USER MOD reduce.3.24.130724 H: found=0, std=0, add=1070, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1069 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 12 SER OG : rot -160:sc= -0.558 USER MOD Set 1.2: A 139 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 78 SER OG : rot -111:sc= -0.0497 USER MOD Set 2.2: A 80 TYR OH : rot -165:sc= 1.14 USER MOD Set 2.3: A 114 GLN : amide:sc= 0.309 K(o=1.4,f=-4.9!) USER MOD Set 3.1: A 42 SER OG : rot -50:sc= 0.842 USER MOD Set 3.2: A 66 THR OG1 : rot -95:sc= 0.689 USER MOD Set 4.1: A 60 ASN : amide:sc= -1.4 K(o=-1.6,f=-3.5!) USER MOD Set 4.2: A 62 TYR OH : rot 30:sc= -0.198 USER MOD Set 5.1: A 51 THR OG1 : rot 180:sc= 0 USER MOD Set 5.2: A 53 SER OG : rot 180:sc= 0 USER MOD Set 6.1: A 25 ASN : amide:sc= -0.581 K(o=-0.61,f=-3.5!) USER MOD Set 6.2: A 44 THR OG1 : rot 180:sc= -0.031 USER MOD Single : A 1 ALA N :NH3+ -174:sc= 0 (180deg=-0.0179) USER MOD Single : A 2 THR OG1 : rot -168:sc= 0.401 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot -130:sc= -0.0106 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 TYR OH : rot 180:sc= -0.325 USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 15 GLN : amide:sc= -0.662 K(o=-0.66,f=-3.6!) USER MOD Single : A 17 GLN : amide:sc= -0.0811 X(o=-0.081,f=-0.095) USER MOD Single : A 18 MET CE :methyl -149:sc= -0.937 (180deg=-2.15!) USER MOD Single : A 19 ASN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 MET CE :methyl -159:sc= -0.216 (180deg=-1.27) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 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 180:sc= -0.741 USER MOD Single : A 45 TYR OH : rot 80:sc= 0.149 USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0308) USER MOD Single : A 49 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 30:sc= -0.74 USER MOD Single : A 58 ASN : amide:sc= -1.75 K(o=-1.8,f=-3.3!) USER MOD Single : A 59 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0826) USER MOD Single : A 61 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 63 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= -0.179 X(o=-0.18,f=0) USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=-0.028) USER MOD Single : A 92 THR OG1 : rot 116:sc= 0.682 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 HIS : no HD1:sc= -0.954 K(o=-0.95,f=0) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 105 TYR OH : rot -179:sc= -3.04! USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 116 ASN : amide:sc= -0.795 K(o=-0.79,f=-5!) USER MOD Single : A 118 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 120 ASN : amide:sc=-0.00315 K(o=-0.0032,f=-3.4!) USER MOD Single : A 126 SER OG : rot 180:sc= -0.758 USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= -1.13 X(o=-1.1,f=-0.67) USER MOD Single : A 130 SER OG : rot 180:sc= -0.346 USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 113.835 -18.824 17.874 1.00 0.00 N ATOM 2 CA ALA A 1 114.590 -19.998 17.350 1.00 0.00 C ATOM 3 C ALA A 1 115.056 -19.703 15.928 1.00 0.00 C ATOM 4 O ALA A 1 116.220 -19.921 15.589 1.00 0.00 O ATOM 5 CB ALA A 1 113.682 -21.229 17.358 1.00 0.00 C ATOM 0 H1 ALA A 1 113.603 -18.979 18.876 1.00 0.00 H new ATOM 0 H2 ALA A 1 114.418 -17.967 17.782 1.00 0.00 H new ATOM 0 H3 ALA A 1 112.957 -18.705 17.330 1.00 0.00 H new ATOM 0 HA ALA A 1 115.459 -20.191 17.979 1.00 0.00 H new ATOM 0 HB1 ALA A 1 114.232 -22.089 16.975 1.00 0.00 H new ATOM 0 HB2 ALA A 1 113.354 -21.432 18.377 1.00 0.00 H new ATOM 0 HB3 ALA A 1 112.813 -21.044 16.727 1.00 0.00 H new ATOM 13 N THR A 2 114.141 -19.209 15.099 1.00 0.00 N ATOM 14 CA THR A 2 114.457 -18.888 13.710 1.00 0.00 C ATOM 15 C THR A 2 114.144 -17.424 13.418 1.00 0.00 C ATOM 16 O THR A 2 113.436 -16.767 14.179 1.00 0.00 O ATOM 17 CB THR A 2 113.649 -19.779 12.764 1.00 0.00 C ATOM 18 OG1 THR A 2 112.264 -19.513 12.934 1.00 0.00 O ATOM 19 CG2 THR A 2 113.931 -21.253 13.071 1.00 0.00 C ATOM 0 H THR A 2 113.174 -19.022 15.365 1.00 0.00 H new ATOM 0 HA THR A 2 115.521 -19.065 13.551 1.00 0.00 H new ATOM 0 HB THR A 2 113.937 -19.567 11.734 1.00 0.00 H new ATOM 0 HG1 THR A 2 111.740 -20.202 12.475 1.00 0.00 H new ATOM 0 HG21 THR A 2 113.353 -21.883 12.394 1.00 0.00 H new ATOM 0 HG22 THR A 2 114.994 -21.456 12.937 1.00 0.00 H new ATOM 0 HG23 THR A 2 113.647 -21.471 14.101 1.00 0.00 H new ATOM 27 N SER A 3 114.684 -16.918 12.314 1.00 0.00 N ATOM 28 CA SER A 3 114.454 -15.531 11.927 1.00 0.00 C ATOM 29 C SER A 3 114.596 -15.357 10.417 1.00 0.00 C ATOM 30 O SER