585 CD PRO A 41 -68.233 13.101 37.159 1.00 23.41 C ATOM 0 HA PRO A 41 -67.837 15.253 39.536 1.00 60.13 H new ATOM 0 HB2 PRO A 41 -65.790 13.216 38.689 1.00 3.14 H new ATOM 0 HB3 PRO A 41 -66.788 13.195 40.130 1.00 3.14 H new ATOM 0 HG2 PRO A 41 -67.240 11.467 38.132 1.00 11.33 H new ATOM 0 HG3 PRO A 41 -68.574 12.140 39.047 1.00 11.33 H new ATOM 0 HD2 PRO A 41 -67.558 12.957 36.315 1.00 23.41 H new ATOM 0 HD3 PRO A 41 -69.213 12.740 36.848 1.00 23.41 H new ATOM 593 N GLU A 42 -65.235 15.211 37.538 1.00 73.13 N ATOM 594 CA GLU A 42 -64.067 15.990 37.139 1.00 31.12 C ATOM 595 C GLU A 42 -63.736 15.729 35.667 1.00 54.30 C ATOM 596 O GLU A 42 -64.481 15.037 34.965 1.00 4.51 O ATOM 597 CB GLU A 42 -62.856 15.629 38.020 1.00 3.32 C ATOM 598 CG GLU A 42 -62.979 16.056 39.483 1.00 23.12 C ATOM 599 CD GLU A 42 -61.850 15.542 40.347 1.00 2.04 C ATOM 600 OE1 GLU A 42 -61.909 14.375 40.775 1.00 63.04 O ATOM 601 OE2 GLU A 42 -60.911 16.310 40.626 1.00 74.01 O ATOM 0 H GLU A 42 -65.251 14.265 37.157 1.00 73.13 H new ATOM 0 HA GLU A 42 -64.295 17.048 37.270 1.00 31.12 H new ATOM 0 HB2 GLU A 42 -62.705 14.550 37.982 1.00 3.32 H new ATOM 0 HB3 GLU A 42 -61.965 16.090 37.595 1.00 3.32 H new ATOM 0 HG2 GLU A 42 -63.003 17.144 39.537 1.00 23.12 H new ATOM 0 HG3 GLU A 42 -63.927 15.696 39.882 1.00 23.12 H new ATOM 608 N ALA A 43 -62.623 16.292 35.210 1.00 44.10 N ATOM 609 CA ALA A 43 -62.118 16.040 33.869 1.00 72.42 C ATOM 610 C ALA A 43 -61.131 14.878 33.901 1.00 13.22 C ATOM 611 O ALA A 43 -60.503 14.617 34.935 1.00 13.24 O ATOM 612 CB ALA A 43 -61.463 17.294 33.299 1.00 55.12 C ATOM 0 H ALA A 43 -62.049 16.933 35.757 1.00 44.10 H new ATOM 0 HA ALA A 43 -62.951 15.773 33.219 1.00 72.42 H new ATOM 0 HB1 ALA A 43 -61.091 17.086 32.296 1.00 55.12 H new ATOM 0 HB2 ALA A 43 -62.196 18.099 33.255 1.00 55.12 H new ATOM 0 HB3 ALA A 43 -60.633 17.594 33.939 1.00 55.12 H new ATOM 618 N GLY A 44 -61.003 14.179 32.777 1.00 20.54 N ATOM 619 CA GLY A 44 -60.110 13.036 32.696 1.00 23.25 C ATOM 620 C GLY A 44 -58.703 13.420 32.295 1.00 42.54 C ATOM 621 O GLY A 44 -58.294 13.204 31.152 1.00 61.45 O ATOM 0 H GLY A 44 -61.506 14.386 31.914 1.00 20.54 H new ATOM 0 HA2 GLY A 44 -60.083 12.532 33.662 1.00 23.25 H new ATOM 0 HA3 GLY A 44 -60.506 12.321 31.975 1.00 23.25 H new ATOM 625 N SER A 45 -57.965 13.997 33.240 1.00 32.32 N ATOM 626 CA SER A 45 -56.566 14.341 33.034 1.00 34.43 C ATOM 627 C SER A 45 -55.683 13.170 33.476 1.00 43.41 C ATOM 628 O SER A 45 -55.103 13.173 34.566 1.00 2.30 O ATOM 629 CB SER A 45 -56.224 15.624 33.803 1.00 60.13 C ATOM 630 OG SER A 45 -54.912 16.074 33.517 1.00 60.05 O ATOM 0 H SER A 45 -58.321 14.237 34.165 1.00 32.32 H new ATOM 0 HA SER A 45 -56.382 14.528 31.976 1.00 34.43 H new ATOM 0 HB2 SER A 45 -56.940 16.404 33.545 1.00 60.13 H new ATOM 0 HB3 SER A 45 -56.321 15.443 34.873 1.00 60.13 H new ATOM 0 HG SER A 45 -54.730 16.893 34.023 1.00 60.05 H new ATOM 636 N MET A 46 -55.651 12.135 32.645 1.00 4.43 N ATOM 637 CA MET A 46 -54.960 10.894 32.964 1.00 5.54 C ATOM 638 C MET A 46 -54.059 10.519 31.801 1.00 42.11 C ATOM 639 O MET A 46 -54.536 10.143 30.726 1.00 10.45 O ATOM 640 CB MET A 46 -55.976 9.774 33.256 1.00 55.21 C ATOM 641 CG MET A 46 -56.857 10.035 34.470 1.00 53.02 C ATOM 642 SD MET A 46 -58.185 8.835 34.663 1.00 34.22 S ATOM 643 CE MET A 46 -59.013 9.511 36.098 1.00 20.10 C ATOM 0 H MET A 46 -56.104 12.134 31.731 1.00 4.43 H new ATOM 0 HA MET A 46 -54.352 11.031 33.858 1.00 5.54 H new ATOM 0 HB2 MET A 46 -56.612 9.638 32.381 1.00 55.21 H new ATOM 0 HB3 MET A 46 -55.437 8.839 33.406 1.00 55.21 H new ATOM 0 HG2 MET A 46 -56.238 10.028 35.367 1.00 53.02 H new ATOM 0 HG3 MET A 46 -57.288 11.033 34.389 1.00 53.02 H new ATOM 0 HE1 MET A 46 -59.867 8.884 36.355 1.00 20.10 H new ATOM 0 HE2 MET A 46 -58.319 9.541 36.938 1.00 20.10 H new ATOM 0 HE3 MET A 46 -59.359 10.521 35.877 1.00 20.10 H new ATOM 653 N ASP A 47 -52.763 10.665 32.018 1.00 54.33 N ATOM 654 CA ASP A 47 -51.773 10.507 30.966 1.00 40.41 C ATOM 655 C ASP A 47 -50.513 9.845 31.520 1.00 70.32 C ATOM 656 O ASP A 47 -49.905 10.339 32.474 1.00 10.53 O ATOM 657 CB ASP A 47 -51.462 11.884 30.359 1.00 75.31 C ATOM 658 CG ASP A 47 -50.405 11.850 29.271 1.00 45.43 C ATOM 659 OD1 ASP A 47 -50.701 11.386 28.158 1.00 1.13 O ATOM 660 OD2 ASP A 47 -49.271 12.290 29.532 1.00 41.01 O ATOM 0 H ASP A 47 -52.367 10.897 32.929 1.00 54.33 H new ATOM 0 HA ASP A 47 -52.165 9.859 30.182 1.00 40.41 H new ATOM 0 HB2 ASP A 47 -52.380 12.305 29.948 1.00 75.31 H new ATOM 0 HB3 ASP A 47 -51.132 12.554 31.153 1.00 75.31 H new ATOM 665 N TYR A 48 -50.138 8.726 30.914 1.00 23.41 N ATOM 666 CA TYR A 48 -48.969 7.967 31.330 1.00 50.33 C ATOM 667 C TYR A 48 -48.175 7.497 30.109 1.00 13.55 C ATOM 668 O TYR A 48 -48.692 6.787 29.244 1.00 41.02 O ATOM 669 CB TYR A 48 -49.410 6.783 32.224 1.00 42.14 C ATOM 670 CG TYR A 48 -48.358 5.718 32.459 1.00 11.34 C ATOM 671 CD1 TYR A 48 -47.152 6.009 33.087 1.00 63.31 C ATOM 672 CD2 TYR A 48 -48.569 4.418 32.023 1.00 0.22 C ATOM 673 CE1 TYR A 48 -46.193 5.037 33.272 1.00 13.13 C ATOM 674 CE2 TYR A 48 -47.615 3.443 32.203 1.00 43.14 C ATOM 675 CZ TYR A 48 -46.430 3.756 32.826 1.00 51.11 C ATOM 676 OH TYR A 48 -45.472 2.787 32.996 1.00 75.03 O ATOM 0 H TYR A 48 -50.636 8.321 30.121 1.00 23.41 H new ATOM 0 HA TYR A 48 -48.308 8.605 31.917 1.00 50.33 H new ATOM 0 HB2 TYR A 48 -49.725 7.177 33.190 1.00 42.14 H new ATOM 0 HB3 TYR A 48 -50.283 6.313 31.771 1.00 42.14 H new ATOM 0 HD1 TYR A 48 -46.964 7.014 33.436 1.00 63.31 H new ATOM 0 HD2 TYR A 48 -49.498 4.167 31.534 1.00 0.22 H new ATOM 0 HE1 TYR A 48 -45.262 5.278 33.763 1.00 13.13 H new ATOM 0 HE2 TYR A 48 -47.796 2.436 31.856 1.00 43.14 H new ATOM 0 HH TYR A 48 -45.796 1.939 32.627 1.00 75.03 H new ATOM 686 N MET A 49 -46.911 7.898 30.061 1.00 22.33 N ATOM 687 CA MET A 49 -46.000 7.466 29.015 1.00 71.33 C ATOM 688 C MET A 49 -44.586 7.328 29.582 1.00 43.12 C ATOM 689 O MET A 49 -43.969 8.325 29.960 1.00 51.03 O ATOM 690 CB MET A 49 -46.016 8.459 27.846 1.00 52.31 C ATOM 691 CG MET A 49 -45.189 8.013 26.648 1.00 35.41 C ATOM 692 SD MET A 49 -45.319 9.137 25.246 1.00 40.50 S ATOM 693 CE MET A 49 -47.079 9.064 24.917 1.00 62.51 C ATOM 0 H MET A 49 -46.492 8.529 30.744 1.00 22.33 H new ATOM 0 HA MET A 49 -46.326 6.495 28.642 1.00 71.33 H new ATOM 0 HB2 MET A 49 -47.047 8.613 27.527 1.00 52.31 H new ATOM 0 HB3 MET A 49 -45.643 9.422 28.195 1.00 52.31 H new ATOM 0 HG2 MET A 49 -44.144 7.931 26.945 1.00 35.41 H new ATOM 0 HG3 MET A 49 -45.512 7.018 26.341 1.00 35.41 H new ATOM 0 HE1 MET A 49 -47.266 9.333 23.877 1.00 62.51 H new ATOM 0 HE2 MET A 49 -47.442 8.053 25.101 1.00 62.51 H new ATOM 0 HE3 MET A 49 -47.601 9.762 25.572 1.00 62.51 H new ATOM 703 N PRO A 50 -44.062 6.085 29.680 1.00 61.03 N ATOM 704 CA PRO A 50 -42.703 5.838 30.178 1.00 20.41 C ATOM 705 C PRO A 50 -41.609 6.045 29.105 1.00 11.41 C ATOM 706 O PRO A 50 -41.907 6.226 27.916 1.00 13.01 O ATOM 707 CB PRO A 50 -42.773 4.380 30.634 1.00 21.51 C ATOM 708 CG PRO A 50 -43.786 3.739 29.748 1.00 72.11 C ATOM 709 CD PRO A 50 -44.760 4.819 29.347 1.00 64.13 C ATOM 0 HA PRO A 50 -42.420 6.536 30.966 1.00 20.41 H new ATOM 0 HB2 PRO A 50 -41.803 3.892 30.540 1.00 21.51 H new ATOM 0 HB3 PRO A 50 -43.066 4.309 31.682 1.00 21.51 H new ATOM 0 HG2 PRO A 50 -43.310 3.302 28.870 1.00 72.11 H new ATOM 0 HG3 PRO A 50 -44.299 2.930 30.269 1.00 72.11 H new ATOM 0 HD2 PRO A 50 -44.999 4.764 28.285 1.00 64.13 H new ATOM 0 HD3 PRO A 50 -45.700 4.728 29.891 1.00 64.13 H new ATOM 717 N LEU A 51 -40.349 6.024 29.539 1.00 1.11 N ATOM 718 CA LEU A 51 -39.208 6.297 28.665 1.00 52.04 C ATOM 719 C LEU A 51 -38.128 5.219 28.815 1.00 62.54 C ATOM 720 O LEU A 51 -37.678 4.929 29.926 1.00 14.32 O ATOM 721 CB LEU A 51 -38.627 7.679 29.013 1.00 42.32 C ATOM 722 CG LEU A 51 -37.365 8.100 28.248 1.00 30.23 C ATOM 723 CD1 LEU A 51 -37.688 8.469 26.811 1.00 13.32 C ATOM 724 CD2 LEU A 51 -36.680 9.253 28.960 1.00 23.34 C ATOM 0 H LEU A 51 -40.091 5.818 30.504 1.00 1.11 H new ATOM 0 HA LEU A 51 -39.547 6.288 27.629 1.00 52.04 H new ATOM 0 HB2 LEU A 51 -39.399 8.428 28.838 1.00 42.32 H new ATOM 0 HB3 LEU A 51 -38.402 7.697 30.079 1.00 42.32 H new ATOM 0 HG LEU A 51 -36.683 7.250 28.223 1.00 30.23 H new ATOM 0 HD11 LEU A 51 -36.773 8.763 26.296 1.00 13.32 H new ATOM 0 HD12 LEU A 51 -38.129 7.610 26.305 1.00 13.32 H new ATOM 0 HD13 LEU A 51 -38.394 9.300 26.798 1.00 13.32 H new ATOM 0 HD21 LEU A 51 -35.786 9.542 28.407 1.00 23.34 H new ATOM 0 HD22 LEU A 51 -37.362 10.102 29.017 1.00 23.34 H new ATOM 0 HD23 LEU A 51 -36.400 8.944 29.967 1.00 23.34 H new ATOM 736 N MET A 52 -37.747 4.609 27.693 1.00 51.33 N ATOM 737 CA MET A 52 -36.594 3.705 27.643 1.00 31.22 C ATOM 738 C MET A 52 -35.679 4.077 26.487 1.00 73.33 C ATOM 739 O MET A 52 -36.046 3.929 25.319 1.00 3.43 O ATOM 740 CB MET A 52 -37.012 2.236 27.499 1.00 34.42 C ATOM 741 CG MET A 52 -37.335 1.542 28.807 1.00 62.11 C ATOM 742 SD MET A 52 -37.843 -0.170 28.569 1.00 42.04 S ATOM 743 CE MET A 52 -38.280 -0.627 30.243 1.00 54.52 C ATOM 0 H MET A 52 -38.223 4.725 26.799 1.00 51.33 H new ATOM 0 HA MET A 52 -36.066 3.816 28.590 1.00 31.22 H new ATOM 0 HB2 MET A 52 -37.885 2.182 26.849 1.00 34.42 H new ATOM 0 HB3 MET A 52 -36.210 1.691 27.002 1.00 34.42 H new ATOM 0 HG2 MET A 52 -36.460 1.572 29.457 1.00 62.11 H new ATOM 0 HG3 MET A 52 -38.130 2.086 29.317 1.00 62.11 H new ATOM 0 HE1 MET A 52 -38.616 -1.664 30.261 1.00 54.52 H new ATOM 0 HE2 MET A 52 -37.409 -0.516 30.889 1.00 54.52 H new ATOM 0 HE3 MET A 52 -39.081 0.020 30.599 1.00 54.52 H new ATOM 753 N GLU A 53 -34.497 4.574 26.818 1.00 74.11 N ATOM 754 CA GLU A 53 -33.498 4.894 25.812 1.00 71.51 C ATOM 755 C GLU A 53 -32.341 3.905 25.897 1.00 52.21 C ATOM 756 O GLU A 53 -32.026 3.389 26.977 1.00 50.40 O ATOM 757 CB GLU A 53 -32.993 6.341 25.967 1.00 33.21 C ATOM 758 CG GLU A 53 -32.383 6.656 27.329 1.00 41.55 C ATOM 759 CD GLU A 53 -31.713 8.008 27.368 1.00 53.45 C ATOM 760 OE1 GLU A 53 -30.558 8.110 26.916 1.00 55.55 O ATOM 761 OE2 GLU A 53 -32.332 8.967 27.860 1.00 33.22 O ATOM 0 H GLU A 53 -34.207 4.764 27.777 1.00 74.11 H new ATOM 0 HA GLU A 53 -33.961 4.812 24.829 1.00 71.51 H new ATOM 0 HB2 GLU A 53 -32.248 6.537 25.196 1.00 33.21 H new ATOM 0 HB3 GLU A 53 -33.824 7.023 25.789 1.00 33.21 H new ATOM 0 HG2 GLU A 53 -33.163 6.620 28.089 1.00 41.55 H new ATOM 0 HG3 GLU A 53 -31.654 5.886 27.583 1.00 41.55 H new ATOM 768 N TYR A 54 -31.735 3.617 24.763 1.00 40.41 N ATOM 769 CA TYR A 54 -30.582 2.732 24.720 1.00 72.43 C ATOM 770 C TYR A 54 -29.345 3.517 24.321 1.00 14.11 C ATOM 771 O TYR A 54 -29.435 4.696 23.978 1.00 62.43 O ATOM 772 CB TYR A 54 -30.812 1.568 23.745 1.00 50.51 C ATOM 773 CG TYR A 54 -31.980 0.680 24.119 1.00 1.23 C ATOM 774 CD1 TYR A 54 -32.008 0.015 25.338 1.00 73.22 C ATOM 775 CD2 TYR A 54 -33.053 0.518 23.260 1.00 22.44 C ATOM 776 CE1 TYR A 54 -33.076 -0.779 25.691 1.00 51.30 C ATOM 777 CE2 TYR A 54 -34.125 -0.280 23.602 1.00 45.31 C ATOM 778 CZ TYR A 54 -34.135 -0.924 24.822 1.00 71.15 C ATOM 779 OH TYR A 54 -35.210 -1.708 25.180 1.00 12.31 O ATOM 0 H TYR A 54 -32.021 3.983 23.855 1.00 40.41 H new ATOM 0 HA TYR A 54 -30.435 2.311 25.715 1.00 72.43 H new ATOM 0 HB2 TYR A 54 -30.979 1.971 22.746 