USER MOD reduce.3.24.130724 H: found=0, std=0, add=1060, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 890 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 108 SER OG : rot 180:sc= 0.978 USER MOD Set 1.2: A 130 SER OG : rot 130:sc= 1.25 USER MOD Set 2.1: A 92 THR OG1 : rot 76:sc= 1.42! USER MOD Set 2.2: A 95 TYR OH : rot -35:sc= 0.841! USER MOD Set 3.1: A 78 SER OG : rot 176:sc= 0 USER MOD Set 3.2: A 80 TYR OH : rot 30:sc= -0.464 USER MOD Set 4.1: A 45 TYR OH : rot 180:sc= -2.37 USER MOD Set 4.2: A 61 GLN : amide:sc= -0.165 K(o=-1.4,f=-6.8!) USER MOD Set 4.3: A 63 TYR OH : rot 123:sc= 1.11 USER MOD Set 5.1: A 25 ASN : amide:sc= -1.34 K(o=-2.2,f=-8.7!) USER MOD Set 5.2: A 42 SER OG : rot 20:sc= 0.299 USER MOD Set 5.3: A 44 THR OG1 : rot 180:sc= 0 USER MOD Set 5.4: A 66 THR OG1 : rot 180:sc= -1.2 USER MOD Set 6.1: A 12 SER OG : rot -150:sc= -1.4 USER MOD Set 6.2: A 139 THR OG1 : rot 180:sc= -1.8 USER MOD Single : A 2 THR OG1 : rot -150:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot -170:sc=-0.00395 USER MOD Single : A 6 THR OG1 : rot -24:sc= 0.0802 USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 15 GLN : amide:sc= -0.901 K(o=-0.9,f=-4.6!) USER MOD Single : A 17 GLN : amide:sc= -1.66 K(o=-1.7,f=-6.3!) USER MOD Single : A 18 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 ASN : amide:sc= 1.1 K(o=1.1,f=-1.4!) USER MOD Single : A 20 LYS NZ :NH3+ -149:sc= 0 (180deg=-0.0293) USER MOD Single : A 21 MET CE :methyl -157:sc= -0.189 (180deg=-1.44!) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 TYR OH : rot 0:sc= -2.11 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 SER OG : rot 29:sc= 0.0175 USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= -0.0682 K(o=-0.068,f=-0.96) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 ASN : amide:sc= -5.11! C(o=-5.1!,f=-7.4!) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= -1.63 K(o=-1.6,f=-2.8) USER MOD Single : A 87 TYR OH : rot -82:sc= 1.18 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 GLN : amide:sc= -1.04 K(o=-1,f=-2.9!) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot -37:sc= 0.713 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ -155:sc= -0.0121 (180deg=-0.517) USER MOD Single : A 100 ASN : amide:sc= -0.0722 K(o=-0.072,f=-1.3) USER MOD Single : A 102 THR OG1 : rot 180:sc= -0.171 USER MOD Single : A 103 SER OG : rot 120:sc= -1.1 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 GLN : amide:sc= -0.468 X(o=-0.47,f=-0.072) USER MOD Single : A 116 ASN : amide:sc= 0 X(o=0,f=-0.06) USER MOD Single : A 118 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 120 ASN : amide:sc= -3.25! C(o=-3.2!,f=-11!) USER MOD Single : A 126 SER OG : rot 180:sc= -0.27 USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= 0 X(o=0,f=-0.041) USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 146 TYR OH : rot 30:sc= -0.128 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 2 124.545 -17.943 1.745 1.00 0.00 N ATOM 2 CA THR A 2 124.294 -17.512 0.339 1.00 0.00 C ATOM 3 C THR A 2 123.907 -16.028 0.307 1.00 0.00 C ATOM 4 O THR A 2 123.529 -15.458 1.314 1.00 0.00 O ATOM 5 CB THR A 2 123.143 -18.402 -0.151 1.00 0.00 C ATOM 6 OG1 THR A 2 122.950 -18.200 -1.543 1.00 0.00 O ATOM 7 CG2 THR A 2 121.853 -18.064 0.604 1.00 0.00 C ATOM 0 HA THR A 2 125.173 -17.616 -0.296 1.00 0.00 H new ATOM 0 HB THR A 2 123.396 -19.446 0.036 1.00 0.00 H new ATOM 0 HG1 THR A 2 122.008 -18.348 -1.768 1.00 0.00 H new ATOM 0 HG21 THR A 2 121.045 -18.702 0.247 1.00 0.00 H new ATOM 0 HG22 THR A 2 122.002 -18.230 1.671 1.00 0.00 H new ATOM 0 HG23 THR A 2 121.594 -17.019 0.432 1.00 0.00 H new ATOM 15 N SER A 3 123.998 -15.398 -0.836 1.00 0.00 N ATOM 16 CA SER A 3 123.634 -13.955 -0.923 1.00 0.00 C ATOM 17 C SER A 3 122.636 -13.741 -2.059 1.00 0.00 C ATOM 18 O SER A 3 122.713 -14.387 -3.086 1.00 0.00 O ATOM 19 CB SER A 3 124.946 -13.230 -1.215 1.00 0.00 C ATOM 20 OG SER A 3 124.722 -11.826 -1.193 1.00 0.00 O ATOM 0 H SER A 3 124.308 -15.821 -1.711 1.00 0.00 H new ATOM 0 HA SER A 3 123.166 -13.587 -0.010 1.00 0.00 H new ATOM 0 HB2 SER A 3 125.698 -13.502 -0.474 1.00 0.00 H new ATOM 0 HB3 SER A 3 125.334 -13.533 -2.188 1.00 0.00 H new ATOM 0 HG SER A 3 125.563 -11.358 -1.378 1.00 0.00 H new ATOM 25 N THR A 4 121.711 -12.833 -1.896 1.00 0.00 N ATOM 26 CA THR A 4 120.726 -12.577 -2.983 1.00 0.00 C ATOM 27 C THR A 4 120.536 -11.070 -3.173 1.00 0.00 C ATOM 28 O THR A 4 120.413 -10.325 -2.218 1.00 0.00 O ATOM 29 CB THR A 4 119.425 -13.238 -2.519 1.00 0.00 C ATOM 30 OG1 THR A 4 119.684 -14.585 -2.151 1.00 0.00 O ATOM 31 CG2 THR A 4 118.400 -13.207 -3.654 1.00 0.00 C ATOM 0 H THR A 4 121.596 -12.260 -1.060 1.00 0.00 H new ATOM 0 HA THR A 4 121.055 -12.979 -3.941 1.00 0.00 H new ATOM 0 HB THR A 4 119.030 -12.695 -1.660 1.00 0.00 H new ATOM 0 HG1 THR A 4 118.836 -15.053 -2.006 1.00 0.00 H new ATOM 0 HG21 THR A 4 117.475 -13.678 -3.322 1.00 0.00 H new ATOM 0 HG22 THR A 4 118.200 -12.173 -3.936 1.00 0.00 H new ATOM 0 HG23 THR A 4 118.794 -13.748 -4.515 1.00 0.00 H new ATOM 39 N VAL A 5 120.504 -10.622 -4.397 1.00 0.00 N ATOM 40 CA VAL A 5 120.315 -9.164 -4.662 1.00 0.00 C ATOM 41 C VAL A 5 118.909 -8.930 -5.214 1.00 0.00 C ATOM 42 O VAL A 5 118.425 -9.692 -6.029 1.00 0.00 O ATOM 43 CB VAL A 5 121.373 -8.800 -5.706 1.00 0.00 C ATOM 44 CG1 VAL A 5 121.290 -7.303 -6.016 1.00 0.00 C ATOM 45 CG2 VAL A 5 122.766 -9.125 -5.161 1.00 0.00 C ATOM 0 H VAL A 5 120.601 -11.203 -5.230 1.00 0.00 H new ATOM 0 HA VAL A 5 120.421 -8.557 -3.763 1.00 0.00 H new ATOM 0 HB VAL A 5 121.194 -9.374 -6.615 1.00 0.00 H new ATOM 0 HG11 VAL A 5 122.043 -7.043 -6.760 1.00 0.00 H new ATOM 0 HG12 VAL A 5 120.300 -7.066 -6.405 1.00 0.00 H new ATOM 0 HG13 VAL A 5 121.468 -6.732 -5.105 1.00 0.00 H new ATOM 0 HG21 VAL A 5 123.518 -8.865 -5.906 1.00 0.00 H new ATOM 0 HG22 VAL A 5 122.943 -8.552 -4.251 1.00 0.00 H new ATOM 0 HG23 VAL A 5 122.830 -10.190 -4.937 1.00 0.00 H new ATOM 55 N THR A 6 118.248 -7.885 -4.792 1.00 0.00 N ATOM 56 CA THR A 6 116.875 -7.618 -5.316 1.00 0.00 C ATOM 57 C THR A 6 116.548 -6.127 -5.214 1.00 0.00 C ATOM 58 O THR A 6 116.710 -5.523 -4.170 1.00 0.00 O ATOM 59 CB THR A 6 115.942 -8.435 -4.419 1.00 0.00 C ATOM 60 OG1 THR A 6 116.352 -9.795 -4.428 1.00 0.00 O ATOM 61 CG2 THR A 6 114.508 -8.328 -4.940 1.00 0.00 C ATOM 0 H THR A 6 118.595 -7.209 -4.112 1.00 0.00 H new ATOM 0 HA THR A 6 116.775 -7.892 -6.366 1.00 0.00 H new ATOM 0 HB THR A 6 115.985 -8.049 -3.401 1.00 0.00 H new ATOM 0 HG1 THR A 6 116.853 -9.980 -5.250 1.00 0.00 H new ATOM 0 HG21 THR A 6 113.844 -8.910 -4.301 1.00 0.00 H new ATOM 0 HG22 THR A 6 114.195 -7.284 -4.933 1.00 0.00 H new ATOM 0 HG23 THR A 6 114.461 -8.714 -5.958 1.00 0.00 H new ATOM 69 N GLY A 7 116.088 -5.527 -6.282 1.00 0.00 N ATOM 70 CA GLY A 7 115.753 -4.076 -6.231 1.00 0.00 C ATOM 71 C GLY A 7 114.886 -3.703 -7.435 1.00 0.00 C ATOM 72 O GLY A 7 114.734 -4.476 -8.361 1.00 0.00 O ATOM 0 H GLY A 7 115.931 -5.979 -7.183 1.00 0.00 H new ATOM 0 HA2 GLY A 7 115.224 -3.848 -5.306 1.00 0.00 H new ATOM 0 HA3 GLY A 7 116.667 -3.482 -6.231 1.00 0.00 H new ATOM 75 N GLY A 8 114.321 -2.521 -7.431 1.00 0.00 N ATOM 76 CA GLY A 8 113.464 -2.093 -8.576 1.00 0.00 C ATOM 77 C GLY A 8 112.999 -0.649 -8.365 1.00 0.00 C ATOM 78 O GLY A 8 113.789 0.230 -8.078 1.00 0.00 O ATOM 0 H GLY A 8 114.417 -1.834 -6.683 1.00 0.00 H new ATOM 0 HA2 GLY A 8 114.022 -2.172 -9.509 1.00 0.00 H new ATOM 0 HA3 GLY A 8 112.601 -2.753 -8.663 1.00 0.00 H new ATOM 81 N TYR A 9 111.722 -0.400 -8.506 1.00 0.00 N ATOM 82 CA TYR A 9 111.196 0.988 -8.316 1.00 0.00 C ATOM 83 C TYR A 9 110.042 0.971 -7.311 1.00 0.00 C ATOM 84 O TYR A 9 109.423 -0.057 -7.091 1.00 0.00 O ATOM 85 CB TYR A 9 110.699 1.421 -9.697 1.00 0.00 C ATOM 86 CG TYR A 9 111.849 1.403 -10.678 1.00 0.00 C ATOM 87 CD1 TYR A 9 112.739 2.482 -10.735 1.00 0.00 C ATOM 88 CD2 TYR A 9 112.024 0.306 -11.531 1.00 0.00 C ATOM 89 CE1 TYR A 9 113.804 2.464 -11.644 1.00 0.00 C ATOM 90 CE2 TYR A 9 113.088 0.289 -12.440 1.00 0.00 C ATOM 91 CZ TYR A 9 113.979 1.368 -12.496 1.00 0.00 C ATOM 92 OH TYR A 9 115.028 1.351 -13.391 1.00 0.00 O ATOM 0 H TYR A 9 111.019 -1.099 -8.745 1.00 0.00 H new ATOM 0 HA TYR A 9 111.953 1.670 -7.928 1.00 0.00 H new ATOM 0 HB2 TYR A 9 109.908 0.752 -10.036 1.00 0.00 H new ATOM 0 HB3 TYR A 9 110.269 2.421 -9.643 1.00 0.00 H new ATOM 0 HD1 TYR A 9 112.604 3.328 -10.078 1.00 0.00 H new ATOM 0 HD2 TYR A 9 111.338 -0.527 -11.487 1.00 0.00 H new ATOM 0 HE1 TYR A 9 114.491 3.296 -11.687 1.00 0.00 H new ATOM 0 HE2 TYR A 9 113.222 -0.556 -13.098 1.00 0.00 H new ATOM 0 HH TYR A 9 115.005 0.518 -13.906 1.00 0.00 H new ATOM 101 N ALA A 10 109.743 2.090 -6.692 1.00 0.00 N ATOM 102 CA ALA A 10 108.628 2.103 -5.704 1.00 0.00 C ATOM 103 C ALA A 10 107.697 3.294 -5.941 1.00 0.00 C ATOM 104 O ALA A 10 108.082 4.437 -5.791 1.00 0.00 O ATOM 105 CB ALA A 10 109.310 2.223 -4.341 1.00 0.00 C ATOM 0 H ALA A 10 110.219 2.982 -6.829 1.00 0.00 H new ATOM 0 HA ALA A 10 108.010 1.209 -5.781 1.00 0.00 H new ATOM 0 HB1 ALA A 10 108.554 2.239 -3.556 1.00 0.00 H new ATOM 0 HB2 ALA A 10 109.972 1.371 -4.189 1.00 0.00 H new ATOM 0 HB3 ALA A 10 109.891 3.145 -4.305 1.00 0.00 H new ATOM 111 N GLN A 11 106.464 3.026 -6.277 1.00 0.00 N ATOM 112 CA GLN A 11 105.478 4.125 -6.494 1.00 0.00 C ATOM 113 C GLN A 11 104.413 4.029 -5.404 1.00 0.00 C ATOM 114 O GLN A 11 104.043 2.942 -4.999 1.00 0.00 O ATOM 115 CB GLN A 11 104.872 3.860 -7.872 1.00 0.00 C ATOM 116 CG GLN A 11 105.963 3.965 -8.941 1.00 0.00 C ATOM 117 CD GLN A 11 105.370 3.644 -10.316 1.00 0.00 C ATOM 118 OE1 GLN A 11 104.310 3.057 -10.414 1.00 0.00 O ATOM 119 NE2 GLN A 11 106.015 4.007 -11.392 1.00 0.00 N ATOM 0 H GLN A 11 106.094 2.085 -6.412 1.00 0.00 H new ATOM 0 HA GLN A 11 105.921 5.120 -6.451 1.00 0.00 H new ATOM 0 HB2 GLN A 11 104.419 2.869 -7.897 1.00 0.00 H new ATOM 0 HB3 GLN A 11 104.078 4.579 -8.076 1.00 0.00 H new ATOM 0 HG2 GLN A 11 106.389 4.969 -8.943 1.00 0.00 H new ATOM 0 HG3 GLN A 11 106.776 3.275 -8.714 1.00 0.00 H new ATOM 0 HE21 GLN A 11 106.905 4.500 -11.312 1.00 0.00 H new ATOM 0 HE22 GLN A 11 105.629 3.798 -12.313 1.00 0.00 H new ATOM 126 N SER A 12 103.931 5.135 -4.897 1.00 0.00 N ATOM 127 CA SER A 12 102.916 5.040 -3.807 1.00 0.00 C ATOM 128 C SER A 12 101.997 6.258 -3.750 1.00 0.00 C ATOM 129 O SER A 12 102.367 7.359 -4.118 1.00 0.00 O ATOM 130 CB SER A 12 103.749 4.973 -2.530 1.00 0.00 C ATOM 131 OG SER A 12 104.309 6.254 -2.270 1.00 0.00 O ATOM 0 H SER A 12 104.189 6.079 -5.183 1.00 0.00 H new ATOM 0 HA SER A 12 102.261 4.182 -3.958 1.00 0.00 H new ATOM 0 HB2 SER A 12 103.127 4.658 -1.692 1.00 0.00 H new ATOM 0 HB3 SER A 12 104.541 4.231 -2.636 1.00 0.00 H new ATOM 0 HG SER A 12 105.162 6.149 -1.800 1.00 0.00 H new ATOM 136 N ASP A 13 100.815 6.064 -3.222 1.00 0.00 N ATOM 137 CA ASP A 13 99.862 7.192 -3.049 1.00 0.00 C ATOM 138 C ASP A 13 100.073 7.715 -1.633 1.00 0.00 C ATOM 139 O ASP A 13 100.515 6.978 -0.778 1.00 0.00 O ATOM 140 CB ASP A 13 98.467 6.582 -3.212 1.00 0.00 C ATOM 141 CG ASP A 13 98.287 6.063 -4.643 1.00 0.00 C ATOM 142 OD1 ASP A 13 99.051 6.466 -5.506 1.00 0.00 O ATOM 143 OD2 ASP A 13 97.385 5.268 -4.852 1.00 0.00 O ATOM 0 H ASP A 13 100.470 5.160 -2.901 1.00 0.00 H new ATOM 0 HA ASP A 13 99.994 8.009 -3.758 1.00 0.00 H new ATOM 0 HB2 ASP A 13 98.332 5.767 -2.501 1.00 0.00 H new ATOM 0 HB3 ASP A 13 97.706 7.329 -2.989 1.00 0.00 H new ATOM 147 N ALA A 14 99.799 8.963 -1.363 1.00 0.00 N ATOM 148 CA ALA A 14 100.046 9.466 0.012 1.00 0.00 C ATOM 149 C ALA A 14 98.888 10.313 0.523 1.00 0.00 C ATOM 150 O ALA A 14 98.568 11.353 -0.021 1.00 0.00 O ATOM 151 CB ALA A 14 101.314 10.308 -0.109 1.00 0.00 C ATOM 0 H ALA A 14 99.422 9.643 -2.024 1.00 0.00 H new ATOM 0 HA ALA A 14 100.148 8.648 0.725 1.00 0.00 H new ATOM 0 HB1 ALA A 14 101.571 10.721 0.866 1.00 0.00 H new ATOM 0 HB2 ALA A 14 102.133 9.683 -0.466 1.00 0.00 H new ATOM 0 HB3 ALA A 14 101.145 11.122 -0.814 1.00 0.00 H new ATOM 157 N GLN A 15 98.284 9.881 1.591 1.00 0.00 N ATOM 158 CA GLN A 15 97.164 10.657 2.191 1.00 0.00 C ATOM 159 C GLN A 15 97.743 11.917 2.833 1.00 0.00 C ATOM 160 O GLN A 15 98.601 11.846 3.699 1.00 0.00 O ATOM 161 CB GLN A 15 96.552 9.736 3.249 1.00 0.00 C ATOM 162 CG GLN A 15 95.920 8.521 2.564 1.00 0.00 C ATOM 163 CD GLN A 15 95.357 7.568 3.623 1.00 0.00 C ATOM 164 OE1 GLN A 15 95.730 7.633 4.778 1.00 0.00 O ATOM 165 NE2 GLN A 15 94.467 6.680 3.274 1.00 0.00 N ATOM 0 H GLN A 15 98.519 9.017 2.079 1.00 0.00 H new ATOM 0 HA GLN A 15 96.413 10.964 1.463 1.00 0.00 H new ATOM 0 HB2 GLN A 15 97.319 9.412 3.952 1.00 0.00 H new ATOM 0 HB3 GLN A 15 95.799 10.275 3.824 1.00 0.00 H new ATOM 0 HG2 GLN A 15 95.125 8.843 1.891 1.00 0.00 H new ATOM 0 HG3 GLN A 15 96.664 8.006 1.956 1.00 0.00 H new ATOM 0 HE21 GLN A 15 94.154 6.625 2.305 1.00 0.00 H new ATOM 0 HE22 GLN A 15 94.084 6.040 3.970 1.00 0.00 H new ATOM 172 N GLY A 16 97.312 13.062 2.375 1.00 0.00 N ATOM 173 CA GLY A 16 97.856 14.349 2.897 1.00 0.00 C ATOM 174 C GLY A 16 98.788 14.956 1.832 1.00 0.00 C ATOM 175 O GLY A 16 99.115 16.126 1.869 1.00 0.00 O ATOM 0 H GLY A 16 96.598 13.161 1.653 1.00 0.00 H new ATOM 0 HA2 GLY A 16 97.043 15.038 3.126 1.00 0.00 H new ATOM 0 HA3 GLY A 16 98.402 14.180 3.825 1.00 0.00 H new ATOM 178 N GLN A 17 99.182 14.162 0.864 1.00 0.00 N ATOM 179 CA GLN A 17 100.054 14.668 -0.236 1.00 0.00 C ATOM 180 C GLN A 17 99.290 14.585 -1.561 1.00 0.00 C ATOM 181 O GLN A 17 98.365 13.808 -1.697 1.00 0.00 O ATOM 182 CB GLN A 17 101.271 13.745 -0.247 1.00 0.00 C ATOM 183 CG GLN A 17 102.020 13.871 1.082 1.00 0.00 C ATOM 184 CD GLN A 17 103.239 12.943 1.080 1.00 0.00 C ATOM 185 OE1 GLN A 17 103.369 12.087 0.227 1.00 0.00 O ATOM 186 NE2 GLN A 17 104.144 13.077 2.010 1.00 0.00 N ATOM 0 H GLN A 17 98.932 13.176 0.792 1.00 0.00 H new ATOM 0 HA GLN A 17 100.352 15.707 -0.095 1.00 0.00 H new ATOM 0 HB2 GLN A 17 100.957 12.713 -0.403 1.00 0.00 H new ATOM 0 HB3 GLN A 17 101.931 14.006 -1.075 1.00 0.00 H new ATOM 0 HG2 GLN A 17 102.337 14.903 1.235 1.00 0.00 H new ATOM 0 HG3 GLN A 17 101.358 13.615 1.909 1.00 0.00 H new ATOM 0 HE21 GLN A 17 104.036 13.795 2.727 1.00 0.00 H new ATOM 0 HE22 GLN A 17 104.959 12.464 2.021 1.00 0.00 H new ATOM 193 N MET A 18 99.656 15.377 -2.536 1.00 0.00 N ATOM 194 CA MET A 18 98.931 15.331 -3.841 1.00 0.00 C ATOM 195 C MET A 18 99.664 14.430 -4.846 1.00 0.00 C ATOM 196 O MET A 18 99.259 13.310 -5.094 1.00 0.00 O ATOM 197 CB MET A 18 98.905 16.782 -4.327 1.00 0.00 C ATOM 198 CG MET A 18 98.031 17.618 -3.391 1.00 0.00 C ATOM 199 SD MET A 18 97.901 19.305 -4.036 1.00 0.00 S ATOM 200 CE MET A 18 97.001 20.015 -2.636 1.00 0.00 C ATOM 0 H MET A 18 100.421 16.050 -2.486 1.00 0.00 H new ATOM 0 HA MET A 18 97.929 14.915 -3.737 1.00 0.00 H new ATOM 0 HB2 MET A 18 99.917 17.186 -4.354 1.00 0.00 H new ATOM 0 HB3 MET A 18 98.516 16.829 -5.344 1.00 0.00 H new ATOM 0 HG2 MET A 18 97.040 17.172 -3.306 1.00 0.00 H new ATOM 0 HG3 MET A 18 98.461 17.632 -2.390 1.00 0.00 H new ATOM 0 HE1 MET A 18 96.810 21.072 -2.824 1.00 0.00 H new ATOM 0 HE2 MET A 18 96.053 19.492 -2.510 1.00 0.00 H new ATOM 0 HE3 MET A 18 97.597 19.910 -1.729 1.00 0.00 H new ATOM 208 N ASN A 19 100.724 14.917 -5.437 1.00 0.00 N ATOM 209 CA ASN A 19 101.469 14.097 -6.442 1.00 0.00 C ATOM 210 C ASN A 19 102.119 12.878 -5.781 1.00 0.00 C ATOM 211 O ASN A 19 102.735 12.978 -4.737 1.00 0.00 O ATOM 212 CB ASN A 19 102.538 15.035 -7.006 1.00 0.00 C ATOM 213 CG ASN A 19 101.866 16.192 -7.749 1.00 0.00 C ATOM 214 OD1 ASN A 19 100.711 16.106 -8.120 1.00 0.00 O ATOM 215 ND2 ASN A 19 102.545 17.282 -7.983 1.00 0.00 N ATOM 0 H ASN A 19 101.107 15.847 -5.268 1.00 0.00 H new ATOM 0 HA ASN A 19 100.809 13.711 -7.218 1.00 0.00 H new ATOM 0 HB2 ASN A 19 103.160 15.421 -6.199 1.00 0.00 H new ATOM 0 HB3 ASN A 19 103.196 14.489 -7.682 1.00 0.00 H new ATOM 0 HD21 ASN A 19 102.107 18.060 -8.476 1.00 0.00 H new ATOM 0 HD22 ASN A 19 103.514 17.356 -7.673 1.00 0.00 H new ATOM 221 N LYS A 20 101.988 11.727 -6.391 1.00 0.00 N ATOM 222 CA LYS A 20 102.597 10.490 -5.813 1.00 0.00 C ATOM 223 C LYS A 20 104.125 10.567 -5.896 1.00 0.00 C ATOM 224 O LYS A 20 104.677 11.531 -6.393 1.00 0.00 O ATOM 225 CB LYS A 20 102.050 9.334 -6.662 1.00 0.00 C ATOM 226 CG LYS A 20 102.574 9.436 -8.100 1.00 0.00 C ATOM 227 CD LYS A 20 101.907 8.362 -8.961 1.00 0.00 C ATOM 228 CE LYS A 20 102.654 8.234 -10.290 1.00 0.00 C ATOM 229 NZ LYS A 20 103.780 7.300 -10.008 1.00 0.00 N ATOM 0 H LYS A 20 101.484 11.590 -7.267 1.00 0.00 H new ATOM 0 HA LYS A 20 102.349 10.358 -4.760 1.00 0.00 H new ATOM 0 HB2 LYS A 20 102.348 8.381 -6.226 1.00 0.00 H new ATOM 0 HB3 LYS A 20 100.960 9.358 -6.662 1.00 0.00 H new ATOM 0 HG2 LYS A 20 102.364 10.426 -8.506 1.00 0.00 H new ATOM 0 HG3 LYS A 20 103.656 9.309 -8.114 1.00 0.00 H new ATOM 0 HD2 LYS A 20 101.911 7.407 -8.436 1.00 0.00 H new ATOM 0 HD3 LYS A 20 100.864 8.622 -9.142 1.00 0.00 H new ATOM 0 HE2 LYS A 20 102.004 7.844 -11.073 1.00 0.00 H new ATOM 0 HE3 LYS A 20 103.020 9.202 -10.