A 3 115.162 -16.211 9.734 1.00 0.00 O ATOM 31 CB SER A 3 115.447 -14.615 12.645 1.00 0.00 C ATOM 32 OG SER A 3 116.750 -14.832 12.118 1.00 0.00 O ATOM 0 H SER A 3 115.280 -17.444 11.675 1.00 0.00 H new ATOM 0 HA SER A 3 113.438 -15.262 12.214 1.00 0.00 H new ATOM 0 HB2 SER A 3 115.158 -13.572 12.514 1.00 0.00 H new ATOM 0 HB3 SER A 3 115.437 -14.817 13.716 1.00 0.00 H new ATOM 0 HG SER A 3 117.389 -14.246 12.574 1.00 0.00 H new ATOM 38 N THR A 4 114.079 -14.244 9.903 1.00 0.00 N ATOM 39 CA THR A 4 114.132 -13.966 8.469 1.00 0.00 C ATOM 40 C THR A 4 114.679 -12.564 8.216 1.00 0.00 C ATOM 41 O THR A 4 114.393 -11.633 8.968 1.00 0.00 O ATOM 42 CB THR A 4 112.726 -14.080 7.875 1.00 0.00 C ATOM 43 OG1 THR A 4 112.135 -15.301 8.296 1.00 0.00 O ATOM 44 CG2 THR A 4 112.800 -14.054 6.347 1.00 0.00 C ATOM 0 H THR A 4 113.619 -13.521 10.456 1.00 0.00 H new ATOM 0 HA THR A 4 114.793 -14.691 7.995 1.00 0.00 H new ATOM 0 HB THR A 4 112.123 -13.239 8.219 1.00 0.00 H new ATOM 0 HG1 THR A 4 111.773 -15.774 7.518 1.00 0.00 H new ATOM 0 HG21 THR A 4 111.795 -14.136 5.933 1.00 0.00 H new ATOM 0 HG22 THR A 4 113.252 -13.118 6.021 1.00 0.00 H new ATOM 0 HG23 THR A 4 113.405 -14.890 5.998 1.00 0.00 H new ATOM 52 N VAL A 5 115.465 -12.417 7.152 1.00 0.00 N ATOM 53 CA VAL A 5 116.015 -11.109 6.785 1.00 0.00 C ATOM 54 C VAL A 5 115.668 -10.786 5.332 1.00 0.00 C ATOM 55 O VAL A 5 115.936 -11.583 4.434 1.00 0.00 O ATOM 56 CB VAL A 5 117.538 -11.104 6.968 1.00 0.00 C ATOM 57 CG1 VAL A 5 118.092 -9.705 6.679 1.00 0.00 C ATOM 58 CG2 VAL A 5 117.887 -11.486 8.410 1.00 0.00 C ATOM 0 H VAL A 5 115.735 -13.180 6.531 1.00 0.00 H new ATOM 0 HA VAL A 5 115.578 -10.351 7.435 1.00 0.00 H new ATOM 0 HB VAL A 5 117.978 -11.824 6.278 1.00 0.00 H new ATOM 0 HG11 VAL A 5 119.174 -9.708 6.811 1.00 0.00 H new ATOM 0 HG12 VAL A 5 117.852 -9.423 5.654 1.00 0.00 H new ATOM 0 HG13 VAL A 5 117.645 -8.987 7.367 1.00 0.00 H new ATOM 0 HG21 VAL A 5 118.970 -11.481 8.536 1.00 0.00 H new ATOM 0 HG22 VAL A 5 117.439 -10.767 9.096 1.00 0.00 H new ATOM 0 HG23 VAL A 5 117.501 -12.482 8.626 1.00 0.00 H new ATOM 68 N THR A 6 115.072 -9.615 5.104 1.00 0.00 N ATOM 69 CA THR A 6 114.656 -9.223 3.757 1.00 0.00 C ATOM 70 C THR A 6 115.183 -7.838 3.395 1.00 0.00 C ATOM 71 O THR A 6 115.248 -6.947 4.239 1.00 0.00 O ATOM 72 CB THR A 6 113.127 -9.255 3.650 1.00 0.00 C ATOM 73 OG1 THR A 6 112.741 -8.943 2.320 1.00 0.00 O ATOM 74 CG2 THR A 6 112.505 -8.244 4.617 1.00 0.00 C ATOM 0 H THR A 6 114.868 -8.926 5.828 1.00 0.00 H new ATOM 0 HA THR A 6 115.080 -9.936 3.050 1.00 0.00 H new ATOM 0 HB THR A 6 112.774 -10.253 3.911 1.00 0.00 H new ATOM 0 HG1 THR A 6 111.764 -8.965 2.249 1.00 0.00 H new ATOM 0 HG21 THR A 6 111.419 -8.278 4.530 1.00 0.00 H new ATOM 0 HG22 THR A 6 112.795 -8.491 5.638 1.00 0.00 H new ATOM 0 HG23 THR A 6 112.857 -7.242 4.372 1.00 0.00 H new ATOM 82 N GLY A 7 115.559 -7.661 2.134 1.00 0.00 N ATOM 83 CA GLY A 7 115.966 -6.349 1.640 1.00 0.00 C ATOM 84 C GLY A 7 115.221 -6.060 0.347 1.00 0.00 C ATOM 85 O GLY A 7 115.034 -6.967 -0.465 1.00 0.00 O ATOM 0 H GLY A 7 115.591 -8.405 1.437 1.00 0.00 H new ATOM 0 HA2 GLY A 7 115.746 -5.581 2.382 1.00 0.00 H new ATOM 0 HA3 GLY A 7 117.042 -6.327 1.468 1.00 0.00 H new ATOM 89 N GLY A 8 114.794 -4.815 0.156 1.00 0.00 N ATOM 90 CA GLY A 8 113.973 -4.496 -1.008 1.00 0.00 C ATOM 91 C GLY A 8 114.008 -3.015 -1.351 1.00 0.00 C ATOM 92 O GLY A 8 114.695 -2.228 -0.703 1.00 0.00 O ATOM 0 H GLY A 8 114.996 -4.029 0.774 1.00 0.00 H new ATOM 0 HA2 GLY A 8 114.321 -5.073 -1.865 1.00 0.00 H new ATOM 0 HA3 GLY A 8 112.943 -4.798 -0.817 1.00 0.00 H new ATOM 96 N TYR A 9 113.211 -2.652 -2.351 1.00 0.00 N ATOM 97 CA TYR A 9 113.185 -1.285 -2.855 1.00 0.00 C ATOM 98 C TYR A 9 111.751 -0.784 -2.890 1.00 0.00 C ATOM 99 O TYR A 9 110.830 -1.538 -3.202 1.00 0.00 O ATOM 100 CB TYR A 9 113.781 -1.233 -4.263 1.00 0.00 C ATOM 101 CG TYR A 9 113.861 0.168 -4.828 1.00 0.00 C ATOM 102 CD1 TYR A 9 114.965 0.977 -4.541 1.00 0.00 C ATOM 103 CD2 TYR A 9 112.828 0.653 -5.638 1.00 0.00 C ATOM 104 CE1 TYR A 9 115.037 2.275 -5.063 1.00 0.00 C ATOM 105 CE2 TYR A 9 112.900 1.950 -6.161 1.00 0.00 C ATOM 106 CZ TYR A 9 114.004 2.761 -5.874 1.00 0.00 C ATOM 107 OH TYR A 9 114.075 4.039 -6.390 1.00 0.00 O ATOM 0 H TYR A 9 112.573 -3.288 -2.829 1.00 0.00 H new ATOM 0 HA TYR A 9 113.777 -0.651 -2.195 1.00 0.00 H new ATOM 0 HB2 TYR A 9 114.781 -1.667 -4.243 1.00 0.00 H new ATOM 0 HB3 TYR A 9 113.178 -1.852 -4.928 1.00 0.00 H new ATOM 0 HD1 TYR A 9 