1.00 50.51 H new ATOM 0 HB3 TYR A 54 -29.907 0.962 23.697 1.00 50.51 H new ATOM 0 HD1 TYR A 54 -31.178 0.123 26.021 1.00 73.22 H new ATOM 0 HD2 TYR A 54 -33.051 1.025 22.306 1.00 22.44 H new ATOM 0 HE1 TYR A 54 -33.083 -1.286 26.645 1.00 51.30 H new ATOM 0 HE2 TYR A 54 -34.952 -0.400 22.918 1.00 45.31 H new ATOM 0 HH TYR A 54 -35.872 -1.705 24.457 1.00 12.31 H new ATOM 789 N LEU A 55 -28.192 2.869 24.363 1.00 10.30 N ATOM 790 CA LEU A 55 -26.932 3.529 24.032 1.00 0.52 C ATOM 791 C LEU A 55 -26.617 3.354 22.553 1.00 20.11 C ATOM 792 O LEU A 55 -27.267 2.571 21.857 1.00 73.51 O ATOM 793 CB LEU A 55 -25.763 2.998 24.899 1.00 34.41 C ATOM 794 CG LEU A 55 -25.724 3.433 26.385 1.00 72.25 C ATOM 795 CD1 LEU A 55 -25.943 4.931 26.538 1.00 33.11 C ATOM 796 CD2 LEU A 55 -26.717 2.649 27.233 1.00 53.42 C ATOM 0 H LEU A 55 -28.099 1.887 24.623 1.00 10.30 H new ATOM 0 HA LEU A 55 -27.047 4.591 24.248 1.00 0.52 H new ATOM 0 HB2 LEU A 55 -25.788 1.909 24.867 1.00 34.41 H new ATOM 0 HB3 LEU A 55 -24.829 3.309 24.432 1.00 34.41 H new ATOM 0 HG LEU A 55 -24.724 3.203 26.753 1.00 72.25 H new ATOM 0 HD11 LEU A 55 -25.909 5.198 27.594 1.00 33.11 H new ATOM 0 HD12 LEU A 55 -25.161 5.470 26.002 1.00 33.11 H new ATOM 0 HD13 LEU A 55 -26.916 5.200 26.127 1.00 33.11 H new ATOM 0 HD21 LEU A 55 -26.657 2.985 28.268 1.00 53.42 H new ATOM 0 HD22 LEU A 55 -27.727 2.813 26.856 1.00 53.42 H new ATOM 0 HD23 LEU A 55 -26.479 1.586 27.183 1.00 53.42 H new ATOM 808 N HIS A 56 -25.636 4.098 22.070 1.00 20.43 N ATOM 809 CA HIS A 56 -25.211 3.990 20.677 1.00 3.24 C ATOM 810 C HIS A 56 -24.247 2.822 20.521 1.00 52.53 C ATOM 811 O HIS A 56 -23.148 2.837 21.082 1.00 50.21 O ATOM 812 CB HIS A 56 -24.560 5.292 20.172 1.00 70.54 C ATOM 813 CG HIS A 56 -25.504 6.456 20.060 1.00 65.35 C ATOM 814 ND1 HIS A 56 -25.157 7.737 20.413 1.00 23.21 N ATOM 815 CD2 HIS A 56 -26.782 6.526 19.620 1.00 21.11 C ATOM 816 CE1 HIS A 56 -26.175 8.546 20.201 1.00 40.15 C ATOM 817 NE2 HIS A 56 -27.176 7.838 19.718 1.00 61.13 N ATOM 0 H HIS A 56 -25.117 4.784 22.618 1.00 20.43 H new ATOM 0 HA HIS A 56 -26.099 3.814 20.069 1.00 3.24 H new ATOM 0 HB2 HIS A 56 -23.747 5.563 20.846 1.00 70.54 H new ATOM 0 HB3 HIS A 56 -24.115 5.106 19.195 1.00 70.54 H new ATOM 0 HD2 HIS A 56 -27.381 5.703 19.259 1.00 21.11 H new ATOM 0 HE1 HIS A 56 -26.187 9.609 20.391 1.00 40.15 H new ATOM 0 HE2 HIS A 56 -28.092 8.204 19.460 1.00 61.13 H new ATOM 826 N SER A 57 -24.692 1.801 19.796 1.00 54.31 N ATOM 827 CA SER A 57 -23.882 0.619 19.524 1.00 51.12 C ATOM 828 C SER A 57 -22.791 0.967 18.520 1.00 11.41 C ATOM 829 O SER A 57 -23.080 1.242 17.352 1.00 1.45 O ATOM 830 CB SER A 57 -24.763 -0.507 18.978 1.00 64.50 C ATOM 831 OG SER A 57 -25.945 -0.647 19.745 1.00 1.41 O ATOM 0 H SER A 57 -25.623 1.770 19.381 1.00 54.31 H new ATOM 0 HA SER A 57 -23.419 0.280 20.451 1.00 51.12 H new ATOM 0 HB2 SER A 57 -25.022 -0.299 17.940 1.00 64.50 H new ATOM 0 HB3 SER A 57 -24.207 -1.445 18.986 1.00 64.50 H new ATOM 0 HG SER A 57 -26.491 -1.371 19.375 1.00 1.41 H new ATOM 837 N SER A 58 -21.553 0.994 19.000 1.00 53.11 N ATOM 838 CA SER A 58 -20.417 1.427 18.204 1.00 30.22 C ATOM 839 C SER A 58 -19.922 0.309 17.284 1.00 72.54 C ATOM 840 O SER A 58 -19.505 -0.752 17.759 1.00 42.03 O ATOM 841 CB SER A 58 -19.307 1.909 19.138 1.00 0.33 C ATOM 842 OG SER A 58 -19.088 0.986 20.199 1.00 51.42 O ATOM 0 H SER A 58 -21.312 0.716 19.951 1.00 53.11 H new ATOM 0 HA SER A 58 -20.726 2.251 17.560 1.00 30.22 H new ATOM 0 HB2 SER A 58 -18.385 2.042 18.572 1.00 0.33 H new ATOM 0 HB3 SER A 58 -19.572 2.883 19.549 1.00 0.33 H new ATOM 0 HG SER A 58 -19.118 0.071 19.848 1.00 51.42 H new ATOM 848 N PRO A 59 -19.992 0.513 15.949 1.00 41.21 N ATOM 849 CA PRO A 59 -19.530 -0.479 14.984 1.00 10.35 C ATOM 850 C PRO A 59 -18.018 -0.449 14.770 1.00 2.43 C ATOM 851 O PRO A 59 -17.351 0.561 15.017 1.00 34.24 O ATOM 852 CB PRO A 59 -20.264 -0.092 13.703 1.00 42.04 C ATOM 853 CG PRO A 59 -20.460 1.382 13.804 1.00 10.22 C ATOM 854 CD PRO A 59 -20.549 1.708 15.273 1.00 24.31 C ATOM 0 HA PRO A 59 -19.735 -1.495 15.323 1.00 10.35 H new ATOM 0 HB2 PRO A 59 -19.682 -0.354 12.820 1.00 42.04 H new ATOM 0 HB3 PRO A 59 -21.218 -0.613 13.622 1.00 42.04 H new ATOM 0 HG2 PRO A 59 -19.631 1.915 13.339 1.00 10.22 H new ATOM 0 HG3 PRO A 59 -21.368 1.688 13.284 1.00 10.22 H new ATOM 0 HD2 PRO A 59 -19.979 2.604 15.517 1.00 24.31 H new ATOM 0 HD3 PRO A 59 -21.579 1.893 15.577 1.00 24.31 H new ATOM 862 N VAL A 60 -17.493 -1.570 14.320 1.00 15.43 N ATOM 863 CA VAL A 60 -16.085 -1.688 14.024 1.00 63.14 C ATOM 864 C VAL A 60 -15.864 -1.602 12.507 1.00 73.22 C ATOM 865 O VAL A 60 -16.536 -2.276 11.719 1.00 63.25 O ATOM 866 CB VAL A 60 -15.476 -2.976 14.662 1.00 60.52 C ATOM 867 CG1 VAL A 60 -16.137 -4.261 14.165 1.00 63.33 C ATOM 868 CG2 VAL A 60 -13.977 -3.037 14.452 1.00 24.30 C ATOM 0 H VAL A 60 -18.030 -2.420 14.151 1.00 15.43 H new ATOM 0 HA VAL A 60 -15.550 -0.854 14.478 1.00 63.14 H new ATOM 0 HB VAL A 60 -15.680 -2.907 15.730 1.00 60.52 H new ATOM 0 HG11 VAL A 60 -15.669 -5.120 14.646 1.00 63.33 H new ATOM 0 HG12 VAL A 60 -17.199 -4.242 14.410 1.00 63.33 H new ATOM 0 HG13 VAL A 60 -16.015 -4.339 13.085 1.00 63.33 H new ATOM 0 HG21 VAL A 60 -13.582 -3.945 14.908 1.00 24.30 H new ATOM 0 HG22 VAL A 60 -13.759 -3.043 13.384 1.00 24.30 H new ATOM 0 HG23 VAL A 60 -13.509 -2.167 14.913 1.00 24.30 H new ATOM 878 N LEU A 61 -14.989 -0.696 12.106 1.00 75.33 N ATOM 879 CA LEU A 61 -14.666 -0.492 10.698 1.00 4.15 C ATOM 880 C LEU A 61 -13.185 -0.817 10.452 1.00 44.01 C ATOM 881 O LEU A 61 -12.396 -0.836 11.405 1.00 11.52 O ATOM 882 CB LEU A 61 -15.076 0.941 10.176 1.00 15.33 C ATOM 883 CG LEU A 61 -14.889 2.223 11.048 1.00 4.34 C ATOM 884 CD1 LEU A 61 -15.943 2.352 12.142 1.00 73.22 C ATOM 885 CD2 LEU A 61 -13.501 2.319 11.653 1.00 12.15 C ATOM 0 H LEU A 61 -14.482 -0.081 12.742 1.00 75.33 H new ATOM 0 HA LEU A 61 -15.267 -1.184 10.108 1.00 4.15 H new ATOM 0 HB2 LEU A 61 -14.526 1.108 9.250 1.00 15.33 H new ATOM 0 HB3 LEU A 61 -16.133 0.890 9.914 1.00 15.33 H new ATOM 0 HG LEU A 61 -15.018 3.056 10.357 1.00 4.34 H new ATOM 0 HD11 LEU A 61 -15.763 3.261 12.716 1.00 73.22 H new ATOM 0 HD12 LEU A 61 -16.933 2.399 11.689 1.00 73.22 H new ATOM 0 HD13 LEU A 61 -15.888 1.488 12.804 1.00 73.22 H new ATOM 0 HD21 LEU A 61 -13.426 3.229 12.249 1.00 12.15 H new ATOM 0 HD22 LEU A 61 -13.321 1.452 12.289 1.00 12.15 H new ATOM 0 HD23 LEU A 61 -12.758 2.345 10.856 1.00 12.15 H new ATOM 897 N PRO A 62 -12.777 -1.121 9.191 1.00 3.41 N ATOM 898 CA PRO A 62 -11.389 -1.470 8.885 1.00 45.11 C ATOM 899 C PRO A 62 -10.426 -0.295 8.912 1.00 2.11 C ATOM 900 O PRO A 62 -10.813 0.865 9.092 1.00 34.43 O ATOM 901 CB PRO A 62 -11.438 -1.999 7.469 1.00 73.33 C ATOM 902 CG PRO A 62 -12.625 -1.353 6.862 1.00 1.24 C ATOM 903 CD PRO A 62 -13.618 -1.184 7.978 1.00 23.10 C ATOM 0 HA PRO A 62 -11.022 -2.170 9.635 1.00 45.11 H new ATOM 0 HB2 PRO A 62 -10.529 -1.749 6.922 1.00 73.33 H new ATOM 0 HB3 PRO A 62 -11.529 -3.085 7.456 1.00 73.33 H new ATOM 0 HG2 PRO A 62 -12.364 -0.390 6.422 1.00 1.24 H new ATOM 0 HG3 PRO A 62 -13.038 -1.967 6.062 1.00 1.24 H new ATOM 0 HD2 PRO A 62 -14.209 -0.277 7.854 1.00 23.10 H new ATOM 0 HD3 PRO A 62 -14.319 -2.018 8.020 1.00 23.10 H new ATOM 911 N THR A 63 -9.158 -0.622 8.728 1.00 32.31 N ATOM 912 CA THR A 63 -8.106 0.349 8.651 1.00 0.25 C ATOM 913 C THR A 63 -7.050 -0.148 7.669 1.00 22.11 C ATOM 914 O THR A 63 -6.480 -1.227 7.873 1.00 4.04 O ATOM 915 CB THR A 63 -7.448 0.591 10.022 1.00 21.12 C ATOM 916 OG1 THR A 63 -8.429 0.756 11.055 1.00 45.41 O ATOM 917 CG2 THR A 63 -6.612 1.832 9.946 1.00 62.40 C ATOM 0 H THR A 63 -8.837 -1.585 8.628 1.00 32.31 H new ATOM 0 HA THR A 63 -8.536 1.293 8.316 1.00 0.25 H new ATOM 0 HB THR A 63 -6.837 -0.278 10.266 1.00 21.12 H new ATOM 0 HG1 THR A 63 -7.979 0.906 11.913 1.00 45.41 H new ATOM 0 HG21 THR A 63 -6.141 2.013 10.912 1.00 62.40 H new ATOM 0 HG22 THR A 63 -5.842 1.706 9.185 1.00 62.40 H new ATOM 0 HG23 THR A 63 -7.244 2.681 9.686 1.00 62.40 H new ATOM 925 N ALA A 64 -6.806 0.604 6.608 1.00 54.10 N ATOM 926 CA ALA A 64 -5.768 0.261 5.655 1.00 13.50 C ATOM 927 C ALA A 64 -4.471 0.925 6.060 1.00 20.23 C ATOM 928 O ALA A 64 -4.283 2.120 5.856 1.00 61.34 O ATOM 929 CB ALA A 64 -6.165 0.675 4.254 1.00 2.34 C ATOM 0 H ALA A 64 -7.316 1.459 6.386 1.00 54.10 H new ATOM 0 HA ALA A 64 -5.631 -0.820 5.656 1.00 13.50 H new ATOM 0 HB1 ALA A 64 -5.371 0.408 3.557 1.00 2.34 H new ATOM 0 HB2 ALA A 64 -7.085 0.163 3.970 1.00 2.34 H new ATOM 0 HB3 ALA A 64 -6.326 1.753 4.225 1.00 2.34 H new ATOM 935 N ARG A 65 -3.588 0.140 6.645 1.00 0.11 N ATOM 936 CA ARG A 65 -2.305 0.627 7.121 1.00 44.01 C ATOM 937 C ARG A 65 -1.216 -0.242 6.548 1.00 23.41 C ATOM 938 O ARG A 65 -1.446 -1.422 6.339 1.00 64.13 O ATOM 939 CB ARG A 65 -2.233 0.597 8.655 1.00 4.31 C ATOM 940 CG ARG A 65 -3.002 1.707 9.339 1.00 1.41 C ATOM 941 CD ARG A 65 -2.817 1.667 10.845 1.00 35.33 C ATOM 942 NE ARG A 65 -1.402 1.724 11.229 1.00 5.34 N ATOM 943 CZ ARG A 65 -0.822 2.773 11.823 1.00 72.55 C ATOM 944 NH1 ARG A 65 -1.531 3.845 12.179 1.00 25.02 N ATOM 945 NH2 ARG A 65 0.477 2.740 12.070 1.00 21.31 N ATOM 0 H ARG A 65 -3.739 -0.856 6.805 1.00 0.11 H new ATOM 0 HA ARG A 65 -2.179 1.661 6.799 1.00 44.01 H new ATOM 0 HB2 ARG A 65 -2.614 -0.362 9.006 1.00 4.31 H new ATOM 0 HB3 ARG A 65 -1.188 0.655 8.959 1.00 4.31 H new ATOM 0 HG2 ARG A 65 -2.668 2.671 8.956 1.00 1.41 H new ATOM 0 HG3 ARG A 65 -4.062 1.618 9.099 1.00 1.41 H new ATOM 0 HD2 ARG A 65 -3.349 2.504 11.297 1.00 35.33 H new ATOM 0 HD3 ARG A 65 -3.263 0.754 11.240 1.00 35.33 H new ATOM 0 HE ARG A 65 -0.822 0.909 11.030 1.00 5.34 H new ATOM 0 HH11 ARG A 65 -2.535 3.875 11.999 1.00 25.02 H new ATOM 0 HH12 ARG A 65 -1.070 4.635 12.631 1.00 25.02 H new ATOM 0 HH21 ARG A 65 1.025 1.921 11.808 1.00 21.31 H new ATOM 0 HH22 ARG A 65 0.930 3.534 12.522 1.00 21.31 H new ATOM 959 N PHE A 66 -0.067 0.345 6.247 1.00 11.21 N ATOM 960 CA PHE A 66 1.088 -0.411 5.777 1.00 63.44 C ATOM 961 C PHE A 66 2.366 0.384 5.999 1.00 73.45 C ATOM 962 O PHE A 66 2.324 1.608 6.136 1.00 74.32 O ATOM 963 CB PHE A 66 0.958 -0.819 4.282 1.00 34.35 C ATOM 964 CG PHE A 66 0.955 0.305 3.275 1.00 72.44 C ATOM 965 CD1 PHE A 66 -0.099 1.206 3.202 1.00 74.42 C ATOM 966 CD2 PHE A 66 2.003 0.440 2.382 1.00 21.45 C ATOM 967 CE1 PHE A 66 -0.105 2.216 2.267 1.00 22.41 C ATOM 968 CE2 PHE A 66 1.999 1.445 1.441 1.00 2.34 C ATOM 969 CZ PHE A 66 0.943 2.333 1.387 1.00 0.24 C ATOM 0 H PHE A 66 0.092 1.350 6.320 1.00 11.21 H new ATOM 0 HA PHE A 66 1.130 -1.331 6.360 1.00 63.44 H new ATOM 0 HB2 PHE A 66 1.780 -1.492 4.039 1.00 34.35 H new ATOM 0 HB3 PHE A 66 0.035 -1.387 4.162 1.00 34.35 H new ATOM 0 HD1 PHE A 66 -0.927 1.113 3.889 1.00 74.42 H new ATOM 0 HD2 PHE A 66 2.833 -0.250 2.423 1.00 21.45 H new ATOM 0 HE1 PHE A 66 -0.929 2.913 2.226 1.00 22.41 H new ATOM 0 HE2 PHE A 66 2.821 1.539 0.746 1.00 2.34 H new ATOM 0 HZ PHE A 66 0.941 3.122 0.650 1.00 0.24 H new ATOM 979 N THR A 67 3.483 -0.316 6.046 1.00 4.13 N ATOM 980 CA THR A 67 4.777 0.322 6.051 1.00 62.10 C ATOM 981 C THR A 67 5.510 -0.015 4.753 1.00 3.51 C ATOM 982 O THR A 67 5.436 -1.143 4.245 1.00 20.31 O ATOM 983 CB THR A 67 5.627 -0.055 7.307 1.00 21.51 C ATOM 