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 104.591 7.541 -10.613 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 104.057 7.382 -9.009 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 103.479 6.324 -10.205 1.00 0.00 H new ATOM 239 N MET A 21 104.814 9.569 -5.402 1.00 0.00 N ATOM 240 CA MET A 21 106.309 9.606 -5.444 1.00 0.00 C ATOM 241 C MET A 21 106.862 8.366 -6.158 1.00 0.00 C ATOM 242 O MET A 21 106.170 7.380 -6.333 1.00 0.00 O ATOM 243 CB MET A 21 106.744 9.626 -3.978 1.00 0.00 C ATOM 244 CG MET A 21 106.149 10.852 -3.284 1.00 0.00 C ATOM 245 SD MET A 21 106.881 11.030 -1.639 1.00 0.00 S ATOM 246 CE MET A 21 106.358 9.426 -0.983 1.00 0.00 C ATOM 0 H MET A 21 104.410 8.736 -4.974 1.00 0.00 H new ATOM 0 HA MET A 21 106.682 10.470 -5.993 1.00 0.00 H new ATOM 0 HB2 MET A 21 106.413 8.716 -3.477 1.00 0.00 H new ATOM 0 HB3 MET A 21 107.832 9.650 -3.911 1.00 0.00 H new ATOM 0 HG2 MET A 21 106.339 11.747 -3.877 1.00 0.00 H new ATOM 0 HG3 MET A 21 105.067 10.748 -3.203 1.00 0.00 H new ATOM 0 HE1 MET A 21 106.333 9.469 0.106 1.00 0.00 H new ATOM 0 HE2 MET A 21 105.364 9.185 -1.360 1.00 0.00 H new ATOM 0 HE3 MET A 21 107.062 8.656 -1.299 1.00 0.00 H new ATOM 254 N GLY A 22 108.107 8.410 -6.569 1.00 0.00 N ATOM 255 CA GLY A 22 108.709 7.236 -7.274 1.00 0.00 C ATOM 256 C GLY A 22 110.213 7.179 -6.995 1.00 0.00 C ATOM 257 O GLY A 22 110.923 8.150 -7.190 1.00 0.00 O ATOM 0 H GLY A 22 108.731 9.208 -6.446 1.00 0.00 H new ATOM 0 HA2 GLY A 22 108.232 6.315 -6.938 1.00 0.00 H new ATOM 0 HA3 GLY A 22 108.532 7.314 -8.347 1.00 0.00 H new ATOM 260 N GLY A 23 110.703 6.062 -6.509 1.00 0.00 N ATOM 261 CA GLY A 23 112.159 5.970 -6.194 1.00 0.00 C ATOM 262 C GLY A 23 112.693 4.579 -6.531 1.00 0.00 C ATOM 263 O GLY A 23 112.112 3.849 -7.311 1.00 0.00 O ATOM 0 H GLY A 23 110.161 5.219 -6.319 1.00 0.00 H new ATOM 0 HA2 GLY A 23 112.708 6.723 -6.759 1.00 0.00 H new ATOM 0 HA3 GLY A 23 112.323 6.183 -5.138 1.00 0.00 H new ATOM 266 N PHE A 24 113.804 4.210 -5.946 1.00 0.00 N ATOM 267 CA PHE A 24 114.393 2.868 -6.222 1.00 0.00 C ATOM 268 C PHE A 24 114.697 2.147 -4.905 1.00 0.00 C ATOM 269 O PHE A 24 114.777 2.758 -3.856 1.00 0.00 O ATOM 270 CB PHE A 24 115.681 3.146 -7.008 1.00 0.00 C ATOM 271 CG PHE A 24 116.625 3.987 -6.177 1.00 0.00 C ATOM 272 CD1 PHE A 24 116.516 5.382 -6.191 1.00 0.00 C ATOM 273 CD2 PHE A 24 117.611 3.368 -5.398 1.00 0.00 C ATOM 274 CE1 PHE A 24 117.392 6.160 -5.425 1.00 0.00 C ATOM 275 CE2 PHE A 24 118.486 4.146 -4.632 1.00 0.00 C ATOM 276 CZ PHE A 24 118.378 5.542 -4.645 1.00 0.00 C ATOM 0 H PHE A 24 114.329 4.784 -5.287 1.00 0.00 H new ATOM 0 HA PHE A 24 113.715 2.225 -6.783 1.00 0.00 H new ATOM 0 HB2 PHE A 24 116.161 2.206 -7.279 1.00 0.00 H new ATOM 0 HB3 PHE A 24 115.444 3.662 -7.938 1.00 0.00 H new ATOM 0 HD1 PHE A 24 115.756 5.858 -6.793 1.00 0.00 H new ATOM 0 HD2 PHE A 24 117.696 2.291 -5.389 1.00 0.00 H new ATOM 0 HE1 PHE A 24 117.308 7.237 -5.435 1.00 0.00 H new ATOM 0 HE2 PHE A 24 119.245 3.669 -4.030 1.00 0.00 H new ATOM 0 HZ PHE A 24 119.054 6.142 -4.054 1.00 0.00 H new ATOM 285 N ASN A 25 114.855 0.850 -4.953 1.00 0.00 N ATOM 286 CA ASN A 25 115.140 0.090 -3.700 1.00 0.00 C ATOM 287 C ASN A 25 116.154 -1.031 -3.946 1.00 0.00 C ATOM 288 O ASN A 25 116.021 -1.809 -4.865 1.00 0.00 O ATOM 289 CB ASN A 25 113.788 -0.495 -3.286 1.00 0.00 C ATOM 290 CG ASN A 25 113.856 -0.987 -1.838 1.00 0.00 C ATOM 291 OD1 ASN A 25 114.918 -1.048 -1.250 1.00 0.00 O ATOM 292 ND2 ASN A 25 112.755 -1.339 -1.232 1.00 0.00 N ATOM 0 H ASN A 25 114.799 0.286 -5.801 1.00 0.00 H new ATOM 0 HA ASN A 25 115.575 0.728 -2.931 1.00 0.00 H new ATOM 0 HB2 ASN A 25 113.009 0.260 -3.387 1.00 0.00 H new ATOM 0 HB3 ASN A 25 113.520 -1.319 -3.947 1.00 0.00 H new ATOM 0 HD21 ASN A 25 112.786 -1.665 -0.266 1.00 0.00 H new ATOM 0 HD22 ASN A 25 111.863 -1.288 -1.724 1.00 0.00 H new ATOM 298 N LEU A 26 117.148 -1.128 -3.106 1.00 0.00 N ATOM 299 CA LEU A 26 118.168 -2.212 -3.245 1.00 0.00 C ATOM 300 C LEU A 26 118.110 -3.062 -1.979 1.00 0.00 C ATOM 301 O LEU A 26 117.926 -2.528 -0.901 1.00 0.00 O ATOM 302 CB LEU A 26 119.511 -1.492 -3.361 1.00 0.00 C ATOM 303 CG LEU A 26 120.614 -2.511 -3.646 1.00 0.00 C ATOM 304 CD1 LEU A 26 120.479 -3.023 -5.081 1.00 0.00 C ATOM 305 CD2 LEU A 26 121.980 -1.844 -3.471 1.00 0.00 C ATOM 0 H LEU A 26 117.300 -0.496 -2.320 1.00 0.00 H new ATOM 0 HA LEU A 26 118.007 -2.862 -4.105 1.00 0.00 H new ATOM 0 HB2 LEU A 26 119.471 -0.751 -4.160 1.00 0.00 H new ATOM 0 HB3 LEU A 26 119.728 -0.954 -2.438 1.00 0.00 H new ATOM 0 HG LEU A 26 120.524 -3.347 -2.952 1.00 0.00 H new ATOM 0 HD11 LEU A 26 121.266 -3.750 -5.284 1.00 0.00 H new ATOM 0 HD12 LEU A 26 119.506 -3.497 -5.208 1.00 0.00 H new ATOM 0 HD13 LEU A 26 120.569 -2.188 -5.775 1.00 0.00 H new ATOM 0 HD21 LEU A 26 122.768 -2.569 -3.674 1.00 0.00 H new ATOM 0 HD22 LEU A 26 122.069 -1.008 -4.165 1.00 0.00 H new ATOM 0 HD23 LEU A 26 122.078 -1.478 -2.449 1.00 0.00 H new ATOM 316 N LYS A 27 118.241 -4.367 -2.061 1.00 0.00 N ATOM 317 CA LYS A 27 118.157 -5.175 -0.810 1.00 0.00 C ATOM 318 C LYS A 27 119.272 -6.226 -0.751 1.00 0.00 C ATOM 319 O LYS A 27 119.669 -6.786 -1.757 1.00 0.00 O ATOM 320 CB LYS A 27 116.796 -5.870 -0.882 1.00 0.00 C ATOM 321 CG LYS A 27 115.681 -4.828 -0.992 1.00 0.00 C ATOM 322 CD LYS A 27 114.323 -5.531 -0.942 1.00 0.00 C ATOM 323 CE LYS A 27 113.211 -4.519 -1.224 1.00 0.00 C ATOM 324 NZ LYS A 27 112.078 -4.941 -0.355 1.00 0.00 N ATOM 0 H LYS A 27 118.399 -4.893 -2.920 1.00 0.00 H new ATOM 0 HA LYS A 27 118.268 -4.550 0.076 1.00 0.00 H new ATOM 0 HB2 LYS A 27 116.765 -6.539 -1.742 1.00 0.00 H new ATOM 0 HB3 LYS A 27 116.645 -6.484 0.006 1.00 0.00 H new ATOM 0 HG2 LYS A 27 115.760 -4.107 -0.178 1.00 0.00 H new ATOM 0 HG3 LYS A 27 115.780 -4.270 -1.923 1.00 0.00 H new ATOM 0 HD2 LYS A 27 114.291 -6.336 -1.677 1.00 0.00 H new ATOM 0 HD3 LYS A 27 114.174 -5.987 0.037 1.00 0.00 H new ATOM 0 HE2 LYS A 27 113.532 -3.504 -0.989 1.00 0.00 H new ATOM 0 HE3 LYS A 27 112.926 -4.528 -2.276 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 111.275 -4.294 -0.492 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 111.790 -5.908 -0.606 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 112.376 -4.916 0.641 1.00 0.00 H new ATOM 334 N TYR A 28 119.747 -6.517 0.433 1.00 0.00 N ATOM 335 CA TYR A 28 120.809 -7.554 0.600 1.00 0.00 C ATOM 336 C TYR A 28 120.238 -8.712 1.424 1.00 0.00 C ATOM 337 O TYR A 28 119.511 -8.496 2.372 1.00 0.00 O ATOM 338 CB TYR A 28 121.940 -6.859 1.360 1.00 0.00 C ATOM 339 CG TYR A 28 122.477 -5.712 0.537 1.00 0.00 C ATOM 340 CD1 TYR A 28 123.415 -5.957 -0.474 1.00 0.00 C ATOM 341 CD2 TYR A 28 122.043 -4.406 0.789 1.00 0.00 C ATOM 342 CE1 TYR A 28 123.917 -4.895 -1.234 1.00 0.00 C ATOM 343 CE2 TYR A 28 122.546 -3.343 0.028 1.00 0.00 C ATOM 344 CZ TYR A 28 123.482 -3.588 -0.983 1.00 0.00 C ATOM 345 OH TYR A 28 123.979 -2.540 -1.732 1.00 0.00 O ATOM 0 H TYR A 28 119.441 -6.076 1.300 1.00 0.00 H new ATOM 0 HA TYR A 28 121.163 -7.957 -0.349 1.00 0.00 H new ATOM 0 HB2 TYR A 28 121.575 -6.491 2.319 1.00 0.00 H new ATOM 0 HB3 TYR A 28 122.738 -7.570 1.574 1.00 0.00 H new ATOM 0 HD1 TYR A 28 123.751 -6.965 -0.667 1.00 0.00 H new ATOM 0 HD2 TYR A 28 121.321 -4.218 1.570 1.00 0.00 H new ATOM 0 HE1 TYR A 28 124.640 -5.083 -2.014 1.00 0.00 H new ATOM 0 HE2 TYR A 28 122.211 -2.335 0.221 1.00 0.00 H new ATOM 0 HH TYR A 28 124.620 -2.883 -2.389 1.00 0.00 H new ATOM 354 N ARG A 29 120.539 -9.934 1.065 1.00 0.00 N ATOM 355 CA ARG A 29 119.976 -11.088 1.832 1.00 0.00 C ATOM 356 C ARG A 29 121.065 -12.084 2.243 1.00 0.00 C ATOM 357 O ARG A 29 121.988 -12.358 1.502 1.00 0.00 O ATOM 358 CB ARG A 29 119.002 -11.752 0.863 1.00 0.00 C ATOM 359 CG ARG A 29 118.298 -12.925 1.554 1.00 0.00 C ATOM 360 CD ARG A 29 117.334 -13.590 0.569 1.00 0.00 C ATOM 361 NE ARG A 29 116.651 -14.652 1.359 1.00 0.00 N ATOM 362 CZ ARG A 29 116.890 -15.909 1.104 1.00 0.00 C ATOM 363 NH1 ARG A 29 118.114 -16.311 0.895 1.00 0.00 N ATOM 364 NH2 ARG A 29 115.906 -16.765 1.058 1.00 0.00 N ATOM 0 H ARG A 29 121.144 -10.182 0.282 1.00 0.00 H new ATOM 0 HA ARG A 29 119.504 -10.758 2.757 1.00 0.00 H new ATOM 0 HB2 ARG A 29 118.265 -11.026 0.519 1.00 0.00 H new ATOM 0 HB3 ARG A 29 119.537 -12.106 -0.019 1.00 0.00 H new ATOM 0 HG2 ARG A 29 119.033 -13.649 1.905 1.00 0.00 H new ATOM 0 HG3 ARG A 29 117.754 -12.572 2.430 1.00 0.00 H new ATOM 0 HD2 ARG A 29 116.618 -12.871 0.171 1.00 0.00 H new ATOM 0 HD3 ARG A 29 117.868 -14.012 -0.282 1.00 0.00 H new ATOM 0 HE ARG A 29 115.997 -14.397 2.099 1.00 0.00 H new ATOM 0 HH11 ARG A 29 118.884 -15.642 0.931 1.00 0.00 H new ATOM 0 HH12 ARG A 29 118.301 -17.294 0.696 1.00 0.00 H new ATOM 0 HH21 ARG A 29 114.949 -16.451 1.221 1.00 0.00 H new ATOM 0 HH22 ARG A 29 116.094 -17.748 0.859 1.00 0.00 H new ATOM 375 N TYR A 30 120.934 -12.646 3.415 1.00 0.00 N ATOM 376 CA TYR A 30 121.923 -13.655 3.893 1.00 0.00 C ATOM 377 C TYR A 30 121.167 -14.848 4.486 1.00 0.00 C ATOM 378 O TYR A 30 120.247 -14.679 5.264 1.00 0.00 O ATOM 379 CB TYR A 30 122.741 -12.940 4.970 1.00 0.00 C ATOM 380 CG TYR A 30 123.861 -13.843 5.431 1.00 0.00 C ATOM 381 CD1 TYR A 30 125.068 -13.874 4.724 1.00 0.00 C ATOM 382 CD2 TYR A 30 123.691 -14.647 6.564 1.00 0.00 C ATOM 383 CE1 TYR A 30 126.107 -14.710 5.150 1.00 0.00 C ATOM 384 CE2 TYR A 30 124.729 -15.484 6.989 1.00 0.00 C ATOM 385 CZ TYR A 30 125.937 -15.516 6.282 1.00 0.00 C ATOM 386 OH TYR A 30 126.961 -16.341 6.702 1.00 0.00 O ATOM 0 H TYR A 30 120.176 -12.447 4.068 1.00 0.00 H new ATOM 0 HA TYR A 30 122.565 -14.032 3.097 1.00 0.00 H new ATOM 0 HB2 TYR A 30 123.148 -12.009 4.575 1.00 0.00 H new ATOM 0 HB3 TYR A 30 122.102 -12.676 5.812 1.00 0.00 H new ATOM 0 HD1 TYR A 30 125.198 -13.253 3.850 1.00 0.00 H new ATOM 0 HD2 TYR A 30 122.759 -14.621 7.110 1.00 0.00 H new ATOM 0 HE1 TYR A 30 127.039 -14.733 4.606 1.00 0.00 H new ATOM 0 HE2 TYR A 30 124.598 -16.105 7.863 1.00 0.00 H new ATOM 0 HH TYR A 30 126.679 -16.831 7.502 1.00 0.00 H new ATOM 395 N GLU A 31 121.538 -16.050 4.127 1.00 0.00 N ATOM 396 CA GLU A 31 120.827 -17.246 4.673 1.00 0.00 C ATOM 397 C GLU A 31 121.815 -18.387 4.926 1.00 0.00 C ATOM 398 O GLU A 31 122.815 -18.514 4.243 1.00 0.00 O ATOM 399 CB GLU A 31 119.821 -17.639 3.589 1.00 0.00 C ATOM 400 CG GLU A 31 118.936 -18.781 4.101 1.00 0.00 C ATOM 401 CD GLU A 31 117.995 -19.257 2.987 1.00 0.00 C ATOM 402 OE1 GLU A 31 118.088 -18.739 1.885 1.00 0.00 O ATOM 403 OE2 GLU A 31 117.194 -20.138 3.257 1.00 0.00 O ATOM 0 H GLU A 31 122.300 -16.255 3.481 1.00 0.00 H new ATOM 0 HA GLU A 31 120.341 -17.034 5.625 1.00 0.00 H new ATOM 0 HB2 GLU A 31 119.206 -16.780 3.321 1.00 0.00 H new ATOM 0 HB3 GLU A 31 120.346 -17.949 2.686 1.00 0.00 H new ATOM 0 HG2 GLU A 31 119.558 -19.609 4.441 1.00 0.00 H new ATOM 0 HG3 GLU A 31 118.355 -18.445 4.960 1.00 0.00 H new ATOM 408 N GLU A 32 121.542 -19.223 5.895 1.00 0.00 N ATOM 409 CA GLU A 32 122.461 -20.358 6.185 1.00 0.00 C ATOM 410 C GLU A 32 121.851 -21.658 5.651 1.00 0.00 C ATOM 411 O GLU A 32 120.687 -21.941 5.861 1.00 0.00 O ATOM 412 CB GLU A 32 122.574 -20.390 7.711 1.00 0.00 C ATOM 413 CG GLU A 32 123.713 -21.327 8.126 1.00 0.00 C ATOM 414 CD GLU A 32 123.759 -21.453 9.654 1.00 0.00 C ATOM 415 OE1 GLU A 32 122.919 -20.860 10.313 1.00 0.00 O ATOM 416 OE2 GLU A 32 124.640 -22.144 10.142 1.00 0.00 O ATOM 0 H GLU A 32 120.721 -19.166 6.497 1.00 0.00 H new ATOM 0 HA GLU A 32 123.438 -20.247 5.714 1.00 0.00 H new ATOM 0 HB2 GLU A 32 122.759 -19.386 8.093 1.00 0.00 H new ATOM 0 HB3 GLU A 32 121.634 -20.729 8.148 1.00 0.00 H new ATOM 0 HG2 GLU A 32 123.569 -22.309 7.676 1.00 0.00 H new ATOM 0 HG3 GLU A 32 124.664 -20.943 7.756 1.00 0.00 H new ATOM 421 N ASP A 33 122.626 -22.442 4.951 1.00 0.00 N ATOM 422 CA ASP A 33 122.099 -23.723 4.383 1.00 0.00 C ATOM 423 C ASP A 33 121.534 -24.622 5.487 1.00 0.00 C ATOM 424 O ASP A 33 120.702 -25.474 5.239 1.00 0.00 O ATOM 425 CB ASP A 33 123.308 -24.391 3.720 1.00 0.00 C ATOM 426 CG ASP A 33 123.765 -23.568 2.510 1.00 0.00 C ATOM 427 OD1 ASP A 33 122.998 -22.735 2.054 1.00 0.00 O ATOM 428 OD2 ASP A 33 124.876 -23.788 2.058 1.00 0.00 O ATOM 0 H ASP A 33 123.607 -22.252 4.746 1.00 0.00 H new ATOM 0 HA ASP A 33 121.285 -23.547 3.680 1.00 0.00 H new ATOM 0 HB2 ASP A 33 124.123 -24.480 4.438 1.00 0.00 H new ATOM 0 HB3 ASP A 33 123.048 -25.402 3.405 1.00 0.00 H new ATOM 432 N ASN A 34 121.990 -24.451 6.698 1.00 0.00 N ATOM 433 CA ASN A 34 121.494 -25.310 7.818 1.00 0.00 C ATOM 434 C ASN A 34 119.980 -25.156 7.998 1.00 0.00 C ATOM 435 O ASN A 34 119.282 -26.119 8.253 1.00 0.00 O ATOM 436 CB ASN A 34 122.234 -24.808 9.060 1.00 0.00 C ATOM 437 CG ASN A 34 122.050 -25.808 10.202 1.00 0.00 C ATOM 438 OD1 ASN A 34 122.473 -26.942 10.105 1.00 0.00 O ATOM 439 ND2 ASN A 34 121.435 -25.431 11.290 1.00 0.00 N ATOM 0 H ASN A 34 122.685 -23.754 6.963 1.00 0.00 H new ATOM 0 HA ASN A 34 121.676 -26.368 7.628 1.00 0.00 H new ATOM 0 HB2 ASN A 34 123.294 -24.683 8.839 1.00 0.00 H new ATOM 0 HB3 ASN A 34 121.852 -23.830 9.354 1.00 0.00 H new ATOM 0 HD21 ASN A 34 121.310 -26.089 12.059 1.00 0.00 H new ATOM 0 HD22 ASN A 34 121.080 -24.478 11.371 1.00 0.00 H new ATOM 445 N SER A 35 119.466 -23.959 7.878 1.00 0.00 N ATOM 446 CA SER A 35 117.996 -23.759 8.054 1.00 0.00 C ATOM 447 C SER A 35 117.464 -22.730 7.047 1.00 0.00 C ATOM 448 O SER A 35 118.233 -22.061 6.385 1.00 0.00 O ATOM 449 CB SER A 35 117.835 -23.243 9.482 1.00 0.00 C ATOM 450 OG SER A 35 117.653 -24.344 10.362 1.00 0.00 O ATOM 0 H SER A 35 119.998 -23.115 7.667 1.00 0.00 H new ATOM 0 HA SER A 35 117.436 -24.679 7.884 1.00 0.00 H new ATOM 0 HB2 SER A 35 118.715 -22.670 9.775 1.00 0.00 H new ATOM 0 HB3 SER A 35 116.981 -22.569 9.543 1.00 0.00 H new ATOM 0 HG SER A 35 118.102 -25.134 9.995 1.00 0.00 H new ATOM 455 N PRO A 36 116.154 -22.631 6.964 1.00 0.00 N ATOM 456 CA PRO A 36 115.519 -21.669 6.031 1.00 0.00 C ATOM 457 C PRO A 36 115.416 -20.272 6.661 1.00 0.00 C ATOM 458 O PRO A 36 114.410 -19.600 6.529 1.00 0.00 O ATOM 459 CB PRO A 36 114.129 -22.258 5.815 1.00 0.00 C ATOM 460 CG PRO A 36 113.840 -23.081 7.036 1.00 0.00 C ATOM 461 CD PRO A 36 115.153 -23.400 7.714 1.00 0.00 C ATOM 0 HA PRO A 36 116.085 -21.540 5.108 1.00 0.00 H new ATOM 0 HB2 PRO A 36 113.386 -21.471 5.689 1.00 0.00 H new ATOM 0 HB3 PRO A 36 114.100 -22.871 4.914 1.00 0.00 H new ATOM 0 HG2 PRO A 36 113.184 -22.536 7.715 1.00 0.00 H new ATOM 0 HG3 PRO A 36 113.321 -23.999 6.761 1.00 0.00 H new ATOM 0 HD2 PRO A 36 115.137 -23.111 8.765 1.00 0.00 H new ATOM 0 HD3 PRO A 36 115.367 -24.468 7.680 1.00 0.00 H new ATOM 466 N LEU A 37 116.441 -19.830 7.341 1.00 0.00 N ATOM 467 CA LEU A 37 116.395 -18.478 7.972 1.00 0.00 C ATOM 468 C LEU A 37 116.872 -17.417 6.978 1.00 0.00 C ATOM 469 O LEU A 37 118.057 -17.221 6.790 1.00 0.00 O ATOM 470 CB LEU A 37 117.346 -18.562 9.170 1.00 0.00 C ATOM 471 CG LEU A 37 116.551 -18.776 10.467 1.00 0.00 C ATOM 472 CD1 LEU A 37 115.601 -17.599 10.694 1.00 0.00 C ATOM 473 CD2 LEU A 37 115.742 -20.074 10.373 1.00 0.00 C ATOM 0 H LEU A 37 117.308 -20.347 7.487 1.00 0.00 H new ATOM 0 HA LEU A 37 115.386 -18.198 8.276 1.00 0.00 H new ATOM 0 HB2 LEU A 37 118.050 -19.382 9.027 1.00 0.00 H new ATOM 0 HB3 LEU A 37 117.933 -17.646 9.242 1.00 0.00 H new ATOM 0 HG LEU A 37 117.248 -18.844 11.302 1.00 0.00 H new ATOM 0 HD11 