115.762 0.601 -3.917 1.00 0.00 H new ATOM 0 HD2 TYR A 9 111.976 0.027 -5.860 1.00 0.00 H new ATOM 0 HE1 TYR A 9 115.889 2.901 -4.840 1.00 0.00 H new ATOM 0 HE2 TYR A 9 112.103 2.325 -6.786 1.00 0.00 H new ATOM 0 HH TYR A 9 113.278 4.218 -6.932 1.00 0.00 H new ATOM 117 N ALA A 10 111.565 0.483 -2.541 1.00 0.00 N ATOM 118 CA ALA A 10 110.236 1.078 -2.510 1.00 0.00 C ATOM 119 C ALA A 10 110.211 2.369 -3.315 1.00 0.00 C ATOM 120 O ALA A 10 111.212 3.078 -3.392 1.00 0.00 O ATOM 121 CB ALA A 10 109.835 1.376 -1.063 1.00 0.00 C ATOM 0 H ALA A 10 112.318 1.118 -2.276 1.00 0.00 H new ATOM 0 HA ALA A 10 109.531 0.372 -2.949 1.00 0.00 H new ATOM 0 HB1 ALA A 10 108.840 1.821 -1.045 1.00 0.00 H new ATOM 0 HB2 ALA A 10 109.828 0.449 -0.489 1.00 0.00 H new ATOM 0 HB3 ALA A 10 110.551 2.070 -0.623 1.00 0.00 H new ATOM 127 N GLN A 11 109.057 2.667 -3.903 1.00 0.00 N ATOM 128 CA GLN A 11 108.879 3.904 -4.656 1.00 0.00 C ATOM 129 C GLN A 11 107.730 4.706 -4.058 1.00 0.00 C ATOM 130 O GLN A 11 106.680 4.145 -3.740 1.00 0.00 O ATOM 131 CB GLN A 11 108.606 3.584 -6.132 1.00 0.00 C ATOM 132 CG GLN A 11 107.311 2.777 -6.274 1.00 0.00 C ATOM 133 CD GLN A 11 107.069 2.434 -7.741 1.00 0.00 C ATOM 134 OE1 GLN A 11 107.641 1.473 -8.256 1.00 0.00 O ATOM 135 NE2 GLN A 11 106.250 3.165 -8.446 1.00 0.00 N ATOM 0 H GLN A 11 108.231 2.069 -3.873 1.00 0.00 H new ATOM 0 HA GLN A 11 109.790 4.500 -4.596 1.00 0.00 H new ATOM 0 HB2 GLN A 11 108.530 4.509 -6.703 1.00 0.00 H new ATOM 0 HB3 GLN A 11 109.441 3.020 -6.549 1.00 0.00 H new ATOM 0 HG2 GLN A 11 107.376 1.863 -5.684 1.00 0.00 H new ATOM 0 HG3 GLN A 11 106.471 3.350 -5.882 1.00 0.00 H new ATOM 0 HE21 GLN A 11 105.778 3.960 -8.016 1.00 0.00 H new ATOM 0 HE22 GLN A 11 106.082 2.941 -9.427 1.00 0.00 H new ATOM 144 N SER A 12 107.939 6.010 -3.895 1.00 0.00 N ATOM 145 CA SER A 12 106.926 6.879 -3.306 1.00 0.00 C ATOM 146 C SER A 12 106.427 7.870 -4.348 1.00 0.00 C ATOM 147 O SER A 12 107.215 8.377 -5.147 1.00 0.00 O ATOM 148 CB SER A 12 107.516 7.638 -2.117 1.00 0.00 C ATOM 149 OG SER A 12 106.489 8.390 -1.486 1.00 0.00 O ATOM 0 H SER A 12 108.800 6.487 -4.162 1.00 0.00 H new ATOM 0 HA SER A 12 106.092 6.267 -2.962 1.00 0.00 H new ATOM 0 HB2 SER A 12 107.959 6.939 -1.408 1.00 0.00 H new ATOM 0 HB3 SER A 12 108.314 8.300 -2.453 1.00 0.00 H new ATOM 0 HG SER A 12 106.890 9.104 -0.947 1.00 0.00 H new ATOM 155 N ASP A 13 105.134 8.179 -4.290 1.00 0.00 N ATOM 156 CA ASP A 13 104.512 9.007 -5.317 1.00 0.00 C ATOM 157 C ASP A 13 104.834 10.481 -5.102 1.00 0.00 C ATOM 158 O ASP A 13 104.823 10.981 -3.977 1.00 0.00 O ATOM 159 CB ASP A 13 102.995 8.807 -5.297 1.00 0.00 C ATOM 160 CG ASP A 13 102.641 7.363 -5.645 1.00 0.00 C ATOM 161 OD1 ASP A 13 103.375 6.755 -6.409 1.00 0.00 O ATOM 162 OD2 ASP A 13 101.638 6.886 -5.142 1.00 0.00 O ATOM 0 H ASP A 13 104.503 7.872 -3.550 1.00 0.00 H new ATOM 0 HA ASP A 13 104.911 8.704 -6.285 1.00 0.00 H new ATOM 0 HB2 ASP A 13 102.602 9.056 -4.311 1.00 0.00 H new ATOM 0 HB3 ASP A 13 102.524 9.485 -6.009 1.00 0.00 H new ATOM 167 N ALA A 14 105.116 11.165 -6.208 1.00 0.00 N ATOM 168 CA ALA A 14 105.530 12.561 -6.167 1.00 0.00 C ATOM 169 C ALA A 14 104.405 13.483 -6.629 1.00 0.00 C ATOM 170 O ALA A 14 103.643 13.152 -7.536 1.00 0.00 O ATOM 171 CB ALA A 14 106.757 12.764 -7.058 1.00 0.00 C ATOM 0 H ALA A 14 105.064 10.771 -7.147 1.00 0.00 H new ATOM 0 HA ALA A 14 105.778 12.811 -5.135 1.00 0.00 H new ATOM 0 HB1 ALA A 14 107.063 13.810 -7.024 1.00 0.00 H new ATOM 0 HB2 ALA A 14 107.573 12.136 -6.702 1.00 0.00 H new ATOM 0 HB3 ALA A 14 106.511 12.491 -8.084 1.00 0.00 H new ATOM 177 N GLN A 15 104.314 14.642 -5.988 1.00 0.00 N ATOM 178 CA GLN A 15 103.329 15.649 -6.361 1.00 0.00 C ATOM 179 C GLN A 15 103.934 16.569 -7.415 1.00 0.00 C ATOM 180 O GLN A 15 105.153 16.729 -7.474 1.00 0.00 O ATOM 181 CB GLN A 15 102.913 16.458 -5.130 1.00 0.00 C ATOM 182 CG GLN A 15 101.770 17.412 -5.493 1.00 0.00 C ATOM 183 CD GLN A 15 101.283 18.177 -4.261 1.00 0.00 C ATOM 184 OE1 GLN A 15 101.688 17.888 -3.134 1.00 0.00 O ATOM 185 NE2 GLN A 15 100.425 19.147 -4.414 1.00 0.00 N ATOM 0 H GLN A 15 104.912 14.908 -5.206 1.00 0.00 H new ATOM 0 HA GLN A 15 102.443 15.161 -6.769 1.00 0.00 H new ATOM 0 HB2 GLN A 15 102.597 15.786 -4.332 1.00 0.00 H new ATOM 0 HB3 GLN A 15 103.764 17.024 -4.752 1.00 0.00 H new ATOM 0 HG2 GLN A 15 102.107 18.117 -6.253 1.00 0.00 H new ATOM 0 HG3 GLN A 15 100.944 16.848 -5.925 1.00 0.00 H new ATOM 0 HE21 GLN A 15 100.088 19.388 -5.346 1.00 0.00 H new ATOM 