984 OG1 THR A 67 6.871 0.650 7.300 1.00 11.45 O ATOM 985 CG2 THR A 67 5.906 -1.552 7.408 1.00 3.32 C ATOM 0 H THR A 67 3.515 -1.335 6.081 1.00 4.13 H new ATOM 0 HA THR A 67 4.626 1.400 6.110 1.00 62.10 H new ATOM 0 HB THR A 67 5.033 0.233 8.174 1.00 21.51 H new ATOM 0 HG1 THR A 67 7.391 0.404 8.094 1.00 11.45 H new ATOM 0 HG21 THR A 67 6.500 -1.752 8.300 1.00 3.32 H new ATOM 0 HG22 THR A 67 4.963 -2.094 7.471 1.00 3.32 H new ATOM 0 HG23 THR A 67 6.455 -1.880 6.525 1.00 3.32 H new ATOM 993 N SER A 68 6.146 0.989 4.189 1.00 72.24 N ATOM 994 CA SER A 68 7.017 0.800 3.054 1.00 21.03 C ATOM 995 C SER A 68 8.410 0.445 3.561 1.00 10.21 C ATOM 996 O SER A 68 8.788 0.872 4.656 1.00 32.44 O ATOM 997 CB SER A 68 7.036 2.071 2.205 1.00 34.12 C ATOM 998 OG SER A 68 7.311 3.222 2.991 1.00 63.20 O ATOM 0 H SER A 68 6.073 1.956 4.505 1.00 72.24 H new ATOM 0 HA SER A 68 6.657 -0.014 2.425 1.00 21.03 H new ATOM 0 HB2 SER A 68 7.789 1.975 1.423 1.00 34.12 H new ATOM 0 HB3 SER A 68 6.074 2.191 1.707 1.00 34.12 H new ATOM 0 HG SER A 68 8.193 3.578 2.753 1.00 63.20 H new ATOM 1004 N ASP A 69 9.149 -0.355 2.788 1.00 71.41 N ATOM 1005 CA ASP A 69 10.487 -0.798 3.185 1.00 44.12 C ATOM 1006 C ASP A 69 11.447 0.388 3.255 1.00 12.11 C ATOM 1007 O ASP A 69 12.064 0.639 4.292 1.00 54.34 O ATOM 1008 CB ASP A 69 11.008 -1.850 2.214 1.00 2.35 C ATOM 1009 CG ASP A 69 12.201 -2.581 2.766 1.00 25.24 C ATOM 1010 OD1 ASP A 69 11.996 -3.514 3.566 1.00 41.54 O ATOM 1011 OD2 ASP A 69 13.336 -2.241 2.403 1.00 44.20 O ATOM 0 H ASP A 69 8.842 -0.709 1.882 1.00 71.41 H new ATOM 0 HA ASP A 69 10.422 -1.245 4.177 1.00 44.12 H new ATOM 0 HB2 ASP A 69 10.215 -2.564 1.993 1.00 2.35 H new ATOM 0 HB3 ASP A 69 11.279 -1.372 1.272 1.00 2.35 H new ATOM 1016 N ILE A 70 11.545 1.124 2.154 1.00 1.10 N ATOM 1017 CA ILE A 70 12.181 2.431 2.165 1.00 4.53 C ATOM 1018 C ILE A 70 11.127 3.517 2.011 1.00 64.51 C ATOM 1019 O ILE A 70 10.054 3.281 1.453 1.00 4.44 O ATOM 1020 CB ILE A 70 13.301 2.585 1.078 1.00 12.13 C ATOM 1021 CG1 ILE A 70 12.829 2.180 -0.335 1.00 1.21 C ATOM 1022 CG2 ILE A 70 14.537 1.787 1.467 1.00 43.12 C ATOM 1023 CD1 ILE A 70 12.377 3.345 -1.202 1.00 33.05 C ATOM 0 H ILE A 70 11.191 0.835 1.242 1.00 1.10 H new ATOM 0 HA ILE A 70 12.681 2.536 3.128 1.00 4.53 H new ATOM 0 HB ILE A 70 13.550 3.645 1.038 1.00 12.13 H new ATOM 0 HG12 ILE A 70 13.642 1.659 -0.841 1.00 1.21 H new ATOM 0 HG13 ILE A 70 12.006 1.471 -0.241 1.00 1.21 H new ATOM 0 HG21 ILE A 70 15.303 1.906 0.701 1.00 43.12 H new ATOM 0 HG22 ILE A 70 14.919 2.150 2.421 1.00 43.12 H new ATOM 0 HG23 ILE A 70 14.276 0.733 1.558 1.00 43.12 H new ATOM 0 HD11 ILE A 70 12.062 2.972 -2.177 1.00 33.05 H new ATOM 0 HD12 ILE A 70 11.542 3.854 -0.721 1.00 33.05 H new ATOM 0 HD13 ILE A 70 13.203 4.045 -1.331 1.00 33.05 H new ATOM 1035 N THR A 71 11.424 4.692 2.525 1.00 71.40 N ATOM 1036 CA THR A 71 10.552 5.842 2.341 1.00 2.14 C ATOM 1037 C THR A 71 11.193 6.815 1.365 1.00 23.21 C ATOM 1038 O THR A 71 10.502 7.485 0.598 1.00 15.34 O ATOM 1039 CB THR A 71 10.243 6.544 3.678 1.00 60.53 C ATOM 1040 OG1 THR A 71 11.450 6.724 4.428 1.00 12.33 O ATOM 1041 CG2 THR A 71 9.250 5.742 4.506 1.00 52.53 C ATOM 0 H THR A 71 12.262 4.880 3.075 1.00 71.40 H new ATOM 0 HA THR A 71 9.604 5.489 1.935 1.00 2.14 H new ATOM 0 HB THR A 71 9.801 7.514 3.451 1.00 60.53 H new ATOM 0 HG1 THR A 71 11.245 7.172 5.275 1.00 12.33 H new ATOM 0 HG21 THR A 71 9.053 6.263 5.443 1.00 52.53 H new ATOM 0 HG22 THR A 71 8.319 5.630 3.950 1.00 52.53 H new ATOM 0 HG23 THR A 71 9.666 4.757 4.719 1.00 52.53 H new ATOM 1049 N GLU A 72 12.528 6.843 1.391 1.00 61.14 N ATOM 1050 CA GLU A 72 13.322 7.636 0.476 1.00 42.55 C ATOM 1051 C GLU A 72 14.725 7.029 0.368 1.00 3.03 C ATOM 1052 O GLU A 72 15.217 6.407 1.314 1.00 62.34 O ATOM 1053 CB GLU A 72 13.394 9.098 0.922 1.00 14.31 C ATOM 1054 CG GLU A 72 13.964 10.019 -0.146 1.00 2.32 C ATOM 1055 CD GLU A 72 14.103 11.442 0.312 1.00 52.13 C ATOM 1056 OE1 GLU A 72 14.809 11.685 1.302 1.00 61.23 O ATOM 1057 OE2 GLU A 72 13.512 12.331 -0.317 1.00 21.42 O ATOM 0 H GLU A 72 13.084 6.308 2.058 1.00 61.14 H new ATOM 0 HA GLU A 72 12.846 7.623 -0.504 1.00 42.55 H new ATOM 0 HB2 GLU A 72 12.395 9.439 1.192 1.00 14.31 H new ATOM 0 HB3 GLU A 72 14.008 9.168 1.820 1.00 14.31 H new ATOM 0 HG2 GLU A 72 14.941 9.646 -0.454 1.00 2.32 H new ATOM 0 HG3 GLU A 72 13.320 9.988 -1.025 1.00 2.32 H new ATOM 1064 N GLY A 73 15.333 7.194 -0.794 1.00 20.22 N ATOM 1065 CA GLY A 73 16.645 6.651 -1.063 1.00 5.50 C ATOM 1066 C GLY A 73 16.726 6.230 -2.502 1.00 65.03 C ATOM 1067 O GLY A 73 15.899 6.652 -3.292 1.00 23.11 O ATOM 0 H GLY A 73 14.927 7.709 -1.575 1.00 20.22 H new ATOM 0 HA2 GLY A 73 17.410 7.397 -0.847 1.00 5.50 H new ATOM 0 HA3 GLY A 73 16.838 5.798 -0.412 1.00 5.50 H new ATOM 1071 N PHE A 74 17.686 5.387 -2.849 1.00 34.25 N ATOM 1072 CA PHE A 74 17.777 4.852 -4.207 1.00 63.34 C ATOM 1073 C PHE A 74 16.688 3.793 -4.406 1.00 55.14 C ATOM 1074 O PHE A 74 16.322 3.120 -3.442 1.00 62.33 O ATOM 1075 CB PHE A 74 19.180 4.248 -4.474 1.00 20.04 C ATOM 1076 CG PHE A 74 19.556 3.063 -3.596 1.00 64.12 C ATOM 1077 CD1 PHE A 74 20.055 3.254 -2.313 1.00 3.22 C ATOM 1078 CD2 PHE A 74 19.409 1.758 -4.056 1.00 52.12 C ATOM 1079 CE1 PHE A 74 20.392 2.180 -1.513 1.00 54.51 C ATOM 1080 CE2 PHE A 74 19.747 0.681 -3.259 1.00 42.20 C ATOM 1081 CZ PHE A 74 20.237 0.893 -1.986 1.00 60.03 C ATOM 0 H PHE A 74 18.413 5.057 -2.214 1.00 34.25 H new ATOM 0 HA PHE A 74 17.627 5.664 -4.919 1.00 63.34 H new ATOM 0 HB2 PHE A 74 19.231 3.937 -5.517 1.00 20.04 H new ATOM 0 HB3 PHE A 74 19.926 5.031 -4.338 1.00 20.04 H new ATOM 0 HD1 PHE A 74 20.181 4.258 -1.936 1.00 3.22 H new ATOM 0 HD2 PHE A 74 19.025 1.584 -5.050 1.00 52.12 H new ATOM 0 HE1 PHE A 74 20.777 2.347 -0.518 1.00 54.51 H new ATOM 0 HE2 PHE A 74 19.628 -0.326 -3.632 1.00 42.20 H new ATOM 0 HZ PHE A 74 20.499 0.052 -1.361 1.00 60.03 H new ATOM 1091 N ALA A 75 16.126 3.718 -5.621 1.00 43.35 N ATOM 1092 CA ALA A 75 15.203 2.633 -6.001 1.00 40.24 C ATOM 1093 C ALA A 75 15.862 1.251 -5.894 1.00 73.02 C ATOM 1094 O ALA A 75 16.797 0.947 -6.639 1.00 12.54 O ATOM 1095 CB ALA A 75 14.678 2.854 -7.414 1.00 32.14 C ATOM 0 H ALA A 75 16.294 4.398 -6.362 1.00 43.35 H new ATOM 0 HA ALA A 75 14.370 2.656 -5.298 1.00 40.24 H new ATOM 0 HB1 ALA A 75 13.998 2.045 -7.680 1.00 32.14 H new ATOM 0 HB2 ALA A 75 14.147 3.805 -7.460 1.00 32.14 H new ATOM 0 HB3 ALA A 75 15.513 2.871 -8.114 1.00 32.14 H new ATOM 1101 N PRO A 76 15.407 0.410 -4.935 1.00 22.32 N ATOM 1102 CA PRO A 76 15.945 -0.932 -4.716 1.00 73.13 C ATOM 1103 C PRO A 76 15.249 -2.005 -5.567 1.00 2.42 C ATOM 1104 O PRO A 76 14.283 -1.726 -6.285 1.00 63.11 O ATOM 1105 CB PRO A 76 15.683 -1.168 -3.212 1.00 54.21 C ATOM 1106 CG PRO A 76 14.959 0.045 -2.720 1.00 1.02 C ATOM 1107 CD PRO A 76 14.375 0.697 -3.940 1.00 61.42 C ATOM 0 HA PRO A 76 16.994 -1.002 -5.002 1.00 73.13 H new ATOM 0 HB2 PRO A 76 15.087 -2.067 -3.057 1.00 54.21 H new ATOM 0 HB3 PRO A 76 16.619 -1.309 -2.671 1.00 54.21 H new ATOM 0 HG2 PRO A 76 14.178 -0.227 -2.010 1.00 1.02 H new ATOM 0 HG3 PRO A 76 15.638 0.722 -2.202 1.00 1.02 H new ATOM 0 HD2 PRO A 76 13.410 0.270 -4.213 1.00 61.42 H new ATOM 0 HD3 PRO A 76 14.223 1.767 -3.802 1.00 61.42 H new ATOM 1115 N LEU A 77 15.732 -3.238 -5.458 1.00 52.15 N ATOM 1116 CA LEU A 77 15.205 -4.346 -6.250 1.00 43.24 C ATOM 1117 C LEU A 77 14.254 -5.222 -5.426 1.00 52.43 C ATOM 1118 O LEU A 77 13.516 -6.037 -5.972 1.00 32.15 O ATOM 1119 CB LEU A 77 16.362 -5.169 -6.871 1.00 33.25 C ATOM 1120 CG LEU A 77 17.458 -5.685 -5.916 1.00 53.32 C ATOM 1121 CD1 LEU A 77 17.106 -7.050 -5.339 1.00 64.45 C ATOM 1122 CD2 LEU A 77 18.794 -5.744 -6.637 1.00 41.13 C ATOM 0 H LEU A 77 16.490 -3.497 -4.827 1.00 52.15 H new ATOM 0 HA LEU A 77 14.617 -3.931 -7.069 1.00 43.24 H new ATOM 0 HB2 LEU A 77 15.928 -6.029 -7.381 1.00 33.25 H new ATOM 0 HB3 LEU A 77 16.841 -4.555 -7.633 1.00 33.25 H new ATOM 0 HG LEU A 77 17.531 -4.985 -5.083 1.00 53.32 H new ATOM 0 HD11 LEU A 77 17.902 -7.379 -4.672 1.00 64.45 H new ATOM 0 HD12 LEU A 77 16.172 -6.980 -4.782 1.00 64.45 H new ATOM 0 HD13 LEU A 77 16.992 -7.769 -6.150 1.00 64.45 H new ATOM 0 HD21 LEU A 77 19.560 -6.110 -5.954 1.00 41.13 H new ATOM 0 HD22 LEU A 77 18.717 -6.418 -7.490 1.00 41.13 H new ATOM 0 HD23 LEU A 77 19.064 -4.747 -6.985 1.00 41.13 H new ATOM 1134 N SER A 78 14.302 -5.078 -4.115 1.00 5.02 N ATOM 1135 CA SER A 78 13.381 -5.778 -3.249 1.00 34.02 C ATOM 1136 C SER A 78 12.819 -4.810 -2.223 1.00 53.10 C ATOM 1137 O SER A 78 13.521 -4.367 -1.317 1.00 22.12 O ATOM 1138 CB SER A 78 14.083 -6.961 -2.574 1.00 50.03 C ATOM 1139 OG SER A 78 13.159 -7.802 -1.903 1.00 60.31 O ATOM 0 H SER A 78 14.971 -4.481 -3.629 1.00 5.02 H new ATOM 0 HA SER A 78 12.555 -6.177 -3.838 1.00 34.02 H new ATOM 0 HB2 SER A 78 14.625 -7.539 -3.323 1.00 50.03 H new ATOM 0 HB3 SER A 78 14.821 -6.590 -1.863 1.00 50.03 H new ATOM 0 HG SER A 78 13.639 -8.547 -1.485 1.00 60.31 H new ATOM 1145 N VAL A 79 11.563 -4.427 -2.425 1.00 1.14 N ATOM 1146 CA VAL A 79 10.862 -3.539 -1.506 1.00 23.23 C ATOM 1147 C VAL A 79 9.604 -4.236 -1.014 1.00 24.45 C ATOM 1148 O VAL A 79 8.566 -4.215 -1.680 1.00 60.10 O ATOM 1149 CB VAL A 79 10.486 -2.176 -2.161 1.00 12.03 C ATOM 1150 CG1 VAL A 79 9.873 -1.208 -1.153 1.00 15.32 C ATOM 1151 CG2 VAL A 79 11.693 -1.538 -2.808 1.00 0.35 C ATOM 0 H VAL A 79 11.005 -4.722 -3.226 1.00 1.14 H new ATOM 0 HA VAL A 79 11.533 -3.319 -0.676 1.00 23.23 H new ATOM 0 HB VAL A 79 9.738 -2.389 -2.925 1.00 12.03 H new ATOM 0 HG11 VAL A 79 9.626 -0.271 -1.652 1.00 15.32 H new ATOM 0 HG12 VAL A 79 8.967 -1.645 -0.733 1.00 15.32 H new ATOM 0 HG13 VAL A 79 10.587 -1.015 -0.353 1.00 15.32 H new ATOM 0 HG21 VAL A 79 11.405 -0.588 -3.258 1.00 0.35 H new ATOM 0 HG22 VAL A 79 12.461 -1.364 -2.054 1.00 0.35 H new ATOM 0 HG23 VAL A 79 12.085 -2.201 -3.579 1.00 0.35 H new ATOM 1161 N ARG A 80 9.717 -4.886 0.127 1.00 63.54 N ATOM 1162 CA ARG A 80 8.604 -5.627 0.705 1.00 30.30 C ATOM 1163 C ARG A 80 7.726 -4.707 1.541 1.00 13.23 C ATOM 1164 O ARG A 80 8.204 -3.998 2.430 1.00 64.31 O ATOM 1165 CB ARG A 80 9.078 -6.852 1.522 1.00 1.30 C ATOM 1166 CG ARG A 80 10.282 -6.622 2.432 1.00 42.21 C ATOM 1167 CD ARG A 80 11.605 -6.934 1.740 1.00 23.14 C ATOM 1168 NE ARG A 80 12.581 -5.870 1.949 1.00 73.25 N ATOM 1169 CZ ARG A 80 13.831 -5.887 1.497 1.00 42.32 C ATOM 1170 NH1 ARG A 80 14.316 -6.956 0.885 1.00 23.15 N ATOM 1171 NH2 ARG A 80 14.594 -4.825 1.683 1.00 32.21 N ATOM 0 H ARG A 80 10.574 -4.918 0.679 1.00 63.54 H new ATOM 0 HA ARG A 80 8.006 -6.016 -0.119 1.00 30.30 H new ATOM 0 HB2 ARG A 80 8.246 -7.200 2.134 1.00 1.30 H new ATOM 0 HB3 ARG A 80 9.321 -7.656 0.827 1.00 1.30 H new ATOM 0 HG2 ARG A 80 10.287 -5.585 2.768 1.00 42.21 H new ATOM 0 HG3 ARG A 80 10.185 -7.244 3.322 1.00 42.21 H new ATOM 0 HD2 ARG A 80 12.003 -7.874 2.121 1.00 23.14 H new ATOM 0 HD3 ARG A 80 11.435 -7.069 0.672 1.00 23.14 H new ATOM 0 HE ARG A 80 12.282 -5.053 2.481 1.00 73.25 H new ATOM 0 HH11 ARG A 80 13.729 -7.780 0.755 1.00 23.15 H new ATOM 0 HH12 ARG A 80 15.277 -6.956 0.543 1.00 23.15 H new ATOM 0 HH21 ARG A 80 14.222 -4.008 2.167 1.00 32.21 H new ATOM 0 HH22 ARG A 80 15.555 -4.822 1.342 1.00 32.21 H new ATOM 1185 N