LEU A 37 115.040 -17.757 11.615 1.00 0.00 H new ATOM 0 HD12 LEU A 37 116.177 -16.677 10.773 1.00 0.00 H new ATOM 0 HD13 LEU A 37 114.908 -17.524 9.856 1.00 0.00 H new ATOM 0 HD21 LEU A 37 115.180 -20.220 11.296 1.00 0.00 H new ATOM 0 HD22 LEU A 37 115.050 -20.011 9.533 1.00 0.00 H new ATOM 0 HD23 LEU A 37 116.419 -20.915 10.223 1.00 0.00 H new ATOM 484 N GLY A 38 115.956 -16.735 6.341 1.00 0.00 N ATOM 485 CA GLY A 38 116.356 -15.690 5.358 1.00 0.00 C ATOM 486 C GLY A 38 116.071 -14.303 5.933 1.00 0.00 C ATOM 487 O GLY A 38 114.993 -14.033 6.419 1.00 0.00 O ATOM 0 H GLY A 38 114.950 -16.858 6.460 1.00 0.00 H new ATOM 0 HA2 GLY A 38 117.416 -15.786 5.123 1.00 0.00 H new ATOM 0 HA3 GLY A 38 115.809 -15.827 4.425 1.00 0.00 H new ATOM 490 N VAL A 39 117.029 -13.416 5.857 1.00 0.00 N ATOM 491 CA VAL A 39 116.821 -12.030 6.372 1.00 0.00 C ATOM 492 C VAL A 39 117.268 -11.036 5.300 1.00 0.00 C ATOM 493 O VAL A 39 118.353 -11.152 4.761 1.00 0.00 O ATOM 494 CB VAL A 39 117.707 -11.921 7.616 1.00 0.00 C ATOM 495 CG1 VAL A 39 117.531 -10.538 8.246 1.00 0.00 C ATOM 496 CG2 VAL A 39 117.302 -12.994 8.631 1.00 0.00 C ATOM 0 H VAL A 39 117.951 -13.593 5.458 1.00 0.00 H new ATOM 0 HA VAL A 39 115.780 -11.817 6.613 1.00 0.00 H new ATOM 0 HB VAL A 39 118.749 -12.065 7.331 1.00 0.00 H new ATOM 0 HG11 VAL A 39 118.161 -10.459 9.132 1.00 0.00 H new ATOM 0 HG12 VAL A 39 117.818 -9.771 7.527 1.00 0.00 H new ATOM 0 HG13 VAL A 39 116.488 -10.397 8.529 1.00 0.00 H new ATOM 0 HG21 VAL A 39 117.934 -12.915 9.516 1.00 0.00 H new ATOM 0 HG22 VAL A 39 116.260 -12.851 8.915 1.00 0.00 H new ATOM 0 HG23 VAL A 39 117.424 -13.981 8.185 1.00 0.00 H new ATOM 506 N ILE A 40 116.447 -10.076 4.965 1.00 0.00 N ATOM 507 CA ILE A 40 116.842 -9.103 3.903 1.00 0.00 C ATOM 508 C ILE A 40 116.787 -7.662 4.419 1.00 0.00 C ATOM 509 O ILE A 40 115.897 -7.288 5.154 1.00 0.00 O ATOM 510 CB ILE A 40 115.816 -9.299 2.783 1.00 0.00 C ATOM 511 CG1 ILE A 40 115.844 -10.753 2.305 1.00 0.00 C ATOM 512 CG2 ILE A 40 116.155 -8.377 1.608 1.00 0.00 C ATOM 513 CD1 ILE A 40 114.712 -10.984 1.303 1.00 0.00 C ATOM 0 H ILE A 40 115.526 -9.923 5.377 1.00 0.00 H new ATOM 0 HA ILE A 40 117.865 -9.273 3.569 1.00 0.00 H new ATOM 0 HB ILE A 40 114.823 -9.059 3.163 1.00 0.00 H new ATOM 0 HG12 ILE A 40 116.805 -10.976 1.841 1.00 0.00 H new ATOM 0 HG13 ILE A 40 115.735 -11.428 3.154 1.00 0.00 H new ATOM 0 HG21 ILE A 40 115.424 -8.518 0.812 1.00 0.00 H new ATOM 0 HG22 ILE A 40 116.133 -7.339 1.941 1.00 0.00 H new ATOM 0 HG23 ILE A 40 117.150 -8.616 1.233 1.00 0.00 H new ATOM 0 HD11 ILE A 40 114.733 -12.019 0.963 1.00 0.00 H new ATOM 0 HD12 ILE A 40 113.755 -10.778 1.782 1.00 0.00 H new ATOM 0 HD13 ILE A 40 114.841 -10.319 0.449 1.00 0.00 H new ATOM 524 N GLY A 41 117.717 -6.847 3.997 1.00 0.00 N ATOM 525 CA GLY A 41 117.714 -5.413 4.407 1.00 0.00 C ATOM 526 C GLY A 41 117.345 -4.594 3.172 1.00 0.00 C ATOM 527 O GLY A 41 117.686 -4.967 2.069 1.00 0.00 O ATOM 0 H GLY A 41 118.484 -7.116 3.381 1.00 0.00 H new ATOM 0 HA2 GLY A 41 116.997 -5.243 5.210 1.00 0.00 H new ATOM 0 HA3 GLY A 41 118.693 -5.119 4.786 1.00 0.00 H new ATOM 530 N SER A 42 116.632 -3.508 3.322 1.00 0.00 N ATOM 531 CA SER A 42 116.238 -2.718 2.113 1.00 0.00 C ATOM 532 C SER A 42 116.338 -1.209 2.351 1.00 0.00 C ATOM 533 O SER A 42 116.004 -0.708 3.407 1.00 0.00 O ATOM 534 CB SER A 42 114.787 -3.116 1.853 1.00 0.00 C ATOM 535 OG SER A 42 114.274 -2.341 0.777 1.00 0.00 O ATOM 0 H SER A 42 116.308 -3.136 4.215 1.00 0.00 H new ATOM 0 HA SER A 42 116.898 -2.927 1.271 1.00 0.00 H new ATOM 0 HB2 SER A 42 114.726 -4.178 1.613 1.00 0.00 H new ATOM 0 HB3 SER A 42 114.188 -2.957 2.749 1.00 0.00 H new ATOM 0 HG SER A 42 115.018 -1.970 0.257 1.00 0.00 H new ATOM 540 N PHE A 43 116.764 -0.480 1.349 1.00 0.00 N ATOM 541 CA PHE A 43 116.857 1.004 1.469 1.00 0.00 C ATOM 542 C PHE A 43 116.022 1.626 0.348 1.00 0.00 C ATOM 543 O PHE A 43 116.053 1.157 -0.774 1.00 0.00 O ATOM 544 CB PHE A 43 118.340 1.330 1.289 1.00 0.00 C ATOM 545 CG PHE A 43 118.567 2.804 1.523 1.00 0.00 C ATOM 546 CD1 PHE A 43 118.791 3.281 2.820 1.00 0.00 C ATOM 547 CD2 PHE A 43 118.555 3.694 0.443 1.00 0.00 C ATOM 548 CE1 PHE A 43 119.001 4.648 3.037 1.00 0.00 C ATOM 549 CE2 PHE A 43 118.766 5.061 0.660 1.00 0.00 C ATOM 550 CZ PHE A 43 118.990 5.538 1.957 1.00 0.00 C ATOM 0 H PHE A 43 117.053 -0.855 0.446 1.00 0.00 H new ATOM 0 HA PHE A 43 116.487 1.387 2.420 1.00 0.00 H new ATOM 0 HB2 PHE A 43 118.939 0.744 1.987 1.00 0.00 H new ATOM 0 HB3 PHE A 43 118.663 1.057 0.284 1.00 0.00 H new ATOM 0 HD1 PHE A 43 118.802 2.594 3.653 1.00 0.00 H new ATOM 0 HD2 PHE A 43 118.383 3.326 -0.558 1.00 0.00 H new ATOM 0 HE1 PHE A 43 119.172 5.016 4.038 1.00 0.00 H new ATOM 0 HE2 PHE A 43 118.756 5.748 -0.173 1.00 0.00 H new ATOM 0 HZ PHE A 43 119.154 6.592 2.124 1.00 0.00 H new ATOM 559 N THR A 44 115.268 2.661 0.622 1.00 0.00 N ATOM 560 CA THR A 44 114.439 3.263 -0.463 1.00 0.00 C ATOM 561 C THR A 44 114.599 4.782 -0.498 1.00 0.00 C ATOM 562 O THR A 44 114.628 5.435 0.526 1.00 0.00 O ATOM 563 CB THR A 44 112.999 2.887 -0.111 1.00 0.00 C ATOM 564 OG1 THR A 44 112.905 1.479 0.049 1.00 0.00 O ATOM 565 CG2 THR A 44 112.061 3.338 -1.233 1.00 0.00 C ATOM 0 H THR A 44 115.191 3.108 1.535 1.00 0.00 H new ATOM 0 HA THR A 44 114.735 2.900 -1.447 1.00 0.00 H new ATOM 0 HB THR A 44 112.712 3.379 0.818 1.00 0.00 H new ATOM 0 HG1 THR A 44 111.983 1.236 0.276 1.00 0.00 H new ATOM 0 HG21 THR A 44 111.035 3.069 -0.980 1.00 0.00 H new ATOM 0 HG22 THR A 44 112.133 4.419 -1.355 1.00 0.00 H new ATOM 0 HG23 THR A 44 112.345 2.848 -2.164 1.00 0.00 H new ATOM 573 N TYR A 45 114.666 5.353 -1.674 1.00 0.00 N ATOM 574 CA TYR A 45 114.781 6.831 -1.790 1.00 0.00 C ATOM 575 C TYR A 45 113.792 7.293 -2.862 1.00 0.00 C ATOM 576 O TYR A 45 113.962 7.011 -4.031 1.00 0.00 O ATOM 577 CB TYR A 45 116.223 7.089 -2.228 1.00 0.00 C ATOM 578 CG TYR A 45 116.468 8.575 -2.321 1.00 0.00 C ATOM 579 CD1 TYR A 45 116.835 9.298 -1.179 1.00 0.00 C ATOM 580 CD2 TYR A 45 116.327 9.231 -3.549 1.00 0.00 C ATOM 581 CE1 TYR A 45 117.062 10.676 -1.266 1.00 0.00 C ATOM 582 CE2 TYR A 45 116.555 10.609 -3.637 1.00 0.00 C ATOM 583 CZ TYR A 45 116.922 11.332 -2.496 1.00 0.00 C ATOM 584 OH TYR A 45 117.146 12.690 -2.582 1.00 0.00 O ATOM 0 H TYR A 45 114.646 4.852 -2.562 1.00 0.00 H new ATOM 0 HA TYR A 45 114.558 7.363 -0.865 1.00 0.00 H new ATOM 0 HB2 TYR A 45 116.915 6.640 -1.516 1.00 0.00 H new ATOM 0 HB3 TYR A 45 116.410 6.619 -3.193 1.00 0.00 H new ATOM 0 HD1 TYR A 45 116.943 8.792 -0.231 1.00 0.00 H new ATOM 0 HD2 TYR A 45 116.042 8.674 -4.429 1.00 0.00 H new ATOM 0 HE1 TYR A 45 117.345 11.234 -0.385 1.00 0.00 H new ATOM 0 HE2 TYR A 45 116.448 11.115 -4.585 1.00 0.00 H new ATOM 0 HH TYR A 45 117.007 12.987 -3.506 1.00 0.00 H new ATOM 593 N THR A 46 112.751 7.974 -2.469 1.00 0.00 N ATOM 594 CA THR A 46 111.727 8.422 -3.461 1.00 0.00 C ATOM 595 C THR A 46 111.625 9.948 -3.465 1.00 0.00 C ATOM 596 O THR A 46 111.798 10.587 -2.445 1.00 0.00 O ATOM 597 CB THR A 46 110.424 7.790 -2.966 1.00 0.00 C ATOM 598 OG1 THR A 46 110.678 6.455 -2.551 1.00 0.00 O ATOM 599 CG2 THR A 46 109.394 7.774 -4.094 1.00 0.00 C ATOM 0 H THR A 46 112.563 8.241 -1.503 1.00 0.00 H new ATOM 0 HA THR A 46 111.968 8.126 -4.482 1.00 0.00 H new ATOM 0 HB THR A 46 110.038 8.373 -2.130 1.00 0.00 H new ATOM 0 HG1 THR A 46 109.846 6.048 -2.232 1.00 0.00 H new ATOM 0 HG21 THR A 46 108.469 7.323 -3.735 1.00 0.00 H new ATOM 0 HG22 THR A 46 109.197 8.795 -4.421 1.00 0.00 H new ATOM 0 HG23 THR A 46 109.780 7.193 -4.931 1.00 0.00 H new ATOM 607 N GLU A 47 111.353 10.545 -4.601 1.00 0.00 N ATOM 608 CA GLU A 47 111.252 12.034 -4.655 1.00 0.00 C ATOM 609 C GLU A 47 109.898 12.457 -5.232 1.00 0.00 C ATOM 610 O GLU A 47 109.237 11.694 -5.911 1.00 0.00 O ATOM 611 CB GLU A 47 112.389 12.475 -5.579 1.00 0.00 C ATOM 612 CG GLU A 47 112.468 14.006 -5.596 1.00 0.00 C ATOM 613 CD GLU A 47 113.537 14.466 -6.597 1.00 0.00 C ATOM 614 OE1 GLU A 47 114.131 13.617 -7.244 1.00 0.00 O ATOM 615 OE2 GLU A 47 113.742 15.664 -6.700 1.00 0.00 O ATOM 0 H GLU A 47 111.198 10.066 -5.488 1.00 0.00 H new ATOM 0 HA GLU A 47 111.329 12.487 -3.666 1.00 0.00 H new ATOM 0 HB2 GLU A 47 113.335 12.055 -5.236 1.00 0.00 H new ATOM 0 HB3 GLU A 47 112.220 12.098 -6.587 1.00 0.00 H new ATOM 0 HG2 GLU A 47 111.499 14.425 -5.868 1.00 0.00 H new ATOM 0 HG3 GLU A 47 112.708 14.377 -4.599 1.00 0.00 H new ATOM 620 N LYS A 48 109.483 13.670 -4.963 1.00 0.00 N ATOM 621 CA LYS A 48 108.174 14.151 -5.492 1.00 0.00 C ATOM 622 C LYS A 48 108.351 15.483 -6.233 1.00 0.00 C ATOM 623 O LYS A 48 109.223 16.267 -5.914 1.00 0.00 O ATOM 624 CB LYS A 48 107.287 14.322 -4.253 1.00 0.00 C ATOM 625 CG LYS A 48 107.831 15.443 -3.362 1.00 0.00 C ATOM 626 CD LYS A 48 107.014 15.504 -2.070 1.00 0.00 C ATOM 627 CE LYS A 48 107.336 16.796 -1.319 1.00 0.00 C ATOM 628 NZ LYS A 48 106.813 16.577 0.058 1.00 0.00 N ATOM 0 H LYS A 48 109.996 14.347 -4.399 1.00 0.00 H new ATOM 0 HA LYS A 48 107.736 13.457 -6.210 1.00 0.00 H new ATOM 0 HB2 LYS A 48 106.266 14.553 -4.557 1.00 0.00 H new ATOM 0 HB3 LYS A 48 107.249 13.388 -3.692 1.00 0.00 H new ATOM 0 HG2 LYS A 48 108.882 15.264 -3.133 1.00 0.00 H new ATOM 0 HG3 LYS A 48 107.777 16.398 -3.885 1.00 0.00 H new ATOM 0 HD2 LYS A 48 105.949 15.461 -2.299 1.00 0.00 H new ATOM 0 HD3 LYS A 48 107.241 14.641 -1.444 1.00 0.00 H new ATOM 0 HE2 LYS A 48 108.408 16.990 -1.308 1.00 0.00 H new ATOM 0 HE3 LYS A 48 106.861 17.656 -1.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 106.996 17.421 0.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 105.789 16.401 0.016 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 107.289 15.756 0.483 1.00 0.00 H new ATOM 638 N SER A 49 107.527 15.742 -7.214 1.00 0.00 N ATOM 639 CA SER A 49 107.641 17.022 -7.976 1.00 0.00 C ATOM 640 C SER A 49 106.318 17.790 -7.918 1.00 0.00 C ATOM 641 O SER A 49 105.252 17.213 -8.013 1.00 0.00 O ATOM 642 CB SER A 49 107.956 16.602 -9.410 1.00 0.00 C ATOM 643 OG SER A 49 108.201 17.761 -10.195 1.00 0.00 O ATOM 0 H SER A 49 106.778 15.121 -7.522 1.00 0.00 H new ATOM 0 HA SER A 49 108.408 17.680 -7.567 1.00 0.00 H new ATOM 0 HB2 SER A 49 108.827 15.947 -9.426 1.00 0.00 H new ATOM 0 HB3 SER A 49 107.123 16.036 -9.827 1.00 0.00 H new ATOM 0 HG SER A 49 108.405 17.495 -11.116 1.00 0.00 H new ATOM 648 N ARG A 50 106.380 19.087 -7.765 1.00 0.00 N ATOM 649 CA ARG A 50 105.127 19.897 -7.702 1.00 0.00 C ATOM 650 C ARG A 50 105.193 21.058 -8.699 1.00 0.00 C ATOM 651 O ARG A 50 106.256 21.545 -9.028 1.00 0.00 O ATOM 652 CB ARG A 50 105.064 20.424 -6.268 1.00 0.00 C ATOM 653 CG ARG A 50 104.908 19.249 -5.298 1.00 0.00 C ATOM 654 CD ARG A 50 104.691 19.777 -3.876 1.00 0.00 C ATOM 655 NE ARG A 50 105.885 20.620 -3.585 1.00 0.00 N ATOM 656 CZ ARG A 50 105.752 21.909 -3.435 1.00 0.00 C ATOM 657 NH1 ARG A 50 104.855 22.383 -2.613 1.00 0.00 N ATOM 658 NH2 ARG A 50 106.515 22.726 -4.110 1.00 0.00 N ATOM 0 H ARG A 50 107.245 19.621 -7.681 1.00 0.00 H new ATOM 0 HA ARG A 50 104.245 19.310 -7.959 1.00 0.00 H new ATOM 0 HB2 ARG A 50 105.970 20.984 -6.035 1.00 0.00 H new ATOM 0 HB3 ARG A 50 104.226 21.113 -6.159 1.00 0.00 H new ATOM 0 HG2 ARG A 50 104.064 18.627 -5.598 1.00 0.00 H new ATOM 0 HG3 ARG A 50 105.796 18.618 -5.330 1.00 0.00 H new ATOM 0 HD2 ARG A 50 103.772 20.359 -3.808 1.00 0.00 H new ATOM 0 HD3 ARG A 50 104.603 18.959 -3.161 1.00 0.00 H new ATOM 0 HE ARG A 50 106.806 20.189 -3.503 1.00 0.00 H new ATOM 0 HH11 ARG A 50 104.257 21.745 -2.087 1.00 0.00 H new ATOM 0 HH12 ARG A 50 104.752 23.391 -2.497 1.00 0.00 H new ATOM 0 HH21 ARG A 50 107.214 22.356 -4.754 1.00 0.00 H new ATOM 0 HH22 ARG A 50 106.412 23.734 -3.993 1.00 0.00 H new ATOM 669 N THR A 51 104.058 21.506 -9.178 1.00 0.00 N ATOM 670 CA THR A 51 104.038 22.642 -10.155 1.00 0.00 C ATOM 671 C THR A 51 104.992 22.370 -11.325 1.00 0.00 C ATOM 672 O THR A 51 105.757 23.225 -11.724 1.00 0.00 O ATOM 673 CB THR A 51 104.499 23.866 -9.359 1.00 0.00 C ATOM 674 OG1 THR A 51 103.794 23.920 -8.127 1.00 0.00 O ATOM 675 CG2 THR A 51 104.222 25.135 -10.165 1.00 0.00 C ATOM 0 H THR A 51 103.141 21.133 -8.934 1.00 0.00 H new ATOM 0 HA THR A 51 103.048 22.786 -10.588 1.00 0.00 H new ATOM 0 HB THR A 51 105.568 23.791 -9.162 1.00 0.00 H new ATOM 0 HG1 THR A 51 104.089 24.702 -7.615 1.00 0.00 H new ATOM 0 HG21 THR A 51 104.551 26.006 -9.597 1.00 0.00 H new ATOM 0 HG22 THR A 51 104.764 25.092 -11.109 1.00 0.00 H new ATOM 0 HG23 THR A 51 103.153 25.214 -10.364 1.00 0.00 H new ATOM 683 N ALA A 52 104.946 21.182 -11.876 1.00 0.00 N ATOM 684 CA ALA A 52 105.846 20.840 -13.025 1.00 0.00 C ATOM 685 C ALA A 52 107.305 21.177 -12.694 1.00 0.00 C ATOM 686 O ALA A 52 107.690 21.242 -11.542 1.00 0.00 O ATOM 687 CB ALA A 52 105.346 21.696 -14.192 1.00 0.00 C ATOM 0 H ALA A 52 104.323 20.431 -11.580 1.00 0.00 H new ATOM 0 HA ALA A 52 105.820 19.775 -13.258 1.00 0.00 H new ATOM 0 HB1 ALA A 52 105.957 21.502 -15.074 1.00 0.00 H new ATOM 0 HB2 ALA A 52 104.307 21.446 -14.408 1.00 0.00 H new ATOM 0 HB3 ALA A 52 105.418 22.751 -13.926 1.00 0.00 H new ATOM 693 N SER A 53 108.119 21.392 -13.699 1.00 0.00 N ATOM 694 CA SER A 53 109.561 21.725 -13.461 1.00 0.00 C ATOM 695 C SER A 53 110.225 20.652 -12.593 1.00 0.00 C ATOM 696 O SER A 53 109.576 19.752 -12.095 1.00 0.00 O ATOM 697 CB SER A 53 109.552 23.073 -12.737 1.00 0.00 C ATOM 698 OG SER A 53 110.767 23.759 -13.008 1.00 0.00 O ATOM 0 H SER A 53 107.845 21.351 -14.681 1.00 0.00 H new ATOM 0 HA SER A 53 110.126 21.769 -14.392 1.00 0.00 H new ATOM 0 HB2 SER A 53 108.702 23.670 -13.067 1.00 0.00 H new ATOM 0 HB3 SER A 53 109.438 22.922 -11.664 1.00 0.00 H new ATOM 0 HG SER A 53 110.764 24.624 -12.547 1.00 0.00 H new ATOM 703 N SER A 54 111.516 20.741 -12.412 1.00 0.00 N ATOM 704 CA SER A 54 112.231 19.728 -11.579 1.00 0.00 C ATOM 705 C SER A 54 113.331 20.402 -10.756 1.00 0.00 C ATOM 706 O SER A 54 113.763 21.497 -11.062 1.00 0.00 O ATOM 707 CB SER A 54 112.837 18.747 -12.582 1.00 0.00 C ATOM 708 OG SER A 54 113.867 19.402 -13.311 1.00 0.00 O ATOM 0 H SER A 54 112.108 21.473 -12.805 1.00 0.00 H new ATOM 0 HA SER A 54 111.566 19.230 -10.873 1.00 0.00 H new ATOM 0 HB2 SER A 54 113.239 17.878 -12.061 1.00 0.00 H new ATOM 0 HB3 SER A 54 112.068 18.383 -13.263 1.00 0.00 H new ATOM 0 HG SER A 54 114.261 18.777 -13.955 1.00 0.00 H new ATOM 713 N GLY A 55 113.789 19.756 -9.716 1.00 0.00 N ATOM 714 CA GLY A 55 114.863 20.356 -8.874 1.00 0.00 C ATOM 715 C GLY A 55 114.286 21.509 -8.051 1.00 0.00 C ATOM 716 O GLY A 55 114.830 22.596 -8.023 1.00 0.00 O ATOM 0 H GLY A 55 113.464 18.837 -9.414 1.00 0.00 H new ATOM 0 HA2 GLY A 55 115.286 19.600 -8.213 1.00 0.00 H new ATOM 0 HA3 GLY A 55 115.675 20.717 -9.505 1.00 0.00 H new ATOM 719 N ASP A 56 113.185 21.281 -7.381 1.00 0.00 N ATOM 720 CA ASP A 56 112.566 22.367 -6.561 1.00 0.00 C ATOM 721 C ASP A 56 113.544 22.841 -5.482 1.00 0.00 C ATOM 722 O ASP A 56 114.342 22.077 -4.975 1.00 0.00 O ATOM 723 CB ASP A 56 111.329 21.731 -5.922 1.00 0.00 C ATOM 724 CG ASP A 56 110.315 21.354 -7.009 1.00 0.00 C ATOM 725 OD1 ASP A 56 110.409 21.893 -8.100 1.00 0.00 O ATOM 726 OD2 ASP A 56 109.461 20.528 -6.730 1.00 0.00 O ATOM 0 H ASP A 56 112.688 20.390 -7.366 1.00 0.00 H new ATOM 0 HA ASP A 56 112.310 23.239 -7.162 1.00 0.00 H new ATOM 0 HB2 ASP A 56 111.616 20.844 -5.357 1.00 0.00 H new ATOM 0 HB3 ASP A 56 110.876 22.426 -5.215 1.00 0.00 H new ATOM 730 N TYR A 57 113.485 24.098 -5.132 1.00 0.00 N ATOM 731 CA TYR A 57 114.411 24.634 -4.089 1.00 0.00 C ATOM 732 C TYR A 57 114.175 23.925 -2.753 1.00 0.00 C ATOM 733 O TYR A 57 115.066 23.820 -1.932 1.00 0.00 O ATOM 734 CB TYR A 57 114.070 26.121 -3.971 1.00 0.00 C ATOM 735 CG TYR A 57 114.311 26.802 -5.299 1.00 0.00 C ATOM 736 CD1 TYR A 57 115.615 27.112 -5.700 1.00 0.00 C ATOM 737 CD2 TYR A 57 113.229 27.120 -6.127 1.00 0.00 C ATOM 738 CE1 TYR A 57 115.838 27.741 -6.931 1.00 0.00 C ATOM 739 CE2 TYR A 57 113.451 27.749 -7.358 1.00 0.00 C ATOM 740 CZ TYR A 57 114.756 28.060 -7.760 1.00 0.00 C ATOM 741 OH TYR A 57 114.975 28.680 -8.973 1.00 0.00 O ATOM 0 H TYR A 57 112.835 24.779 -5.524 1.00 0.00 H new ATOM 0 HA TYR A 57 115.457 24.477 -4.353 1.00 0.00 H new ATOM 0 HB2 TYR A 57 113.029 26.243 -3.671 1.00 0.00 H new ATOM 0 HB3 TYR A 57 114.681 26.585 -3.197 1.00 0.00 H new ATOM 0 HD1 TYR A 57 116.450 26.866 -5.060 1.00 0.00 H new ATOM 0 HD2 TYR A 57 112.223 26.880 -5.817 1.00 0.00 H new ATOM 0 HE1 TYR A 57 116.845 27.980 -7.241 1.00 0.00 H new ATOM 0 HE2 TYR A 57 112.616 27.994 -7.997 1.00 0.00 H new ATOM 0 HH TYR A 57 114.118 28.829 -9.424 1.00 0.00 H new ATOM 750 N ASN A 58 112.984 23.430 -2.531 1.00 0.00 N ATOM 751 CA ASN A 58 112.694 22.719 -1.247 1.00 0.00 C ATOM 752 C ASN A 58 113.634 21.521 -1.088 1.00 0.00 C ATOM 753 O ASN A 58 114.113 21.232 -0.008 1.00 0.00 O ATOM 754 CB ASN A 58 111.243 22.251 -1.369 1.00 0.00 C ATOM 755 CG ASN A 58 110.324 23.468 -1.492 1.00 0.00 C ATOM 756 OD1 ASN A 58 110.612 24.519 -0.955 1.00 0.00 O ATOM 757 ND2 ASN A 58 109.222 23.371 -2.185 1.00 0.00 N ATOM 0 H ASN A 58 112.200 23.487 -3.182 1.00 0.00 H new ATOM 0 HA ASN A 58 112.841 23.359 -0.377 1.00 0.00 H new ATOM 0 HB2 ASN A 58 111.129 21.606 -2.241 1.00 0.00 H new ATOM 0 HB3 ASN A 58 110.966 21.659 -0.497 1.00 0.00 H new ATOM 0 HD21 ASN A 58 108.604 24.177 -2.275 1.00 0.00 H new ATOM 0 HD22 ASN A 58 108.979 22.489 -2.636 1.00 0.00 H new ATOM 763 N LYS A 59 113.904 20.826 -2.165 1.00 0.00 N ATOM 764 CA LYS A 59 114.818 19.642 -2.104 1.00 0.00 C ATOM 765 C LYS A 59 114.342 18.643 -1.043 1.00 0.00 C ATOM 766 O LYS A 59 115.093 18.247 -0.172 1.00 0.00 O ATOM 767 CB LYS A 59 116.197 20.202 -1.741 1.00 0.00 C ATOM 768 CG LYS A 59 116.685 21.119 -2.863 1.00 0.00 C ATOM 769 CD LYS A 59 118.122 21.559 -2.574 1.00 0.00 C ATOM 770 CE LYS A 59 118.573 22.564 -3.637 1.00 0.00 C ATOM 771 NZ LYS A 59 119.989 22.206 -3.925 1.00 0.00 N ATOM 0 H LYS A 59 113.528 21.029 -3.091 1.00 0.00 H new ATOM 0 HA LYS A 59 114.840 19.104 -3.051 1.00 0.00 H new ATOM 0 HB2 LYS A 59 116.142 20.755 -0.803 1.00 0.00 H new ATOM 0 HB3 LYS A 59 116.904 19.387 -1.589 1.00 0.00 H new ATOM 0 HG2 LYS A 59 116.638 20.598 -3.819 1.00 0.00 H new ATOM 0 HG3 LYS A 59 116.036 21.991 -2.943 1.00 0.00 H new ATOM 0 HD2 LYS A 59 118.183 22.010 -1.583 1.00 0.00 H new ATOM 0 HD3 LYS A 59 118.785 20.694 -2.572 1.00 0.00 H new ATOM 0 HE2 LYS A 59 117.957 22.494 -4.534 1.00 0.00 H new ATOM 0 HE3 LYS A 59 118.490 23.588 -3.