0 HE22 GLN A 15 100.090 19.665 -3.601 1.00 0.00 H new ATOM 194 N GLY A 16 103.090 17.168 -8.253 1.00 0.00 N ATOM 195 CA GLY A 16 103.570 17.922 -9.411 1.00 0.00 C ATOM 196 C GLY A 16 104.663 18.923 -9.035 1.00 0.00 C ATOM 197 O GLY A 16 104.717 19.408 -7.906 1.00 0.00 O ATOM 0 H GLY A 16 102.075 17.147 -8.153 1.00 0.00 H new ATOM 0 HA2 GLY A 16 103.956 17.229 -10.159 1.00 0.00 H new ATOM 0 HA3 GLY A 16 102.735 18.453 -9.868 1.00 0.00 H new ATOM 201 N GLN A 17 105.532 19.211 -10.001 1.00 0.00 N ATOM 202 CA GLN A 17 106.727 20.031 -9.766 1.00 0.00 C ATOM 203 C GLN A 17 107.753 19.311 -8.877 1.00 0.00 C ATOM 204 O GLN A 17 108.602 19.957 -8.262 1.00 0.00 O ATOM 205 CB GLN A 17 106.340 21.371 -9.129 1.00 0.00 C ATOM 206 CG GLN A 17 107.409 22.425 -9.435 1.00 0.00 C ATOM 207 CD GLN A 17 107.270 22.902 -10.877 1.00 0.00 C ATOM 208 OE1 GLN A 17 106.254 23.490 -11.242 1.00 0.00 O ATOM 209 NE2 GLN A 17 108.240 22.684 -11.722 1.00 0.00 N ATOM 0 H GLN A 17 105.433 18.887 -10.963 1.00 0.00 H new ATOM 0 HA GLN A 17 107.191 20.209 -10.736 1.00 0.00 H new ATOM 0 HB2 GLN A 17 105.374 21.699 -9.512 1.00 0.00 H new ATOM 0 HB3 GLN A 17 106.232 21.253 -8.051 1.00 0.00 H new ATOM 0 HG2 GLN A 17 107.306 23.268 -8.752 1.00 0.00 H new ATOM 0 HG3 GLN A 17 108.402 22.005 -9.276 1.00 0.00 H new ATOM 0 HE21 GLN A 17 109.082 22.196 -11.417 1.00 0.00 H new ATOM 0 HE22 GLN A 17 108.156 23.002 -12.688 1.00 0.00 H new ATOM 218 N MET A 18 107.680 17.980 -8.803 1.00 0.00 N ATOM 219 CA MET A 18 108.661 17.198 -8.054 1.00 0.00 C ATOM 220 C MET A 18 108.823 15.817 -8.684 1.00 0.00 C ATOM 221 O MET A 18 108.010 15.405 -9.511 1.00 0.00 O ATOM 222 CB MET A 18 108.230 17.045 -6.593 1.00 0.00 C ATOM 223 CG MET A 18 108.176 18.422 -5.926 1.00 0.00 C ATOM 224 SD MET A 18 107.895 18.231 -4.147 1.00 0.00 S ATOM 225 CE MET A 18 106.302 17.378 -4.247 1.00 0.00 C ATOM 0 H MET A 18 106.953 17.424 -9.252 1.00 0.00 H new ATOM 0 HA MET A 18 109.614 17.726 -8.087 1.00 0.00 H new ATOM 0 HB2 MET A 18 107.252 16.566 -6.540 1.00 0.00 H new ATOM 0 HB3 MET A 18 108.930 16.400 -6.062 1.00 0.00 H new ATOM 0 HG2 MET A 18 109.109 18.958 -6.101 1.00 0.00 H new ATOM 0 HG3 MET A 18 107.378 19.019 -6.368 1.00 0.00 H new ATOM 0 HE1 MET A 18 105.697 17.634 -3.377 1.00 0.00 H new ATOM 0 HE2 MET A 18 105.782 17.684 -5.154 1.00 0.00 H new ATOM 0 HE3 MET A 18 106.467 16.301 -4.269 1.00 0.00 H new ATOM 235 N ASN A 19 109.878 15.108 -8.290 1.00 0.00 N ATOM 236 CA ASN A 19 110.135 13.768 -8.817 1.00 0.00 C ATOM 237 C ASN A 19 109.870 12.708 -7.752 1.00 0.00 C ATOM 238 O ASN A 19 109.912 12.994 -6.555 1.00 0.00 O ATOM 239 CB ASN A 19 111.588 13.665 -9.288 1.00 0.00 C ATOM 240 CG ASN A 19 111.837 14.614 -10.456 1.00 0.00 C ATOM 241 OD1 ASN A 19 110.901 15.011 -11.153 1.00 0.00 O ATOM 242 ND2 ASN A 19 113.055 15.003 -10.717 1.00 0.00 N ATOM 0 H ASN A 19 110.566 15.435 -7.612 1.00 0.00 H new ATOM 0 HA ASN A 19 109.463 13.595 -9.658 1.00 0.00 H new ATOM 0 HB2 ASN A 19 112.261 13.906 -8.466 1.00 0.00 H new ATOM 0 HB3 ASN A 19 111.807 12.641 -9.590 1.00 0.00 H new ATOM 0 HD21 ASN A 19 113.232 15.635 -11.497 1.00 0.00 H new ATOM 0 HD22 ASN A 19 113.830 14.675 -10.140 1.00 0.00 H new ATOM 249 N LYS A 20 109.602 11.482 -8.195 1.00 0.00 N ATOM 250 CA LYS A 20 109.350 10.385 -7.267 1.00 0.00 C ATOM 251 C LYS A 20 110.585 10.125 -6.411 1.00 0.00 C ATOM 252 O LYS A 20 111.679 10.590 -6.730 1.00 0.00 O ATOM 253 CB LYS A 20 108.983 9.116 -8.037 1.00 0.00 C ATOM 254 CG LYS A 20 107.727 9.371 -8.875 1.00 0.00 C ATOM 255 CD LYS A 20 107.198 8.047 -9.433 1.00 0.00 C ATOM 256 CE LYS A 20 108.214 7.450 -10.407 1.00 0.00 C ATOM 257 NZ LYS A 20 107.660 6.203 -11.007 1.00 0.00 N ATOM 0 H LYS A 20 109.554 11.226 -9.181 1.00 0.00 H new ATOM 0 HA LYS A 20 108.519 10.663 -6.619 1.00 0.00 H new ATOM 0 HB2 LYS A 20 109.809 8.818 -8.683 1.00 0.00 H new ATOM 0 HB3 LYS A 20 108.809 8.294 -7.342 1.00 0.00 H new ATOM 0 HG2 LYS A 20 106.962 9.850 -8.264 1.00 0.00 H new ATOM 0 HG3 LYS A 20 107.957 10.055 -9.692 1.00 0.00 H new ATOM 0 HD2 LYS A 20 107.009 7.349 -8.618 1.00 0.00 H new ATOM 0 HD3 LYS A 20 106.247 8.210 -9.940 1.00 0.00 H new ATOM 0 HE2 LYS A 20 108.447 8.170 -11.191 1.00 0.00 H new ATOM 0 HE3 LYS A 20 109.147 7.232 -9.887 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 108.353 5.799 -11.