PHE A 81 6.447 -4.700 1.214 1.00 21.34 N ATOM 1186 CA PHE A 81 5.479 -3.892 1.922 1.00 52.32 C ATOM 1187 C PHE A 81 4.783 -4.743 2.966 1.00 45.23 C ATOM 1188 O PHE A 81 4.208 -5.784 2.645 1.00 55.22 O ATOM 1189 CB PHE A 81 4.452 -3.295 0.948 1.00 54.01 C ATOM 1190 CG PHE A 81 5.050 -2.392 -0.101 1.00 12.35 C ATOM 1191 CD1 PHE A 81 5.347 -1.070 0.193 1.00 33.44 C ATOM 1192 CD2 PHE A 81 5.317 -2.865 -1.382 1.00 22.14 C ATOM 1193 CE1 PHE A 81 5.896 -0.238 -0.766 1.00 75.34 C ATOM 1194 CE2 PHE A 81 5.866 -2.036 -2.342 1.00 23.42 C ATOM 1195 CZ PHE A 81 6.156 -0.721 -2.033 1.00 14.35 C ATOM 0 H PHE A 81 6.054 -5.253 0.453 1.00 21.34 H new ATOM 0 HA PHE A 81 5.996 -3.067 2.413 1.00 52.32 H new ATOM 0 HB2 PHE A 81 3.922 -4.108 0.452 1.00 54.01 H new ATOM 0 HB3 PHE A 81 3.712 -2.732 1.517 1.00 54.01 H new ATOM 0 HD1 PHE A 81 5.147 -0.685 1.182 1.00 33.44 H new ATOM 0 HD2 PHE A 81 5.093 -3.892 -1.629 1.00 22.14 H new ATOM 0 HE1 PHE A 81 6.121 0.790 -0.524 1.00 75.34 H new ATOM 0 HE2 PHE A 81 6.068 -2.416 -3.333 1.00 23.42 H new ATOM 0 HZ PHE A 81 6.586 -0.072 -2.782 1.00 14.35 H new ATOM 1205 N LYS A 82 4.853 -4.301 4.208 1.00 40.01 N ATOM 1206 CA LYS A 82 4.216 -5.008 5.305 1.00 64.21 C ATOM 1207 C LYS A 82 2.893 -4.332 5.626 1.00 51.21 C ATOM 1208 O LYS A 82 2.876 -3.182 6.059 1.00 53.20 O ATOM 1209 CB LYS A 82 5.131 -5.021 6.542 1.00 12.14 C ATOM 1210 CG LYS A 82 4.572 -5.745 7.773 1.00 33.12 C ATOM 1211 CD LYS A 82 4.803 -7.254 7.739 1.00 20.22 C ATOM 1212 CE LYS A 82 3.771 -7.999 6.895 1.00 13.31 C ATOM 1213 NZ LYS A 82 2.402 -7.896 7.468 1.00 12.14 N ATOM 0 H LYS A 82 5.347 -3.452 4.484 1.00 40.01 H new ATOM 0 HA LYS A 82 4.033 -6.042 5.014 1.00 64.21 H new ATOM 0 HB2 LYS A 82 6.077 -5.488 6.267 1.00 12.14 H new ATOM 0 HB3 LYS A 82 5.352 -3.990 6.819 1.00 12.14 H new ATOM 0 HG2 LYS A 82 5.034 -5.333 8.670 1.00 33.12 H new ATOM 0 HG3 LYS A 82 3.502 -5.549 7.847 1.00 33.12 H new ATOM 0 HD2 LYS A 82 5.799 -7.454 7.344 1.00 20.22 H new ATOM 0 HD3 LYS A 82 4.779 -7.642 8.757 1.00 20.22 H new ATOM 0 HE2 LYS A 82 3.771 -7.595 5.883 1.00 13.31 H new ATOM 0 HE3 LYS A 82 4.054 -9.049 6.820 1.00 13.31 H new ATOM 0 HZ1 LYS A 82 1.790 -8.619 7.038 1.00 12.14 H new ATOM 0 HZ2 LYS A 82 2.444 -8.046 8.496 1.00 12.14 H new ATOM 0 HZ3 LYS A 82 2.013 -6.952 7.271 1.00 12.14 H new ATOM 1227 N ASP A 83 1.791 -5.039 5.422 1.00 21.34 N ATOM 1228 CA ASP A 83 0.483 -4.460 5.656 1.00 23.21 C ATOM 1229 C ASP A 83 0.049 -4.694 7.094 1.00 73.24 C ATOM 1230 O ASP A 83 0.378 -5.710 7.709 1.00 23.15 O ATOM 1231 CB ASP A 83 -0.559 -4.983 4.656 1.00 31.23 C ATOM 1232 CG ASP A 83 -1.111 -6.359 4.974 1.00 41.12 C ATOM 1233 OD1 ASP A 83 -0.384 -7.350 4.803 1.00 34.13 O ATOM 1234 OD2 ASP A 83 -2.284 -6.445 5.388 1.00 53.14 O ATOM 0 H ASP A 83 1.779 -6.006 5.098 1.00 21.34 H new ATOM 0 HA ASP A 83 0.557 -3.384 5.495 1.00 23.21 H new ATOM 0 HB2 ASP A 83 -1.387 -4.276 4.613 1.00 31.23 H new ATOM 0 HB3 ASP A 83 -0.109 -5.008 3.664 1.00 31.23 H new ATOM 1239 N PHE A 84 -0.630 -3.709 7.625 1.00 30.13 N ATOM 1240 CA PHE A 84 -1.118 -3.709 8.995 1.00 33.05 C ATOM 1241 C PHE A 84 -2.617 -3.437 8.992 1.00 43.10 C ATOM 1242 O PHE A 84 -3.148 -2.751 9.879 1.00 53.35 O ATOM 1243 CB PHE A 84 -0.387 -2.646 9.829 1.00 54.21 C ATOM 1244 CG PHE A 84 1.057 -2.953 10.099 1.00 74.24 C ATOM 1245 CD1 PHE A 84 1.409 -3.977 10.967 1.00 43.05 C ATOM 1246 CD2 PHE A 84 2.058 -2.215 9.497 1.00 21.00 C ATOM 1247 CE1 PHE A 84 2.733 -4.256 11.226 1.00 73.14 C ATOM 1248 CE2 PHE A 84 3.385 -2.489 9.757 1.00 2.12 C ATOM 1249 CZ PHE A 84 3.724 -3.509 10.621 1.00 22.34 C ATOM 0 H PHE A 84 -0.868 -2.861 7.110 1.00 30.13 H new ATOM 0 HA PHE A 84 -0.925 -4.683 9.444 1.00 33.05 H new ATOM 0 HB2 PHE A 84 -0.451 -1.689 9.312 1.00 54.21 H new ATOM 0 HB3 PHE A 84 -0.905 -2.529 10.781 1.00 54.21 H new ATOM 0 HD1 PHE A 84 0.637 -4.562 11.445 1.00 43.05 H new ATOM 0 HD2 PHE A 84 1.799 -1.417 8.817 1.00 21.00 H new ATOM 0 HE1 PHE A 84 2.995 -5.057 11.901 1.00 73.14 H new ATOM 0 HE2 PHE A 84 4.159 -1.904 9.283 1.00 2.12 H new ATOM 0 HZ PHE A 84 4.763 -3.723 10.824 1.00 22.34 H new ATOM 1259 N SER A 85 -3.276 -3.954 7.950 1.00 32.42 N ATOM 1260 CA SER A 85 -4.723 -3.888 7.801 1.00 24.41 C ATOM 1261 C SER A 85 -5.435 -4.516 8.993 1.00 1.20 C ATOM 1262 O SER A 85 -5.283 -5.708 9.270 1.00 52.31 O ATOM 1263 CB SER A 85 -5.146 -4.614 6.532 1.00 24.41 C ATOM 1264 OG SER A 85 -4.310 -4.264 5.436 1.00 22.45 O ATOM 0 H SER A 85 -2.809 -4.434 7.181 1.00 32.42 H new ATOM 0 HA SER A 85 -5.003 -2.836 7.744 1.00 24.41 H new ATOM 0 HB2 SER A 85 -5.104 -5.691 6.695 1.00 24.41 H new ATOM 0 HB3 SER A 85 -6.181 -4.367 6.297 1.00 24.41 H new ATOM 0 HG SER A 85 -3.600 -4.933 5.340 1.00 22.45 H new ATOM 1270 N GLU A 86 -6.192 -3.695 9.697 1.00 62.11 N ATOM 1271 CA GLU A 86 -6.906 -4.119 10.884 1.00 61.40 C ATOM 1272 C GLU A 86 -8.398 -4.123 10.572 1.00 61.44 C ATOM 1273 O GLU A 86 -8.855 -3.271 9.810 1.00 1.22 O ATOM 1274 CB GLU A 86 -6.598 -3.149 12.040 1.00 64.41 C ATOM 1275 CG GLU A 86 -7.162 -3.556 13.398 1.00 21.42 C ATOM 1276 CD GLU A 86 -6.665 -4.905 13.885 1.00 23.24 C ATOM 1277 OE1 GLU A 86 -5.634 -4.950 14.574 1.00 23.05 O ATOM 1278 OE2 GLU A 86 -7.313 -5.928 13.588 1.00 70.14 O ATOM 0 H GLU A 86 -6.329 -2.712 9.460 1.00 62.11 H new ATOM 0 HA GLU A 86 -6.595 -5.120 11.182 1.00 61.40 H new ATOM 0 HB2 GLU A 86 -5.516 -3.048 12.129 1.00 64.41 H new ATOM 0 HB3 GLU A 86 -6.990 -2.165 11.782 1.00 64.41 H new ATOM 0 HG2 GLU A 86 -6.900 -2.795 14.133 1.00 21.42 H new ATOM 0 HG3 GLU A 86 -8.250 -3.580 13.337 1.00 21.42 H new ATOM 1285 N ASN A 87 -9.126 -5.118 11.120 1.00 4.42 N ATOM 1286 CA ASN A 87 -10.613 -5.199 11.064 1.00 35.00 C ATOM 1287 C ASN A 87 -11.122 -5.308 9.624 1.00 63.21 C ATOM 1288 O ASN A 87 -12.208 -4.832 9.289 1.00 51.02 O ATOM 1289 CB ASN A 87 -11.239 -3.976 11.756 1.00 72.04 C ATOM 1290 CG ASN A 87 -10.771 -3.786 13.185 1.00 31.02 C ATOM 1291 OD1 ASN A 87 -10.585 -4.744 13.936 1.00 1.44 O ATOM 1292 ND2 ASN A 87 -10.523 -2.543 13.549 1.00 42.23 N ATOM 0 H ASN A 87 -8.701 -5.899 11.620 1.00 4.42 H new ATOM 0 HA ASN A 87 -10.914 -6.104 11.591 1.00 35.00 H new ATOM 0 HB2 ASN A 87 -11.000 -3.081 11.181 1.00 72.04 H new ATOM 0 HB3 ASN A 87 -12.324 -4.079 11.748 1.00 72.04 H new ATOM 0 HD21 ASN A 87 -10.163 -2.347 14.483 1.00 42.23 H new ATOM 0 HD22 ASN A 87 -10.691 -1.777 12.896 1.00 42.23 H new ATOM 1299 N ALA A 88 -10.334 -5.958 8.782 1.00 64.52 N ATOM 1300 CA ALA A 88 -10.611 -6.005 7.361 1.00 30.43 C ATOM 1301 C ALA A 88 -11.037 -7.395 6.945 1.00 42.11 C ATOM 1302 O ALA A 88 -10.560 -8.388 7.494 1.00 53.52 O ATOM 1303 CB ALA A 88 -9.384 -5.571 6.576 1.00 41.30 C ATOM 0 H ALA A 88 -9.493 -6.462 9.064 1.00 64.52 H new ATOM 0 HA ALA A 88 -11.430 -5.318 7.145 1.00 30.43 H new ATOM 0 HB1 ALA A 88 -9.602 -5.610 5.509 1.00 41.30 H new ATOM 0 HB2 ALA A 88 -9.115 -4.552 6.855 1.00 41.30 H new ATOM 0 HB3 ALA A 88 -8.553 -6.240 6.801 1.00 41.30 H new ATOM 1309 N THR A 89 -11.949 -7.453 5.989 1.00 51.34 N ATOM 1310 CA THR A 89 -12.372 -8.708 5.395 1.00 1.01 C ATOM 1311 C THR A 89 -11.341 -9.145 4.350 1.00 32.42 C ATOM 1312 O THR A 89 -10.896 -10.293 4.344 1.00 34.11 O ATOM 1313 CB THR A 89 -13.762 -8.564 4.735 1.00 12.21 C ATOM 1314 OG1 THR A 89 -14.661 -7.916 5.641 1.00 42.43 O ATOM 1315 CG2 THR A 89 -14.339 -9.918 4.351 1.00 62.05 C ATOM 0 H THR A 89 -12.416 -6.632 5.604 1.00 51.34 H new ATOM 0 HA THR A 89 -12.445 -9.461 6.179 1.00 1.01 H new ATOM 0 HB THR A 89 -13.641 -7.969 3.830 1.00 12.21 H new ATOM 0 HG1 THR A 89 -15.553 -7.867 5.238 1.00 42.43 H new ATOM 0 HG21 THR A 89 -15.317 -9.779 3.890 1.00 62.05 H new ATOM 0 HG22 THR A 89 -13.671 -10.411 3.645 1.00 62.05 H new ATOM 0 HG23 THR A 89 -14.443 -10.535 5.243 1.00 62.05 H new ATOM 1323 N SER A 90 -10.970 -8.209 3.474 1.00 73.20 N ATOM 1324 CA SER A 90 -9.961 -8.446 2.445 1.00 11.22 C ATOM 1325 C SER A 90 -9.144 -7.178 2.212 1.00 2.21 C ATOM 1326 O SER A 90 -9.670 -6.066 2.343 1.00 40.34 O ATOM 1327 CB SER A 90 -10.624 -8.883 1.128 1.00 54.10 C ATOM 1328 OG SER A 90 -11.328 -10.101 1.287 1.00 33.44 O ATOM 0 H SER A 90 -11.361 -7.267 3.460 1.00 73.20 H new ATOM 0 HA SER A 90 -9.301 -9.243 2.787 1.00 11.22 H new ATOM 0 HB2 SER A 90 -11.309 -8.106 0.788 1.00 54.10 H new ATOM 0 HB3 SER A 90 -9.863 -8.998 0.356 1.00 54.10 H new ATOM 0 HG SER A 90 -11.741 -10.354 0.435 1.00 33.44 H new ATOM 1334 N ARG A 91 -7.859 -7.342 1.901 1.00 13.35 N ATOM 1335 CA ARG A 91 -7.039 -6.217 1.483 1.00 72.02 C ATOM 1336 C ARG A 91 -6.779 -6.306 -0.020 1.00 75.40 C ATOM 1337 O ARG A 91 -6.496 -7.377 -0.570 1.00 51.12 O ATOM 1338 CB ARG A 91 -5.725 -6.066 2.303 1.00 62.34 C ATOM 1339 CG ARG A 91 -4.546 -6.983 1.950 1.00 4.42 C ATOM 1340 CD ARG A 91 -4.779 -8.442 2.321 1.00 15.31 C ATOM 1341 NE ARG A 91 -3.599 -9.270 2.066 1.00 61.32 N ATOM 1342 CZ ARG A 91 -3.406 -10.004 0.966 1.00 12.54 C ATOM 1343 NH1 ARG A 91 -4.291 -10.002 -0.029 1.00 23.11 N ATOM 1344 NH2 ARG A 91 -2.314 -10.740 0.857 1.00 14.40 N ATOM 0 H ARG A 91 -7.371 -8.237 1.931 1.00 13.35 H new ATOM 0 HA ARG A 91 -7.598 -5.305 1.693 1.00 72.02 H new ATOM 0 HB2 ARG A 91 -5.387 -5.034 2.205 1.00 62.34 H new ATOM 0 HB3 ARG A 91 -5.967 -6.223 3.354 1.00 62.34 H new ATOM 0 HG2 ARG A 91 -4.351 -6.915 0.880 1.00 4.42 H new ATOM 0 HG3 ARG A 91 -3.652 -6.625 2.460 1.00 4.42 H new ATOM 0 HD2 ARG A 91 -5.048 -8.509 3.375 1.00 15.31 H new ATOM 0 HD3 ARG A 91 -5.624 -8.830 1.752 1.00 15.31 H new ATOM 0 HE ARG A 91 -2.871 -9.288 2.780 1.00 61.32 H new ATOM 0 HH11 ARG A 91 -5.135 -9.433 0.040 1.00 23.11 H new ATOM 0 HH12 ARG A 91 -4.125 -10.569 -0.860 1.00 23.11 H new ATOM 0 HH21 ARG A 91 -1.625 -10.745 1.609 1.00 14.40 H new ATOM 0 HH22 ARG A 91 -2.160 -11.303 0.020 1.00 14.40 H new ATOM 1358 N LEU A 92 -6.905 -5.170 -0.668 1.00 23.13 N ATOM 1359 CA LEU A 92 -6.878 -5.063 -2.108 1.00 53.02 C ATOM 1360 C LEU A 92 -5.612 -4.324 -2.519 1.00 51.15 C ATOM 1361 O LEU A 92 -5.401 -3.170 -2.136 1.00 5.24 O ATOM 1362 CB LEU A 92 -8.144 -4.314 -2.566 1.00 73.11 C ATOM 1363 CG LEU A 92 -8.404 -4.236 -4.076 1.00 74.45 C ATOM 1364 CD1 LEU A 92 -8.809 -5.584 -4.637 1.00 44.14 C ATOM 1365 CD2 LEU A 92 -9.485 -3.211 -4.371 1.00 12.12 C ATOM 0 H LEU A 92 -7.032 -4.274 -0.197 1.00 23.13 H new ATOM 0 HA LEU A 92 -6.868 -6.046 -2.579 1.00 53.02 H new ATOM 0 HB2 LEU A 92 -9.006 -4.790 -2.099 1.00 73.11 H new ATOM 0 HB3 LEU A 92 -8.093 -3.296 -2.179 1.00 73.11 H new ATOM 0 HG LEU A 92 -7.475 -3.931 -4.558 1.00 74.45 H new ATOM 0 HD11 LEU A 92 -8.986 -5.494 -5.709 1.00 44.14 H new ATOM 0 HD12 LEU A 92 -8.012 -6.306 -4.460 1.00 44.14 H new ATOM 0 HD13 LEU A 92 -9.721 -5.923 -4.146 1.00 44.14 H new ATOM 0 HD21 LEU A 92 -9.660 -3.166 -5.446 1.00 12.12 H new ATOM 0 HD22 LEU A 92 -10.407 -3.499 -3.865 1.00 12.12 H new ATOM 0 HD23 LEU A 92 -9.165 -2.232 -4.014 1.00 12.12 H new ATOM 1377 N TRP A 93 -4.746 -5.009 -3.243 1.00 75.13 N ATOM 1378 CA TRP A 93 -3.534 -4.394 -3.756 1.00 23.30 C ATOM 1379 C TRP A 93 -3.787 -3.859 -5.157 1.00 72.00 C ATOM 1380 O TRP A 93 -4.051 -4.626 -6.090 1.00 10.33 O ATOM 1381 CB TRP A 93 -2.374 -5.396 -3.772 1.00 22.44 C ATOM 1382 CG TRP A 93 -1.932 -5.860 -2.410 1.00 74.45 C ATOM 1383 CD1 TRP A 93 -2.158 -7.085 -1.849 1.00 11.51 C ATOM 1384 CD2 TRP A 93 -1.181 -5.109 -1.440 1.00 23.23 C ATOM 1385 NE1 TRP A 93 -1.582 -7.149 -0.603 1.00 44.02 N ATOM 1386 CE2 TRP A 93 -0.979 -5.950 -0.328 1.00 12.01 C ATOM 1387 CE3 TRP A 93 -0.657 -3.807 -1.404 1.00 23.33 C ATOM 1388 CZ2 TRP A 93 -0.284 -5.534 0.805 1.00 62.22 C ATOM 1389 CZ3 TRP A 93 0.042 -3.401 -0.281 1.00 30.35 C ATOM 1390 CH2 TRP A 93 0.222 -4.262 0.809 1.00 53.23 C ATOM 0 H TRP A 93 -4.859 -5.992 -3.490 1.00 75.13 H new ATOM 0 HA TRP A 93 -3.257 -3.570 -3.099 1.00 23.30 H new ATOM 0 HB2 TRP A 93 -2.669 -6.265 -4.360 1.00 22.44 H new ATOM 0 HB3 TRP A 93 -1.524 -4.941 -4.280 1.00 22.44 H new ATOM 0 HD1 TRP A 93 -2.710 -7.887 -2.317 1.00 11.51 H new ATOM 0 HE1 TRP A 93 -1.600 -7.959 0.017 1.00 44.02 H new ATOM 0 HE3 TRP A 93 -0.797 -3.135 -2.238 1.00 23.33 H new ATOM 0 HZ2 TRP A 93 -0.149 -6.192 1.651 1.00 62.22 H new ATOM 0 HZ3 TRP A 93 0.456 -2.404 -0.244 1.00 30.35 H new ATOM 0 HH2 TRP A 93 0.772 -3.915 1.671 1.00 53.23 H new ATOM 1401 N MET A 94 -3.746 -2.538 -5.285 1.00 20.03 N ATOM 1402 CA MET A 94 -4.016 -1.879 -6.554 1.00 62.44 C ATOM 1403 C MET A 94 -2.761 -1.203 -7.078 1.00 11.41 C ATOM 1404 O MET A 94 -2.355 -0.146 -6.587 1.00 30.34 O ATOM 1405 CB MET A 94 -5.143 -0.846 -6.417 1.00 60.33 C ATOM 1406 CG MET A 94 -6.478 -1.436 -5.996 1.00 70.04 C ATOM 1407 SD MET A 94 -7.797 -0.208 -5.918 1.00 41.50 S ATOM 1408 CE MET A 94 -7.990 0.214 -7.650 1.00 2.22 C ATOM 0 H MET A 94 -3.527 -1.900 -4.520 1.00 20.03 H new ATOM 0 HA MET A 94 -4.335 -2.644 -7.262 1.00 62.44 H new ATOM 0 HB2 MET A 94 -4.844 -0.093 -5.687 1.00 60.33 H new ATOM 0 HB3 MET A 94 -5.269 -0.333 -7.371 1.00 60.33 H new ATOM 0 HG2 MET A 94 -6.760 -2.220 -6.698 1.00 70.04 H new ATOM 0 HG3 MET A 94 -6.369 -1.907 -5.019 1.00 70.04 H new ATOM 0 HE1 MET A 94 -8.945 0.718 -7.798 1.00 2.22 H new ATOM 0 HE2 MET A 94 -7.180 0.876 -7.956 1.00 2.22 H new ATOM 0 HE3 MET A 94 -7.962 -0.695 -8.251 1.00 2.22 H new ATOM 1418 N PHE A 95 -2.131 -1.841 -8.054 1.00 42.05 N ATOM 1419 CA PHE A 95 -0.958 -1.279 -8.712 1.00 64.51 C ATOM 1420 C PHE A 95 -1.337 -0.683 -10.069 1.00 71.40 C ATOM 1421 O PHE A 95 -0.652 0.203 -10.577 1.00 74.33 O ATOM 1422 CB PHE A 95 0.138 -2.345 -8.867 1.00 12.11 C ATOM 1423 CG PHE A 95 0.701 -2.831 -7.553 1.00 33.32 C ATOM 1424 CD1 PHE A 95 1.657 -2.086 -6.877 1.00 2.42 C ATOM 1425 CD2 PHE A 95 0.266 -4.022 -6.990 1.00 21.21 C ATOM 1426 CE1 PHE A 95 2.167 -2.519 -5.668 1.00 42.14 C ATOM 1427 CE2 PHE A 95 0.771 -4.458 -5.778 1.00 73.34 C ATOM 1428 CZ PHE A 95 1.722 -3.706 -5.117 1.00 32.14 C ATOM 0 H PHE A 95 -2.414 -2.754 -8.410 1.00 42.05 H new ATOM 0 HA PHE A 95 -0.563 -0.477 -8.088 1.00 64.51 H new ATOM 0 HB2 PHE A 95 -0.269 -3.195 -9.415 1.00 12.11 H new ATOM 0 HB3 PHE A 95 0.948 -1.936 -9.470 1.00 12.11 H new ATOM 0 HD1 PHE A 95 2.007 -1.156 -7.301 1.00 2.42 H new ATOM 0 HD2 PHE A 95 -0.476 -4.616 -7.504 1.00 21.21 H new ATOM 0 HE1 PHE A 95 2.913 -1.931 -5.154 1.00 42.14 H new ATOM 0 HE2 PHE A 95 0.422 -5.386 -5.349 1.00 73.34 H new ATOM 0 HZ PHE A 95 2.118 -4.045 -4.171 1.00 32.14 H new ATOM 1438 N GLY A 96 -2.434 -1.179 -10.647 1.00 21.44 N ATOM 1439 CA GLY A 96 -2.949 -0.623 -11.891 1.00 71.03 C ATOM 1440 C GLY A 96 -2.637 -1.470 -13.114 1.00 62.23 C ATOM 1441 O GLY A 96 -2.841 -1.028 -14.242 1.00 54.31 O ATOM 0 H GLY A 96 -2.976 -1.958 -10.274 1.00 21.44 H new ATOM 0 HA2 GLY A 96 -4.029 -0.506 -11.807 1.00 71.03 H new ATOM 0 HA3 GLY A 96 -2.531 0.373 -12.034 1.00 71.03 H new ATOM 1445 N ASP A 97 -2.179 -2.697 -12.884 1.00 60.41 N ATOM 1446 CA ASP A 97 -1.805 -3.608 -13.972 1.00 13.54 C ATOM 1447 C ASP A 97 -2.505 -4.940 -13.815 1.00 61.32 C ATOM 1448 O ASP A 97 -2.226 -5.675 -12.863 1.00 60.41 O ATOM 1449 CB ASP A 97 -0.286 -3.841 -14.020 1.00 33.32 C ATOM 1450 CG ASP A 97 0.485 -2.604 -14.416 1.00 72.21 C ATOM 1451 OD1 ASP A 97 0.524 -2.279 -15.615 1.00 5.14 O ATOM 1452 OD2 ASP A 97 1.069 -1.958 -13.527 1.00 24.23 O ATOM 0 H ASP A 97 -2.056 -3.089 -11.950 1.00 60.41 H new ATOM 0 HA ASP A 97 -2.115 -3.137 -14.905 1.00 13.54 H new ATOM 0 HB2 ASP A 97 0.056 -4.179 -13.042 1.00 33.32 H new ATOM 0 HB3 ASP A 97 -0.068 -4.641 -14.728 1.00 33.32 H new ATOM 1457 N GLY A 98 -3.420 -5.239 -14.734 1.00 51.22 N ATOM 1458 CA GLY A 98 -4.095 -6.525 -14.720 1.00 12.00 C ATOM 1459 C GLY A 98 -5.118 -6.642 -13.609 1.00 34.34 C ATOM 1460 O GLY A 98 -6.027 -5.811 -13.493 1.00 15.45 O ATOM 0 H GLY A 98 -3.706 -4.614 -15.488 1.00 51.22 H new ATOM 0 HA2 GLY A 98 -4.589 -6.681 -15.679 1.00 12.00 H new ATOM 0 HA3 GLY A 98 -3.354 -7.317 -14.610 1.00 12.00 H new ATOM 1464 N ASN A 99 -4.955 -7.691 -12.808 1.00 63.32 N ATOM 1465 CA ASN A 99 -5.848 -8.001 -11.685 1.00 42.32 C ATOM 1466 C ASN A 99 -5.545 -7.132 -10.452 1.00 4.14 C ATOM 1467 O ASN A 99 -4.744 -6.198 -10.503 1.00 1.44 O ATOM 1468 CB ASN A 99 -5.724 -9.494 -11.313 1.00 51.14 C ATOM 1469 CG ASN A 99 -6.368 -10.435 -12.325 1.00 12.32 C ATOM 1470 OD1 ASN A 99 -6.446 -10.147 -13.520 1.00 73.13 O ATOM 1471 ND2 ASN A 99 -6.814 -11.587 -11.855 1.00 54.04 N ATOM 0 H ASN A 99 -4.193 -8.360 -12.918 1.00 63.32 H new ATOM 0 HA ASN A 99 -6.867 -7.781 -12.004 1.00 42.32 H new ATOM 0 HB2 ASN A 99 -4.669 -9.748 -11.215 1.00 51.14 H new ATOM 0 HB3 ASN A 99 -6.183 -9.655 -10.337 1.00 51.14 H new ATOM 0 HD21 ASN A 99 -7.237 -12.266 -12.487 1.00 54.04 H new ATOM 0 HD22 ASN A 99 -6.735 -11.797 -10.860 1.00 54.04 H new ATOM 1478 N THR A 100 -6.171 -7.488 -9.334 1.00 13.04 N ATOM 1479 CA THR A 100 -6.107 -6.734 -8.075 1.00 35.32 C ATOM 1480 C THR A 100 -6.193 -7.714 -6.907 1.00 1.43 C ATOM 1481 O THR A 100 -6.729 -8.806 -7.085 1.00 71.34 O ATOM 1482 CB THR A 100 -7.235 -5.681 -7.942 1.00 44.12 C ATOM 1483 OG1 THR A 100 -8.460 -6.195 -8.475 1.00 30.02 O ATOM 1484 CG2 THR A 100 -6.873 -4.375 -8.630 1.00 31.24 C ATOM 0 H THR A 100 -6.750 -8.325 -9.271 1.00 13.04 H new ATOM 0 HA THR A 100 -5.162 -6.192 -8.068 1.00 35.32 H new ATOM 0 HB THR A 100 -7.364 -5.472 -6.880 1.00 44.12 H new ATOM 0 HG1 THR A 100 -9.165 -5.521 -8.383 1.00 30.02 H new ATOM 0 HG21 THR A 100 -7.690 -3.664 -8.513 1.00 31.24 H new ATOM 0 HG22 THR A 100 -5.969 -3.965 -8.180 1.00 31.24 H new ATOM 0 HG23 THR A 100 -6.700 -4.558 -9.690 1.00 31.24 H new ATOM 1492 N SER A 101 -5.663 -7.287 -5.738 1.00 55.53 N ATOM 1493 CA SER A 101 -5.524 -8.069 -4.455 1.00 24.11 C ATOM 1494 C SER A 101 -4.592 -9.291 -4.547 1.00 43.04 C ATOM 1495 O SER A 101 -3.742 -9.483 -3.672 1.00 64.21 O ATOM 1496 CB SER A 101 -6.866 -8.445 -3.792 1.00 74.32 C ATOM 1497 OG SER A 101 -7.657 -9.323 -4.564 1.00 23.25 O ATOM 0 H SER A 101 -5.297 -6.340 -5.643 1.00 55.53 H new ATOM 0 HA SER A 101 -5.034 -7.355 -3.794 1.00 24.11 H new ATOM 0 HB2 SER A 101 -6.666 -8.906 -2.825 1.00 74.32 H new ATOM 0 HB3 SER A 101 -7.433 -7.534 -3.599 1.00 74.32 H new ATOM 0 HG SER A 101 -7.323 -9.339 -5.485 1.00 23.25 H new ATOM 1503 N ASP A 102 -4.760 -10.112 -5.585 1.00 11.11 N ATOM 1504 CA ASP A 102 -3.861 -11.202 -5.887 1.00 72.21 C ATOM 1505 C ASP A 102 -2.578 -10.626 -6.487 1.00 40.33 C ATOM 1506 O ASP A 102 -2.532 -10.249 -7.661 1.00 20.23 O ATOM 1507 CB ASP A 102 -4.536 -12.197 -6.853 1.00 60.44 C ATOM 1508 CG ASP A 102 -3.704 -13.439 -7.117 1.00 11.24 C ATOM 1509 OD1 ASP A 102 -3.842 -14.417 -6.362 1.00 53.32 O ATOM 1510 OD2 ASP A 102 -2.921 -13.454 -8.092 1.00 63.31 O ATOM 0 H ASP A 102 -5.537 -10.029 -6.241 1.00 11.11 H new ATOM 0 HA ASP A 102 -3.613 -11.748 -4.977 1.00 72.21 H new ATOM 0 HB2 ASP A 102 -5.500 -12.495 -6.441 1.00 60.44 H new ATOM 0 HB3 ASP A 102 -4.736 -11.695 -7.799 1.00 60.44 H new ATOM 1515 N SER A 103 -1.578 -10.481 -5.638 1.00 53.15 N ATOM 1516 CA SER A 103 -0.277 -10.022 -6.056 1.00 75.42 C ATOM 1517 C SER A 103 0.688 -11.204 -6.018 1.00 3.24 C ATOM 1518 O SER A 103 0.714 -11.944 -5.031 1.00 0.21 O ATOM 1519 CB SER A 103 0.199 -8.877 -5.140 1.00 32.45 C ATOM 1520 OG SER A 103 1.419 -8.316 -5.596 1.00 43.20 O ATOM 0 H SER A 103 -1.650 -10.679 -4.640 1.00 53.15 H new ATOM 0 HA SER A 103 -0.320 -9.631 -7.072 1.00 75.42 H new ATOM 0 HB2 SER A 103 -0.566 -8.101 -5.099 1.00 32.45 H new ATOM 0 HB3 SER A 103 0.327 -9.252 -4.125 1.00 32.45 H new ATOM 0 HG SER A 103 2.147 -8.588 -4.999 1.00 43.20 H new ATOM 1526 N PRO A 104 1.470 -11.424 -7.101 1.00 22.20 N ATOM 1527 CA PRO A 104 2.421 -12.547 -7.174 1.00 2.02 C ATOM 1528 C PRO A 104 3.627 -12.391 -6.235 1.00 42.05 C ATOM 1529 O PRO A 104 4.310 -13.368 -5.928 1.00 65.23 O ATOM 1530 CB PRO A 104 2.859 -12.558 -8.643 1.00 3.31 C ATOM 1531 CG PRO A 104 2.610 -11.176 -9.146 1.00 40.21 C ATOM 1532 CD PRO A 104 1.464 -10.622 -8.344 1.00 70.23 C ATOM 0 HA PRO A 104 1.958 -13.479 -6.850 1.00 2.02 H new ATOM 0 HB2 PRO A 104 3.912 -12.825 -8.736 1.00 3.31 H new ATOM 0 HB3 PRO A 104 2.292 -13.292 -9.216 1.00 3.31 H new ATOM 0 HG2 PRO A 104 3.499 -10.556 -9.029 1.00 40.21 H new ATOM 0 HG3 PRO A 104 2.368 -11.189 -10.209 1.00 40.21 H new ATOM 0 HD2 PRO A 104 1.601 -9.561 -8.134 1.00 70.23 H new ATOM 0 HD3 PRO A 104 0.519 -10.722 -8.878 1.00 70.23 H new ATOM 1540 N SER A 105 3.844 -11.170 -5.748 1.00 42.20 N ATOM 1541 CA SER A 105 4.971 -10.856 -4.896 1.00 22.21 C ATOM 1542 C SER A 105 4.615 -9.736 -3.903 1.00 4.15 C ATOM 1543 O SER A 105 4.067 -8.701 -4.299 1.00 73.23 O ATOM 1544 CB SER A 105 6.175 -10.467 -5.764 1.00 44.23 C ATOM 1545 OG SER A 105 5.825 -9.474 -6.719 1.00 43.21 O ATOM 0 H SER A 105 3.236 -10.374 -5.939 1.00 42.20 H new ATOM 0 HA SER A 105 5.231 -11.737 -4.309 1.00 22.21 H new ATOM 0 HB2 SER A 105 6.979 -10.096 -5.129 1.00 44.23 H new ATOM 0 HB3 SER A 105 6.556 -11.350 -6.277 1.00 44.23 H new ATOM 0 HG SER A 105 6.248 -8.624 -6.477 1.00 43.21 H new ATOM 1551 N PRO A 106 4.876 -9.947 -2.586 1.00 52.42 N ATOM 1552 CA PRO A 106 4.714 -8.898 -1.556 1.00 12.31 C ATOM 1553 C PRO A 106 5.805 -7.823 -1.657 1.00 65.23 C ATOM 1554 O PRO A 106 5.599 -6.656 -1.303 1.00 74.41 O ATOM 1555 CB PRO A 106 4.838 -9.659 -0.226 1.00 2.41 C ATOM 1556 CG PRO A 106 4.800 -11.111 -0.579 1.00 13.23 C ATOM 1557 CD PRO A 106 5.305 -11.222 -1.986 1.00 55.11 C ATOM 0 HA PRO A 106 3.767 -8.369 -1.664 1.00 12.31 H new ATOM 0 HB2 PRO A 106 5.767 -9.405 0.284 1.00 2.41 H new ATOM 0 HB3 PRO A 106 4.023 -9.400 0.450 1.00 2.41 H new ATOM 0 HG2 PRO A 106 5.421 -11.692 0.103 1.00 13.23 H new ATOM 0 HG3 PRO A 106 3.786 -11.503 -0.499 1.00 13.23 H new ATOM 0 HD2 PRO A 106 6.388 -11.341 -2.019 1.00 55.11 H new ATOM 0 HD3 PRO A 106 4.874 -12.079 -2.504 1.00 55.11 H new ATOM 1565 N LEU A 107 6.964 -8.244 -2.148 1.00 63.04 N ATOM 1566 CA LEU A 107 8.067 -7.358 -2.453 1.00 71.10 C ATOM 1567 C LEU A 107 8.035 -6.983 -3.927 1.00 73.21 C ATOM 1568 O LEU A 107 7.673 -7.795 -4.770 1.00 12.14 O ATOM 1569 CB LEU A 107 9.402 -8.014 -2.042 1.00 62.23 C ATOM 1570 CG LEU A 107 9.559 -9.513 -2.358 1.00 52.03 C ATOM 1571 CD1 LEU A 107 10.162 -9.736 -3.737 1.00 15.41 C ATOM 1572 CD2 LEU A 107 10.403 -10.195 -1.291 1.00 10.23 C ATOM 0 H LEU A 107 7.161 -9.225 -2.346 1.00 63.04 H new ATOM 0 HA LEU A 107 7.971 -6.436 -1.880 1.00 71.10 H new ATOM 0 HB2 LEU A 107 10.212 -7.475 -2.534 1.00 62.23 H new ATOM 0 HB3 LEU A 107 9.533 -7.876 -0.969 1.00 62.23 H new ATOM 0 HG LEU A 107 8.564 -9.957 -2.358 1.00 52.03 H new ATOM 0 HD11 LEU A 107 10.257 -10.806 -3.924 1.00 15.41 H new ATOM 0 HD12 LEU A 107 9.515 -9.292 -4.493 1.00 15.41 H