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 120.370 22.851 -4.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 120.552 22.288 -3.054 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 120.035 21.228 -4.276 1.00 0.00 H new ATOM 781 N ASN A 60 113.103 18.233 -1.114 1.00 0.00 N ATOM 782 CA ASN A 60 112.580 17.257 -0.113 1.00 0.00 C ATOM 783 C ASN A 60 112.931 15.833 -0.551 1.00 0.00 C ATOM 784 O ASN A 60 112.763 15.471 -1.700 1.00 0.00 O ATOM 785 CB ASN A 60 111.065 17.462 -0.114 1.00 0.00 C ATOM 786 CG ASN A 60 110.735 18.877 0.366 1.00 0.00 C ATOM 787 OD1 ASN A 60 111.549 19.523 0.999 1.00 0.00 O ATOM 788 ND2 ASN A 60 109.568 19.392 0.091 1.00 0.00 N ATOM 0 H ASN A 60 112.431 18.531 -1.821 1.00 0.00 H new ATOM 0 HA ASN A 60 113.006 17.405 0.879 1.00 0.00 H new ATOM 0 HB2 ASN A 60 110.668 17.306 -1.117 1.00 0.00 H new ATOM 0 HB3 ASN A 60 110.589 16.727 0.535 1.00 0.00 H new ATOM 0 HD21 ASN A 60 109.339 20.335 0.407 1.00 0.00 H new ATOM 0 HD22 ASN A 60 108.884 18.852 -0.440 1.00 0.00 H new ATOM 794 N GLN A 61 113.423 15.026 0.352 1.00 0.00 N ATOM 795 CA GLN A 61 113.793 13.624 -0.019 1.00 0.00 C ATOM 796 C GLN A 61 113.040 12.623 0.859 1.00 0.00 C ATOM 797 O GLN A 61 112.621 12.943 1.956 1.00 0.00 O ATOM 798 CB GLN A 61 115.299 13.536 0.225 1.00 0.00 C ATOM 799 CG GLN A 61 116.020 14.520 -0.700 1.00 0.00 C ATOM 800 CD GLN A 61 117.529 14.451 -0.453 1.00 0.00 C ATOM 801 OE1 GLN A 61 117.970 13.976 0.574 1.00 0.00 O ATOM 802 NE2 GLN A 61 118.347 14.910 -1.362 1.00 0.00 N ATOM 0 H GLN A 61 113.585 15.274 1.328 1.00 0.00 H new ATOM 0 HA GLN A 61 113.534 13.388 -1.051 1.00 0.00 H new ATOM 0 HB2 GLN A 61 115.524 13.766 1.266 1.00 0.00 H new ATOM 0 HB3 GLN A 61 115.650 12.521 0.040 1.00 0.00 H new ATOM 0 HG2 GLN A 61 115.801 14.282 -1.741 1.00 0.00 H new ATOM 0 HG3 GLN A 61 115.659 15.533 -0.522 1.00 0.00 H new ATOM 0 HE21 GLN A 61 117.978 15.309 -2.225 1.00 0.00 H new ATOM 0 HE22 GLN A 61 119.355 14.869 -1.209 1.00 0.00 H new ATOM 809 N TYR A 62 112.859 11.414 0.386 1.00 0.00 N ATOM 810 CA TYR A 62 112.125 10.401 1.199 1.00 0.00 C ATOM 811 C TYR A 62 113.056 9.254 1.614 1.00 0.00 C ATOM 812 O TYR A 62 113.717 8.643 0.798 1.00 0.00 O ATOM 813 CB TYR A 62 111.010 9.890 0.286 1.00 0.00 C ATOM 814 CG TYR A 62 110.130 8.936 1.057 1.00 0.00 C ATOM 815 CD1 TYR A 62 109.084 9.432 1.844 1.00 0.00 C ATOM 816 CD2 TYR A 62 110.361 7.557 0.988 1.00 0.00 C ATOM 817 CE1 TYR A 62 108.267 8.550 2.561 1.00 0.00 C ATOM 818 CE2 TYR A 62 109.545 6.673 1.707 1.00 0.00 C ATOM 819 CZ TYR A 62 108.498 7.171 2.493 1.00 0.00 C ATOM 820 OH TYR A 62 107.694 6.301 3.201 1.00 0.00 O ATOM 0 H TYR A 62 113.187 11.088 -0.523 1.00 0.00 H new ATOM 0 HA TYR A 62 111.734 10.828 2.122 1.00 0.00 H new ATOM 0 HB2 TYR A 62 110.419 10.726 -0.088 1.00 0.00 H new ATOM 0 HB3 TYR A 62 111.437 9.388 -0.582 1.00 0.00 H new ATOM 0 HD1 TYR A 62 108.907 10.496 1.898 1.00 0.00 H new ATOM 0 HD2 TYR A 62 111.168 7.174 0.381 1.00 0.00 H new ATOM 0 HE1 TYR A 62 107.459 8.933 3.166 1.00 0.00 H new ATOM 0 HE2 TYR A 62 109.723 5.609 1.655 1.00 0.00 H new ATOM 0 HH TYR A 62 107.989 5.380 3.043 1.00 0.00 H new ATOM 829 N TYR A 63 113.099 8.975 2.888 1.00 0.00 N ATOM 830 CA TYR A 63 113.977 7.878 3.390 1.00 0.00 C ATOM 831 C TYR A 63 113.122 6.712 3.872 1.00 0.00 C ATOM 832 O TYR A 63 112.118 6.908 4.525 1.00 0.00 O ATOM 833 CB TYR A 63 114.755 8.490 4.551 1.00 0.00 C ATOM 834 CG TYR A 63 115.661 9.584 4.036 1.00 0.00 C ATOM 835 CD1 TYR A 63 116.935 9.266 3.552 1.00 0.00 C ATOM 836 CD2 TYR A 63 115.229 10.916 4.048 1.00 0.00 C ATOM 837 CE1 TYR A 63 117.778 10.279 3.080 1.00 0.00 C ATOM 838 CE2 TYR A 63 116.071 11.929 3.576 1.00 0.00 C ATOM 839 CZ TYR A 63 117.346 11.611 3.092 1.00 0.00 C ATOM 840 OH TYR A 63 118.177 12.609 2.628 1.00 0.00 O ATOM 0 H TYR A 63 112.562 9.461 3.606 1.00 0.00 H new ATOM 0 HA TYR A 63 114.643 7.491 2.619 1.00 0.00 H new ATOM 0 HB2 TYR A 63 114.065 8.895 5.291 1.00 0.00 H new ATOM 0 HB3 TYR A 63 115.344 7.722 5.052 1.00 0.00 H new ATOM 0 HD1 TYR A 63 117.268 8.239 3.543 1.00 0.00 H new ATOM 0 HD2 TYR A 63 114.246 11.161 4.422 1.00 0.00 H new ATOM 0 HE1 TYR A 63 118.761 10.033 2.707 1.00 0.00 H new ATOM 0 HE2 TYR A 63 115.738 12.956 3.585 1.00 0.00 H new ATOM 0 HH TYR A 63 117.729 13.099 1.907 1.00 0.00 H new ATOM 849 N GLY A 64 113.499 5.499 3.550 1.00 0.00 N ATOM 850 CA GLY A 64 112.686 4.335 3.994 1.00 0.00 C ATOM 851 C GLY A 64 113.584 3.128 4.259 1.00 0.00 C ATOM 852 O GLY A 64 114.186 2.579 3.356 1.00 0.00 O ATOM 0 H GLY A 64 114.329 5.270 3.003 1.00 0.00 H new ATOM 0 HA2 GLY A 64 112.135 4.592 4.899 1.00 0.00 H new ATOM 0 HA3 GLY A 64 111.948 4.087 3.231 1.00 0.00 H new ATOM 855 N ILE A 65 113.651 2.697 5.490 1.00 0.00 N ATOM 856 CA ILE A 65 114.478 1.507 5.820 1.00 0.00 C ATOM 857 C ILE A 65 113.533 0.334 6.041 1.00 0.00 C ATOM 858 O ILE A 65 112.513 0.480 6.685 1.00 0.00 O ATOM 859 CB ILE A 65 115.219 1.865 7.111 1.00 0.00 C ATOM 860 CG1 ILE A 65 116.064 3.122 6.886 1.00 0.00 C ATOM 861 CG2 ILE A 65 116.131 0.703 7.512 1.00 0.00 C ATOM 862 CD1 ILE A 65 116.699 3.558 8.208 1.00 0.00 C ATOM 0 H ILE A 65 113.166 3.121 6.281 1.00 0.00 H new ATOM 0 HA ILE A 65 115.186 1.237 5.037 1.00 0.00 H new ATOM 0 HB ILE A 65 114.496 2.053 7.905 1.00 0.00 H new ATOM 0 HG12 ILE A 65 116.840 2.923 6.147 1.00 0.00 H new ATOM 0 HG13 ILE A 65 115.442 3.924 6.488 1.00 0.00 H new ATOM 0 HG21 ILE A 65 116.660 0.956 8.431 1.00 0.00 H new ATOM 0 HG22 ILE A 65 115.530 -0.192 7.673 1.00 0.00 H new ATOM 0 HG23 ILE A 65 116.854 0.517 6.717 1.00 0.00 H new ATOM 0 HD11 ILE A 65 117.300 4.453 8.045 1.00 0.00 H new ATOM 0 HD12 ILE A 65 115.915 3.774 8.934 1.00 0.00 H new ATOM 0 HD13 ILE A 65 117.335 2.758 8.588 1.00 0.00 H new ATOM 873 N THR A 66 113.839 -0.819 5.514 1.00 0.00 N ATOM 874 CA THR A 66 112.922 -1.972 5.718 1.00 0.00 C ATOM 875 C THR A 66 113.683 -3.298 5.692 1.00 0.00 C ATOM 876 O THR A 66 114.560 -3.510 4.879 1.00 0.00 O ATOM 877 CB THR A 66 111.929 -1.897 4.556 1.00 0.00 C ATOM 878 OG1 THR A 66 112.616 -1.545 3.364 1.00 0.00 O ATOM 879 CG2 THR A 66 110.864 -0.842 4.861 1.00 0.00 C ATOM 0 H THR A 66 114.673 -1.011 4.958 1.00 0.00 H new ATOM 0 HA THR A 66 112.428 -1.926 6.688 1.00 0.00 H new ATOM 0 HB THR A 66 111.452 -2.868 4.426 1.00 0.00 H new ATOM 0 HG1 THR A 66 111.979 -1.499 2.621 1.00 0.00 H new ATOM 0 HG21 THR A 66 110.157 -0.789 4.033 1.00 0.00 H new ATOM 0 HG22 THR A 66 110.334 -1.113 5.774 1.00 0.00 H new ATOM 0 HG23 THR A 66 111.341 0.129 4.993 1.00 0.00 H new ATOM 887 N ALA A 67 113.329 -4.199 6.567 1.00 0.00 N ATOM 888 CA ALA A 67 113.993 -5.531 6.603 1.00 0.00 C ATOM 889 C ALA A 67 112.988 -6.568 7.111 1.00 0.00 C ATOM 890 O ALA A 67 112.087 -6.241 7.861 1.00 0.00 O ATOM 891 CB ALA A 67 115.156 -5.376 7.584 1.00 0.00 C ATOM 0 H ALA A 67 112.599 -4.066 7.267 1.00 0.00 H new ATOM 0 HA ALA A 67 114.345 -5.859 5.625 1.00 0.00 H new ATOM 0 HB1 ALA A 67 115.694 -6.321 7.663 1.00 0.00 H new ATOM 0 HB2 ALA A 67 115.834 -4.601 7.225 1.00 0.00 H new ATOM 0 HB3 ALA A 67 114.770 -5.095 8.564 1.00 0.00 H new ATOM 897 N GLY A 68 113.120 -7.808 6.715 1.00 0.00 N ATOM 898 CA GLY A 68 112.151 -8.840 7.189 1.00 0.00 C ATOM 899 C GLY A 68 112.695 -10.247 6.916 1.00 0.00 C ATOM 900 O GLY A 68 113.627 -10.413 6.153 1.00 0.00 O ATOM 0 H GLY A 68 113.850 -8.148 6.089 1.00 0.00 H new ATOM 0 HA2 GLY A 68 111.969 -8.714 8.256 1.00 0.00 H new ATOM 0 HA3 GLY A 68 111.194 -8.709 6.684 1.00 0.00 H new ATOM 903 N PRO A 69 112.087 -11.222 7.551 1.00 0.00 N ATOM 904 CA PRO A 69 112.516 -12.630 7.369 1.00 0.00 C ATOM 905 C PRO A 69 112.070 -13.161 6.002 1.00 0.00 C ATOM 906 O PRO A 69 111.329 -12.514 5.285 1.00 0.00 O ATOM 907 CB PRO A 69 111.802 -13.374 8.495 1.00 0.00 C ATOM 908 CG PRO A 69 110.606 -12.537 8.818 1.00 0.00 C ATOM 909 CD PRO A 69 110.957 -11.109 8.488 1.00 0.00 C ATOM 0 HA PRO A 69 113.599 -12.750 7.402 1.00 0.00 H new ATOM 0 HB2 PRO A 69 111.509 -14.376 8.182 1.00 0.00 H new ATOM 0 HB3 PRO A 69 112.449 -13.489 9.364 1.00 0.00 H new ATOM 0 HG2 PRO A 69 109.741 -12.864 8.241 1.00 0.00 H new ATOM 0 HG3 PRO A 69 110.342 -12.634 9.871 1.00 0.00 H new ATOM 0 HD2 PRO A 69 110.115 -10.586 8.035 1.00 0.00 H new ATOM 0 HD3 PRO A 69 111.235 -10.551 9.382 1.00 0.00 H new ATOM 914 N ALA A 70 112.507 -14.341 5.648 1.00 0.00 N ATOM 915 CA ALA A 70 112.104 -14.935 4.338 1.00 0.00 C ATOM 916 C ALA A 70 111.938 -16.449 4.488 1.00 0.00 C ATOM 917 O ALA A 70 112.721 -17.099 5.159 1.00 0.00 O ATOM 918 CB ALA A 70 113.251 -14.611 3.381 1.00 0.00 C ATOM 0 H ALA A 70 113.128 -14.921 6.212 1.00 0.00 H new ATOM 0 HA ALA A 70 111.155 -14.540 3.975 1.00 0.00 H new ATOM 0 HB1 ALA A 70 113.027 -15.017 2.394 1.00 0.00 H new ATOM 0 HB2 ALA A 70 113.371 -13.530 3.310 1.00 0.00 H new ATOM 0 HB3 ALA A 70 114.173 -15.055 3.755 1.00 0.00 H new ATOM 924 N TYR A 71 110.921 -17.015 3.884 1.00 0.00 N ATOM 925 CA TYR A 71 110.708 -18.486 4.014 1.00 0.00 C ATOM 926 C TYR A 71 110.732 -19.161 2.642 1.00 0.00 C ATOM 927 O TYR A 71 110.136 -18.685 1.695 1.00 0.00 O ATOM 928 CB TYR A 71 109.328 -18.632 4.657 1.00 0.00 C ATOM 929 CG TYR A 71 109.340 -17.998 6.028 1.00 0.00 C ATOM 930 CD1 TYR A 71 109.826 -18.716 7.128 1.00 0.00 C ATOM 931 CD2 TYR A 71 108.864 -16.692 6.200 1.00 0.00 C ATOM 932 CE1 TYR A 71 109.837 -18.128 8.398 1.00 0.00 C ATOM 933 CE2 TYR A 71 108.875 -16.105 7.471 1.00 0.00 C ATOM 934 CZ TYR A 71 109.362 -16.823 8.570 1.00 0.00 C ATOM 935 OH TYR A 71 109.372 -16.245 9.823 1.00 0.00 O ATOM 0 H TYR A 71 110.235 -16.524 3.311 1.00 0.00 H new ATOM 0 HA TYR A 71 111.491 -18.959 4.607 1.00 0.00 H new ATOM 0 HB2 TYR A 71 108.572 -18.157 4.032 1.00 0.00 H new ATOM 0 HB3 TYR A 71 109.061 -19.686 4.735 1.00 0.00 H new ATOM 0 HD1 TYR A 71 110.192 -19.723 6.996 1.00 0.00 H new ATOM 0 HD2 TYR A 71 108.489 -16.138 5.352 1.00 0.00 H new ATOM 0 HE1 TYR A 71 110.212 -18.682 9.246 1.00 0.00 H new ATOM 0 HE2 TYR A 71 108.508 -15.098 7.604 1.00 0.00 H new ATOM 0 HH TYR A 71 109.009 -15.336 9.767 1.00 0.00 H new ATOM 944 N ARG A 72 111.408 -20.273 2.538 1.00 0.00 N ATOM 945 CA ARG A 72 111.464 -20.993 1.234 1.00 0.00 C ATOM 946 C ARG A 72 110.641 -22.282 1.311 1.00 0.00 C ATOM 947 O ARG A 72 111.160 -23.340 1.615 1.00 0.00 O ATOM 948 CB ARG A 72 112.944 -21.312 1.024 1.00 0.00 C ATOM 949 CG ARG A 72 113.135 -21.977 -0.341 1.00 0.00 C ATOM 950 CD ARG A 72 114.620 -22.266 -0.565 1.00 0.00 C ATOM 951 NE ARG A 72 114.957 -23.330 0.422 1.00 0.00 N ATOM 952 CZ ARG A 72 115.091 -24.567 0.029 1.00 0.00 C ATOM 953 NH1 ARG A 72 114.247 -25.076 -0.827 1.00 0.00 N ATOM 954 NH2 ARG A 72 116.068 -25.297 0.492 1.00 0.00 N ATOM 0 H ARG A 72 111.924 -20.714 3.300 1.00 0.00 H new ATOM 0 HA ARG A 72 111.055 -20.402 0.414 1.00 0.00 H new ATOM 0 HB2 ARG A 72 113.535 -20.398 1.081 1.00 0.00 H new ATOM 0 HB3 ARG A 72 113.300 -21.972 1.815 1.00 0.00 H new ATOM 0 HG2 ARG A 72 112.562 -22.903 -0.389 1.00 0.00 H new ATOM 0 HG3 ARG A 72 112.757 -21.327 -1.130 1.00 0.00 H new ATOM 0 HD2 ARG A 72 114.808 -22.600 -1.585 1.00 0.00 H new ATOM 0 HD3 ARG A 72 115.225 -21.373 -0.405 1.00 0.00 H new ATOM 0 HE ARG A 72 115.083 -23.091 1.406 1.00 0.00 H new ATOM 0 HH11 ARG A 72 113.482 -24.507 -1.189 1.00 0.00 H new ATOM 0 HH12 ARG A 72 114.352 -26.043 -1.134 1.00 0.00 H new ATOM 0 HH21 ARG A 72 116.728 -24.901 1.162 1.00 0.00 H new ATOM 0 HH22 ARG A 72 116.172 -26.264 0.184 1.00 0.00 H new ATOM 965 N ILE A 73 109.369 -22.205 1.024 1.00 0.00 N ATOM 966 CA ILE A 73 108.518 -23.432 1.069 1.00 0.00 C ATOM 967 C ILE A 73 108.419 -24.038 -0.334 1.00 0.00 C ATOM 968 O ILE A 73 108.309 -25.238 -0.501 1.00 0.00 O ATOM 969 CB ILE A 73 107.143 -22.969 1.577 1.00 0.00 C ATOM 970 CG1 ILE A 73 106.494 -22.013 0.567 1.00 0.00 C ATOM 971 CG2 ILE A 73 107.303 -22.255 2.921 1.00 0.00 C ATOM 972 CD1 ILE A 73 105.064 -21.698 1.011 1.00 0.00 C ATOM 0 H ILE A 73 108.882 -21.348 0.761 1.00 0.00 H new ATOM 0 HA ILE A 73 108.930 -24.202 1.721 1.00 0.00 H new ATOM 0 HB ILE A 73 106.504 -23.843 1.699 1.00 0.00 H new ATOM 0 HG12 ILE A 73 107.075 -21.094 0.495 1.00 0.00 H new ATOM 0 HG13 ILE A 73 106.487 -22.464 -0.425 1.00 0.00 H new ATOM 0 HG21 ILE A 73 106.326 -21.928 3.278 1.00 0.00 H new ATOM 0 HG22 ILE A 73 107.744 -22.939 3.646 1.00 0.00 H new ATOM 0 HG23 ILE A 73 107.953 -21.389 2.798 1.00 0.00 H new ATOM 0 HD11 ILE A 73 104.602 -21.019 0.294 1.00 0.00 H new ATOM 0 HD12 ILE A 73 104.487 -22.621 1.061 1.00 0.00 H new ATOM 0 HD13 ILE A 73 105.083 -21.229 1.995 1.00 0.00 H new ATOM 983 N ASN A 74 108.474 -23.208 -1.341 1.00 0.00 N ATOM 984 CA ASN A 74 108.401 -23.711 -2.741 1.00 0.00 C ATOM 985 C ASN A 74 109.504 -23.059 -3.576 1.00 0.00 C ATOM 986 O ASN A 74 109.652 -21.853 -3.586 1.00 0.00 O ATOM 987 CB ASN A 74 107.020 -23.289 -3.249 1.00 0.00 C ATOM 988 CG ASN A 74 105.937 -23.949 -2.393 1.00 0.00 C ATOM 989 OD1 ASN A 74 106.078 -25.085 -1.983 1.00 0.00 O ATOM 990 ND2 ASN A 74 104.853 -23.282 -2.105 1.00 0.00 N ATOM 0 H ASN A 74 108.567 -22.196 -1.252 1.00 0.00 H new ATOM 0 HA ASN A 74 108.538 -24.790 -2.806 1.00 0.00 H new ATOM 0 HB2 ASN A 74 106.921 -22.204 -3.207 1.00 0.00 H new ATOM 0 HB3 ASN A 74 106.901 -23.579 -4.293 1.00 0.00 H new ATOM 0 HD21 ASN A 74 104.125 -23.714 -1.536 1.00 0.00 H new ATOM 0 HD22 ASN A 74 104.734 -22.329 -2.449 1.00 0.00 H new ATOM 996 N ASP A 75 110.279 -23.842 -4.278 1.00 0.00 N ATOM 997 CA ASP A 75 111.373 -23.257 -5.114 1.00 0.00 C ATOM 998 C ASP A 75 110.791 -22.265 -6.126 1.00 0.00 C ATOM 999 O ASP A 75 111.407 -21.274 -6.466 1.00 0.00 O ATOM 1000 CB ASP A 75 112.007 -24.451 -5.835 1.00 0.00 C ATOM 1001 CG ASP A 75 112.699 -25.369 -4.820 1.00 0.00 C ATOM 1002 OD1 ASP A 75 112.944 -24.923 -3.709 1.00 0.00 O ATOM 1003 OD2 ASP A 75 112.976 -26.502 -5.173 1.00 0.00 O ATOM 0 H ASP A 75 110.204 -24.859 -4.310 1.00 0.00 H new ATOM 0 HA ASP A 75 112.102 -22.710 -4.516 1.00 0.00 H new ATOM 0 HB2 ASP A 75 111.242 -25.006 -6.378 1.00 0.00 H new ATOM 0 HB3 ASP A 75 112.729 -24.100 -6.572 1.00 0.00 H new ATOM 1007 N TRP A 76 109.610 -22.538 -6.612 1.00 0.00 N ATOM 1008 CA TRP A 76 108.974 -21.630 -7.613 1.00 0.00 C ATOM 1009 C TRP A 76 108.796 -20.212 -7.051 1.00 0.00 C ATOM 1010 O TRP A 76 108.918 -19.240 -7.773 1.00 0.00 O ATOM 1011 CB TRP A 76 107.610 -22.257 -7.909 1.00 0.00 C ATOM 1012 CG TRP A 76 107.806 -23.560 -8.616 1.00 0.00 C ATOM 1013 CD1 TRP A 76 107.627 -24.780 -8.061 1.00 0.00 C ATOM 1014 CD2 TRP A 76 108.215 -23.793 -9.995 1.00 0.00 C ATOM 1015 NE1 TRP A 76 107.898 -25.748 -9.011 1.00 0.00 N ATOM 1016 CE2 TRP A 76 108.266 -25.189 -10.220 1.00 0.00 C ATOM 1017 CE3 TRP A 76 108.544 -22.937 -11.062 1.00 0.00 C ATOM 1018 CZ2 TRP A 76 108.630 -25.718 -11.459 1.00 0.00 C ATOM 1019 CZ3 TRP A 76 108.912 -23.466 -12.310 1.00 0.00 C ATOM 1020 CH2 TRP A 76 108.955 -24.853 -12.508 1.00 0.00 C ATOM 0 H TRP A 76 109.055 -23.355 -6.358 1.00 0.00 H new ATOM 0 HA TRP A 76 109.590 -21.530 -8.506 1.00 0.00 H new ATOM 0 HB2 TRP A 76 107.060 -22.413 -6.981 1.00 0.00 H new ATOM 0 HB3 TRP A 76 107.013 -21.583 -8.524 1.00 0.00 H new ATOM 0 HD1 TRP A 76 107.322 -24.968 -7.042 1.00 0.00 H new ATOM 0 HE1 TRP A 76 107.834 -26.752 -8.840 1.00 0.00 H new ATOM 0 HE3 TRP A 76 108.513 -21.867 -10.921 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 108.660 -26.787 -11.606 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 109.163 -22.800 -13.122 1.00 0.00 H new ATOM 0 HH2 TRP A 76 109.239 -25.253 -13.470 1.00 0.00 H new ATOM 1030 N ALA A 77 108.495 -20.077 -5.782 1.00 0.00 N ATOM 1031 CA ALA A 77 108.297 -18.707 -5.212 1.00 0.00 C ATOM 1032 C ALA A 77 108.769 -18.622 -3.755 1.00 0.00 C ATOM 1033 O ALA A 77 108.807 -19.603 -3.040 1.00 0.00 O ATOM 1034 CB ALA A 77 106.790 -18.465 -5.296 1.00 0.00 C ATOM 0 H ALA A 77 108.379 -20.846 -5.123 1.00 0.00 H new ATOM 0 HA ALA A 77 108.876 -17.962 -5.758 1.00 0.00 H new ATOM 0 HB1 ALA A 77 106.557 -17.478 -4.897 1.00 0.00 H new ATOM 0 HB2 ALA A 77 106.470 -18.520 -6.337 1.00 0.00 H new ATOM 0 HB3 ALA A 77 106.267 -19.224 -4.715 1.00 0.00 H new ATOM 1040 N SER A 78 109.117 -17.439 -3.318 1.00 0.00 N ATOM 1041 CA SER A 78 109.582 -17.244 -1.909 1.00 0.00 C ATOM 1042 C SER A 78 108.757 -16.135 -1.246 1.00 0.00 C ATOM 1043 O SER A 78 108.128 -15.345 -1.924 1.00 0.00 O ATOM 1044 CB SER A 78 111.048 -16.828 -2.028 1.00 0.00 C ATOM 1045 OG SER A 78 111.771 -17.848 -2.703 1.00 0.00 O ATOM 0 H SER A 78 109.099 -16.590 -3.883 1.00 0.00 H new ATOM 0 HA SER A 78 109.468 -18.141 -1.301 1.00 0.00 H new ATOM 0 HB2 SER A 78 111.128 -15.888 -2.573 1.00 0.00 H new ATOM 0 HB3 SER A 78 111.472 -16.660 -1.038 1.00 0.00 H new ATOM 0 HG SER A 78 112.699 -17.560 -2.833 1.00 0.00 H new ATOM 1050 N ILE A 79 108.746 -16.060 0.065 1.00 0.00 N ATOM 1051 CA ILE A 79 107.945 -14.989 0.731 1.00 0.00 C ATOM 1052 C ILE A 79 108.862 -14.065 1.534 1.00 0.00 C ATOM 1053 O ILE A 79 109.761 -14.511 2.220 1.00 0.00 O ATOM 1054 CB ILE A 79 106.977 -15.728 1.659 1.00 0.00 C ATOM 1055 CG1 ILE A 79 106.115 -16.694 0.838 1.00 0.00 C ATOM 1056 CG2 ILE A 79 106.070 -14.717 2.366 1.00 0.00 C ATOM 1057 CD1 ILE A 79 105.255 -17.538 1.780 1.00 0.00 C ATOM 0 H ILE A 79 109.250 -16.686 0.693 1.00 0.00 H new ATOM 0 HA ILE A 79 107.416 -14.364 0.011 1.00 0.00 H new ATOM 0 HB ILE A 79 107.547 -16.287 2.401 1.00 0.00 H new ATOM 0 HG12 ILE A 79 105.479 -16.136 0.150 1.00 0.00 H new ATOM 0 HG13 ILE A 79 106.750 -17.340 0.232 1.00 0.00 H new ATOM 0 HG21 ILE A 79 105.382 -15.245 3.026 1.00 0.00 H new ATOM 0 HG22 ILE A 79 106.679 -14.029 2.952 1.00 0.00 H new ATOM 0 HG23 ILE A 79 105.502 -14.156 1.624 1.00 0.00 H new ATOM 0 HD11 ILE A 79 104.642 -18.225 1.196 1.00 0.00 H new ATOM 0 HD12 ILE A 79 105.900 -18.107 2.450 1.00 0.00 H new ATOM 0 HD13 ILE A 79 104.609 -16.885 2.367 1.00 0.00 H new ATOM 1068 N TYR A 80 108.640 -12.781 1.444 1.00 0.00 N ATOM 1069 CA TYR A 80 109.497 -11.817 2.193 1.00 0.00 C ATOM 1070 C TYR A 80 108.628 -10.791 2.923 1.00 0.00 C ATOM 1071 O TYR A 80 107.519 -10.501 2.516 1.00 0.00 O ATOM 1072 CB TYR A 80 110.351 -11.125 1.125 1.00 0.00 C ATOM 1073 CG TYR A 80 111.135 -12.155 0.346 1.00 0.00 C ATOM 1074 CD1 TYR A 80 112.300 -12.709 0.890 1.00 0.00 C ATOM 1075 CD2 TYR A 80 110.697 -12.554 -0.922 1.00 0.00 C ATOM 1076 CE1 TYR A 80 113.025 -13.662 0.165 1.00 0.00 C ATOM 1077 CE2 TYR A 80 111.421 -13.507 -1.646 1.00 0.00 C ATOM 1078 CZ TYR A 80 112.586 -14.061 -1.103 1.00 0.00 C ATOM 1079 OH TYR A 80 113.301 -15.001 -1.818 1.00 0.00 O ATOM 0 H TYR A 80 107.901 -12.358 0.883 1.00 0.00 H new ATOM 0 HA TYR A 80 110.108 -12.314 2.947 1.00 0.00 H new ATOM 0 HB2 TYR A 80 109.713 -10.554 0.450 1.00 0.00 H new ATOM 0 HB3 TYR A 80 111.032 -10.416 1.595 1.00 0.00 H new ATOM 0 HD1 TYR A 80 112.639 -12.401 1.868 1.00 0.00 H new ATOM 0 HD2 TYR A 80 109.799 -12.126 -1.342 1.00 0.00 H new ATOM 0 HE1 TYR A 80 113.924 -14.090 0.584 1.00 0.00 H new ATOM 0 HE2 TYR A 80 111.081 -13.815 -2.624 1.00 0.00 H new ATOM 0 HH TYR A 80 113.751 -15.612 -1.197 1.00 0.00 H new ATOM 1088 N GLY A 81 109.130 -10.229 3.990 1.00 0.00 N ATOM 1089 CA GLY A 81 108.349 -9.205 4.741 1.00 0.00 C ATOM 1090 C GLY A 81 109.215 -7.957 4.899 1.00 0.00 C ATOM 1091 O GLY A 81 110.417 -8.010 4.724 1.00 0.00 O ATOM 0 H GLY A 81 110.052 -10.436 4.375 1.00 0.00 H new ATOM 0 HA2 GLY A 81 107.430 -8.963 4.208 1.00 0.00 H new ATOM 0 HA3 GLY A 81 108.059 -9.591 5.718 1.00 0.00 H new ATOM 1094 N VAL A 82 108.628 -6.833 5.221 1.00 0.00 N ATOM 1095 CA VAL A 82 109.449 -5.599 5.378 1.00 0.00 C ATOM 1096 C VAL A 82 109.032 -4.808 6.623 1.00 0.00 C ATOM 1097 O VAL A 82 107.868 -4.547 6.853 1.00 0.00 O ATOM 1098 CB VAL A 82 109.192 -4.781 4.108 1.00 0.00 C ATOM 1099 CG1 VAL A 82 109.644 -5.583 2.884 1.00 0.00 C ATOM 1100 CG2 VAL A 82 107.695 -4.460 3.985 1.00 0.00 C ATOM 0 H VAL A 82 107.627 -6.718 5.380 1.00 0.00 H new ATOM 0 HA VAL A 82 110.505 -5.836 5.508 1.00 0.00 H new ATOM 0 HB VAL A 82 109.754 -3.849 4.163 1.00 0.00 H new ATOM 0 HG11 VAL A 82 109.461 -5.002 1.980 1.00 0.00 H new ATOM 0 HG12 VAL A 82 110.709 -5.802 2.966 1.00 0.00 H new ATOM 0 HG13 VAL A 82 109.084 -6.517 2.834 1.00 0.00 H new ATOM 0 HG21 VAL A 82 107.521 -3.878 3.080 1.00 0.00 H new ATOM 0 HG22 VAL A 82 107.127 -5.389 3.935 1.00 0.00 H new ATOM 0 HG23 VAL A 82 107.374 -3.885 4.853 1.00 0.00 H new ATOM 1110 N VAL A 83 109.994 -4.415 7.407 1.00 0.00 N ATOM 1111 CA VAL A 83 109.716 -3.619 8.639 1.00 0.00 C ATOM 1112 C VAL A 83 110.801 -2.548 8.789 1.00 0.00 C ATOM 1113 O VAL A 83 111.950 -2.790 8.476 1.00 0.00 O ATOM 1114 CB VAL A 83 109.780 -4.620 9.795 1.00 0.00 C ATOM 1115 CG1 VAL A 83 109.464 -3.902 11.109 1.00 0.00 C ATOM 1116 CG2 VAL A 83 108.752 -5.731 9.568 1.00 0.00 C ATOM 0 H VAL A 83 110.981 -4.614 7.245 1.00 0.00 H new ATOM 0 HA VAL A 83 108.750 -3.115 8.610 1.00 0.00 H new ATOM 0 HB VAL A 83 110.780 -5.052 9.844 1.00 0.00 H new ATOM 0 HG11 VAL A 83 109.509 -4.614 11.933 1.00 0.00 H new ATOM 0 HG12 VAL A 83 110.193 -3.109 11.275 1.00 0.00 H new ATOM 0 HG13 VAL A 83 108.464 -3.471 11.057 1.00 0.00 H new ATOM 0 HG21 VAL A 83 108.798 -6.443 10.392 1.00 0.00 H new ATOM 0 HG22 VAL A 83 107.753 -5.298 9.519 1.00 0.00 H new ATOM 0 HG23 VAL A 83 108.972 -6.244 8.632 1.00 0.00 H new ATOM 1126 N GLY A 84 110.469 -1.385 9.292 1.00 0.00 N ATOM 1127 CA GLY A 84 111.511 -0.346 9.469 1.00 0.00 C ATOM 1128 C GLY A 84 110.881 1.037 9.607 1.00 0.00 C ATOM 1129 O GLY A 84 109.809 1.202 10.157 1.00 0.00 O ATOM 0 H GLY A 84 109.529 -1.118 9.583 1.00 0.00 H new ATOM 0 HA2 GLY A 84 112.106 -0.569 10.354 1.00 0.00 H new ATOM 0 HA3 GLY A 84 112.190 -0.357 8.617 1.00 0.00 H new ATOM 1132 N VAL A 85 111.587 2.032 9.155 1.00 0.00 N ATOM 1133 CA VAL A 85 111.087 3.432 9.300 1.00 0.00 C ATOM 1134 C VAL A 85 111.068 4.201 7.974 1.00 0.00 C ATOM 1135 O VAL A 85 111.768 3.889 7.033 1.00 0.00 O ATOM 1136 CB VAL A 85 112.060 4.095 10.281 1.00 0.00 C ATOM 1137 CG1 VAL A 85 112.033 3.348 11.616 1.00 0.00 C ATOM 1138 CG2 VAL A 85 113.480 4.057 9.708 1.00 0.00 C ATOM 0 H VAL A 85 112.490 1.940 8.690 1.00 0.00 H new ATOM 0 HA VAL A 85 110.054 3.435 9.647 1.00 0.00 H new ATOM 0 HB VAL A 85 111.759 5.131 10.436 1.00 0.00 H new ATOM 0 HG11 VAL A 85 112.726 3.821 12.312 1.00 0.00 H new ATOM 0 HG12 VAL A 85 111.025 3.379 12.030 1.00 0.00 H new ATOM 0 HG13 VAL A 85 112.329 2.311 11.459 1.00 0.00 H new ATOM 0 HG21 VAL A 85 114.168 4.530 10.409 1.00 0.00 H new ATOM 0 HG22 VAL A 85 113.780 3.021 9.547 1.00 0.00 H new ATOM 0 HG23 VAL A 85 113.504 4.593 8.759 1.00 0.00 H new ATOM 1148 N GLY A 86 110.260 5.224 7.934 1.00 0.00 N ATOM 1149 CA GLY A 86 110.152 6.073 6.714 1.00 0.00 C ATOM 1150 C GLY A 86 110.027 7.536 7.140 1.00 0.00 C ATOM 1151 O GLY A 86 109.220 7.866 7.988 1.00 0.00 O ATOM 0 H GLY A 86 109.661 5.512 8.707 1.00 0.00 H new ATOM 0 HA2 GLY A 86 111.029 5.938 6.082 1.00 0.00 H new ATOM 0 HA3 GLY A 86 109.285 5.777 6.124 1.00 0.00 H new ATOM 1154 N TYR A 87 110.810 8.422 6.571 1.00 0.00 N ATOM 1155 CA TYR A 87 110.703 9.852 6.975 1.00 0.00 C ATOM 1156 C TYR A 87 111.112 10.783 5.832 1.00 0.00 C ATOM 1157 O TYR A 87 111.732 10.371 4.870 1.00 0.00 O ATOM 1158 CB TYR A 87 111.630 10.003 8.192 1.00 0.00 C ATOM 1159 CG TYR A 87 113.084 9.876 7.797 1.00 0.00 C ATOM 1160 CD1 TYR A 87 113.802 11.008 7.393 1.00 0.00 C ATOM 1161 CD2 TYR A 87 113.717 8.629 7.854 1.00 0.00 C ATOM 1162 CE1 TYR A 87 115.153 10.893 7.044 1.00 0.00 C ATOM 1163 CE2 TYR A 87 115.070 8.514 7.507 1.00 0.00 C ATOM 1164 CZ TYR A 87 115.787 9.646 7.102 1.00 0.00 C ATOM 1165 OH TYR A 87 117.119 9.532 6.761 1.00 0.00 O ATOM 0 H TYR A 87 111.507 8.217 5.855 1.00 0.00 H new ATOM 0 HA TYR A 87 109.678 10.127 7.222 1.00 0.00 H new ATOM 0 HB2 TYR A 87 111.462 10.972 8.661 1.00 0.00 H new ATOM 0 HB3 TYR A 87 111.385 9.243 8.934 1.00 0.00 H new ATOM 0 HD1 TYR A 87 113.314 11.970 7.351 1.00 0.00 H new ATOM 0 HD2 TYR A 87 113.163 7.756 8.165 1.00 0.00 H new ATOM 0 HE1 TYR A 87 115.706 11.766 6.730 1.00 0.00 H new ATOM 0 HE2 TYR A 87 115.559 7.552 7.552 1.00 0.00 H new ATOM 0 HH TYR A 87 117.203 9.469 5.787 1.00 0.00 H new ATOM 1174 N GLY A 88 110.767 12.038 5.940 1.00 0.00 N ATOM 1175 CA GLY A 88 111.125 13.011 4.873 1.00 0.00 C ATOM 1176 C GLY A 88 111.799 14.228 5.506 1.00 0.00 C ATOM 1177 O GLY A 88 111.585 14.538 6.667 1.00 0.00 O ATOM 0 H GLY A 88 110.250 12.431 6.726 1.00 0.00 H new ATOM 0 HA2 GLY A 88 111.794 12.545 4.150 1.00 0.00 H new ATOM 0 HA3 GLY A 88 110.231 13.317 4.329 1.00 0.00 H new ATOM 1180 N LYS A 89 112.612 14.915 4.748 1.00 0.00 N ATOM 1181 CA LYS A 89 113.315 16.115 5.285 1.00 0.00 C ATOM 1182 C LYS A 89 113.118 17.310 4.349 1.00 0.00 C ATOM 1183 O LYS A 89 113.159 17.176 3.138 1.00 0.00 O ATOM 1184 CB LYS A 89 114.790 15.714 5.340 1.00 0.00 C ATOM 1185 CG LYS A 89 115.593 16.817 6.031 1.00 0.00 C ATOM 1186 CD LYS A 89 117.079 16.448 6.021 1.00 0.00 C ATOM 1187 CE LYS A 89 117.868 17.475 6.839 1.00 0.00 C ATOM 1188 NZ LYS A 89 118.130 16.806 8.145 1.00 0.00 N ATOM 0 H LYS A 89 112.820 14.694 3.774 1.00 0.00 H new ATOM 0 HA LYS A 89 112.935 16.414 6.262 1.00 0.00 H new ATOM 0 HB2 LYS A 89 114.902 14.774 5.881 1.00 0.00 H new ATOM 0 HB3 LYS A 89 115.171 15.549 4.332 1.00 0.00 H new ATOM 0 HG2 LYS A 89 115.440 17.768 5.520 1.00 0.00 H new ATOM 0 HG3 LYS A 89 115.246 16.946 7.056 1.00 0.00 H new ATOM 0 HD2 LYS A 89 117.219 15.451 6.438 1.00 0.00 H new ATOM 0 HD3 LYS A 89 117.451 16.421 4.997 1.00 0.00 H new ATOM 0 HE2 LYS A 89 118.799 17.746 6.340 1.00 0.00 H new ATOM 0 HE3 LYS A 89 117.299 18.395 6.973 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 118.668 17.448 8.762 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 117.226 16.565 8.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 118.679 15.937 7.986 1.00 0.00 H new ATOM 1198 N PHE A 90 112.908 18.473 4.906 1.00 0.00 N ATOM 1199 CA PHE A 90 112.707 19.693 4.068 1.00 0.00 C ATOM 1200 C PHE A 90 113.853 20.682 4.294 1.00 0.00 C ATOM 1201 O PHE A 90 114.476 20.693 5.339 1.00 0.00 O ATOM 1202 CB PHE A 90 111.388 20.294 4.555 1.00 0.00 C ATOM 1203 CG PHE A 90 110.253 19.348 4.249 1.00 0.00 C ATOM 1204 CD1 PHE A 90 109.911 18.344 5.162 1.00 0.00 C ATOM 1205 CD2 PHE A 90 109.541 19.477 3.051 1.00 0.00 C ATOM 1206 CE1 PHE A 90 108.857 17.468 4.876 1.00 0.00 C ATOM 1207 CE2 PHE A 90 108.487 18.603 2.766 1.00 0.00 C ATOM 1208 CZ PHE A 90 108.145 17.597 3.678 1.00 0.00 C ATOM 0 H PHE A 90 112.867 18.632 5.913 1.00 0.00 H new ATOM 0 HA PHE A 90 112.686 19.462 3.003 1.00 0.00 H new ATOM 0 HB2 PHE A 90 111.437 20.483 5.627 1.00 0.00 H new ATOM 0 HB3 PHE A 90 111.214 21.255 4.070 1.00 0.00 H new ATOM 0 HD1 PHE A 90 110.460 18.245 6.087 1.00 0.00 H new ATOM 0 HD2 PHE A 90 109.806 20.252 2.346 1.00 0.00 H new ATOM 0 HE1 PHE A 90 108.593 16.693 5.580 1.00 0.00 H new ATOM 0 HE2 PHE A 90 107.937 18.704 1.842 1.00 0.00 H new ATOM 0 HZ PHE A 90 107.332 16.921 3.457 1.00 0.00 H new ATOM 1217 N GLN A 91 114.130 21.517 3.328 1.00 0.00 N ATOM 1218 CA GLN A 91 115.230 22.513 3.492 1.00 0.00 C ATOM 1219 C GLN A 91 114.667 23.935 3.425 1.00 0.00 C ATOM 1220 O GLN A 91 114.359 24.439 2.362 1.00 0.00 O ATOM 1221 CB GLN A 91 116.181 22.256 2.323 1.00 0.00 C ATOM 1222 CG GLN A 91 117.422 23.137 2.475 1.00 0.00 C ATOM 1223 CD GLN A 91 118.312 22.988 1.240 1.00 0.00 C ATOM 1224 OE1 GLN A 91 117.934 23.379 0.155 1.00 0.00 O ATOM 1225 NE2 GLN A 91 119.487 22.434 1.361 1.00 0.00 N ATOM 0 H GLN A 91 113.643 21.553 2.433 1.00 0.00 H new ATOM 0 HA GLN A 91 115.735 22.415 4.453 1.00 0.00 H new ATOM 0 HB2 GLN A 91 116.468 21.205 2.298 1.00 0.00 H new ATOM 0 HB3 GLN A 91 115.681 22.472 1.379 1.00 0.00 H new ATOM 0 HG2 GLN A 91 117.127 24.179 2.600 1.00 0.00 H new ATOM 0 HG3 GLN A 91 117.975 22.853 3.370 1.00 0.00 H new ATOM 0 HE21 GLN A 91 119.804 22.105 2.273 1.00 0.00 H new ATOM 0 HE22 GLN A 91 120.088 22.329 0.544 1.00 0.00 H new ATOM 1232 N THR A 92 114.536 24.585 4.551 1.00 0.00 N ATOM 1233 CA THR A 92 113.998 25.978 4.557 1.00 0.00 C ATOM 1234 C THR A 92 114.894 26.889 5.401 1.00 0.00 C ATOM 1235 O THR A 92 115.625 26.433 6.258 1.00 0.00 O ATOM 1236 CB THR A 92 112.605 25.862 5.179 1.00 0.00 C ATOM 1237 OG1 THR A 92 112.717 25.332 6.492 1.00 0.00 O ATOM 1238 CG2 THR A 92 111.735 24.939 4.324 1.00 0.00 C ATOM 0 H THR A 92 114.779 24.211 5.469 1.00 0.00 H new ATOM 0 HA THR A 92 113.961 26.412 3.558 1.00 0.00 H new ATOM 0 HB THR A 92 112.144 26.849 5.224 1.00 0.00 H new ATOM 0 HG1 THR A 92 113.046 26.028 7.099 1.00 0.00 H new ATOM 0 HG21 THR A 92 110.743 24.858 4.769 1.00 0.00 H new ATOM 0 HG22 THR A 92 111.649 25.349 3.318 1.00 0.00 H new ATOM 0 HG23 THR A 92 112.192 23.951 4.275 1.00 0.00 H new ATOM 1246 N THR A 93 114.840 28.175 5.163 1.00 0.00 N ATOM 1247 CA THR A 93 115.686 29.121 5.951 1.00 0.00 C ATOM 1248 C THR A 93 114.825 30.248 6.531 1.00 0.00 C ATOM 1249 O THR A 93 113.742 30.515 6.054 1.00 0.00 O ATOM 1250 CB THR A 93 116.701 29.685 4.952 1.00 0.00 C ATOM 1251 OG1 THR A 93 116.013 30.417 3.946 1.00 0.00 O ATOM 1252 CG2 THR A 93 117.489 28.541 4.309 1.00 0.00 C ATOM 0 H THR A 93 114.246 28.610 4.457 1.00 0.00 H new ATOM 0 HA THR A 93 116.174 28.628 6.791 1.00 0.00 H new ATOM 0 HB THR A 93 117.394 30.344 5.474 1.00 0.00 H new ATOM 0 HG1 THR A 93 116.660 30.781 3.306 1.00 0.00 H new ATOM 0 HG21 THR A 93 118.209 28.949 3.600 1.00 0.00 H new ATOM 0 HG22 THR A 93 118.017 27.983 5.082 1.00 0.00 H new ATOM 0 HG23 THR A 93 116.802 27.875 3.787 1.00 0.00 H new ATOM 1260 N GLU A 94 115.312 30.913 7.552 1.00 0.00 N ATOM 1261 CA GLU A 94 114.547 32.040 8.182 1.00 0.00 C ATOM 1262 C GLU A 94 113.150 31.583 8.624 1.00 0.00 C ATOM 1263 O GLU A 94 112.305 31.256 7.815 1.00 0.00 O ATOM 1264 CB GLU A 94 114.442 33.119 7.100 1.00 0.00 C ATOM 1265 CG GLU A 94 115.843 33.615 6.728 1.00 0.00 C ATOM 1266 CD GLU A 94 116.511 34.266 7.945 1.00 0.00 C ATOM 1267 OE1 GLU A 94 115.801 34.618 8.874 1.00 0.00 O ATOM 1268 OE2 GLU A 94 117.723 34.404 7.926 1.00 0.00 O ATOM 0 H GLU A 94 116.217 30.722 7.981 1.00 0.00 H new ATOM 0 HA GLU A 94 115.048 32.408 9.077 1.00 0.00 H new ATOM 0 HB2 GLU A 94 113.942 32.717 6.219 1.00 0.00 H new ATOM 0 HB3 GLU A 94 113.835 33.950 7.459 