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 107.459 5.515 -10.254 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 106.781 6.424 -11.518 1.00 0.00 H new ATOM 271 N MET A 21 110.408 9.380 -5.321 1.00 0.00 N ATOM 272 CA MET A 21 111.508 9.120 -4.393 1.00 0.00 C ATOM 273 C MET A 21 111.784 7.624 -4.296 1.00 0.00 C ATOM 274 O MET A 21 110.879 6.815 -4.494 1.00 0.00 O ATOM 275 CB MET A 21 111.160 9.665 -3.007 1.00 0.00 C ATOM 276 CG MET A 21 111.034 11.189 -3.076 1.00 0.00 C ATOM 277 SD MET A 21 110.846 11.867 -1.408 1.00 0.00 S ATOM 278 CE MET A 21 109.316 11.002 -0.971 1.00 0.00 C ATOM 0 H MET A 21 109.521 8.949 -5.060 1.00 0.00 H new ATOM 0 HA MET A 21 112.401 9.620 -4.768 1.00 0.00 H new ATOM 0 HB2 MET A 21 110.225 9.227 -2.656 1.00 0.00 H new ATOM 0 HB3 MET A 21 111.932 9.385 -2.290 1.00 0.00 H new ATOM 0 HG2 MET A 21 111.917 11.614 -3.554 1.00 0.00 H new ATOM 0 HG3 MET A 21 110.176 11.464 -3.689 1.00 0.00 H new ATOM 0 HE1 MET A 21 108.818 11.531 -0.158 1.00 0.00 H new ATOM 0 HE2 MET A 21 108.657 10.967 -1.839 1.00 0.00 H new ATOM 0 HE3 MET A 21 109.551 9.986 -0.653 1.00 0.00 H new ATOM 288 N GLY A 22 113.021 7.262 -3.964 1.00 0.00 N ATOM 289 CA GLY A 22 113.401 5.855 -3.874 1.00 0.00 C ATOM 290 C GLY A 22 113.929 5.541 -2.480 1.00 0.00 C ATOM 291 O GLY A 22 114.638 6.353 -1.891 1.00 0.00 O ATOM 0 H GLY A 22 113.773 7.919 -3.754 1.00 0.00 H new ATOM 0 HA2 GLY A 22 112.541 5.223 -4.096 1.00 0.00 H new ATOM 0 HA3 GLY A 22 114.163 5.628 -4.619 1.00 0.00 H new ATOM 295 N GLY A 23 113.579 4.372 -1.953 1.00 0.00 N ATOM 296 CA GLY A 23 113.993 4.003 -0.603 1.00 0.00 C ATOM 297 C GLY A 23 114.483 2.561 -0.535 1.00 0.00 C ATOM 298 O GLY A 23 113.947 1.685 -1.211 1.00 0.00 O ATOM 0 H GLY A 23 113.016 3.670 -2.434 1.00 0.00 H new ATOM 0 HA2 GLY A 23 114.786 4.672 -0.270 1.00 0.00 H new ATOM 0 HA3 GLY A 23 113.156 4.135 0.083 1.00 0.00 H new ATOM 302 N PHE A 24 115.506 2.330 0.283 1.00 0.00 N ATOM 303 CA PHE A 24 116.024 0.981 0.492 1.00 0.00 C ATOM 304 C PHE A 24 115.676 0.533 1.907 1.00 0.00 C ATOM 305 O PHE A 24 115.889 1.288 2.853 1.00 0.00 O ATOM 306 CB PHE A 24 117.543 0.966 0.305 1.00 0.00 C ATOM 307 CG PHE A 24 117.980 1.360 -1.085 1.00 0.00 C ATOM 308 CD1 PHE A 24 118.027 0.401 -2.104 1.00 0.00 C ATOM 309 CD2 PHE A 24 118.337 2.686 -1.356 1.00 0.00 C ATOM 310 CE1 PHE A 24 118.432 0.768 -3.393 1.00 0.00 C ATOM 311 CE2 PHE A 24 118.742 3.054 -2.645 1.00 0.00 C ATOM 312 CZ PHE A 24 118.790 2.094 -3.664 1.00 0.00 C ATOM 0 H PHE A 24 115.991 3.056 0.810 1.00 0.00 H new ATOM 0 HA PHE A 24 115.576 0.302 -0.234 1.00 0.00 H new ATOM 0 HB2 PHE A 24 117.997 1.645 1.027 1.00 0.00 H new ATOM 0 HB3 PHE A 24 117.919 -0.033 0.527 1.00 0.00 H new ATOM 0 HD1 PHE A 24 117.751 -0.622 -1.896 1.00 0.00 H new ATOM 0 HD2 PHE A 24 118.300 3.426 -0.570 1.00 0.00 H new ATOM 0 HE1 PHE A 24 118.468 0.028 -4.179 1.00 0.00 H new ATOM 0 HE2 PHE A 24 119.017 4.077 -2.853 1.00 0.00 H new ATOM 0 HZ PHE A 24 119.103 2.377 -4.658 1.00 0.00 H new ATOM 322 N ASN A 25 115.140 -0.680 2.048 1.00 0.00 N ATOM 323 CA ASN A 25 114.635 -1.137 3.343 1.00 0.00 C ATOM 324 C ASN A 25 115.235 -2.481 3.740 1.00 0.00 C ATOM 325 O ASN A 25 115.382 -3.373 2.904 1.00 0.00 O ATOM 326 CB ASN A 25 113.111 -1.267 3.279 1.00 0.00 C ATOM 327 CG ASN A 25 112.534 -1.484 4.676 1.00 0.00 C ATOM 328 OD1 ASN A 25 113.175 -1.163 5.677 1.00 0.00 O ATOM 329 ND2 ASN A 25 111.348 -2.015 4.803 1.00 0.00 N ATOM 0 H ASN A 25 115.045 -1.357 1.291 1.00 0.00 H new ATOM 0 HA ASN A 25 114.924 -0.401 4.093 1.00 0.00 H new ATOM 0 HB2 ASN A 25 112.682 -0.368 2.837 1.00 0.00 H new ATOM 0 HB3 ASN A 25 112.838 -2.101 2.633 1.00 0.00 H new ATOM 0 HD21 ASN A 25 110.953 -2.164 5.731 1.00 0.00 H new ATOM 0 HD22 ASN A 25 110.817 -2.281 3.974 1.00 0.00 H new ATOM 336 N LEU A 26 115.576 -2.606 5.021 1.00 0.00 N ATOM 337 CA LEU A 26 116.083 -3.865 5.566 1.00 0.00 C ATOM 338 C LEU A 26 115.266 -4.231 6.804 1.00 0.00 C ATOM 339 O LEU A 26 115.029 -3.377 7.657 1.00 0.00 O ATOM 340 CB LEU A 26 117.565 -3.702 5.941 1.00 0.00 C ATOM 341 CG LEU A 26 118.348 -5.019 5.808 1.00 0.00 C ATOM 342 CD1 LEU A 26 117.699 -6.133 6.641 1.00 0.00 C ATOM 343 CD2 LEU A 26 118.413 -5.442 4.337 1.00 0.00 C ATOM 0 H LEU A 26 115.510 -1.850 5.702 1.00 0.00 H new ATOM 0 HA LEU A 26 115.993 -4.658 4.823 1.00 0.00 H new ATOM 0 HB2 LEU A 26 118.019 -2.946 5.300 1.00 0.00 H new ATOM 0 HB3 LEU A 26 117.641 -3.339 6.966 1.00 0.00 H new ATOM 0 HG LEU A 26 119.358 -4.854 6.184 1.00 0.00 H new ATOM 0 HD11 LEU A 26 118.273 -7.053 6.529 1.00 0.00 H new ATOM 0 HD12 LEU A 26 117.684 -5.841 7.691 1.00 0.00 H new ATOM 0 HD13 LEU A 26 116.678 -6.298 6.296 1.00 0.00 H new ATOM 0 HD21 LEU A 26 118.969 -6.376 4.251 1.00 0.00 H new ATOM 0 HD22 LEU A 26 117.402 -5.585 3.955 1.00 0.00 H new ATOM 0 HD23 LEU A 26 118.914 -4.667 3.757 1.00 0.00 H new ATOM 355 N LYS A 27 114.822 -5.485 6.895 1.00 0.00 N ATOM 356 CA LYS A 27 113.964 -5.903 8.000 1.00 0.00 C ATOM 357 C LYS A 27 114.408 -7.255 8.550 1.00 0.00 C ATOM 358 O LYS A 27 114.910 -8.106 7.814 1.00 0.00 O ATOM 359 CB LYS A 27 112.510 -5.996 7.522 1.00 0.00 C ATOM 360 CG LYS A 27 111.589 -6.313 8.705 1.00 0.00 C ATOM 361 CD LYS A 27 110.133 -6.302 8.237 1.00 0.00 C ATOM 362 CE LYS A 27 109.891 -7.482 7.295 1.00 0.00 C ATOM 363 NZ LYS A 27 108.426 -7.662 7.089 1.00 0.00 N ATOM 0 H LYS A 27 115.040 -6.221 6.224 1.00 0.00 H new ATOM 0 HA LYS A 27 114.042 -5.161 8.795 1.00 0.00 H new ATOM 0 HB2 LYS A 27 112.210 -5.056 7.059 1.00 0.00 H new ATOM 0 HB3 LYS A 27 112.418 -6.771 6.761 1.00 0.00 H new ATOM 0 HG2 LYS A 27 111.840 -7.288 9.124 1.00 0.00 H new ATOM 0 HG3 LYS A 27 111.733 -5.579 9.498 1.00 0.00 H new ATOM 0 HD2 LYS A 27 109.464 -6.365 9.095 1.00 0.00 H new ATOM 0 HD3 LYS A 27 109.911 -5.365 7.727 1.00 0.00 H new ATOM 0 HE2 LYS A 27 110.384 -7.305 6.339 1.00 0.00 H new ATOM 0 HE3 LYS A 27 110.324 -8.390 7.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 108.262 -8.465 6.448 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 107.967 -7.849 8.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 108.025 -6.798 6.671 1.00 0.00 H new ATOM 377 N TYR A 28 114.217 -7.439 9.852 1.00 0.00 N ATOM 378 CA TYR A 28 114.515 -8.713 10.496 1.00 0.00 C ATOM 379 C TYR A 28 113.338 -9.101 11.379 1.00 0.00 C ATOM 380 O TYR A 28 112.624 -8.223 11.866 1.00 0.00 O ATOM 381 CB TYR A 28 115.799 -8.598 11.325 1.00 0.00 C ATOM 382 CG TYR A 28 115.684 -7.669 12.512 1.00 0.00 C ATOM 383 CD1 TYR A 28 115.268 -8.163 13.753 1.00 0.00 C ATOM 384 CD2 TYR A 28 115.996 -6.311 12.368 1.00 0.00 C ATOM 385 CE1 TYR A 28 115.164 -7.299 14.851 1.00 0.00 C ATOM 386 CE2 TYR A 28 115.891 -5.448 13.464 1.00 0.00 C ATOM 387 CZ TYR A 28 115.476 -5.942 14.707 1.00 0.00 C ATOM 388 OH TYR A 28 115.374 -5.091 15.788 1.00 0.00 O ATOM 0 H TYR A 28 113.857 -6.722 10.482 1.00 0.00 H new ATOM 0 HA TYR A 28 114.671 -9.484 9.741 1.00 0.00 H new ATOM 0 HB2 TYR A 28 116.081 -9.590 11.679 1.00 0.00 H new ATOM 0 HB3 TYR A 28 116.605 -8.249 10.680 1.00 0.00 H new ATOM 0 HD1 TYR A 28 115.027 -9.210 13.865 1.00 0.00 H new ATOM 0 HD2 TYR A 28 116.318 -5.930 11.410 1.00 0.00 H new ATOM 0 HE1 TYR A 28 114.843 -7.680 15.809 1.00 0.00 H new ATOM 0 HE2 TYR A 28 116.130 -4.401 13.352 1.00 0.00 H new ATOM 0 HH TYR A 28 115.628 -4.185 15.516 1.00 0.00 H new ATOM 398 N ARG A 29 113.127 -10.402 11.572 1.00 0.00 N ATOM 399 CA ARG A 29 111.968 -10.850 12.335 1.00 0.00 C ATOM 400 C ARG A 29 112.224 -12.175 13.044 1.00 0.00 C ATOM 401 O ARG A 29 112.930 -13.037 12.526 1.00 0.00 O ATOM 402 CB ARG A 29 110.740 -10.944 11.422 1.00 0.00 C ATOM 403 CG ARG A 29 110.879 -12.079 10.401 1.00 0.00 C ATOM 404 CD ARG A 29 109.706 -12.006 9.420 1.00 0.00 C ATOM 405 NE ARG A 29 109.714 -13.162 8.519 1.00 0.00 N ATOM 406 CZ ARG A 29 109.179 -14.352 8.835 1.00 0.00 C ATOM 407 NH1 ARG A 29 108.599 -14.572 9.989 1.00 0.00 N ATOM 408 NH2 ARG A 29 109.239 -15.319 7.962 1.00 0.00 N ATOM 0 H ARG A 29 113.728 -11.147 11.220 1.00 0.00 H new ATOM 0 HA ARG A 29 111.776 -10.110 13.112 1.00 0.00 H new ATOM 0 HB2 ARG A 29 109.848 -11.106 12.027 1.00 0.00 H new ATOM 0 HB3 ARG A 29 110.602 -9.998 10.898 1.00 0.00 H new ATOM 0 HG2 ARG A 29 111.825 -11.992 9.866 1.00 0.00 H new ATOM 0 HG3 ARG A 29 110.888 -13.044 10.908 1.00 0.00 H new ATOM 0 HD2 ARG A 29 108.766 -11.974 9.971 1.00 0.00 H new ATOM 0 HD3 ARG A 29 109.767 -11.085 8.840 1.00 0.00 H new ATOM 0 HE ARG A 29 110.149 -13.057 7.603 1.00 0.00 H new ATOM 0 HH11 ARG A 29 108.543 -13.826 10.682 1.00 0.00 H new ATOM 0 HH12 ARG A 29 108.203 -15.489 10.194 1.00 0.00 H new ATOM 0 HH21 ARG A 29 109.686 -15.164 7.059 1.00 0.00 H new ATOM 0 HH22 ARG A 29 108.839 -16.231 8.183 1.00 0.00 H new ATOM 422 N TYR A 30 111.655 -12.319 14.239 1.00 0.00 N ATOM 423 CA TYR A 30 111.814 -13.546 15.013 1.00 0.00 C ATOM 424 C TYR A 30 110.521 -14.350 14.968 1.00 0.00 C ATOM 425 O TYR A 30 109.431 -13.776 14.980 1.00 0.00 O ATOM 426 CB TYR A 30 112.159 -13.211 16.464 1.00 0.00 C ATOM 427 CG TYR A 30 113.437 -12.420 16.611 1.00 0.00 C ATOM 428 CD1 TYR A 30 114.660 -13.084 16.765 1.00 0.00 C ATOM 429 CD2 TYR A 30 113.400 -11.019 16.592 1.00 0.00 C ATOM 430 CE1 TYR A 30 115.844 -12.351 16.902 1.00 0.00 C ATOM 431 