new ATOM 0 HD13 LEU A 107 11.147 -9.271 -3.783 1.00 15.41 H new ATOM 0 HD21 LEU A 107 10.504 -11.254 -1.529 1.00 10.23 H new ATOM 0 HD22 LEU A 107 11.390 -9.734 -1.258 1.00 10.23 H new ATOM 0 HD23 LEU A 107 9.920 -10.086 -0.320 1.00 10.23 H new ATOM 1584 N HIS A 108 8.364 -5.746 -4.237 1.00 55.12 N ATOM 1585 CA HIS A 108 8.339 -5.286 -5.618 1.00 23.42 C ATOM 1586 C HIS A 108 9.685 -4.735 -6.047 1.00 0.25 C ATOM 1587 O HIS A 108 10.384 -4.086 -5.267 1.00 53.53 O ATOM 1588 CB HIS A 108 7.229 -4.251 -5.825 1.00 1.22 C ATOM 1589 CG HIS A 108 5.950 -4.836 -6.360 1.00 23.23 C ATOM 1590 ND1 HIS A 108 5.401 -6.019 -5.907 1.00 21.13 N ATOM 1591 CD2 HIS A 108 5.136 -4.406 -7.348 1.00 23.33 C ATOM 1592 CE1 HIS A 108 4.305 -6.284 -6.591 1.00 70.10 C ATOM 1593 NE2 HIS A 108 4.122 -5.325 -7.472 1.00 1.21 N ATOM 0 H HIS A 108 8.651 -5.041 -3.558 1.00 55.12 H new ATOM 0 HA HIS A 108 8.124 -6.148 -6.250 1.00 23.42 H new ATOM 0 HB2 HIS A 108 7.023 -3.757 -4.875 1.00 1.22 H new ATOM 0 HB3 HIS A 108 7.583 -3.484 -6.513 1.00 1.22 H new ATOM 0 HD2 HIS A 108 5.259 -3.506 -7.933 1.00 23.33 H new ATOM 0 HE1 HIS A 108 3.666 -7.143 -6.451 1.00 70.10 H new ATOM 0 HE2 HIS A 108 3.352 -5.272 -8.139 1.00 1.21 H new ATOM 1602 N THR A 109 10.042 -5.028 -7.291 1.00 45.52 N ATOM 1603 CA THR A 109 11.287 -4.560 -7.870 1.00 45.24 C ATOM 1604 C THR A 109 11.062 -3.254 -8.615 1.00 1.43 C ATOM 1605 O THR A 109 10.282 -3.197 -9.572 1.00 23.41 O ATOM 1606 CB THR A 109 11.880 -5.608 -8.841 1.00 31.52 C ATOM 1607 OG1 THR A 109 11.928 -6.885 -8.198 1.00 22.23 O ATOM 1608 CG2 THR A 109 13.290 -5.222 -9.281 1.00 52.25 C ATOM 0 H THR A 109 9.476 -5.595 -7.922 1.00 45.52 H new ATOM 0 HA THR A 109 11.993 -4.400 -7.055 1.00 45.24 H new ATOM 0 HB THR A 109 11.239 -5.650 -9.722 1.00 31.52 H new ATOM 0 HG1 THR A 109 12.439 -6.813 -7.365 1.00 22.23 H new ATOM 0 HG21 THR A 109 13.678 -5.979 -9.963 1.00 52.25 H new ATOM 0 HG22 THR A 109 13.262 -4.257 -9.788 1.00 52.25 H new ATOM 0 HG23 THR A 109 13.938 -5.154 -8.407 1.00 52.25 H new ATOM 1616 N PHE A 110 11.726 -2.207 -8.153 1.00 11.12 N ATOM 1617 CA PHE A 110 11.735 -0.948 -8.870 1.00 4.10 C ATOM 1618 C PHE A 110 12.914 -0.928 -9.823 1.00 1.33 C ATOM 1619 O PHE A 110 14.073 -0.858 -9.405 1.00 20.15 O ATOM 1620 CB PHE A 110 11.773 0.254 -7.915 1.00 41.41 C ATOM 1621 CG PHE A 110 10.517 0.416 -7.103 1.00 11.24 C ATOM 1622 CD1 PHE A 110 9.329 0.795 -7.709 1.00 10.55 C ATOM 1623 CD2 PHE A 110 10.523 0.188 -5.740 1.00 75.01 C ATOM 1624 CE1 PHE A 110 8.172 0.941 -6.968 1.00 43.34 C ATOM 1625 CE2 PHE A 110 9.369 0.334 -4.993 1.00 50.33 C ATOM 1626 CZ PHE A 110 8.192 0.710 -5.607 1.00 33.44 C ATOM 0 H PHE A 110 12.264 -2.206 -7.286 1.00 11.12 H new ATOM 0 HA PHE A 110 10.809 -0.863 -9.438 1.00 4.10 H new ATOM 0 HB2 PHE A 110 12.621 0.144 -7.239 1.00 41.41 H new ATOM 0 HB3 PHE A 110 11.942 1.162 -8.494 1.00 41.41 H new ATOM 0 HD1 PHE A 110 9.308 0.978 -8.773 1.00 10.55 H new ATOM 0 HD2 PHE A 110 11.440 -0.108 -5.253 1.00 75.01 H new ATOM 0 HE1 PHE A 110 7.253 1.235 -7.453 1.00 43.34 H new ATOM 0 HE2 PHE A 110 9.389 0.154 -3.928 1.00 50.33 H new ATOM 0 HZ PHE A 110 7.289 0.823 -5.025 1.00 33.44 H new ATOM 1636 N PHE A 111 12.602 -1.025 -11.113 1.00 40.40 N ATOM 1637 CA PHE A 111 13.617 -1.074 -12.162 1.00 13.24 C ATOM 1638 C PHE A 111 14.033 0.334 -12.566 1.00 65.10 C ATOM 1639 O PHE A 111 15.091 0.531 -13.166 1.00 42.42 O ATOM 1640 CB PHE A 111 13.096 -1.826 -13.390 1.00 23.33 C ATOM 1641 CG PHE A 111 12.792 -3.279 -13.154 1.00 54.23 C ATOM 1642 CD1 PHE A 111 13.808 -4.220 -13.157 1.00 72.14 C ATOM 1643 CD2 PHE A 111 11.491 -3.706 -12.944 1.00 72.45 C ATOM 1644 CE1 PHE A 111 13.534 -5.557 -12.952 1.00 1.52 C ATOM 1645 CE2 PHE A 111 11.211 -5.041 -12.736 1.00 21.10 C ATOM 1646 CZ PHE A 111 12.233 -5.967 -12.740 1.00 30.31 C ATOM 0 H PHE A 111 11.644 -1.072 -11.459 1.00 40.40 H new ATOM 0 HA PHE A 111 14.483 -1.605 -11.766 1.00 13.24 H new ATOM 0 HB2 PHE A 111 12.191 -1.332 -13.745 1.00 23.33 H new ATOM 0 HB3 PHE A 111 13.835 -1.748 -14.187 1.00 23.33 H new ATOM 0 HD1 PHE A 111 14.827 -3.904 -13.322 1.00 72.14 H new ATOM 0 HD2 PHE A 111 10.686 -2.986 -12.943 1.00 72.45 H new ATOM 0 HE1 PHE A 111 14.336 -6.281 -12.957 1.00 1.52 H new ATOM 0 HE2 PHE A 111 10.193 -5.360 -12.570 1.00 21.10 H new ATOM 0 HZ PHE A 111 12.016 -7.012 -12.577 1.00 30.31 H new ATOM 1656 N ASN A 112 13.180 1.298 -12.247 1.00 23.21 N ATOM 1657 CA ASN A 112 13.476 2.704 -12.436 1.00 35.34 C ATOM 1658 C ASN A 112 13.034 3.457 -11.186 1.00 2.43 C ATOM 1659 O ASN A 112 12.318 2.901 -10.344 1.00 62.21 O ATOM 1660 CB ASN A 112 12.804 3.256 -13.716 1.00 51.45 C ATOM 1661 CG ASN A 112 11.283 3.356 -13.656 1.00 5.43 C ATOM 1662 OD1 ASN A 112 10.730 4.393 -13.295 1.00 63.32 O ATOM 1663 ND2 ASN A 112 10.594 2.289 -14.028 1.00 74.43 N ATOM 0 H ASN A 112 12.258 1.121 -11.847 1.00 23.21 H new ATOM 0 HA ASN A 112 14.548 2.842 -12.578 1.00 35.34 H new ATOM 0 HB2 ASN A 112 13.210 4.246 -13.923 1.00 51.45 H new ATOM 0 HB3 ASN A 112 13.078 2.617 -14.556 1.00 51.45 H new ATOM 0 HD21 ASN A 112 9.574 2.312 -14.020 1.00 74.43 H new ATOM 0 HD22 ASN A 112 11.083 1.443 -14.322 1.00 74.43 H new ATOM 1670 N GLU A 113 13.487 4.692 -11.045 1.00 13.55 N ATOM 1671 CA GLU A 113 13.130 5.506 -9.888 1.00 3.14 C ATOM 1672 C GLU A 113 12.066 6.550 -10.239 1.00 23.11 C ATOM 1673 O GLU A 113 11.708 6.724 -11.404 1.00 51.23 O ATOM 1674 CB GLU A 113 14.370 6.180 -9.273 1.00 13.34 C ATOM 1675 CG GLU A 113 15.115 7.140 -10.194 1.00 73.24 C ATOM 1676 CD GLU A 113 16.116 6.461 -11.104 1.00 33.22 C ATOM 1677 OE1 GLU A 113 17.190 6.070 -10.617 1.00 43.03 O ATOM 1678 OE2 GLU A 113 15.831 6.321 -12.302 1.00 32.00 O ATOM 0 H GLU A 113 14.102 5.155 -11.714 1.00 13.55 H new ATOM 0 HA GLU A 113 12.705 4.834 -9.143 1.00 3.14 H new ATOM 0 HB2 GLU A 113 14.062 6.725 -8.381 1.00 13.34 H new ATOM 0 HB3 GLU A 113 15.062 5.403 -8.949 1.00 13.34 H new ATOM 0 HG2 GLU A 113 14.390 7.679 -10.804 1.00 73.24 H new ATOM 0 HG3 GLU A 113 15.635 7.881 -9.587 1.00 73.24 H new ATOM 1685 N GLY A 114 11.595 7.248 -9.213 1.00 45.14 N ATOM 1686 CA GLY A 114 10.545 8.231 -9.368 1.00 2.13 C ATOM 1687 C GLY A 114 9.765 8.393 -8.089 1.00 32.43 C ATOM 1688 O GLY A 114 10.015 7.682 -7.114 1.00 12.30 O ATOM 0 H GLY A 114 11.933 7.145 -8.256 1.00 45.14 H new ATOM 0 HA2 GLY A 114 10.978 9.188 -9.658 1.00 2.13 H new ATOM 0 HA3 GLY A 114 9.874 7.928 -10.172 1.00 2.13 H new ATOM 1692 N GLU A 115 8.821 9.319 -8.069 1.00 5.22 N ATOM 1693 CA GLU A 115 7.995 9.512 -6.890 1.00 23.42 C ATOM 1694 C GLU A 115 6.653 8.806 -7.090 1.00 15.33 C ATOM 1695 O GLU A 115 5.791 9.258 -7.848 1.00 63.22 O ATOM 1696 CB GLU A 115 7.830 11.005 -6.593 1.00 63.43 C ATOM 1697 CG GLU A 115 7.127 11.297 -5.276 1.00 3.05 C ATOM 1698 CD GLU A 115 7.095 12.770 -4.922 1.00 44.33 C ATOM 1699 OE1 GLU A 115 6.388 13.534 -5.606 1.00 34.53 O ATOM 1700 OE2 GLU A 115 7.779 13.165 -3.958 1.00 31.04 O ATOM 0 H GLU A 115 8.609 9.943 -8.848 1.00 5.22 H new ATOM 0 HA GLU A 115 8.479 9.069 -6.020 1.00 23.42 H new ATOM 0 HB2 GLU A 115 8.814 11.474 -6.580 1.00 63.43 H new ATOM 0 HB3 GLU A 115 7.267 11.467 -7.404 1.00 63.43 H new ATOM 0 HG2 GLU A 115 6.105 10.922 -5.328 1.00 3.05 H new ATOM 0 HG3 GLU A 115 7.628 10.750 -4.477 1.00 3.05 H new ATOM 1707 N TYR A 116 6.519 7.665 -6.427 1.00 72.25 N ATOM 1708 CA TYR A 116 5.346 6.808 -6.543 1.00 63.33 C ATOM 1709 C TYR A 116 4.405 7.061 -5.380 1.00 65.03 C ATOM 1710 O TYR A 116 4.797 7.650 -4.380 1.00 74.13 O ATOM 1711 CB TYR A 116 5.764 5.330 -6.546 1.00 70.32 C ATOM 1712 CG TYR A 116 6.769 4.971 -7.617 1.00 24.44 C ATOM 1713 CD1 TYR A 116 6.367 4.782 -8.929 1.00 64.34 C ATOM 1714 CD2 TYR A 116 8.114 4.807 -7.309 1.00 44.13 C ATOM 1715 CE1 TYR A 116 7.275 4.440 -9.910 1.00 1.31 C ATOM 1716 CE2 TYR A 116 9.030 4.470 -8.286 1.00 22.13 C ATOM 1717 CZ TYR A 116 8.605 4.287 -9.583 1.00 72.21 C ATOM 1718 OH TYR A 116 9.510 3.934 -10.551 1.00 11.12 O ATOM 0 H TYR A 116 7.228 7.305 -5.788 1.00 72.25 H new ATOM 0 HA TYR A 116 4.839 7.038 -7.480 1.00 63.33 H new ATOM 0 HB2 TYR A 116 6.184 5.081 -5.572 1.00 70.32 H new ATOM 0 HB3 TYR A 116 4.875 4.713 -6.677 1.00 70.32 H new ATOM 0 HD1 TYR A 116 5.326 4.904 -9.188 1.00 64.34 H new ATOM 0 HD2 TYR A 116 8.448 4.945 -6.291 1.00 44.13 H new ATOM 0 HE1 TYR A 116 6.945 4.293 -10.928 1.00 1.31 H new ATOM 0 HE2 TYR A 116 10.073 4.351 -8.034 1.00 22.13 H new ATOM 0 HH TYR A 116 10.344 3.640 -10.128 1.00 11.12 H new ATOM 1728 N ILE A 117 3.152 6.658 -5.528 1.00 13.33 N ATOM 1729 CA ILE A 117 2.200 6.702 -4.424 1.00 52.14 C ATOM 1730 C ILE A 117 1.476 5.353 -4.340 1.00 52.34 C ATOM 1731 O ILE A 117 0.616 5.045 -5.169 1.00 34.12 O ATOM 1732 CB ILE A 117 1.160 7.860 -4.558 1.00 34.35 C ATOM 1733 CG1 ILE A 117 1.858 9.214 -4.799 1.00 54.41 C ATOM 1734 CG2 ILE A 117 0.304 7.942 -3.291 1.00 61.50 C ATOM 1735 CD1 ILE A 117 0.939 10.333 -5.239 1.00 74.33 C ATOM 0 H ILE A 117 2.769 6.296 -6.401 1.00 13.33 H new ATOM 0 HA ILE A 117 2.762 6.898 -3.511 1.00 52.14 H new ATOM 0 HB ILE A 117 0.525 7.644 -5.417 1.00 34.35 H new ATOM 0 HG12 ILE A 117 2.361 9.516 -3.880 1.00 54.41 H new ATOM 0 HG13 ILE A 117 2.631 9.079 -5.556 1.00 54.41 H new ATOM 0 HG21 ILE A 117 -0.419 8.752 -3.392 1.00 61.50 H new ATOM 0 HG22 ILE A 117 -0.225 7.000 -3.147 1.00 61.50 H new ATOM 0 HG23 ILE A 117 0.945 8.133 -2.430 1.00 61.50 H new ATOM 0 HD11 ILE A 117 1.519 11.245 -5.384 1.00 74.33 H new ATOM 0 HD12 ILE A 117 0.455 10.059 -6.176 1.00 74.33 H new ATOM 0 HD13 ILE A 117 0.181 10.503 -4.475 1.00 74.33 H new ATOM 1747 N VAL A 118 1.866 4.539 -3.358 1.00 20.30 N ATOM 1748 CA VAL A 118 1.236 3.233 -3.132 1.00 73.54 C ATOM 1749 C VAL A 118 0.030 3.411 -2.218 1.00 2.40 C ATOM 1750 O VAL A 118 0.122 4.086 -1.194 1.00 65.13 O ATOM 1751 CB VAL A 118 2.236 2.201 -2.516 1.00 62.10 C ATOM 1752 CG1 VAL A 118 1.578 0.847 -2.233 1.00 35.32 C ATOM 1753 CG2 VAL A 118 3.428 1.999 -3.435 1.00 43.30 C ATOM 0 H VAL A 118 2.617 4.760 -2.704 1.00 20.30 H new ATOM 0 HA VAL A 118 0.918 2.835 -4.096 1.00 73.54 H new ATOM 0 HB VAL A 118 2.568 2.618 -1.565 1.00 62.10 H new ATOM 0 HG11 VAL A 118 2.315 0.167 -1.806 1.00 35.32 H new ATOM 0 HG12 VAL A 118 0.757 0.981 -1.528 1.00 35.32 H new ATOM 0 HG13 VAL A 118 1.193 0.428 -3.163 1.00 35.32 H new ATOM 0 HG21 VAL A 118 4.113 1.278 -2.989 1.00 43.30 H new ATOM 0 HG22 VAL A 118 3.085 1.625 -4.400 1.00 43.30 H new ATOM 0 HG23 VAL A 118 3.943 2.949 -3.577 1.00 43.30 H new ATOM 1763 N SER A 119 -1.095 2.823 -2.602 1.00 31.05 N ATOM 1764 CA SER A 119 -2.300 2.906 -1.808 1.00 30.34 C ATOM 1765 C SER A 119 -2.793 1.510 -1.456 1.00 53.43 C ATOM 1766 O SER A 119 -3.097 0.700 -2.339 1.00 33.32 O ATOM 1767 CB SER A 119 -3.386 3.679 -2.562 1.00 74.12 C ATOM 1768 OG SER A 119 -4.509 3.933 -1.730 1.00 61.11 O ATOM 0 H SER A 119 -1.192 2.283 -3.462 1.00 31.05 H new ATOM 0 HA SER A 119 -2.073 3.441 -0.886 1.00 30.34 H new ATOM 0 HB2 SER A 119 -2.979 4.623 -2.925 1.00 74.12 H new ATOM 0 HB3 SER A 119 -3.700 3.110 -3.437 1.00 74.12 H new ATOM 0 HG SER A 119 -4.426 4.824 -1.332 1.00 61.11 H new ATOM 1774 N LEU A 120 -2.844 1.233 -0.165 1.00 73.14 N ATOM 1775 CA LEU A 120 -3.487 0.036 0.334 1.00 33.20 C ATOM 1776 C LEU A 120 -4.937 0.376 0.618 1.00 21.02 C ATOM 1777 O LEU A 