1.00 0.00 H new ATOM 0 HG2 GLU A 94 116.450 32.782 6.372 1.00 0.00 H new ATOM 0 HG3 GLU A 94 115.778 34.334 5.911 1.00 0.00 H new ATOM 1273 N TYR A 95 112.899 31.573 9.907 1.00 0.00 N ATOM 1274 CA TYR A 95 111.558 31.149 10.407 1.00 0.00 C ATOM 1275 C TYR A 95 110.890 32.299 11.175 1.00 0.00 C ATOM 1276 O TYR A 95 111.183 32.511 12.335 1.00 0.00 O ATOM 1277 CB TYR A 95 111.838 29.979 11.350 1.00 0.00 C ATOM 1278 CG TYR A 95 112.463 28.842 10.579 1.00 0.00 C ATOM 1279 CD1 TYR A 95 111.796 28.292 9.480 1.00 0.00 C ATOM 1280 CD2 TYR A 95 113.710 28.336 10.966 1.00 0.00 C ATOM 1281 CE1 TYR A 95 112.375 27.236 8.765 1.00 0.00 C ATOM 1282 CE2 TYR A 95 114.290 27.281 10.253 1.00 0.00 C ATOM 1283 CZ TYR A 95 113.623 26.730 9.153 1.00 0.00 C ATOM 1284 OH TYR A 95 114.194 25.689 8.450 1.00 0.00 O ATOM 0 H TYR A 95 113.566 31.841 10.631 1.00 0.00 H new ATOM 0 HA TYR A 95 110.886 30.871 9.595 1.00 0.00 H new ATOM 0 HB2 TYR A 95 112.505 30.297 12.152 1.00 0.00 H new ATOM 0 HB3 TYR A 95 110.911 29.647 11.819 1.00 0.00 H new ATOM 0 HD1 TYR A 95 110.834 28.682 9.182 1.00 0.00 H new ATOM 0 HD2 TYR A 95 114.224 28.760 11.815 1.00 0.00 H new ATOM 0 HE1 TYR A 95 111.860 26.812 7.915 1.00 0.00 H new ATOM 0 HE2 TYR A 95 115.252 26.892 10.552 1.00 0.00 H new ATOM 0 HH TYR A 95 113.492 25.080 8.139 1.00 0.00 H new ATOM 1293 N PRO A 96 110.004 33.007 10.511 1.00 0.00 N ATOM 1294 CA PRO A 96 109.302 34.132 11.170 1.00 0.00 C ATOM 1295 C PRO A 96 108.197 33.603 12.093 1.00 0.00 C ATOM 1296 O PRO A 96 108.259 33.756 13.297 1.00 0.00 O ATOM 1297 CB PRO A 96 108.724 34.930 10.004 1.00 0.00 C ATOM 1298 CG PRO A 96 108.596 33.956 8.872 1.00 0.00 C ATOM 1299 CD PRO A 96 109.580 32.836 9.112 1.00 0.00 C ATOM 0 HA PRO A 96 109.952 34.737 11.802 1.00 0.00 H new ATOM 0 HB2 PRO A 96 107.756 35.358 10.264 1.00 0.00 H new ATOM 0 HB3 PRO A 96 109.378 35.760 9.735 1.00 0.00 H new ATOM 0 HG2 PRO A 96 107.580 33.566 8.817 1.00 0.00 H new ATOM 0 HG3 PRO A 96 108.801 34.447 7.921 1.00 0.00 H new ATOM 0 HD2 PRO A 96 109.118 31.862 8.954 1.00 0.00 H new ATOM 0 HD3 PRO A 96 110.428 32.901 8.430 1.00 0.00 H new ATOM 1304 N THR A 97 107.193 32.973 11.539 1.00 0.00 N ATOM 1305 CA THR A 97 106.093 32.422 12.385 1.00 0.00 C ATOM 1306 C THR A 97 105.563 31.119 11.774 1.00 0.00 C ATOM 1307 O THR A 97 105.477 30.984 10.569 1.00 0.00 O ATOM 1308 CB THR A 97 105.016 33.515 12.393 1.00 0.00 C ATOM 1309 OG1 THR A 97 103.992 33.161 13.313 1.00 0.00 O ATOM 1310 CG2 THR A 97 104.417 33.683 10.992 1.00 0.00 C ATOM 0 H THR A 97 107.088 32.816 10.537 1.00 0.00 H new ATOM 0 HA THR A 97 106.420 32.178 13.396 1.00 0.00 H new ATOM 0 HB THR A 97 105.470 34.459 12.694 1.00 0.00 H new ATOM 0 HG1 THR A 97 103.847 32.192 13.284 1.00 0.00 H new ATOM 0 HG21 THR A 97 103.655 34.462 11.013 1.00 0.00 H new ATOM 0 HG22 THR A 97 105.203 33.964 10.291 1.00 0.00 H new ATOM 0 HG23 THR A 97 103.967 32.743 10.674 1.00 0.00 H new ATOM 1318 N TYR A 98 105.202 30.165 12.599 1.00 0.00 N ATOM 1319 CA TYR A 98 104.672 28.859 12.083 1.00 0.00 C ATOM 1320 C TYR A 98 105.543 28.320 10.938 1.00 0.00 C ATOM 1321 O TYR A 98 106.627 28.813 10.689 1.00 0.00 O ATOM 1322 CB TYR A 98 103.264 29.176 11.575 1.00 0.00 C ATOM 1323 CG TYR A 98 102.414 29.678 12.717 1.00 0.00 C ATOM 1324 CD1 TYR A 98 101.834 28.769 13.610 1.00 0.00 C ATOM 1325 CD2 TYR A 98 102.205 31.052 12.884 1.00 0.00 C ATOM 1326 CE1 TYR A 98 101.046 29.234 14.670 1.00 0.00 C ATOM 1327 CE2 TYR A 98 101.417 31.517 13.943 1.00 0.00 C ATOM 1328 CZ TYR A 98 100.837 30.607 14.836 1.00 0.00 C ATOM 1329 OH TYR A 98 100.060 31.066 15.881 1.00 0.00 O ATOM 0 H TYR A 98 105.252 30.234 13.615 1.00 0.00 H new ATOM 0 HA TYR A 98 104.672 28.092 12.857 1.00 0.00 H new ATOM 0 HB2 TYR A 98 103.312 29.927 10.786 1.00 0.00 H new ATOM 0 HB3 TYR A 98 102.815 28.284 11.139 1.00 0.00 H new ATOM 0 HD1 TYR A 98 101.994 27.709 13.481 1.00 0.00 H new ATOM 0 HD2 TYR A 98 102.652 31.754 12.195 1.00 0.00 H new ATOM 0 HE1 TYR A 98 100.600 28.533 15.359 1.00 0.00 H new ATOM 0 HE2 TYR A 98 101.256 32.577 14.072 1.00 0.00 H new ATOM 0 HH TYR A 98 100.018 32.045 15.852 1.00 0.00 H new ATOM 1338 N LYS A 99 105.077 27.309 10.248 1.00 0.00 N ATOM 1339 CA LYS A 99 105.866 26.725 9.114 1.00 0.00 C ATOM 1340 C LYS A 99 107.253 26.289 9.595 1.00 0.00 C ATOM 1341 O LYS A 99 108.262 26.648 9.019 1.00 0.00 O ATOM 1342 CB LYS A 99 105.979 27.841 8.069 1.00 0.00 C ATOM 1343 CG LYS A 99 104.580 28.233 7.588 1.00 0.00 C ATOM 1344 CD LYS A 99 104.696 29.262 6.462 1.00 0.00 C ATOM 1345 CE LYS A 99 103.299 29.746 6.066 1.00 0.00 C ATOM 1346 NZ LYS A 99 102.672 28.586 5.375 1.00 0.00 N ATOM 0 H LYS A 99 104.178 26.859 10.421 1.00 0.00 H new ATOM 0 HA LYS A 99 105.384 25.839 8.701 1.00 0.00 H new ATOM 0 HB2 LYS A 99 106.483 28.707 8.499 1.00 0.00 H new ATOM 0 HB3 LYS A 99 106.584 27.505 7.227 1.00 0.00 H new ATOM 0 HG2 LYS A 99 104.045 27.351 7.235 1.00 0.00 H new ATOM 0 HG3 LYS A 99 104.002 28.647 8.415 1.00 0.00 H new ATOM 0 HD2 LYS A 99 105.306 30.105 6.787 1.00 0.00 H new ATOM 0 HD3 LYS A 99 105.197 28.819 5.601 1.00 0.00 H new ATOM 0 HE2 LYS A 99 102.721 30.044 6.941 1.00 0.00 H new ATOM 0 HE3 LYS A 99 103.353 30.614 5.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 101.936 28.926 4.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 103.397 28.069 4.838 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 102.245 27.952 6.080 1.00 0.00 H new ATOM 1356 N ASN A 100 107.308 25.517 10.650 1.00 0.00 N ATOM 1357 CA ASN A 100 108.628 25.050 11.180 1.00 0.00 C ATOM 1358 C ASN A 100 109.432 24.346 10.081 1.00 0.00 C ATOM 1359 O ASN A 100 110.647 24.372 10.078 1.00 0.00 O ATOM 1360 CB ASN A 100 108.283 24.068 12.302 1.00 0.00 C ATOM 1361 CG ASN A 100 107.567 24.811 13.434 1.00 0.00 C ATOM 1362 OD1 ASN A 100 107.646 26.019 13.532 1.00 0.00 O ATOM 1363 ND2 ASN A 100 106.864 24.132 14.299 1.00 0.00 N ATOM 0 H ASN A 100 106.494 25.188 11.170 1.00 0.00 H new ATOM 0 HA ASN A 100 109.240 25.879 11.535 1.00 0.00 H new ATOM 0 HB2 ASN A 100 107.647 23.270 11.918 1.00 0.00 H new ATOM 0 HB3 ASN A 100 109.191 23.598 12.679 1.00 0.00 H new ATOM 0 HD21 ASN A 100 106.382 24.616 15.056 1.00 0.00 H new ATOM 0 HD22 ASN A 100 106.797 23.117 14.218 1.00 0.00 H new ATOM 1369 N ASP A 101 108.760 23.710 9.152 1.00 0.00 N ATOM 1370 CA ASP A 101 109.474 22.992 8.046 1.00 0.00 C ATOM 1371 C ASP A 101 110.474 21.986 8.624 1.00 0.00 C ATOM 1372 O ASP A 101 111.612 21.914 8.202 1.00 0.00 O ATOM 1373 CB ASP A 101 110.199 24.082 7.246 1.00 0.00 C ATOM 1374 CG ASP A 101 109.175 25.036 6.621 1.00 0.00 C ATOM 1375 OD1 ASP A 101 108.033 24.634 6.459 1.00 0.00 O ATOM 1376 OD2 ASP A 101 109.552 26.155 6.314 1.00 0.00 O ATOM 0 H ASP A 101 107.742 23.656 9.111 1.00 0.00 H new ATOM 0 HA ASP A 101 108.786 22.428 7.417 1.00 0.00 H new ATOM 0 HB2 ASP A 101 110.875 24.636 7.898 1.00 0.00 H new ATOM 0 HB3 ASP A 101 110.810 23.628 6.466 1.00 0.00 H new ATOM 1380 N THR A 102 110.052 21.214 9.589 1.00 0.00 N ATOM 1381 CA THR A 102 110.966 20.207 10.207 1.00 0.00 C ATOM 1382 C THR A 102 110.778 18.842 9.538 1.00 0.00 C ATOM 1383 O THR A 102 110.023 18.704 8.594 1.00 0.00 O ATOM 1384 CB THR A 102 110.558 20.142 11.683 1.00 0.00 C ATOM 1385 OG1 THR A 102 110.099 21.418 12.112 1.00 0.00 O ATOM 1386 CG2 THR A 102 111.762 19.724 12.529 1.00 0.00 C ATOM 0 H THR A 102 109.110 21.237 9.978 1.00 0.00 H new ATOM 0 HA THR A 102 112.015 20.479 10.089 1.00 0.00 H new ATOM 0 HB THR A 102 109.757 19.412 11.802 1.00 0.00 H new ATOM 0 HG1 THR A 102 109.838 21.371 13.055 1.00 0.00 H new ATOM 0 HG21 THR A 102 111.471 19.678 13.578 1.00 0.00 H new ATOM 0 HG22 THR A 102 112.111 18.743 12.206 1.00 0.00 H new ATOM 0 HG23 THR A 102 112.563 20.453 12.406 1.00 0.00 H new ATOM 1394 N SER A 103 111.459 17.837 10.021 1.00 0.00 N ATOM 1395 CA SER A 103 111.324 16.478 9.419 1.00 0.00 C ATOM 1396 C SER A 103 110.442 15.600 10.311 1.00 0.00 C ATOM 1397 O SER A 103 110.299 15.849 11.492 1.00 0.00 O ATOM 1398 CB SER A 103 112.748 15.926 9.362 1.00 0.00 C ATOM 1399 OG SER A 103 113.546 16.771 8.544 1.00 0.00 O ATOM 0 H SER A 103 112.104 17.899 10.808 1.00 0.00 H new ATOM 0 HA SER A 103 110.860 16.503 8.433 1.00 0.00 H new ATOM 0 HB2 SER A 103 113.169 15.869 10.366 1.00 0.00 H new ATOM 0 HB3 SER A 103 112.742 14.912 8.961 1.00 0.00 H new ATOM 0 HG SER A 103 114.289 17.131 9.072 1.00 0.00 H new ATOM 1404 N ASP A 104 109.847 14.576 9.755 1.00 0.00 N ATOM 1405 CA ASP A 104 108.969 13.684 10.576 1.00 0.00 C ATOM 1406 C ASP A 104 109.274 12.218 10.264 1.00 0.00 C ATOM 1407 O ASP A 104 109.526 11.863 9.129 1.00 0.00 O ATOM 1408 CB ASP A 104 107.539 14.040 10.159 1.00 0.00 C ATOM 1409 CG ASP A 104 106.532 13.331 11.072 1.00 0.00 C ATOM 1410 OD1 ASP A 104 106.955 12.733 12.050 1.00 0.00 O ATOM 1411 OD2 ASP A 104 105.350 13.401 10.779 1.00 0.00 O ATOM 0 H ASP A 104 109.930 14.318 8.772 1.00 0.00 H new ATOM 0 HA ASP A 104 109.123 13.820 11.646 1.00 0.00 H new ATOM 0 HB2 ASP A 104 107.394 15.119 10.213 1.00 0.00 H new ATOM 0 HB3 ASP A 104 107.371 13.748 9.123 1.00 0.00 H new ATOM 1415 N TYR A 105 109.267 11.362 11.257 1.00 0.00 N ATOM 1416 CA TYR A 105 109.576 9.922 11.009 1.00 0.00 C ATOM 1417 C TYR A 105 108.354 9.040 11.292 1.00 0.00 C ATOM 1418 O TYR A 105 107.422 9.444 11.959 1.00 0.00 O ATOM 1419 CB TYR A 105 110.703 9.587 11.990 1.00 0.00 C ATOM 1420 CG TYR A 105 111.901 10.464 11.715 1.00 0.00 C ATOM 1421 CD1 TYR A 105 111.991 11.731 12.304 1.00 0.00 C ATOM 1422 CD2 TYR A 105 112.923 10.012 10.872 1.00 0.00 C ATOM 1423 CE1 TYR A 105 113.101 12.545 12.050 1.00 0.00 C ATOM 1424 CE2 TYR A 105 114.033 10.826 10.618 1.00 0.00 C ATOM 1425 CZ TYR A 105 114.122 12.092 11.207 1.00 0.00 C ATOM 1426 OH TYR A 105 115.216 12.894 10.955 1.00 0.00 O ATOM 0 H TYR A 105 109.061 11.600 12.227 1.00 0.00 H new ATOM 0 HA TYR A 105 109.856 9.744 9.971 1.00 0.00 H new ATOM 0 HB2 TYR A 105 110.361 9.734 13.014 1.00 0.00 H new ATOM 0 HB3 TYR A 105 110.980 8.537 11.894 1.00 0.00 H new ATOM 0 HD1 TYR A 105 111.203 12.081 12.955 1.00 0.00 H new ATOM 0 HD2 TYR A 105 112.855 9.035 10.417 1.00 0.00 H new ATOM 0 HE1 TYR A 105 113.169 13.522 12.504 1.00 0.00 H new ATOM 0 HE2 TYR A 105 114.821 10.477 9.967 1.00 0.00 H new ATOM 0 HH TYR A 105 115.831 12.428 10.351 1.00 0.00 H new ATOM 1435 N GLY A 106 108.368 7.832 10.791 1.00 0.00 N ATOM 1436 CA GLY A 106 107.228 6.895 11.022 1.00 0.00 C ATOM 1437 C GLY A 106 107.704 5.466 10.753 1.00 0.00 C ATOM 1438 O GLY A 106 108.869 5.240 10.487 1.00 0.00 O ATOM 0 H GLY A 106 109.127 7.451 10.227 1.00 0.00 H new ATOM 0 HA2 GLY A 106 106.866 6.986 12.046 1.00 0.00 H new ATOM 0 HA3 GLY A 106 106.394 7.145 10.366 1.00 0.00 H new ATOM 1441 N PHE A 107 106.830 4.493 10.840 1.00 0.00 N ATOM 1442 CA PHE A 107 107.267 3.079 10.610 1.00 0.00 C ATOM 1443 C PHE A 107 106.584 2.476 9.377 1.00 0.00 C ATOM 1444 O PHE A 107 105.529 2.915 8.960 1.00 0.00 O ATOM 1445 CB PHE A 107 106.850 2.328 11.874 1.00 0.00 C ATOM 1446 CG PHE A 107 107.608 2.881 13.058 1.00 0.00 C ATOM 1447 CD1 PHE A 107 108.900 2.419 13.338 1.00 0.00 C ATOM 1448 CD2 PHE A 107 107.022 3.857 13.871 1.00 0.00 C ATOM 1449 CE1 PHE A 107 109.604 2.931 14.434 1.00 0.00 C ATOM 1450 CE2 PHE A 107 107.726 4.371 14.967 1.00 0.00 C ATOM 1451 CZ PHE A 107 109.018 3.907 15.248 1.00 0.00 C ATOM 0 H PHE A 107 105.841 4.614 11.058 1.00 0.00 H new ATOM 0 HA PHE A 107 108.339 3.016 10.423 1.00 0.00 H new ATOM 0 HB2 PHE A 107 105.777 2.431 12.035 1.00 0.00 H new ATOM 0 HB3 PHE A 107 107.055 1.263 11.762 1.00 0.00 H new ATOM 0 HD1 PHE A 107 109.353 1.668 12.708 1.00 0.00 H new ATOM 0 HD2 PHE A 107 106.026 4.214 13.653 1.00 0.00 H new ATOM 0 HE1 PHE A 107 110.599 2.573 14.652 1.00 0.00 H new ATOM 0 HE2 PHE A 107 107.274 5.124 15.595 1.00 0.00 H new ATOM 0 HZ PHE A 107 109.562 4.303 16.093 1.00 0.00 H new ATOM 1460 N SER A 108 107.186 1.469 8.793 1.00 0.00 N ATOM 1461 CA SER A 108 106.589 0.824 7.584 1.00 0.00 C ATOM 1462 C SER A 108 106.413 -0.682 7.813 1.00 0.00 C ATOM 1463 O SER A 108 107.117 -1.287 8.600 1.00 0.00 O ATOM 1464 CB SER A 108 107.595 1.079 6.462 1.00 0.00 C ATOM 1465 OG SER A 108 107.780 2.481 6.308 1.00 0.00 O ATOM 0 H SER A 108 108.069 1.065 9.104 1.00 0.00 H new ATOM 0 HA SER A 108 105.603 1.225 7.350 1.00 0.00 H new ATOM 0 HB2 SER A 108 108.545 0.598 6.694 1.00 0.00 H new ATOM 0 HB3 SER A 108 107.236 0.643 5.530 1.00 0.00 H new ATOM 0 HG SER A 108 108.426 2.649 5.590 1.00 0.00 H new ATOM 1470 N TYR A 109 105.487 -1.293 7.115 1.00 0.00 N ATOM 1471 CA TYR A 109 105.264 -2.763 7.268 1.00 0.00 C ATOM 1472 C TYR A 109 104.678 -3.340 5.973 1.00 0.00 C ATOM 1473 O TYR A 109 103.904 -2.686 5.299 1.00 0.00 O ATOM 1474 CB TYR A 109 104.263 -2.898 8.416 1.00 0.00 C ATOM 1475 CG TYR A 109 104.045 -4.359 8.725 1.00 0.00 C ATOM 1476 CD1 TYR A 109 104.923 -5.032 9.582 1.00 0.00 C ATOM 1477 CD2 TYR A 109 102.965 -5.042 8.152 1.00 0.00 C ATOM 1478 CE1 TYR A 109 104.723 -6.388 9.868 1.00 0.00 C ATOM 1479 CE2 TYR A 109 102.764 -6.398 8.438 1.00 0.00 C ATOM 1480 CZ TYR A 109 103.642 -7.070 9.296 1.00 0.00 C ATOM 1481 OH TYR A 109 103.444 -8.407 9.576 1.00 0.00 O ATOM 0 H TYR A 109 104.873 -0.833 6.442 1.00 0.00 H new ATOM 0 HA TYR A 109 106.188 -3.304 7.472 1.00 0.00 H new ATOM 0 HB2 TYR A 109 104.635 -2.380 9.300 1.00 0.00 H new ATOM 0 HB3 TYR A 109 103.318 -2.428 8.145 1.00 0.00 H new ATOM 0 HD1 TYR A 109 105.756 -4.505 10.023 1.00 0.00 H new ATOM 0 HD2 TYR A 109 102.288 -4.523 7.490 1.00 0.00 H new ATOM 0 HE1 TYR A 109 105.401 -6.907 10.529 1.00 0.00 H new ATOM 0 HE2 TYR A 109 101.931 -6.925 7.996 1.00 0.00 H new ATOM 0 HH TYR A 109 102.650 -8.727 9.100 1.00 0.00 H new ATOM 1490 N GLY A 110 105.030 -4.552 5.617 1.00 0.00 N ATOM 1491 CA GLY A 110 104.472 -5.144 4.362 1.00 0.00 C ATOM 1492 C GLY A 110 105.168 -6.468 4.025 1.00 0.00 C ATOM 1493 O GLY A 110 106.019 -6.942 4.750 1.00 0.00 O ATOM 0 H GLY A 110 105.673 -5.151 6.135 1.00 0.00 H new ATOM 0 HA2 GLY A 110 103.401 -5.311 4.479 1.00 0.00 H new ATOM 0 HA3 GLY A 110 104.597 -4.442 3.537 1.00 0.00 H new ATOM 1496 N ALA A 111 104.800 -7.062 2.918 1.00 0.00 N ATOM 1497 CA ALA A 111 105.418 -8.356 2.490 1.00 0.00 C ATOM 1498 C ALA A 111 105.009 -8.648 1.042 1.00 0.00 C ATOM 1499 O ALA A 111 104.074 -8.054 0.537 1.00 0.00 O ATOM 1500 CB ALA A 111 104.841 -9.408 3.439 1.00 0.00 C ATOM 0 H ALA A 111 104.088 -6.701 2.283 1.00 0.00 H new ATOM 0 HA ALA A 111 106.507 -8.342 2.530 1.00 0.00 H new ATOM 0 HB1 ALA A 111 105.248 -10.387 3.188 1.00 0.00 H new ATOM 0 HB2 ALA A 111 105.107 -9.157 4.466 1.00 0.00 H new ATOM 0 HB3 ALA A 111 103.756 -9.430 3.341 1.00 0.00 H new ATOM 1506 N GLY A 112 105.685 -9.543 0.359 1.00 0.00 N ATOM 1507 CA GLY A 112 105.303 -9.834 -1.056 1.00 0.00 C ATOM 1508 C GLY A 112 105.802 -11.227 -1.456 1.00 0.00 C ATOM 1509 O GLY A 112 106.286 -11.983 -0.635 1.00 0.00 O ATOM 0 H GLY A 112 106.476 -10.078 0.718 1.00 0.00 H new ATOM 0 HA2 GLY A 112 104.220 -9.780 -1.168 1.00 0.00 H new ATOM 0 HA3 GLY A 112 105.730 -9.081 -1.719 1.00 0.00 H new ATOM 1512 N LEU A 113 105.687 -11.568 -2.715 1.00 0.00 N ATOM 1513 CA LEU A 113 106.153 -12.910 -3.185 1.00 0.00 C ATOM 1514 C LEU A 113 107.035 -12.744 -4.426 1.00 0.00 C ATOM 1515 O LEU A 113 106.878 -11.799 -5.176 1.00 0.00 O ATOM 1516 CB LEU A 113 104.874 -13.674 -3.533 1.00 0.00 C ATOM 1517 CG LEU A 113 105.225 -15.114 -3.913 1.00 0.00 C ATOM 1518 CD1 LEU A 113 105.551 -15.913 -2.651 1.00 0.00 C ATOM 1519 CD2 LEU A 113 104.033 -15.755 -4.630 1.00 0.00 C ATOM 0 H LEU A 113 105.289 -10.972 -3.441 1.00 0.00 H new ATOM 0 HA LEU A 113 106.745 -13.434 -2.435 1.00 0.00 H new ATOM 0 HB2 LEU A 113 104.191 -13.667 -2.683 1.00 0.00 H new ATOM 0 HB3 LEU A 113 104.359 -13.184 -4.359 1.00 0.00 H new ATOM 0 HG LEU A 113 106.092 -15.114 -4.574 1.00 0.00 H new ATOM 0 HD11 LEU A 113 105.801 -16.938 -2.924 1.00 0.00 H new ATOM 0 HD12 LEU A 113 106.399 -15.457 -2.140 1.00 0.00 H new ATOM 0 HD13 LEU A 113 104.686 -15.914 -1.988 1.00 0.00 H new ATOM 0 HD21 LEU A 113 104.281 -16.781 -4.902 1.00 0.00 H new ATOM 0 HD22 LEU A 113 103.167 -15.754 -3.968 1.00 0.00 H new ATOM 0 HD23 LEU A 113 103.802 -15.187 -5.531 1.00 0.00 H new ATOM 1530 N GLN A 114 107.953 -13.650 -4.664 1.00 0.00 N ATOM 1531 CA GLN A 114 108.827 -13.534 -5.869 1.00 0.00 C ATOM 1532 C GLN A 114 108.616 -14.747 -6.781 1.00 0.00 C ATOM 1533 O GLN A 114 108.319 -15.833 -6.318 1.00 0.00 O ATOM 1534 CB GLN A 114 110.255 -13.516 -5.322 1.00 0.00 C ATOM 1535 CG GLN A 114 111.246 -13.351 -6.478 1.00 0.00 C ATOM 1536 CD GLN A 114 112.676 -13.427 -5.942 1.00 0.00 C ATOM 1537 OE1 GLN A 114 113.089 -14.443 -5.418 1.00 0.00 O ATOM 1538 NE2 GLN A 114 113.456 -12.387 -6.049 1.00 0.00 N ATOM 0 H GLN A 114 108.133 -14.463 -4.075 1.00 0.00 H new ATOM 0 HA GLN A 114 108.608 -12.644 -6.460 1.00 0.00 H new ATOM 0 HB2 GLN A 114 110.372 -12.699 -4.610 1.00 0.00 H new ATOM 0 HB3 GLN A 114 110.460 -14.441 -4.783 1.00 0.00 H new ATOM 0 HG2 GLN A 114 111.084 -14.130 -7.223 1.00 0.00 H new ATOM 0 HG3 GLN A 114 111.084 -12.395 -6.976 1.00 0.00 H new ATOM 0 HE21 GLN A 114 113.111 -11.534 -6.489 1.00 0.00 H new ATOM 0 HE22 GLN A 114 114.411 -12.427 -5.693 1.00 0.00 H new ATOM 1545 N PHE A 115 108.773 -14.572 -8.069 1.00 0.00 N ATOM 1546 CA PHE A 115 108.584 -15.714 -9.010 1.00 0.00 C ATOM 1547 C PHE A 115 109.910 -16.040 -9.698 1.00 0.00 C ATOM 1548 O PHE A 115 110.780 -15.197 -9.810 1.00 0.00 O ATOM 1549 CB PHE A 115 107.555 -15.227 -10.029 1.00 0.00 C ATOM 1550 CG PHE A 115 106.248 -14.938 -9.327 1.00 0.00 C ATOM 1551 CD1 PHE A 115 105.342 -15.976 -9.079 1.00 0.00 C ATOM 1552 CD2 PHE A 115 105.944 -13.633 -8.924 1.00 0.00 C ATOM 1553 CE1 PHE A 115 104.132 -15.708 -8.429 1.00 0.00 C ATOM 1554 CE2 PHE A 115 104.735 -13.365 -8.273 1.00 0.00 C ATOM 1555 CZ PHE A 115 103.829 -14.403 -8.026 1.00 0.00 C ATOM 0 H PHE A 115 109.024 -13.686 -8.508 1.00 0.00 H new ATOM 0 HA PHE A 115 108.251 -16.620 -8.504 1.00 0.00 H new ATOM 0 HB2 PHE A 115 107.919 -14.329 -10.528 1.00 0.00 H new ATOM 0 HB3 PHE A 115 107.406 -15.982 -10.801 1.00 0.00 H new ATOM 0 HD1 PHE A 115 105.577 -16.983 -9.389 1.00 0.00 H new ATOM 0 HD2 PHE A 115 106.643 -12.832 -9.116 1.00 0.00 H new ATOM 0 HE1 PHE A 115 103.432 -16.508 -8.239 1.00 0.00 H new ATOM 0 HE2 PHE A 115 104.501 -12.358 -7.961 1.00 0.00 H new ATOM 0 HZ PHE A 115 102.895 -14.196 -7.524 1.00 0.00 H new ATOM 1564 N ASN A 116 110.080 -17.257 -10.146 1.00 0.00 N ATOM 1565 CA ASN A 116 111.363 -17.630 -10.808 1.00 0.00 C ATOM 1566 C ASN A 116 111.150 -17.952 -12.296 1.00 0.00 C ATOM 1567 O ASN A 116 111.390 -19.064 -12.725 1.00 0.00 O ATOM 1568 CB ASN A 116 111.847 -18.869 -10.053 1.00 0.00 C ATOM 1569 CG ASN A 116 113.373 -18.945 -10.120 1.00 0.00 C ATOM 1570 OD1 ASN A 116 113.924 -19.563 -11.009 1.00 0.00 O ATOM 1571 ND2 ASN A 116 114.085 -18.338 -9.210 1.00 0.00 N ATOM 0 H ASN A 116 109.389 -18.005 -10.082 1.00 0.00 H new ATOM 0 HA ASN A 116 112.086 -16.815 -10.776 1.00 0.00 H new ATOM 0 HB2 ASN A 116 111.520 -18.825 -9.014 1.00 0.00 H new ATOM 0 HB3 ASN A 116 111.408 -19.767 -10.488 1.00 0.00 H new ATOM 0 HD21 ASN A 116 115.103 -18.383 -9.246 1.00 0.00 H new ATOM 0 HD22 ASN A 116 113.623 -17.819 -8.463 1.00 0.00 H new ATOM 1577 N PRO A 117 110.736 -16.959 -13.050 1.00 0.00 N ATOM 1578 CA PRO A 117 110.533 -17.154 -14.509 1.00 0.00 C ATOM 1579 C PRO A 117 111.890 -17.338 -15.206 1.00 0.00 C ATOM 1580 O PRO A 117 111.966 -17.777 -16.337 1.00 0.00 O ATOM 1581 CB PRO A 117 109.860 -15.858 -14.955 1.00 0.00 C ATOM 1582 CG PRO A 117 110.271 -14.845 -13.938 1.00 0.00 C ATOM 1583 CD PRO A 117 110.420 -15.585 -12.635 1.00 0.00 C ATOM 0 HA PRO A 117 109.940 -18.036 -14.751 1.00 0.00 H new ATOM 0 HB2 PRO A 117 110.183 -15.568 -15.955 1.00 0.00 H new ATOM 0 HB3 PRO A 117 108.776 -15.967 -14.989 1.00 0.00 H new ATOM 0 HG2 PRO A 117 111.209 -14.368 -14.223 1.00 0.00 H new ATOM 0 HG3 PRO A 117 109.524 -14.055 -13.853 1.00 0.00 H new ATOM 0 HD2 PRO A 117 111.214 -15.159 -12.021 1.00 0.00 H new ATOM 0 HD3 PRO A 117 109.504 -15.545 -12.045 1.00 0.00 H new ATOM 1588 N MET A 118 112.961 -17.017 -14.523 1.00 0.00 N ATOM 1589 CA MET A 118 114.316 -17.174 -15.097 1.00 0.00 C ATOM 1590 C MET A 118 115.267 -17.571 -13.970 1.00 0.00 C ATOM 1591 O MET A 118 115.164 -17.089 -12.858 1.00 0.00 O ATOM 1592 CB MET A 118 114.676 -15.803 -15.663 1.00 0.00 C ATOM 1593 CG MET A 118 113.754 -15.472 -16.838 1.00 0.00 C ATOM 1594 SD MET A 118 114.278 -13.912 -17.593 1.00 0.00 S ATOM 1595 CE MET A 118 112.933 -13.778 -18.795 1.00 0.00 C ATOM 0 H MET A 118 112.944 -16.646 -13.573 1.00 0.00 H new ATOM 0 HA MET A 118 114.375 -17.938 -15.872 1.00 0.00 H new ATOM 0 HB2 MET A 118 114.581 -15.042 -14.888 1.00 0.00 H new ATOM 0 HB3 MET A 118 115.716 -15.796 -15.991 1.00 0.00 H new ATOM 0 HG2 MET A 118 113.785 -16.274 -17.576 1.00 0.00 H new ATOM 0 HG3 MET A 118 112.723 -15.394 -16.494 1.00 0.00 H new ATOM 0 HE1 MET A 118 113.059 -12.868 -19.382 1.00 0.00 H new ATOM 0 HE2 MET A 118 112.950 -14.643 -19.458 1.00 0.00 H new ATOM 0 HE3 MET A 118 111.978 -13.742 -18.270 1.00 0.00 H new ATOM 1603 N GLU A 119 116.161 -18.463 -14.243 1.00 0.00 N ATOM 1604 CA GLU A 119 117.108 -18.935 -13.186 1.00 0.00 C ATOM 1605 C GLU A 119 117.977 -17.796 -12.635 1.00 0.00 C ATOM 1606 O GLU A 119 118.270 -17.762 -11.454 1.00 0.00 O ATOM 1607 CB GLU A 119 117.987 -19.978 -13.880 1.00 0.00 C ATOM 1608 CG GLU A 119 117.127 -21.173 -14.298 1.00 0.00 C ATOM 1609 CD GLU A 119 118.022 -22.259 -14.900 1.00 0.00 C ATOM 1610 OE1 GLU A 119 118.439 -22.094 -16.034 1.00 0.00 O ATOM 1611 OE2 GLU A 119 118.274 -23.236 -14.215 1.00 0.00 O ATOM 0 H GLU A 119 116.286 -18.896 -15.158 1.00 0.00 H new ATOM 0 HA GLU A 119 116.566 -19.337 -12.330 1.00 0.00 H new ATOM 0 HB2 GLU A 119 118.469 -19.540 -14.754 1.00 0.00 H new ATOM 0 HB3 GLU A 119 118.781 -20.305 -13.209 1.00 0.00 H new ATOM 0 HG2 GLU A 119 116.589 -21.567 -13.436 1.00 0.00 H new ATOM 0 HG3 GLU A 119 116.378 -20.859 -15.025 1.00 0.00 H new ATOM 1616 N ASN A 120 118.424 -16.883 -13.464 1.00 0.00 N ATOM 1617 CA ASN A 120 119.306 -15.787 -12.949 1.00 0.00 C ATOM 1618 C ASN A 120 118.523 -14.509 -12.596 1.00 0.00 C ATOM 1619 O ASN A 120 119.094 -13.558 -12.096 1.00 0.00 O ATOM 1620 CB ASN A 120 120.296 -15.520 -14.091 1.00 0.00 C ATOM 1621 CG ASN A 120 119.562 -14.922 -15.298 1.00 0.00 C ATOM 1622 OD1 ASN A 120 118.353 -14.996 -15.388 1.00 0.00 O ATOM 1623 ND2 ASN A 120 120.251 -14.329 -16.235 1.00 0.00 N ATOM 0 H ASN A 120 118.220 -16.848 -14.463 1.00 0.00 H new ATOM 0 HA ASN A 120 119.795 -16.082 -12.020 1.00 0.00 H new ATOM 0 HB2 ASN A 120 121.075 -14.836 -13.754 1.00 0.00 H new ATOM 0 HB3 ASN A 120 120.789 -16.448 -14.379 1.00 0.00 H new ATOM 0 HD21 ASN A 120 119.774 -13.928 -17.042 1.00 0.00 H new ATOM 0 HD22 ASN A 120 121.266 -14.267 -16.160 1.00 0.00 H new ATOM 1629 N VAL A 121 117.236 -14.468 -12.837 1.00 0.00 N ATOM 1630 CA VAL A 121 116.467 -13.227 -12.489 1.00 0.00 C ATOM 1631 C VAL A 121 115.010 -13.546 -12.138 1.00 0.00 C ATOM 1632 O VAL A 121 114.271 -14.089 -12.934 1.00 0.00 O ATOM 1633 CB VAL A 121 116.533 -12.335 -13.736 1.00 0.00 C ATOM 1634 CG1 VAL A 121 117.984 -11.946 -14.015 1.00 0.00 C ATOM 1635 CG2 VAL A 121 115.969 -13.080 -14.946 1.00 0.00 C ATOM 0 H VAL A 121 116.690 -15.223 -13.252 1.00 0.00 H new ATOM 0 HA VAL A 121 116.892 -12.739 -11.612 1.00 0.00 H new ATOM 0 HB VAL A 121 115.940 -11.438 -13.558 1.00 0.00 H new ATOM 0 HG11 VAL A 121 118.027 -11.313 -14.901 1.00 0.00 H new ATOM 0 HG12 VAL A 121 118.386 -11.402 -13.160 1.00 0.00 H new ATOM 0 HG13 VAL A 121 118.576 -12.846 -14.183 1.00 0.00 H new ATOM 0 HG21 VAL A 121 116.021 -12.438 -15.825 1.00 0.00 H new ATOM 0 HG22 VAL A 121 116.553 -13.983 -15.122 1.00 0.00 H new ATOM 0 HG23 VAL A 121 114.931 -13.351 -14.755 1.00 0.00 H new ATOM 1645 N ALA A 122 114.592 -13.189 -10.950 1.00 0.00 N ATOM 1646 CA ALA A 122 113.182 -13.442 -10.532 1.00 0.00 C ATOM 1647 C ALA A 122 112.489 -12.103 -10.255 1.00 0.00 C ATOM 1648 O ALA A 122 113.136 -11.125 -9.936 1.00 0.00 O ATOM 1649 CB ALA A 122 113.289 -14.270 -9.251 1.00 0.00 C ATOM 0 H ALA A 122 115.172 -12.730 -10.248 1.00 0.00 H new ATOM 0 HA ALA A 122 112.601 -13.960 -11.295 1.00 0.00 H new ATOM 0 HB1 ALA A 122 112.290 -14.497 -8.880 1.00 0.00 H new ATOM 0 HB2 ALA A 122 113.818 -15.199 -9.462 1.00 0.00 H new ATOM 0 HB3 ALA A 122 113.836 -13.704 -8.497 1.00 0.00 H new ATOM 1655 N LEU A 123 111.187 -12.044 -10.371 1.00 0.00 N ATOM 1656 CA LEU A 123 110.471 -10.757 -10.108 1.00 0.00 C ATOM 1657 C LEU A 123 109.599 -10.896 -8.861 1.00 0.00 C ATOM 1658 O LEU A 123 109.038 -11.943 -8.610 1.00 0.00 O ATOM 1659 CB LEU A 123 109.601 -10.517 -11.347 1.00 0.00 C ATOM 1660 CG LEU A 123 110.471 -10.496 -12.608 1.00 0.00 C ATOM 1661 CD1 LEU A 123 109.586 -10.275 -13.835 1.00 0.00 C ATOM 1662 CD2 LEU A 123 111.491 -9.358 -12.511 1.00 0.00 C ATOM 0 H LEU A 123 110.590 -12.827 -10.635 1.00 0.00 H new ATOM 0 HA LEU A 123 111.158 -9.929 -9.933 1.00 0.00 H new ATOM 0 HB2 LEU A 123 108.848 -11.301 -11.429 1.00 0.00 H new ATOM 0 HB3 LEU A 123 109.068 -9.571 -11.248 1.00 0.00 H new ATOM 0 HG LEU A 123 110.994 -11.448 -12.699 1.00 0.00 H new ATOM 0 HD11 LEU A 123 110.205 -10.260 -14.732 1.00 0.00 H new ATOM 0 HD12 LEU A 123 108.859 -11.083 -13.909 1.00 0.00 H new ATOM 0 HD13 LEU A 123 109.063 -9.324 -13.739 1.00 0.00 H new ATOM 0 HD21 LEU A 123 112.109 -9.345 -13.409 1.00 0.00 H new ATOM 0 HD22 LEU A 123 110.967 -8.407 -12.417 1.00 0.00 H new ATOM 0 HD23 LEU A 123 112.125 -9.511 -11.637 1.00 0.00 H new ATOM 1673 N ASP A 124 109.474 -9.857 -8.077 1.00 0.00 N ATOM 1674 CA ASP A 124 108.628 -9.961 -6.851 1.00 0.00 C ATOM 1675 C ASP A 124 107.789 -8.696 -6.646 1.00 0.00 C ATOM 1676 O ASP A 124 108.169 -7.606 -7.038 1.00 0.00 O ATOM 1677 CB ASP A 124 109.615 -10.155 -5.691 1.00 0.00 C ATOM 1678 CG ASP A 124 110.623 -8.999 -5.637 1.00 0.00 C ATOM 1679 OD1 ASP A 124 110.451 -8.041 -6.371 1.00 0.00 O ATOM 1680 OD2 ASP A 124 111.560 -9.099 -4.860 1.00 0.00 O ATOM 0 H ASP A 124 109.916 -8.950 -8.230 1.00 0.00 H new ATOM 0 HA ASP A 124 107.919 -10.785 -6.924 1.00 0.00 H new ATOM 0 HB2 ASP A 124 109.070 -10.213 -4.749 1.00 0.00 H new ATOM 0 HB3 ASP A 124 110.144 -11.100 -5.812 1.00 0.00 H new ATOM 1684 N PHE A 125 106.646 -8.848 -6.026 1.00 0.00 N ATOM 1685 CA PHE A 125 105.756 -7.679 -5.768 1.00 0.00 C ATOM 1686 C PHE A 125 105.286 -7.717 -4.312 1.00 0.00 C ATOM 1687 O PHE A 125 105.019 -8.774 -3.775 1.00 0.00 O ATOM 1688 CB PHE A 125 104.577 -7.859 -6.725 1.00 0.00 C ATOM 1689 CG PHE A 125 103.700 -6.631 -6.683 1.00 0.00 C ATOM 1690 CD1 PHE A 125 104.001 -5.528 -7.491 1.00 0.00 C ATOM 1691 CD2 PHE A 125 102.586 -6.595 -5.837 1.00 0.00 C ATOM 1692 CE1 PHE A 125 103.188 -4.390 -7.454 1.00 0.00 C ATOM 1693 CE2 PHE A 125 101.773 -5.456 -5.799 1.00 0.00 C ATOM 1694 CZ PHE A 125 102.074 -4.354 -6.608 1.00 0.00 C ATOM 0 H PHE A 125 106.290 -9.741 -5.685 1.00 0.00 H new ATOM 0 HA PHE A 125 106.253 -6.722 -5.926 1.00 0.00 H new ATOM 0 HB2 PHE A 125 104.941 -8.024 -7.739 1.00 0.00 H new ATOM 0 HB3 PHE A 125 104.000 -8.740 -6.446 1.00 0.00 H new ATOM 0 HD1 PHE A 125 104.861 -5.556 -8.143 1.00 0.00 H new ATOM 0 HD2 PHE A 125 102.353 -7.446 -5.214 1.00 0.00 H new ATOM 0 HE1 PHE A 125 103.420 -3.540 -8.078 1.00 0.00 H new ATOM 0 HE2 PHE A 125 100.914 -5.428 -5.146 1.00 0.00 H new ATOM 0 HZ PHE A 125 101.446 -3.476 -6.579 1.00 0.00 H new ATOM 1703 N SER A 126 105.190 -6.584 -3.665 1.00 0.00 N ATOM 1704 CA SER A 126 104.746 -6.583 -2.239 1.00 0.00 C ATOM 1705 C SER A 126 103.921 -5.334 -1.918 1.00 0.00 C ATOM 1706 O SER A 126 103.934 -4.361 -2.646 1.00 0.00 O ATOM 1707 CB SER A 126 106.042 -6.584 -1.430 1.00 0.00 C ATOM 1708 OG SER A 126 106.673 -5.317 -1.554 1.00 0.00 O ATOM 0 H SER A 126 105.398 -5.666 -4.059 1.00 0.00 H new ATOM 0 HA SER A 126 104.109 -7.438 -2.013 1.00 0.00 H new ATOM 0 HB2 SER A 126 105.830 -6.797 -0.382 1.00 0.00 H new ATOM 0 HB3 SER A 126 106.707 -7.371 -1.787 1.00 0.00 H new ATOM 0 HG SER A 126 107.504 -5.313 -1.035 1.00 0.00 H new ATOM 1713 N TYR A 127 103.217 -5.358 -0.815 1.00 0.00 N ATOM 1714 CA TYR A 127 102.398 -4.177 -0.413 1.00 0.00 C ATOM 1715 C TYR A 127 103.002 -3.559 0.850 1.00 0.00 C ATOM 1716 O TYR A 127 103.239 -4.246 1.825 1.00 0.00 O ATOM 1717 CB TYR A 127 101.005 -4.739 -0.111 1.00 0.00 C ATOM 1718 CG TYR A 127 100.444 -5.419 -1.339 1.00 0.00 C ATOM 1719 CD1 TYR A 127 100.690 -6.779 -1.561 1.00 0.00 C ATOM 1720 CD2 TYR A 127 99.676 -4.689 -2.253 1.00 0.00 C ATOM 1721 CE1 TYR A 127 100.167 -7.409 -2.696 1.00 0.00 C ATOM 1722 CE2 TYR A 127 99.152 -5.319 -3.388 1.00 0.00 C ATOM 1723 CZ TYR A 127 99.399 -6.679 -3.610 1.00 0.00 C ATOM 1724 OH TYR A 127 98.883 -7.300 -4.728 1.00 0.00 O ATOM 0 H TYR A 127 103.175 -6.150 -0.173 1.00 0.00 H new ATOM 0 HA TYR A 127 102.363 -3.406 -1.183 1.00 0.00 H new ATOM 0 HB2 TYR A 127 101.061 -5.449 0.714 1.00 0.00 H new ATOM 0 HB3 TYR A 127 100.340 -3.935 0.205 1.00 0.00 H new ATOM 0 HD1 TYR A 127 101.284 -7.342 -0.856 1.00 0.00 H new ATOM 0 HD2 TYR A 127 99.487 -3.639 -2.083 1.00 0.00 H new ATOM 0 HE1 TYR A 127 100.356 -8.459 -2.866 1.00 0.00 H new ATOM 0 HE2 TYR A 127 98.557 -4.756 -4.092 1.00 0.00 H new ATOM 0 HH TYR A 127 98.374 -6.651 -5.257 1.00 0.00 H new ATOM 1733 N GLU A 128 103.262 -2.277 0.844 1.00 0.00 N ATOM 1734 CA GLU A 128 103.863 -1.640 2.054 1.00 0.00 C ATOM 1735 C GLU A 128 103.049 -0.422 2.503 1.00 0.00 C ATOM 1736 O GLU A 128 102.714 0.442 1.715 1.00 0.00 O ATOM 1737 CB GLU A 128 105.264 -1.212 1.618 1.00 0.00 C ATOM 1738 CG GLU A 128 106.028 -0.659 2.825 1.00 0.00 C ATOM 1739 CD GLU A 128 107.400 -0.133 2.385 1.00 0.00 C ATOM 1740 OE1 GLU A 128 107.693 -0.192 1.199 1.00 0.00 O ATOM 1741 OE2 GLU A 128 108.138 0.320 3.243 1.00 0.00 O ATOM 0 H GLU A 128 103.086 -1.648 0.061 1.00 0.00 H new ATOM 0 HA GLU A 128 103.881 -2.325 2.902 1.00 0.00 H new ATOM 0 HB2 GLU A 128 105.799 -2.061 1.193 1.00 0.00 H new ATOM 0 HB3 GLU A 128 105.198 -0.454 0.838 1.00 0.00 H new ATOM 0 HG2 GLU A 128 105.455 0.142 3.292 1.00 0.00 H new ATOM 0 HG3 GLU A 128 106.153 -1.440 3.575 1.00 0.00 H new ATOM 1746 N GLN A 129 102.752 -0.343 3.773 1.00 0.00 N ATOM 1747 CA GLN A 129 101.985 0.822 4.303 1.00 0.00 C ATOM 1748 C GLN A 129 102.792 1.494 5.417 1.00 0.00 C ATOM 1749 O GLN A 129 103.223 0.846 6.352 1.00 0.00 O ATOM 1750 CB GLN A 129 100.688 0.230 4.856 1.00 0.00 C ATOM 1751 CG GLN A 129 99.768 1.360 5.322 1.00 0.00 C ATOM 1752 CD GLN A 129 98.533 0.767 6.001 1.00 0.00 C ATOM 1753 OE1 GLN A 129 98.648 0.020 6.952 1.00 0.00 O ATOM 1754 NE2 GLN A 129 97.346 1.071 5.551 1.00 0.00 N ATOM 0 H GLN A 129 103.010 -1.041 4.471 1.00 0.00 H new ATOM 0 HA GLN A 129 101.785 1.577 3.543 1.00 0.00 H new ATOM 0 HB2 GLN A 129 100.191 -0.364 4.089 1.00 0.00 H new ATOM 0 HB3 GLN A 129 100.907 -0.441 5.687 1.00 0.00 H new ATOM 0 HG2 GLN A 129 100.299 2.013 6.015 1.00 0.00 H new ATOM 0 HG3 GLN A 129 99.469 1.974 4.472 1.00 0.00 H new ATOM 0 HE21 GLN A 129 97.248 1.698 4.753 1.00 0.00 H new ATOM 0 HE22 GLN A 129 96.516 0.681 5.998 1.00 0.00 H new ATOM 1761 N SER A 130 103.011 2.780 5.326 1.00 0.00 N ATOM 1762 CA SER A 130 103.803 3.475 6.385 1.00 0.00 C ATOM 1763 C SER A 130 103.071 4.726 6.876 1.00 0.00 C ATOM 1764 O SER A 130 102.433 5.424 6.111 1.00 0.00 O ATOM 1765 CB SER A 130 105.117 3.858 5.705 1.00 0.00 C ATOM 1766 OG SER A 130 105.996 4.423 6.668 1.00 0.00 O ATOM 0 H SER A 130 102.678 3.377 4.569 1.00 0.00 H new ATOM 0 HA SER A 130 103.959 2.843 7.259 1.00 0.00 H new ATOM 0 HB2 SER A 130 105.574 2.979 5.250 1.00 0.00 H new ATOM 0 HB3 SER A 130 104.930 4.572 4.903 1.00 0.00 H new ATOM 0 HG SER A 130 106.870 3.984 6.611 1.00 0.00 H new ATOM 1771 N ARG A 131 103.170 5.016 8.147 1.00 0.00 N ATOM 1772 CA ARG A 131 102.493 6.227 8.694 1.00 0.00 C ATOM 1773 C ARG A 131 103.519 7.120 9.394 1.00 0.00 C ATOM 1774 O ARG A 131 104.289 6.661 10.220 1.00 0.00 O ATOM 1775 CB ARG A 131 101.475 5.691 9.701 1.00 0.00 C ATOM 1776 CG ARG A 131 100.417 4.862 8.970 1.00 0.00 C ATOM 1777 CD ARG A 131 99.335 4.417 9.958 1.00 0.00 C ATOM 1778 NE ARG A 131 100.055 3.626 10.994 1.00 0.00 N ATOM 1779 CZ ARG A 131 99.617 3.608 12.224 1.00 0.00 C ATOM 1780 NH1 ARG A 131 98.719 2.732 12.584 1.00 0.00 N ATOM 1781 NH2 ARG A 131 100.078 4.465 13.093 1.00 0.00 N ATOM 0 H ARG A 131 103.691 4.466 8.830 1.00 0.00 H new ATOM 0 HA ARG A 131 102.018 6.827 7.918 1.00 