CE2 TYR A 30 114.583 -10.284 16.726 1.00 0.00 C ATOM 432 CZ TYR A 30 115.806 -10.951 16.880 1.00 0.00 C ATOM 433 OH TYR A 30 116.974 -10.227 17.014 1.00 0.00 O ATOM 0 H TYR A 30 111.083 -11.605 14.690 1.00 0.00 H new ATOM 0 HA TYR A 30 112.624 -14.135 14.582 1.00 0.00 H new ATOM 0 HB2 TYR A 30 111.338 -12.645 16.903 1.00 0.00 H new ATOM 0 HB3 TYR A 30 112.247 -14.137 17.032 1.00 0.00 H new ATOM 0 HD1 TYR A 30 114.690 -14.164 16.778 1.00 0.00 H new ATOM 0 HD2 TYR A 30 112.457 -10.506 16.474 1.00 0.00 H new ATOM 0 HE1 TYR A 30 116.786 -12.864 17.025 1.00 0.00 H new ATOM 0 HE2 TYR A 30 114.554 -9.205 16.711 1.00 0.00 H new ATOM 0 HH TYR A 30 116.771 -9.269 16.976 1.00 0.00 H new ATOM 443 N GLU A 31 110.640 -15.675 14.914 1.00 0.00 N ATOM 444 CA GLU A 31 109.455 -16.521 14.826 1.00 0.00 C ATOM 445 C GLU A 31 109.004 -16.937 16.221 1.00 0.00 C ATOM 446 O GLU A 31 109.769 -17.510 16.996 1.00 0.00 O ATOM 447 CB GLU A 31 109.758 -17.767 13.989 1.00 0.00 C ATOM 448 CG GLU A 31 108.462 -18.550 13.748 1.00 0.00 C ATOM 449 CD GLU A 31 108.716 -19.861 12.994 1.00 0.00 C ATOM 450 OE1 GLU A 31 109.860 -20.167 12.693 1.00 0.00 O ATOM 451 OE2 GLU A 31 107.746 -20.548 12.725 1.00 0.00 O ATOM 0 H GLU A 31 111.528 -16.177 14.929 1.00 0.00 H new ATOM 0 HA GLU A 31 108.657 -15.955 14.346 1.00 0.00 H new ATOM 0 HB2 GLU A 31 110.203 -17.479 13.037 1.00 0.00 H new ATOM 0 HB3 GLU A 31 110.485 -18.396 14.504 1.00 0.00 H new ATOM 0 HG2 GLU A 31 107.987 -18.768 14.704 1.00 0.00 H new ATOM 0 HG3 GLU A 31 107.766 -17.933 13.179 1.00 0.00 H new ATOM 458 N GLU A 32 107.743 -16.637 16.519 1.00 0.00 N ATOM 459 CA GLU A 32 107.190 -16.847 17.852 1.00 0.00 C ATOM 460 C GLU A 32 105.987 -17.784 17.800 1.00 0.00 C ATOM 461 O GLU A 32 105.284 -17.852 16.792 1.00 0.00 O ATOM 462 CB GLU A 32 106.772 -15.506 18.457 1.00 0.00 C ATOM 463 CG GLU A 32 108.000 -14.597 18.579 1.00 0.00 C ATOM 464 CD GLU A 32 109.049 -15.200 19.518 1.00 0.00 C ATOM 465 OE1 GLU A 32 108.716 -16.082 20.294 1.00 0.00 O ATOM 466 OE2 GLU A 32 110.187 -14.763 19.444 1.00 0.00 O ATOM 0 H GLU A 32 107.081 -16.245 15.849 1.00 0.00 H new ATOM 0 HA GLU A 32 107.959 -17.305 18.474 1.00 0.00 H new ATOM 0 HB2 GLU A 32 106.016 -15.032 17.831 1.00 0.00 H new ATOM 0 HB3 GLU A 32 106.322 -15.661 19.438 1.00 0.00 H new ATOM 0 HG2 GLU A 32 108.438 -14.441 17.593 1.00 0.00 H new ATOM 0 HG3 GLU A 32 107.695 -13.619 18.951 1.00 0.00 H new ATOM 473 N ASP A 33 105.742 -18.476 18.906 1.00 0.00 N ATOM 474 CA ASP A 33 104.666 -19.458 18.970 1.00 0.00 C ATOM 475 C ASP A 33 103.306 -18.769 19.055 1.00 0.00 C ATOM 476 O ASP A 33 103.212 -17.545 18.960 1.00 0.00 O ATOM 477 CB ASP A 33 104.863 -20.395 20.169 1.00 0.00 C ATOM 478 CG ASP A 33 105.048 -19.597 21.456 1.00 0.00 C ATOM 479 OD1 ASP A 33 105.988 -18.823 21.519 1.00 0.00 O ATOM 480 OD2 ASP A 33 104.245 -19.772 22.357 1.00 0.00 O ATOM 0 H ASP A 33 106.274 -18.376 19.771 1.00 0.00 H new ATOM 0 HA ASP A 33 104.694 -20.051 18.056 1.00 0.00 H new ATOM 0 HB2 ASP A 33 104.001 -21.055 20.266 1.00 0.00 H new ATOM 0 HB3 ASP A 33 105.733 -21.030 20.001 1.00 0.00 H new ATOM 485 N ASN A 34 102.252 -19.568 19.150 1.00 0.00 N ATOM 486 CA ASN A 34 100.888 -19.056 19.059 1.00 0.00 C ATOM 487 C ASN A 34 100.612 -17.868 19.985 1.00 0.00 C ATOM 488 O ASN A 34 99.965 -16.909 19.559 1.00 0.00 O ATOM 489 CB ASN A 34 99.902 -20.179 19.384 1.00 0.00 C ATOM 490 CG ASN A 34 98.485 -19.751 19.022 1.00 0.00 C ATOM 491 OD1 ASN A 34 98.185 -19.520 17.851 1.00 0.00 O ATOM 492 ND2 ASN A 34 97.588 -19.632 19.963 1.00 0.00 N ATOM 0 H ASN A 34 102.314 -20.576 19.290 1.00 0.00 H new ATOM 0 HA ASN A 34 100.761 -18.697 18.038 1.00 0.00 H new ATOM 0 HB2 ASN A 34 100.170 -21.080 18.833 1.00 0.00 H new ATOM 0 HB3 ASN A 34 99.956 -20.426 20.444 1.00 0.00 H new ATOM 0 HD21 ASN A 34 96.637 -19.347 19.728 1.00 0.00 H new ATOM 0 HD22 ASN A 34 97.838 -19.824 20.933 1.00 0.00 H new ATOM 499 N SER A 35 101.090 -17.908 21.233 1.00 0.00 N ATOM 500 CA SER A 35 100.656 -16.908 22.217 1.00 0.00 C ATOM 501 C SER A 35 101.534 -15.650 22.263 1.00 0.00 C ATOM 502 O SER A 35 101.043 -14.592 22.658 1.00 0.00 O ATOM 503 CB SER A 35 100.600 -17.544 23.611 1.00 0.00 C ATOM 504 OG SER A 35 101.648 -18.494 23.749 1.00 0.00 O ATOM 0 H SER A 35 101.756 -18.598 21.580 1.00 0.00 H new ATOM 0 HA SER A 35 99.667 -16.580 21.897 1.00 0.00 H new ATOM 0 HB2 SER A 35 100.692 -16.773 24.376 1.00 0.00 H new ATOM 0 HB3 SER A 35 99.635 -18.029 23.761 1.00 0.00 H new ATOM 0 HG SER A 35 101.609 -18.897 24.642 