120 -5.235 1.420 1.195 1.00 5.44 O ATOM 1778 CB LEU A 120 -2.767 -0.493 1.593 1.00 72.40 C ATOM 1779 CG LEU A 120 -3.324 -1.768 2.263 1.00 30.45 C ATOM 1780 CD1 LEU A 120 -3.515 -2.905 1.265 1.00 12.15 C ATOM 1781 CD2 LEU A 120 -2.382 -2.206 3.349 1.00 22.54 C ATOM 0 H LEU A 120 -2.443 1.828 0.560 1.00 73.14 H new ATOM 0 HA LEU A 120 -3.435 -0.762 -0.407 1.00 33.20 H new ATOM 0 HB2 LEU A 120 -1.727 -0.682 1.328 1.00 72.40 H new ATOM 0 HB3 LEU A 120 -2.767 0.303 2.337 1.00 72.40 H new ATOM 0 HG LEU A 120 -4.303 -1.528 2.678 1.00 30.45 H new ATOM 0 HD11 LEU A 120 -3.908 -3.780 1.782 1.00 12.15 H new ATOM 0 HD12 LEU A 120 -4.217 -2.595 0.490 1.00 12.15 H new ATOM 0 HD13 LEU A 120 -2.557 -3.153 0.808 1.00 12.15 H new ATOM 0 HD21 LEU A 120 -2.770 -3.106 3.826 1.00 22.54 H new ATOM 0 HD22 LEU A 120 -1.403 -2.417 2.918 1.00 22.54 H new ATOM 0 HD23 LEU A 120 -2.289 -1.413 4.091 1.00 22.54 H new ATOM 1793 N ILE A 121 -5.824 -0.477 0.162 1.00 21.00 N ATOM 1794 CA ILE A 121 -7.245 -0.293 0.357 1.00 51.05 C ATOM 1795 C ILE A 121 -7.839 -1.586 0.891 1.00 22.53 C ATOM 1796 O ILE A 121 -7.547 -2.660 0.393 1.00 33.24 O ATOM 1797 CB ILE A 121 -7.954 0.190 -0.955 1.00 33.42 C ATOM 1798 CG1 ILE A 121 -9.490 0.137 -0.817 1.00 3.51 C ATOM 1799 CG2 ILE A 121 -7.479 -0.595 -2.178 1.00 54.34 C ATOM 1800 CD1 ILE A 121 -10.244 0.671 -2.014 1.00 51.42 C ATOM 0 H ILE A 121 -5.581 -1.321 -0.356 1.00 21.00 H new ATOM 0 HA ILE A 121 -7.410 0.498 1.089 1.00 51.05 H new ATOM 0 HB ILE A 121 -7.671 1.231 -1.109 1.00 33.42 H new ATOM 0 HG12 ILE A 121 -9.792 -0.896 -0.644 1.00 3.51 H new ATOM 0 HG13 ILE A 121 -9.783 0.706 0.065 1.00 3.51 H new ATOM 0 HG21 ILE A 121 -7.994 -0.230 -3.067 1.00 54.34 H new ATOM 0 HG22 ILE A 121 -6.404 -0.462 -2.301 1.00 54.34 H new ATOM 0 HG23 ILE A 121 -7.700 -1.653 -2.039 1.00 54.34 H new ATOM 0 HD11 ILE A 121 -11.316 0.596 -1.832 1.00 51.42 H new ATOM 0 HD12 ILE A 121 -9.976 1.715 -2.177 1.00 51.42 H new ATOM 0 HD13 ILE A 121 -9.984 0.088 -2.897 1.00 51.42 H new ATOM 1812 N VAL A 122 -8.626 -1.478 1.938 1.00 54.33 N ATOM 1813 CA VAL A 122 -9.259 -2.632 2.543 1.00 23.14 C ATOM 1814 C VAL A 122 -10.767 -2.486 2.471 1.00 15.20 C ATOM 1815 O VAL A 122 -11.289 -1.378 2.310 1.00 10.14 O ATOM 1816 CB VAL A 122 -8.814 -2.858 4.013 1.00 75.53 C ATOM 1817 CG1 VAL A 122 -7.340 -3.201 4.082 1.00 31.03 C ATOM 1818 CG2 VAL A 122 -9.103 -1.646 4.880 1.00 45.11 C ATOM 0 H VAL A 122 -8.846 -0.592 2.394 1.00 54.33 H new ATOM 0 HA VAL A 122 -8.942 -3.508 1.978 1.00 23.14 H new ATOM 0 HB VAL A 122 -9.394 -3.697 4.399 1.00 75.53 H new ATOM 0 HG11 VAL A 122 -7.051 -3.355 5.122 1.00 31.03 H new ATOM 0 HG12 VAL A 122 -7.151 -4.112 3.514 1.00 31.03 H new ATOM 0 HG13 VAL A 122 -6.756 -2.383 3.660 1.00 31.03 H new ATOM 0 HG21 VAL A 122 -8.777 -1.843 5.901 1.00 45.11 H new ATOM 0 HG22 VAL A 122 -8.566 -0.782 4.488 1.00 45.11 H new ATOM 0 HG23 VAL A 122 -10.174 -1.441 4.874 1.00 45.11 H new ATOM 1828 N SER A 123 -11.465 -3.600 2.571 1.00 62.35 N ATOM 1829 CA SER A 123 -12.909 -3.599 2.499 1.00 51.43 C ATOM 1830 C SER A 123 -13.466 -4.457 3.621 1.00 71.10 C ATOM 1831 O SER A 123 -12.825 -5.418 4.049 1.00 12.55 O ATOM 1832 CB SER A 123 -13.387 -4.126 1.143 1.00 61.23 C ATOM 1833 OG SER A 123 -12.753 -3.433 0.077 1.00 44.14 O ATOM 0 H SER A 123 -11.050 -4.522 2.703 1.00 62.35 H new ATOM 0 HA SER A 123 -13.269 -2.576 2.608 1.00 51.43 H new ATOM 0 HB2 SER A 123 -13.173 -5.192 1.067 1.00 61.23 H new ATOM 0 HB3 SER A 123 -14.468 -4.011 1.064 1.00 61.23 H new ATOM 0 HG SER A 123 -13.072 -3.787 -0.779 1.00 44.14 H new ATOM 1839 N ASN A 124 -14.639 -4.079 4.097 1.00 32.42 N ATOM 1840 CA ASN A 124 -15.338 -4.774 5.167 1.00 3.51 C ATOM 1841 C ASN A 124 -16.836 -4.521 4.972 1.00 74.32 C ATOM 1842 O ASN A 124 -17.208 -3.691 4.133 1.00 20.01 O ATOM 1843 CB ASN A 124 -14.803 -4.271 6.539 1.00 60.04 C ATOM 1844 CG ASN A 124 -15.429 -4.917 7.769 1.00 61.41 C ATOM 1845 OD1 ASN A 124 -16.336 -4.352 8.382 1.00 23.02 O ATOM 1846 ND2 ASN A 124 -14.962 -6.100 8.129 1.00 72.15 N ATOM 0 H ASN A 124 -15.143 -3.265 3.745 1.00 32.42 H new ATOM 0 HA ASN A 124 -15.167 -5.850 5.146 1.00 3.51 H new ATOM 0 HB2 ASN A 124 -13.726 -4.438 6.572 1.00 60.04 H new ATOM 0 HB3 ASN A 124 -14.960 -3.194 6.597 1.00 60.04 H new ATOM 0 HD21 ASN A 124 -15.354 -6.578 8.941 1.00 72.15 H new ATOM 0 HD22 ASN A 124 -14.210 -6.535 7.595 1.00 72.15 H new ATOM 1853 N GLU A 125 -17.687 -5.209 5.740 1.00 14.42 N ATOM 1854 CA GLU A 125 -19.143 -5.113 5.607 1.00 13.41 C ATOM 1855 C GLU A 125 -19.676 -3.765 6.135 1.00 71.32 C ATOM 1856 O GLU A 125 -20.749 -3.323 5.729 1.00 64.31 O ATOM 1857 CB GLU A 125 -19.808 -6.275 6.362 1.00 12.23 C ATOM 1858 CG GLU A 125 -19.479 -6.314 7.855 1.00 73.35 C ATOM 1859 CD GLU A 125 -20.166 -7.439 8.591 1.00 31.21 C ATOM 1860 OE1 GLU A 125 -21.377 -7.330 8.862 1.00 75.10 O ATOM 1861 OE2 GLU A 125 -19.491 -8.431 8.914 1.00 12.32 O ATOM 0 H GLU A 125 -17.384 -5.850 6.473 1.00 14.42 H new ATOM 0 HA GLU A 125 -19.390 -5.173 4.547 1.00 13.41 H new ATOM 0 HB2 GLU A 125 -20.889 -6.203 6.240 1.00 12.23 H new ATOM 0 HB3 GLU A 125 -19.498 -7.216 5.907 1.00 12.23 H new ATOM 0 HG2 GLU A 125 -18.401 -6.413 7.979 1.00 73.35 H new ATOM 0 HG3 GLU A 125 -19.766 -5.365 8.308 1.00 73.35 H new ATOM 1868 N ASN A 126 -18.910 -3.124 7.030 1.00 24.00 N ATOM 1869 CA ASN A 126 -19.308 -1.856 7.632 1.00 55.13 C ATOM 1870 C ASN A 126 -18.849 -0.695 6.752 1.00 73.23 C ATOM 1871 O ASN A 126 -19.667 0.062 6.232 1.00 14.33 O ATOM 1872 CB ASN A 126 -18.700 -1.723 9.044 1.00 23.14 C ATOM 1873 CG ASN A 126 -19.264 -0.550 9.824 1.00 1.43 C ATOM 1874 OD1 ASN A 126 -20.416 -0.165 9.645 1.00 33.30 O ATOM 1875 ND2 ASN A 126 -18.464 0.009 10.713 1.00 14.13 N ATOM 0 H ASN A 126 -18.006 -3.471 7.351 1.00 24.00 H new ATOM 0 HA ASN A 126 -20.395 -1.830 7.715 1.00 55.13 H new ATOM 0 HB2 ASN A 126 -18.882 -2.643 9.600 1.00 23.14 H new ATOM 0 HB3 ASN A 126 -17.619 -1.610 8.959 1.00 23.14 H new ATOM 0 HD21 ASN A 126 -18.797 0.789 11.280 1.00 14.13 H new ATOM 0 HD22 ASN A 126 -17.513 -0.339 10.833 1.00 14.13 H new ATOM 1882 N ASP A 127 -17.534 -0.607 6.553 1.00 1.23 N ATOM 1883 CA ASP A 127 -16.921 0.483 5.793 1.00 41.31 C ATOM 1884 C ASP A 127 -15.764 -0.017 4.952 1.00 52.43 C ATOM 1885 O ASP A 127 -15.412 -1.193 5.012 1.00 14.20 O ATOM 1886 CB ASP A 127 -16.418 1.593 6.719 1.00 74.14 C ATOM 1887 CG ASP A 127 -17.534 2.469 7.237 1.00 75.51 C ATOM 1888 OD1 ASP A 127 -18.012 3.334 6.483 1.00 63.03 O ATOM 1889 OD2 ASP A 127 -17.920 2.311 8.408 1.00 73.33 O ATOM 0 H ASP A 127 -16.865 -1.287 6.913 1.00 1.23 H new ATOM 0 HA ASP A 127 -17.695 0.885 5.139 1.00 41.31 H new ATOM 0 HB2 ASP A 127 -15.891 1.146 7.562 1.00 74.14 H new ATOM 0 HB3 ASP A 127 -15.697 2.209 6.182 1.00 74.14 H new ATOM 1894 N SER A 128 -15.186 0.876 4.155 1.00 31.22 N ATOM 1895 CA SER A 128 -13.966 0.591 3.423 1.00 20.43 C ATOM 1896 C SER A 128 -12.970 1.723 3.652 1.00 3.45 C ATOM 1897 O SER A 128 -13.315 2.900 3.532 1.00 35.42 O ATOM 1898 CB SER A 128 -14.278 0.408 1.933 1.00 51.01 C ATOM 1899 OG SER A 128 -15.004 1.513 1.419 1.00 41.01 O ATOM 0 H SER A 128 -15.553 1.815 4.001 1.00 31.22 H new ATOM 0 HA SER A 128 -13.523 -0.338 3.782 1.00 20.43 H new ATOM 0 HB2 SER A 128 -13.348 0.290 1.376 1.00 51.01 H new ATOM 0 HB3 SER A 128 -14.853 -0.507 1.789 1.00 51.01 H new ATOM 0 HG SER A 128 -14.704 2.335 1.859 1.00 41.01 H new ATOM 1905 N ASP A 129 -11.748 1.366 3.996 1.00 52.23 N ATOM 1906 CA ASP A 129 -10.729 2.351 4.330 1.00 54.13 C ATOM 1907 C ASP A 129 -9.579 2.235 3.341 1.00 61.11 C ATOM 1908 O ASP A 129 -9.214 1.131 2.959 1.00 1.41 O ATOM 1909 CB ASP A 129 -10.244 2.114 5.769 1.00 65.23 C ATOM 1910 CG ASP A 129 -9.346 3.221 6.292 1.00 34.53 C ATOM 1911 OD1 ASP A 129 -8.123 3.145 6.092 1.00 51.45 O ATOM 1912 OD2 ASP A 129 -9.867 4.166 6.918 1.00 63.21 O ATOM 0 H ASP A 129 -11.432 0.398 4.053 1.00 52.23 H new ATOM 0 HA ASP A 129 -11.142 3.358 4.267 1.00 54.13 H new ATOM 0 HB2 ASP A 129 -11.109 2.018 6.425 1.00 65.23 H new ATOM 0 HB3 ASP A 129 -9.705 1.168 5.812 1.00 65.23 H new ATOM 1917 N SER A 130 -9.042 3.359 2.887 1.00 4.21 N ATOM 1918 CA SER A 130 -7.882 3.351 2.004 1.00 71.02 C ATOM 1919 C SER A 130 -6.910 4.463 2.379 1.00 21.33 C ATOM 1920 O SER A 130 -7.328 5.588 2.672 1.00 71.11 O ATOM 1921 CB SER A 130 -8.323 3.502 0.542 1.00 11.22 C ATOM 1922 OG SER A 130 -9.157 4.638 0.359 1.00 3.34 O ATOM 0 H SER A 130 -9.391 4.290 3.116 1.00 4.21 H new ATOM 0 HA SER A 130 -7.371 2.395 2.120 1.00 71.02 H new ATOM 0 HB2 SER A 130 -7.444 3.590 -0.096 1.00 11.22 H new ATOM 0 HB3 SER A 130 -8.856 2.605 0.228 1.00 11.22 H new ATOM 0 HG SER A 130 -9.417 4.704 -0.583 1.00 3.34 H new ATOM 1928 N ALA A 131 -5.619 4.149 2.364 1.00 41.24 N ATOM 1929 CA ALA A 131 -4.587 5.119 2.702 1.00 4.43 C ATOM 1930 C ALA A 131 -3.371 4.952 1.826 1.00 2.32 C ATOM 1931 O ALA A 131 -3.004 3.842 1.435 1.00 11.00 O ATOM 1932 CB ALA A 131 -4.205 5.010 4.164 1.00 25.22 C ATOM 0 H ALA A 131 -5.262 3.225 2.120 1.00 41.24 H new ATOM 0 HA ALA A 131 -4.997 6.113 2.524 1.00 4.43 H new ATOM 0 HB1 ALA A 131 -3.433 5.744 4.394 1.00 25.22 H new ATOM 0 HB2 ALA A 131 -5.081 5.199 4.784 1.00 25.22 H new ATOM 0 HB3 ALA A 131 -3.826 4.009 4.367 1.00 25.22 H new ATOM 1938 N SER A 132 -2.750 6.077 1.527 1.00 21.10 N ATOM 1939 CA SER A 132 -1.661 6.130 0.585 1.00 54.12 C ATOM 1940 C SER A 132 -0.413 6.715 1.243 1.00 64.03 C ATOM 1941 O SER A 132 -0.519 7.531 2.167 1.00 2.54 O ATOM 1942 CB SER A 132 -2.078 7.007 -0.594 1.00 53.42 C ATOM 1943 OG SER A 132 -3.384 6.690 -1.049 1.00 43.23 O ATOM 0 H SER A 132 -2.991 6.980 1.935 1.00 21.10 H new ATOM 0 HA SER A 132 -1.429 5.122 0.242 1.00 54.12 H new ATOM 0 HB2 SER A 132 -2.040 8.056 -0.299 1.00 53.42 H new ATOM 0 HB3 SER A 132 -1.367 6.880 -1.411 1.00 53.42 H new ATOM 0 HG SER A 132 -3.618 7.271 -1.802 1.00 43.23 H new ATOM 1949 N VAL A 133 0.760 6.302 0.776 1.00 51.14 N ATOM 1950 CA VAL A 133 2.011 6.897 1.223 1.00 50.33 C ATOM 1951 C VAL A 133 2.885 7.207 -0.004 1.00 21.44 C ATOM 1952 O VAL A 133 2.790 6.527 -1.038 1.00 2.34 O ATOM 1953 CB VAL A 133 2.758 5.998 2.271 1.00 33.30 C ATOM 1954 CG1 VAL A 133 3.454 4.802 1.641 1.00 64.32 C ATOM 1955 CG2 VAL A 133 3.741 6.813 3.113 1.00 21.51 C ATOM 0 H VAL A 133 0.869 5.557 0.088 1.00 51.14 H new ATOM 0 HA VAL A 133 1.791 7.828 1.745 1.00 50.33 H new ATOM 0 HB VAL A 133 1.984 5.603 2.929 1.00 33.30 H new ATOM 0 HG11 VAL A 133 3.952 4.220 2.417 1.00 64.32 H new ATOM 0 HG12 VAL A 133 2.718 4.177 1.135 1.00 64.32 H new ATOM 0 HG13 VAL A 133 4.192 5.150 0.918 1.00 64.32 H new ATOM 0 HG21 VAL A 133 4.239 6.157 3.827 1.00 21.51 H new ATOM 0 HG22 VAL A 133 4.485 7.272 2.462 1.00 21.51 H new ATOM 0 HG23 VAL A 133 3.201 7.592 3.651 1.00 21.51 H new ATOM 1965 N THR A 134 3.697 8.249 0.104 1.00 54.42 N ATOM 1966 CA THR A 134 4.544 8.685 -0.984 1.00 21.14 C ATOM 1967 C THR A 134 5.888 7.953 -0.941 1.00 34.41 C ATOM 1968 O THR A 134 6.670 8.103 -0.001 1.00 41.03 O ATOM 1969 CB THR A 134 4.748 10.214 -0.917 1.00 60.14 C ATOM 1970 OG1 THR A 134 3.481 10.861 -0.734 1.00 55.24 O ATOM 1971 CG2 THR A 134 5.384 10.752 -2.181 1.00 2.13 C ATOM 0 H THR A 134 3.783 8.812 0.950 1.00 54.42 H new ATOM 0 HA THR A 134 4.057 8.443 -1.929 1.00 21.14 H new ATOM 0 HB THR A 