0.00 H new ATOM 0 HB2 ARG A 131 101.977 5.079 10.450 1.00 0.00 H new ATOM 0 HB3 ARG A 131 101.002 6.518 10.230 1.00 0.00 H new ATOM 0 HG2 ARG A 131 99.971 5.450 8.168 1.00 0.00 H new ATOM 0 HG3 ARG A 131 100.880 3.991 8.507 1.00 0.00 H new ATOM 0 HD2 ARG A 131 98.828 5.275 10.399 1.00 0.00 H new ATOM 0 HD3 ARG A 131 98.572 3.816 9.463 1.00 0.00 H new ATOM 0 HE ARG A 131 100.891 3.098 10.743 1.00 0.00 H new ATOM 0 HH11 ARG A 131 98.359 2.062 11.905 1.00 0.00 H new ATOM 0 HH12 ARG A 131 98.377 2.718 13.545 1.00 0.00 H new ATOM 0 HH21 ARG A 131 100.780 5.149 12.812 1.00 0.00 H new ATOM 0 HH22 ARG A 131 99.736 4.451 14.054 1.00 0.00 H new ATOM 1792 N ILE A 132 103.537 8.389 9.068 1.00 0.00 N ATOM 1793 CA ILE A 132 104.515 9.315 9.707 1.00 0.00 C ATOM 1794 C ILE A 132 103.756 10.341 10.548 1.00 0.00 C ATOM 1795 O ILE A 132 103.795 11.524 10.277 1.00 0.00 O ATOM 1796 CB ILE A 132 105.245 10.020 8.550 1.00 0.00 C ATOM 1797 CG1 ILE A 132 105.644 9.016 7.453 1.00 0.00 C ATOM 1798 CG2 ILE A 132 106.506 10.699 9.090 1.00 0.00 C ATOM 1799 CD1 ILE A 132 106.497 7.893 8.045 1.00 0.00 C ATOM 0 H ILE A 132 102.914 8.822 8.386 1.00 0.00 H new ATOM 0 HA ILE A 132 105.215 8.791 10.357 1.00 0.00 H new ATOM 0 HB ILE A 132 104.571 10.758 8.116 1.00 0.00 H new ATOM 0 HG12 ILE A 132 104.750 8.598 6.991 1.00 0.00 H new ATOM 0 HG13 ILE A 132 106.199 9.528 6.667 1.00 0.00 H new ATOM 0 HG21 ILE A 132 107.027 11.200 8.274 1.00 0.00 H new ATOM 0 HG22 ILE A 132 106.229 11.432 9.848 1.00 0.00 H new ATOM 0 HG23 ILE A 132 107.162 9.949 9.533 1.00 0.00 H new ATOM 0 HD11 ILE A 132 106.771 7.191 7.258 1.00 0.00 H new ATOM 0 HD12 ILE A 132 107.400 8.316 8.485 1.00 0.00 H new ATOM 0 HD13 ILE A 132 105.928 7.371 8.814 1.00 0.00 H new ATOM 1810 N ARG A 133 103.059 9.892 11.565 1.00 0.00 N ATOM 1811 CA ARG A 133 102.273 10.820 12.447 1.00 0.00 C ATOM 1812 C ARG A 133 101.109 11.466 11.678 1.00 0.00 C ATOM 1813 O ARG A 133 99.960 11.309 12.045 1.00 0.00 O ATOM 1814 CB ARG A 133 103.261 11.889 12.937 1.00 0.00 C ATOM 1815 CG ARG A 133 102.634 12.670 14.093 1.00 0.00 C ATOM 1816 CD ARG A 133 103.651 13.678 14.637 1.00 0.00 C ATOM 1817 NE ARG A 133 103.819 14.687 13.552 1.00 0.00 N ATOM 1818 CZ ARG A 133 104.575 15.733 13.746 1.00 0.00 C ATOM 1819 NH1 ARG A 133 105.779 15.587 14.229 1.00 0.00 N ATOM 1820 NH2 ARG A 133 104.128 16.924 13.458 1.00 0.00 N ATOM 0 H ARG A 133 102.999 8.908 11.827 1.00 0.00 H new ATOM 0 HA ARG A 133 101.828 10.278 13.282 1.00 0.00 H new ATOM 0 HB2 ARG A 133 104.190 11.420 13.262 1.00 0.00 H new ATOM 0 HB3 ARG A 133 103.515 12.566 12.122 1.00 0.00 H new ATOM 0 HG2 ARG A 133 101.738 13.189 13.752 1.00 0.00 H new ATOM 0 HG3 ARG A 133 102.325 11.986 14.883 1.00 0.00 H new ATOM 0 HD2 ARG A 133 103.292 14.143 15.555 1.00 0.00 H new ATOM 0 HD3 ARG A 133 104.598 13.193 14.874 1.00 0.00 H new ATOM 0 HE ARG A 133 103.343 14.560 12.659 1.00 0.00 H new ATOM 0 HH11 ARG A 133 106.129 14.656 14.455 1.00 0.00 H new ATOM 0 HH12 ARG A 133 106.370 16.404 14.381 1.00 0.00 H new ATOM 0 HH21 ARG A 133 103.187 17.038 13.081 1.00 0.00 H new ATOM 0 HH22 ARG A 133 104.719 17.741 13.610 1.00 0.00 H new ATOM 1831 N SER A 134 101.389 12.195 10.626 1.00 0.00 N ATOM 1832 CA SER A 134 100.285 12.850 9.855 1.00 0.00 C ATOM 1833 C SER A 134 100.326 12.454 8.372 1.00 0.00 C ATOM 1834 O SER A 134 99.583 12.984 7.568 1.00 0.00 O ATOM 1835 CB SER A 134 100.537 14.348 10.012 1.00 0.00 C ATOM 1836 OG SER A 134 101.626 14.731 9.183 1.00 0.00 O ATOM 0 H SER A 134 102.329 12.365 10.268 1.00 0.00 H new ATOM 0 HA SER A 134 99.304 12.548 10.223 1.00 0.00 H new ATOM 0 HB2 SER A 134 99.643 14.909 9.740 1.00 0.00 H new ATOM 0 HB3 SER A 134 100.757 14.584 11.053 1.00 0.00 H new ATOM 0 HG SER A 134 101.789 15.692 9.280 1.00 0.00 H new ATOM 1841 N VAL A 135 101.181 11.537 8.000 1.00 0.00 N ATOM 1842 CA VAL A 135 101.250 11.129 6.563 1.00 0.00 C ATOM 1843 C VAL A 135 101.088 9.614 6.424 1.00 0.00 C ATOM 1844 O VAL A 135 101.714 8.847 7.126 1.00 0.00 O ATOM 1845 CB VAL A 135 102.637 11.565 6.082 1.00 0.00 C ATOM 1846 CG1 VAL A 135 102.780 11.261 4.590 1.00 0.00 C ATOM 1847 CG2 VAL A 135 102.812 13.070 6.308 1.00 0.00 C ATOM 0 H VAL A 135 101.830 11.056 8.622 1.00 0.00 H new ATOM 0 HA VAL A 135 100.454 11.586 5.976 1.00 0.00 H new ATOM 0 HB VAL A 135 103.398 11.021 6.642 1.00 0.00 H new ATOM 0 HG11 VAL A 135 103.767 11.572 4.248 1.00 0.00 H new ATOM 0 HG12 VAL A 135 102.658 10.191 4.423 1.00 0.00 H new ATOM 0 HG13 VAL A 135 102.016 11.804 4.033 1.00 0.00 H new ATOM 0 HG21 VAL A 135 103.800 13.377 5.965 1.00 0.00 H new ATOM 0 HG22 VAL A 135 102.049 13.613 5.750 1.00 0.00 H new ATOM 0 HG23 VAL A 135 102.712 13.292 7.370 1.00 0.00 H new ATOM 1857 N ASP A 136 100.260 9.180 5.512 1.00 0.00 N ATOM 1858 CA ASP A 136 100.064 7.715 5.313 1.00 0.00 C ATOM 1859 C ASP A 136 100.175 7.403 3.825 1.00 0.00 C ATOM 1860 O ASP A 136 99.348 7.819 3.039 1.00 0.00 O ATOM 1861 CB ASP A 136 98.651 7.424 5.825 1.00 0.00 C ATOM 1862 CG ASP A 136 98.387 5.913 5.800 1.00 0.00 C ATOM 1863 OD1 ASP A 136 99.338 5.159 5.662 1.00 0.00 O ATOM 1864 OD2 ASP A 136 97.232 5.535 5.918 1.00 0.00 O ATOM 0 H ASP A 136 99.710 9.778 4.895 1.00 0.00 H new ATOM 0 HA ASP A 136 100.804 7.110 5.836 1.00 0.00 H new ATOM 0 HB2 ASP A 136 98.537 7.805 6.840 1.00 0.00 H new ATOM 0 HB3 ASP A 136 97.917 7.940 5.206 1.00 0.00 H new ATOM 1868 N VAL A 137 101.198 6.699 3.420 1.00 0.00 N ATOM 1869 CA VAL A 137 101.370 6.392 1.970 1.00 0.00 C ATOM 1870 C VAL A 137 101.353 4.879 1.730 1.00 0.00 C ATOM 1871 O VAL A 137 101.833 4.108 2.539 1.00 0.00 O ATOM 1872 CB VAL A 137 102.748 6.967 1.620 1.00 0.00 C ATOM 1873 CG1 VAL A 137 103.037 6.764 0.131 1.00 0.00 C ATOM 1874 CG2 VAL A 137 102.784 8.464 1.943 1.00 0.00 C ATOM 0 H VAL A 137 101.923 6.323 4.031 1.00 0.00 H new ATOM 0 HA VAL A 137 100.570 6.814 1.362 1.00 0.00 H new ATOM 0 HB VAL A 137 103.505 6.449 2.209 1.00 0.00 H new ATOM 0 HG11 VAL A 137 104.018 7.175 -0.109 1.00 0.00 H new ATOM 0 HG12 VAL A 137 103.024 5.699 -0.100 1.00 0.00 H new ATOM 0 HG13 VAL A 137 102.276 7.273 -0.460 1.00 0.00 H new ATOM 0 HG21 VAL A 137 103.765 8.867 1.692 1.00 0.00 H new ATOM 0 HG22 VAL A 137 102.020 8.980 1.361 1.00 0.00 H new ATOM 0 HG23 VAL A 137 102.592 8.612 3.006 1.00 0.00 H new ATOM 1884 N GLY A 138 100.830 4.451 0.609 1.00 0.00 N ATOM 1885 CA GLY A 138 100.812 2.993 0.293 1.00 0.00 C ATOM 1886 C GLY A 138 101.805 2.748 -0.842 1.00 0.00 C ATOM 1887 O GLY A 138 101.569 3.135 -1.971 1.00 0.00 O ATOM 0 H GLY A 138 100.414 5.052 -0.102 1.00 0.00 H new ATOM 0 HA2 GLY A 138 101.085 2.408 1.172 1.00 0.00 H new ATOM 0 HA3 GLY A 138 99.811 2.678 -0.001 1.00 0.00 H new ATOM 1890 N THR A 139 102.928 2.144 -0.551 1.00 0.00 N ATOM 1891 CA THR A 139 103.947 1.921 -1.619 1.00 0.00 C ATOM 1892 C THR A 139 104.067 0.446 -1.997 1.00 0.00 C ATOM 1893 O THR A 139 104.062 -0.431 -1.155 1.00 0.00 O ATOM 1894 CB THR A 139 105.261 2.417 -1.013 1.00 0.00 C ATOM 1895 OG1 THR A 139 105.082 3.730 -0.501 1.00 0.00 O ATOM 1896 CG2 THR A 139 106.349 2.430 -2.087 1.00 0.00 C ATOM 0 H THR A 139 103.182 1.798 0.374 1.00 0.00 H new ATOM 0 HA THR A 139 103.676 2.443 -2.536 1.00 0.00 H new ATOM 0 HB THR A 139 105.560 1.750 -0.204 1.00 0.00 H new ATOM 0 HG1 THR A 139 105.924 4.047 -0.111 1.00 0.00 H new ATOM 0 HG21 THR A 139 107.284 2.784 -1.653 1.00 0.00 H new ATOM 0 HG22 THR A 139 106.488 1.421 -2.476 1.00 0.00 H new ATOM 0 HG23 THR A 139 106.051 3.094 -2.898 1.00 0.00 H new ATOM 1904 N TRP A 140 104.205 0.183 -3.268 1.00 0.00 N ATOM 1905 CA TRP A 140 104.361 -1.218 -3.744 1.00 0.00 C ATOM 1906 C TRP A 140 105.785 -1.392 -4.277 1.00 0.00 C ATOM 1907 O TRP A 140 106.334 -0.493 -4.886 1.00 0.00 O ATOM 1908 CB TRP A 140 103.340 -1.381 -4.873 1.00 0.00 C ATOM 1909 CG TRP A 140 101.961 -1.125 -4.350 1.00 0.00 C ATOM 1910 CD1 TRP A 140 101.278 -1.945 -3.518 1.00 0.00 C ATOM 1911 CD2 TRP A 140 101.088 0.012 -4.612 1.00 0.00 C ATOM 1912 NE1 TRP A 140 100.042 -1.381 -3.252 1.00 0.00 N ATOM 1913 CE2 TRP A 140 99.879 -0.176 -3.903 1.00 0.00 C ATOM 1914 CE3 TRP A 140 101.228 1.177 -5.387 1.00 0.00 C ATOM 1915 CZ2 TRP A 140 98.844 0.759 -3.961 1.00 0.00 C ATOM 1916 CZ3 TRP A 140 100.189 2.120 -5.448 1.00 0.00 C ATOM 1917 CH2 TRP A 140 98.999 1.911 -4.737 1.00 0.00 C ATOM 0 H TRP A 140 104.216 0.889 -4.004 1.00 0.00 H new ATOM 0 HA TRP A 140 104.198 -1.957 -2.959 1.00 0.00 H new ATOM 0 HB2 TRP A 140 103.566 -0.688 -5.683 1.00 0.00 H new ATOM 0 HB3 TRP A 140 103.401 -2.387 -5.288 1.00 0.00 H new ATOM 0 HD1 TRP A 140 101.638 -2.885 -3.126 1.00 0.00 H new ATOM 0 HE1 TRP A 140 99.338 -1.805 -2.648 1.00 0.00 H new ATOM 0 HE3 TRP A 140 102.140 1.348 -5.939 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 97.930 0.593 -3.410 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 100.307 3.011 -6.046 1.00 0.00 H new ATOM 0 HH2 TRP A 140 98.203 2.639 -4.789 1.00 0.00 H new ATOM 1927 N ILE A 141 106.395 -2.524 -4.050 1.00 0.00 N ATOM 1928 CA ILE A 141 107.791 -2.721 -4.544 1.00 0.00 C ATOM 1929 C ILE A 141 107.829 -3.781 -5.645 1.00 0.00 C ATOM 1930 O ILE A 141 107.316 -4.871 -5.488 1.00 0.00 O ATOM 1931 CB ILE A 141 108.588 -3.196 -3.322 1.00 0.00 C ATOM 1932 CG1 ILE A 141 108.443 -2.189 -2.169 1.00 0.00 C ATOM 1933 CG2 ILE A 141 110.065 -3.326 -3.698 1.00 0.00 C ATOM 1934 CD1 ILE A 141 108.886 -0.795 -2.627 1.00 0.00 C ATOM 0 H ILE A 141 105.992 -3.316 -3.548 1.00 0.00 H new ATOM 0 HA ILE A 141 108.201 -1.806 -4.972 1.00 0.00 H new ATOM 0 HB ILE A 141 108.201 -4.163 -3.000 1.00 0.00 H new ATOM 0 HG12 ILE A 141 107.407 -2.157 -1.832 1.00 0.00 H new ATOM 0 HG13 ILE A 141 109.045 -2.509 -1.319 1.00 0.00 H new ATOM 0 HG21 ILE A 141 110.633 -3.663 -2.831 1.00 0.00 H new ATOM 0 HG22 ILE A 141 110.172 -4.050 -4.506 1.00 0.00 H new ATOM 0 HG23 ILE A 141 110.444 -2.358 -4.025 1.00 0.00 H new ATOM 0 HD11 ILE A 141 108.779 -0.090 -1.803 1.00 0.00 H new ATOM 0 HD12 ILE A 141 109.929 -0.830 -2.942 1.00 0.00 H new ATOM 0 HD13 ILE A 141 108.265 -0.472 -3.463 1.00 0.00 H new ATOM 1945 N ALA A 142 108.449 -3.470 -6.755 1.00 0.00 N ATOM 1946 CA ALA A 142 108.540 -4.463 -7.866 1.00 0.00 C ATOM 1947 C ALA A 142 109.947 -4.422 -8.456 1.00 0.00 C ATOM 1948 O ALA A 142 110.452 -3.364 -8.782 1.00 0.00 O ATOM 1949 CB ALA A 142 107.508 -4.005 -8.896 1.00 0.00 C ATOM 0 H ALA A 142 108.896 -2.572 -6.939 1.00 0.00 H new ATOM 0 HA ALA A 142 108.349 -5.485 -7.540 1.00 0.00 H new ATOM 0 HB1 ALA A 142 107.515 -4.687 -9.746 1.00 0.00 H new ATOM 0 HB2 ALA A 142 106.517 -4.001 -8.442 1.00 0.00 H new ATOM 0 HB3 ALA A 142 107.755 -2.999 -9.236 1.00 0.00 H new ATOM 1955 N GLY A 143 110.600 -5.550 -8.580 1.00 0.00 N ATOM 1956 CA GLY A 143 111.986 -5.519 -9.131 1.00 0.00 C ATOM 1957 C GLY A 143 112.467 -6.907 -9.560 1.00 0.00 C ATOM 1958 O GLY A 143 111.693 -7.803 -9.833 1.00 0.00 O ATOM 0 H GLY A 143 110.242 -6.472 -8.329 1.00 0.00 H new ATOM 0 HA2 GLY A 143 112.021 -4.844 -9.986 1.00 0.00 H new ATOM 0 HA3 GLY A 143 112.665 -5.117 -8.379 1.00 0.00 H new ATOM 1961 N VAL A 144 113.765 -7.062 -9.626 1.00 0.00 N ATOM 1962 CA VAL A 144 114.373 -8.360 -10.047 1.00 0.00 C ATOM 1963 C VAL A 144 115.073 -9.029 -8.856 1.00 0.00 C ATOM 1964 O VAL A 144 115.229 -8.433 -7.809 1.00 0.00 O ATOM 1965 CB VAL A 144 115.379 -7.980 -11.142 1.00 0.00 C ATOM 1966 CG1 VAL A 144 116.434 -7.025 -10.575 1.00 0.00 C ATOM 1967 CG2 VAL A 144 116.067 -9.240 -11.672 1.00 0.00 C ATOM 0 H VAL A 144 114.440 -6.331 -9.402 1.00 0.00 H new ATOM 0 HA VAL A 144 113.633 -9.074 -10.408 1.00 0.00 H new ATOM 0 HB VAL A 144 114.847 -7.486 -11.955 1.00 0.00 H new ATOM 0 HG11 VAL A 144 117.144 -6.760 -11.359 1.00 0.00 H new ATOM 0 HG12 VAL A 144 115.947 -6.122 -10.207 1.00 0.00 H new ATOM 0 HG13 VAL A 144 116.963 -7.512 -9.756 1.00 0.00 H new ATOM 0 HG21 VAL A 144 116.780 -8.966 -12.449 1.00 0.00 H new ATOM 0 HG22 VAL A 144 116.592 -9.738 -10.857 1.00 0.00 H new ATOM 0 HG23 VAL A 144 115.319 -9.915 -12.088 1.00 0.00 H new ATOM 1977 N GLY A 145 115.484 -10.265 -9.006 1.00 0.00 N ATOM 1978 CA GLY A 145 116.163 -10.964 -7.875 1.00 0.00 C ATOM 1979 C GLY A 145 117.304 -11.853 -8.386 1.00 0.00 C ATOM 1980 O GLY A 145 117.155 -12.598 -9.334 1.00 0.00 O ATOM 0 H GLY A 145 115.379 -10.816 -9.858 1.00 0.00 H new ATOM 0 HA2 GLY A 145 116.556 -10.230 -7.172 1.00 0.00 H new ATOM 0 HA3 GLY A 145 115.440 -11.571 -7.331 1.00 0.00 H new ATOM 1983 N TYR A 146 118.436 -11.791 -7.731 1.00 0.00 N ATOM 1984 CA TYR A 146 119.603 -12.639 -8.126 1.00 0.00 C ATOM 1985 C TYR A 146 120.021 -13.483 -6.918 1.00 0.00 C ATOM 1986 O TYR A 146 120.043 -12.992 -5.810 1.00 0.00 O ATOM 1987 CB TYR A 146 120.722 -11.656 -8.483 1.00 0.00 C ATOM 1988 CG TYR A 146 120.281 -10.734 -9.594 1.00 0.00 C ATOM 1989 CD1 TYR A 146 120.506 -11.087 -10.930 1.00 0.00 C ATOM 1990 CD2 TYR A 146 119.655 -9.520 -9.287 1.00 0.00 C ATOM 1991 CE1 TYR A 146 120.106 -10.226 -11.958 1.00 0.00 C ATOM 1992 CE2 TYR A 146 119.253 -8.659 -10.315 1.00 0.00 C ATOM 1993 CZ TYR A 146 119.479 -9.012 -11.650 1.00 0.00 C ATOM 1994 OH TYR A 146 119.083 -8.163 -12.664 1.00 0.00 O ATOM 0 H TYR A 146 118.603 -11.182 -6.930 1.00 0.00 H new ATOM 0 HA TYR A 146 119.377 -13.306 -8.958 1.00 0.00 H new ATOM 0 HB2 TYR A 146 120.995 -11.072 -7.604 1.00 0.00 H new ATOM 0 HB3 TYR A 146 121.612 -12.205 -8.790 1.00 0.00 H new ATOM 0 HD1 TYR A 146 120.988 -12.024 -11.167 1.00 0.00 H new ATOM 0 HD2 TYR A 146 119.482 -9.248 -8.256 1.00 0.00 H new ATOM 0 HE1 TYR A 146 120.281 -10.497 -12.989 1.00 0.00 H new ATOM 0 HE2 TYR A 146 118.769 -7.723 -10.078 1.00 0.00 H new ATOM 0 HH TYR A 146 118.860 -8.687 -13.461 1.00 0.00 H new ATOM 2003 N ARG A 147 120.347 -14.737 -7.105 1.00 0.00 N ATOM 2004 CA ARG A 147 120.753 -15.575 -5.931 1.00 0.00 C ATOM 2005 C ARG A 147 122.109 -16.247 -6.175 1.00 0.00 C ATOM 2006 O ARG A 147 122.280 -16.991 -7.120 1.00 0.00 O ATOM 2007 CB ARG A 147 119.652 -16.628 -5.800 1.00 0.00 C ATOM 2008 CG ARG A 147 119.894 -17.466 -4.544 1.00 0.00 C ATOM 2009 CD ARG A 147 118.831 -18.563 -4.447 1.00 0.00 C ATOM 2010 NE ARG A 147 119.086 -19.231 -3.142 1.00 0.00 N ATOM 2011 CZ ARG A 147 119.414 -20.493 -3.107 1.00 0.00 C ATOM 2012 NH1 ARG A 147 118.619 -21.389 -3.628 1.00 0.00 N ATOM 2013 NH2 ARG A 147 120.538 -20.861 -2.553 1.00 0.00 N ATOM 0 H ARG A 147 120.351 -15.214 -8.007 1.00 0.00 H new ATOM 0 HA ARG A 147 120.865 -14.976 -5.027 1.00 0.00 H new ATOM 0 HB2 ARG A 147 118.677 -16.145 -5.745 1.00 0.00 H new ATOM 0 HB3 ARG A 147 119.641 -17.269 -6.681 1.00 0.00 H new ATOM 0 HG2 ARG A 147 120.888 -17.911 -4.577 1.00 0.00 H new ATOM 0 HG3 ARG A 147 119.858 -16.831 -3.659 1.00 0.00 H new ATOM 0 HD2 ARG A 147 117.826 -18.143 -4.486 1.00 0.00 H new ATOM 0 HD3 ARG A 147 118.914 -19.268 -5.274 1.00 0.00 H new ATOM 0 HE ARG A 147 119.004 -18.702 -2.274 1.00 0.00 H new ATOM 0 HH11 ARG A 147 117.742 -21.102 -4.062 1.00 0.00 H new ATOM 0 HH12 ARG A 147 118.875 -22.376 -3.601 1.00 0.00 H new ATOM 0 HH21 ARG A 147 121.160 -20.161 -2.147 1.00 0.00 H new ATOM 0 HH22 ARG A 147 120.794 -21.848 -2.526 1.00 0.00 H new ATOM 2024 N PHE A 148 123.073 -15.985 -5.326 1.00 0.00 N ATOM 2025 CA PHE A 148 124.418 -16.604 -5.507 1.00 0.00 C ATOM 2026 C PHE A 148 125.000 -17.011 -4.151 1.00 0.00 C ATOM 2027 CB PHE A 148 125.271 -15.511 -6.150 1.00 0.00 C ATOM 2028 CG PHE A 148 126.599 -16.092 -6.574 1.00 0.00 C ATOM 2029 CD1 PHE A 148 126.727 -16.704 -7.826 1.00 0.00 C ATOM 2030 CD2 PHE A 148 127.703 -16.018 -5.715 1.00 0.00 C ATOM 2031 CE1 PHE A 148 127.957 -17.243 -8.220 1.00 0.00 C ATOM 2032 CE2 PHE A 148 128.933 -16.558 -6.109 1.00 0.00 C ATOM 2033 CZ PHE A 148 129.060 -17.170 -7.362 1.00 0.00 C ATOM 0 H PHE A 148 122.984 -15.370 -4.517 1.00 0.00 H new ATOM 0 HA PHE A 148 124.380 -17.505 -6.119 1.00 0.00 H new ATOM 0 HB2 PHE A 148 124.754 -15.092 -7.013 1.00 0.00 H new ATOM 0 HB3 PHE A 148 125.428 -14.695 -5.445 1.00 0.00 H new ATOM 0 HD1 PHE A 148 125.876 -16.760 -8.489 1.00 0.00 H new ATOM 0 HD2 PHE A 148 127.605 -15.545 -4.749 1.00 0.00 H new ATOM 0 HE1 PHE A 148 128.055 -17.715 -9.186 1.00 0.00 H new ATOM 0 HE2 PHE A 148 129.784 -16.503 -5.446 1.00 0.00 H new ATOM 0 HZ PHE A 148 130.009 -17.586 -7.666 1.00 0.00 H new TER 2042 PHE A 148