134 5.413 10.419 -0.078 1.00 60.14 H new ATOM 0 HG1 THR A 134 3.612 11.831 -0.690 1.00 55.24 H new ATOM 0 HG21 THR A 134 5.510 11.831 -2.094 1.00 2.13 H new ATOM 0 HG22 THR A 134 6.357 10.283 -2.327 1.00 2.13 H new ATOM 0 HG23 THR A 134 4.743 10.530 -3.034 1.00 2.13 H new ATOM 1979 N ILE A 135 6.117 7.137 -1.956 1.00 64.12 N ATOM 1980 CA ILE A 135 7.350 6.370 -2.102 1.00 12.01 C ATOM 1981 C ILE A 135 8.337 7.201 -2.899 1.00 64.24 C ATOM 1982 O ILE A 135 8.141 7.440 -4.089 1.00 31.11 O ATOM 1983 CB ILE A 135 7.109 5.016 -2.841 1.00 65.14 C ATOM 1984 CG1 ILE A 135 5.926 4.246 -2.222 1.00 73.44 C ATOM 1985 CG2 ILE A 135 8.376 4.149 -2.849 1.00 4.31 C ATOM 1986 CD1 ILE A 135 6.083 3.898 -0.757 1.00 34.33 C ATOM 0 H ILE A 135 5.448 6.984 -2.711 1.00 64.12 H new ATOM 0 HA ILE A 135 7.735 6.142 -1.108 1.00 12.01 H new ATOM 0 HB ILE A 135 6.857 5.250 -3.875 1.00 65.14 H new ATOM 0 HG12 ILE A 135 5.021 4.842 -2.343 1.00 73.44 H new ATOM 0 HG13 ILE A 135 5.778 3.324 -2.785 1.00 73.44 H new ATOM 0 HG21 ILE A 135 8.174 3.214 -3.371 1.00 4.31 H new ATOM 0 HG22 ILE A 135 9.179 4.682 -3.358 1.00 4.31 H new ATOM 0 HG23 ILE A 135 8.676 3.934 -1.823 1.00 4.31 H new ATOM 0 HD11 ILE A 135 5.200 3.358 -0.415 1.00 34.33 H new ATOM 0 HD12 ILE A 135 6.965 3.272 -0.624 1.00 34.33 H new ATOM 0 HD13 ILE A 135 6.197 4.813 -0.176 1.00 34.33 H new ATOM 1998 N ARG A 136 9.395 7.644 -2.260 1.00 71.30 N ATOM 1999 CA ARG A 136 10.310 8.564 -2.896 1.00 61.15 C ATOM 2000 C ARG A 136 11.590 7.849 -3.296 1.00 42.42 C ATOM 2001 O ARG A 136 12.480 7.622 -2.482 1.00 15.53 O ATOM 2002 CB ARG A 136 10.581 9.758 -1.978 1.00 13.20 C ATOM 2003 CG ARG A 136 9.338 10.599 -1.712 1.00 71.42 C ATOM 2004 CD ARG A 136 9.555 11.621 -0.609 1.00 71.33 C ATOM 2005 NE ARG A 136 10.678 12.516 -0.877 1.00 44.35 N ATOM 2006 CZ ARG A 136 10.566 13.808 -1.199 1.00 62.01 C ATOM 2007 NH1 ARG A 136 9.374 14.357 -1.427 1.00 23.33 N ATOM 2008 NH2 ARG A 136 11.665 14.539 -1.321 1.00 73.33 N ATOM 0 H ARG A 136 9.643 7.384 -1.305 1.00 71.30 H new ATOM 0 HA ARG A 136 9.856 8.948 -3.809 1.00 61.15 H new ATOM 0 HB2 ARG A 136 10.979 9.397 -1.029 1.00 13.20 H new ATOM 0 HB3 ARG A 136 11.349 10.387 -2.427 1.00 13.20 H new ATOM 0 HG2 ARG A 136 9.048 11.113 -2.628 1.00 71.42 H new ATOM 0 HG3 ARG A 136 8.511 9.944 -1.439 1.00 71.42 H new ATOM 0 HD2 ARG A 136 8.648 12.212 -0.484 1.00 71.33 H new ATOM 0 HD3 ARG A 136 9.728 11.100 0.333 1.00 71.33 H new ATOM 0 HE ARG A 136 11.618 12.125 -0.814 1.00 44.35 H new ATOM 0 HH11 ARG A 136 8.529 13.790 -1.357 1.00 23.33 H new ATOM 0 HH12 ARG A 136 9.306 15.345 -1.672 1.00 23.33 H new ATOM 0 HH21 ARG A 136 12.580 14.114 -1.170 1.00 73.33 H new ATOM 0 HH22 ARG A 136 11.596 15.527 -1.566 1.00 73.33 H new ATOM 2022 N ALA A 137 11.657 7.468 -4.557 1.00 63.43 N ATOM 2023 CA ALA A 137 12.834 6.823 -5.089 1.00 2.33 C ATOM 2024 C ALA A 137 13.626 7.862 -5.854 1.00 54.34 C ATOM 2025 O ALA A 137 13.171 8.371 -6.875 1.00 20.51 O ATOM 2026 CB ALA A 137 12.458 5.631 -5.960 1.00 63.44 C ATOM 0 H ALA A 137 10.904 7.597 -5.233 1.00 63.43 H new ATOM 0 HA ALA A 137 13.448 6.424 -4.282 1.00 2.33 H new ATOM 0 HB1 ALA A 137 13.363 5.164 -6.348 1.00 63.44 H new ATOM 0 HB2 ALA A 137 11.902 4.907 -5.365 1.00 63.44 H new ATOM 0 HB3 ALA A 137 11.839 5.969 -6.791 1.00 63.44 H new ATOM 2032 N LEU A 138 14.783 8.196 -5.321 1.00 42.34 N ATOM 2033 CA LEU A 138 15.585 9.312 -5.793 1.00 65.35 C ATOM 2034 C LEU A 138 16.386 8.947 -7.020 1.00 31.11 C ATOM 2035 O LEU A 138 16.934 7.845 -7.117 1.00 43.42 O ATOM 2036 CB LEU A 138 16.532 9.804 -4.696 1.00 63.32 C ATOM 2037 CG LEU A 138 15.870 10.331 -3.424 1.00 0.33 C ATOM 2038 CD1 LEU A 138 16.925 10.843 -2.462 1.00 55.45 C ATOM 2039 CD2 LEU A 138 14.868 11.424 -3.756 1.00 51.44 C ATOM 0 H LEU A 138 15.201 7.695 -4.537 1.00 42.34 H new ATOM 0 HA LEU A 138 14.892 10.110 -6.059 1.00 65.35 H new ATOM 0 HB2 LEU A 138 17.196 8.984 -4.423 1.00 63.32 H new ATOM 0 HB3 LEU A 138 17.156 10.595 -5.111 1.00 63.32 H new ATOM 0 HG LEU A 138 15.331 9.513 -2.945 1.00 0.33 H new ATOM 0 HD11 LEU A 138 16.443 11.216 -1.559 1.00 55.45 H new ATOM 0 HD12 LEU A 138 17.605 10.032 -2.202 1.00 55.45 H new ATOM 0 HD13 LEU A 138 17.487 11.649 -2.933 1.00 55.45 H new ATOM 0 HD21 LEU A 138 14.407 11.786 -2.837 1.00 51.44 H new ATOM 0 HD22 LEU A 138 15.380 12.247 -4.255 1.00 51.44 H new ATOM 0 HD23 LEU A 138 14.098 11.023 -4.415 1.00 51.44 H new ATOM 2051 N GLU A 139 16.458 9.899 -7.937 1.00 42.21 N ATOM 2052 CA GLU A 139 17.144 9.726 -9.201 1.00 10.41 C ATOM 2053 C GLU A 139 18.654 9.876 -9.001 1.00 43.14 C ATOM 2054 O GLU A 139 19.106 10.778 -8.291 1.00 20.45 O ATOM 2055 CB GLU A 139 16.584 10.752 -10.200 1.00 12.14 C ATOM 2056 CG GLU A 139 16.480 10.269 -11.639 1.00 2.52 C ATOM 2057 CD GLU A 139 17.804 10.271 -12.371 1.00 12.31 C ATOM 2058 OE1 GLU A 139 18.234 11.358 -12.802 1.00 34.35 O ATOM 2059 OE2 GLU A 139 18.406 9.193 -12.525 1.00 43.14 O ATOM 0 H GLU A 139 16.037 10.821 -7.821 1.00 42.21 H new ATOM 0 HA GLU A 139 16.976 8.726 -9.601 1.00 10.41 H new ATOM 0 HB2 GLU A 139 15.593 11.058 -9.864 1.00 12.14 H new ATOM 0 HB3 GLU A 139 17.216 11.640 -10.177 1.00 12.14 H new ATOM 0 HG2 GLU A 139 16.071 9.259 -11.647 1.00 2.52 H new ATOM 0 HG3 GLU A 139 15.775 10.903 -12.177 1.00 2.52 H new ATOM 2066 N HIS A 140 19.416 8.970 -9.599 1.00 72.32 N ATOM 2067 CA HIS A 140 20.877 8.982 -9.483 1.00 1.20 C ATOM 2068 C HIS A 140 21.479 10.140 -10.286 1.00 13.44 C ATOM 2069 O HIS A 140 21.133 10.329 -11.448 1.00 62.23 O ATOM 2070 CB HIS A 140 21.510 7.625 -9.898 1.00 35.11 C ATOM 2071 CG HIS A 140 21.036 7.015 -11.201 1.00 55.32 C ATOM 2072 ND1 HIS A 140 21.383 7.494 -12.443 1.00 72.24 N ATOM 2073 CD2 HIS A 140 20.233 5.953 -11.432 1.00 44.23 C ATOM 2074 CE1 HIS A 140 20.818 6.752 -13.376 1.00 22.23 C ATOM 2075 NE2 HIS A 140 20.113 5.809 -12.793 1.00 71.34 N ATOM 0 H HIS A 140 19.049 8.211 -10.174 1.00 72.32 H new ATOM 0 HA HIS A 140 21.115 9.134 -8.430 1.00 1.20 H new ATOM 0 HB2 HIS A 140 22.590 7.760 -9.960 1.00 35.11 H new ATOM 0 HB3 HIS A 140 21.324 6.906 -9.100 1.00 35.11 H new ATOM 0 HD2 HIS A 140 19.769 5.330 -10.682 1.00 44.23 H new ATOM 0 HE1 HIS A 140 20.918 6.896 -14.442 1.00 22.23 H new ATOM 0 HE2 HIS A 140 19.568 5.091 -13.270 1.00 71.34 H new ATOM 2084 N HIS A 141 22.349 10.924 -9.623 1.00 3.14 N ATOM 2085 CA HIS A 141 23.012 12.108 -10.206 1.00 13.35 C ATOM 2086 C HIS A 141 21.961 13.179 -10.603 1.00 72.22 C ATOM 2087 O HIS A 141 22.054 13.834 -11.641 1.00 50.44 O ATOM 2088 CB HIS A 141 23.928 11.686 -11.383 1.00 1.42 C ATOM 2089 CG HIS A 141 24.895 12.726 -11.846 1.00 4.53 C ATOM 2090 ND1 HIS A 141 24.788 13.347 -13.067 1.00 64.03 N ATOM 2091 CD2 HIS A 141 25.988 13.249 -11.254 1.00 0.02 C ATOM 2092 CE1 HIS A 141 25.773 14.206 -13.208 1.00 44.22 C ATOM 2093 NE2 HIS A 141 26.520 14.168 -12.125 1.00 41.41 N ATOM 0 H HIS A 141 22.616 10.751 -8.654 1.00 3.14 H new ATOM 0 HA HIS A 141 23.657 12.571 -9.459 1.00 13.35 H new ATOM 0 HB2 HIS A 141 24.488 10.800 -11.086 1.00 1.42 H new ATOM 0 HB3 HIS A 141 23.299 11.398 -12.225 1.00 1.42 H new ATOM 0 HD2 HIS A 141 26.373 12.993 -10.278 1.00 0.02 H new ATOM 0 HE1 HIS A 141 25.941 14.837 -14.068 1.00 44.22 H new ATOM 0 HE2 HIS A 141 27.356 14.729 -11.960 1.00 41.41 H new ATOM 2102 N HIS A 142 20.967 13.370 -9.734 1.00 11.23 N ATOM 2103 CA HIS A 142 19.930 14.363 -9.984 1.00 53.44 C ATOM 2104 C HIS A 142 20.211 15.645 -9.195 1.00 75.02 C ATOM 2105 O HIS A 142 19.618 16.691 -9.459 1.00 73.43 O ATOM 2106 CB HIS A 142 18.551 13.803 -9.633 1.00 23.42 C ATOM 2107 CG HIS A 142 17.453 14.361 -10.488 1.00 14.22 C ATOM 2108 ND1 HIS A 142 17.152 13.869 -11.738 1.00 35.10 N ATOM 2109 CD2 HIS A 142 16.583 15.367 -10.268 1.00 55.13 C ATOM 2110 CE1 HIS A 142 16.157 14.557 -12.251 1.00 73.22 C ATOM 2111 NE2 HIS A 142 15.789 15.471 -11.379 1.00 50.30 N ATOM 0 H HIS A 142 20.861 12.854 -8.860 1.00 11.23 H new ATOM 0 HA HIS A 142 19.938 14.607 -11.046 1.00 53.44 H new ATOM 0 HB2 HIS A 142 18.569 12.718 -9.738 1.00 23.42 H new ATOM 0 HB3 HIS A 142 18.334 14.019 -8.587 1.00 23.42 H new ATOM 0 HD1 HIS A 142 17.628 13.091 -12.195 1.00 35.10 H new ATOM 0 HD2 HIS A 142 16.523 15.978 -9.380 1.00 55.13 H new ATOM 0 HE1 HIS A 142 15.716 14.399 -13.224 1.00 73.22 H new ATOM 2120 N HIS A 143 21.124 15.558 -8.232 1.00 45.54 N ATOM 2121 CA HIS A 143 21.532 16.721 -7.467 1.00 64.44 C ATOM 2122 C HIS A 143 22.717 17.377 -8.170 1.00 53.52 C ATOM 2123 O HIS A 143 23.848 16.896 -8.087 1.00 52.03 O ATOM 2124 CB HIS A 143 21.891 16.322 -6.025 1.00 33.43 C ATOM 2125 CG HIS A 143 22.089 17.485 -5.093 1.00 44.42 C ATOM 2126 ND1 HIS A 143 21.085 17.988 -4.300 1.00 74.41 N ATOM 2127 CD2 HIS A 143 23.186 18.233 -4.826 1.00 42.21 C ATOM 2128 CE1 HIS A 143 21.552 18.998 -3.591 1.00 24.30 C ATOM 2129 NE2 HIS A 143 22.824 19.166 -3.889 1.00 61.42 N ATOM 0 H HIS A 143 21.593 14.692 -7.966 1.00 45.54 H new ATOM 0 HA HIS A 143 20.709 17.434 -7.410 1.00 64.44 H new ATOM 0 HB2 HIS A 143 21.100 15.685 -5.629 1.00 33.43 H new ATOM 0 HB3 HIS A 143 22.803 15.725 -6.042 1.00 33.43 H new ATOM 0 HD2 HIS A 143 24.164 18.116 -5.269 1.00 42.21 H new ATOM 0 HE1 HIS A 143 20.986 19.588 -2.885 1.00 24.30 H new ATOM 0 HE2 HIS A 143 23.439 19.874 -3.488 1.00 61.42 H new ATOM 2138 N HIS A 144 22.444 18.464 -8.866 1.00 43.51 N ATOM 2139 CA HIS A 144 23.475 19.196 -9.574 1.00 21.02 C ATOM 2140 C HIS A 144 24.005 20.323 -8.692 1.00 63.14 C ATOM 2141 O HIS A 144 23.229 21.079 -8.107 1.00 23.45 O ATOM 2142 CB HIS A 144 22.913 19.731 -10.909 1.00 14.54 C ATOM 2143 CG HIS A 144 23.891 20.502 -11.752 1.00 23.41 C ATOM 2144 ND1 HIS A 144 25.140 20.026 -12.088 1.00 33.34 N ATOM 2145 CD2 HIS A 144 23.802 21.731 -12.304 1.00 13.23 C ATOM 2146 CE1 HIS A 144 25.775 20.929 -12.806 1.00 42.32 C ATOM 2147 NE2 HIS A 144 24.987 21.973 -12.952 1.00 44.53 N ATOM 0 H HIS A 144 21.509 18.862 -8.956 1.00 43.51 H new ATOM 0 HA HIS A 144 24.308 18.532 -9.805 1.00 21.02 H new ATOM 0 HB2 HIS A 144 22.541 18.888 -11.492 1.00 14.54 H new ATOM 0 HB3 HIS A 144 22.058 20.372 -10.694 1.00 14.54 H new ATOM 0 HD2 HIS A 144 22.956 22.399 -12.246 1.00 13.23 H new ATOM 0 HE1 HIS A 144 26.773 20.830 -13.207 1.00 42.32 H new ATOM 0 HE2 HIS A 144 25.220 22.824 -13.464 1.00 44.53 H new ATOM 2156 N HIS A 145 25.327 20.404 -8.595 1.00 52.23 N ATOM 2157 CA HIS A 145 25.983 21.490 -7.889 1.00 13.31 C ATOM 2158 C HIS A 145 26.150 22.681 -8.839 1.00 31.32 C ATOM 2159 O HIS A 145 26.537 22.516 -9.995 1.00 51.13 O ATOM 2160 CB HIS A 145 27.344 21.024 -7.325 1.00 3.52 C ATOM 2161 CG HIS A 145 28.098 22.075 -6.550 1.00 24.23 C ATOM 2162 ND1 HIS A 145 27.639 22.615 -5.371 1.00 34.41 N ATOM 2163 CD2 HIS A 145 29.266 22.706 -6.814 1.00 45.14 C ATOM 2164 CE1 HIS A 145 28.485 23.536 -4.948 1.00 72.02 C ATOM 2165 NE2 HIS A 145 29.479 23.610 -5.803 1.00 73.32 N ATOM 0 H HIS A 145 25.968 19.722 -9.002 1.00 52.23 H new ATOM 0 HA HIS A 145 25.369 21.801 -7.044 1.00 13.31 H new ATOM 0 HB2 HIS A 145 27.178 20.163 -6.677 1.00 3.52 H new ATOM 0 HB3 HIS A 145 27.968 20.685 -8.152 1.00 3.52 H new ATOM 0 HD2 HIS A 145 29.911 22.531 -7.663 1.00 45.14 H new ATOM 0 HE1 HIS A 145 28.378 24.128 -4.051 1.00 72.02 H new ATOM 0 HE2 HIS A 145 30.280 24.238 -5.728 1.00 73.32 H new TER 2174 HIS A 145