1.00 0.00 H new ATOM 510 N PRO A 36 102.790 -15.707 21.890 1.00 0.00 N ATOM 511 CA PRO A 36 103.558 -14.475 21.548 1.00 0.00 C ATOM 512 C PRO A 36 103.713 -14.291 20.039 1.00 0.00 C ATOM 513 O PRO A 36 104.088 -15.220 19.324 1.00 0.00 O ATOM 514 CB PRO A 36 104.913 -14.731 22.203 1.00 0.00 C ATOM 515 CG PRO A 36 105.104 -16.209 22.136 1.00 0.00 C ATOM 516 CD PRO A 36 103.711 -16.845 22.052 1.00 0.00 C ATOM 0 HA PRO A 36 103.064 -13.566 21.891 1.00 0.00 H new ATOM 0 HB2 PRO A 36 105.711 -14.206 21.677 1.00 0.00 H new ATOM 0 HB3 PRO A 36 104.925 -14.378 23.234 1.00 0.00 H new ATOM 0 HG2 PRO A 36 105.703 -16.480 21.267 1.00 0.00 H new ATOM 0 HG3 PRO A 36 105.638 -16.568 23.016 1.00 0.00 H new ATOM 0 HD2 PRO A 36 103.640 -17.534 21.211 1.00 0.00 H new ATOM 0 HD3 PRO A 36 103.481 -17.416 22.952 1.00 0.00 H new ATOM 524 N LEU A 37 103.427 -13.082 19.566 1.00 0.00 N ATOM 525 CA LEU A 37 103.514 -12.781 18.138 1.00 0.00 C ATOM 526 C LEU A 37 104.965 -12.569 17.720 1.00 0.00 C ATOM 527 O LEU A 37 105.833 -12.330 18.560 1.00 0.00 O ATOM 528 CB LEU A 37 102.701 -11.523 17.815 1.00 0.00 C ATOM 529 CG LEU A 37 101.248 -11.706 18.261 1.00 0.00 C ATOM 530 CD1 LEU A 37 100.475 -10.407 18.019 1.00 0.00 C ATOM 531 CD2 LEU A 37 100.598 -12.834 17.456 1.00 0.00 C ATOM 0 H LEU A 37 103.134 -12.296 20.147 1.00 0.00 H new ATOM 0 HA LEU A 37 103.108 -13.628 17.585 1.00 0.00 H new ATOM 0 HB2 LEU A 37 103.138 -10.660 18.317 1.00 0.00 H new ATOM 0 HB3 LEU A 37 102.738 -11.322 16.744 1.00 0.00 H new ATOM 0 HG LEU A 37 101.227 -11.957 19.321 1.00 0.00 H new ATOM 0 HD11 LEU A 37 99.440 -10.535 18.336 1.00 0.00 H new ATOM 0 HD12 LEU A 37 100.932 -9.600 18.591 1.00 0.00 H new ATOM 0 HD13 LEU A 37 100.502 -10.160 16.958 1.00 0.00 H new ATOM 0 HD21 LEU A 37 99.564 -12.961 17.777 1.00 0.00 H new ATOM 0 HD22 LEU A 37 100.621 -12.584 16.395 1.00 0.00 H new ATOM 0 HD23 LEU A 37 101.146 -13.762 17.622 1.00 0.00 H new ATOM 543 N GLY A 38 105.227 -12.655 16.417 1.00 0.00 N ATOM 544 CA GLY A 38 106.582 -12.473 15.909 1.00 0.00 C ATOM 545 C GLY A 38 106.922 -10.991 15.864 1.00 0.00 C ATOM 546 O GLY A 38 106.066 -10.183 15.508 1.00 0.00 O ATOM 0 H GLY A 38 104.526 -12.848 15.702 1.00 0.00 H new ATOM 0 HA2 GLY A 38 107.293 -12.999 16.546 1.00 0.00 H new ATOM 0 HA3 GLY A 38 106.667 -12.905 14.912 1.00 0.00 H new ATOM 550 N VAL A 39 108.151 -10.624 16.223 1.00 0.00 N ATOM 551 CA VAL A 39 108.515 -9.209 16.280 1.00 0.00 C ATOM 552 C VAL A 39 109.288 -8.835 15.024 1.00 0.00 C ATOM 553 O VAL A 39 110.308 -9.448 14.721 1.00 0.00 O ATOM 554 CB VAL A 39 109.371 -8.928 17.520 1.00 0.00 C ATOM 555 CG1 VAL A 39 109.667 -7.428 17.619 1.00 0.00 C ATOM 556 CG2 VAL A 39 108.620 -9.370 18.779 1.00 0.00 C ATOM 0 H VAL A 39 108.898 -11.271 16.474 1.00 0.00 H new ATOM 0 HA VAL A 39 107.606 -8.610 16.342 1.00 0.00 H new ATOM 0 HB VAL A 39 110.306 -9.482 17.435 1.00 0.00 H new ATOM 0 HG11 VAL A 39 110.276 -7.235 18.502 1.00 0.00 H new ATOM 0 HG12 VAL A 39 110.206 -7.104 16.729 1.00 0.00 H new ATOM 0 HG13 VAL A 39 108.730 -6.877 17.696 1.00 0.00 H new ATOM 0 HG21 VAL A 39 109.233 -9.168 19.658 1.00 0.00 H new ATOM 0 HG22 VAL A 39 107.683 -8.819 18.856 1.00 0.00 H new ATOM 0 HG23 VAL A 39 108.409 -10.438 18.721 1.00 0.00 H new ATOM 566 N ILE A 40 108.813 -7.817 14.309 1.00 0.00 N ATOM 567 CA ILE A 40 109.475 -7.372 13.084 1.00 0.00 C ATOM 568 C ILE A 40 109.953 -5.934 13.249 1.00 0.00 C ATOM 569 O ILE A 40 109.275 -5.127 13.885 1.00 0.00 O ATOM 570 CB ILE A 40 108.514 -7.492 11.882 1.00 0.00 C ATOM 571 CG1 ILE A 40 107.302 -6.564 12.059 1.00 0.00 C ATOM 572 CG2 ILE A 40 108.037 -8.952 11.727 1.00 0.00 C ATOM 573 CD1 ILE A 40 106.523 -6.474 10.743 1.00 0.00 C ATOM 0 H ILE A 40 107.977 -7.287 14.555 1.00 0.00 H new ATOM 0 HA ILE A 40 110.339 -8.009 12.894 1.00 0.00 H new ATOM 0 HB ILE A 40 109.052 -7.193 10.983 1.00 0.00 H new ATOM 0 HG12 ILE A 40 106.655 -6.942 12.850 1.00 0.00 H new ATOM 0 HG13 ILE A 40 107.633 -5.572 12.365 1.00 0.00 H new ATOM 0 HG21 ILE A 40 107.360 -9.025 10.876 1.00 0.00 H new ATOM 0 HG22 ILE A 40 108.898 -9.600 11.562 1.00 0.00 H new ATOM 0 HG23 ILE A 40 107.517 -9.263 12.633 1.00 0.00 H new ATOM 0 HD11 ILE A 40 105.664 -5.815 10.873 1.00 0.00 H new ATOM 0 HD12 ILE A 40 107.172 -6.076 9.963 1.00 0.00 H new ATOM 0 HD13 ILE A 40 106.178 -7.467 10.456 1.00 0.00 H new ATOM 585 N GLY A 41 111.118 -5.625 12.689 1.00 0.00 N ATOM 586 CA GLY A 41 111.645 -4.266 12.755 1.00 0.00 C ATOM 587 C GLY A 41 112.419 -3.946 11.485 1.00 0.00 C ATOM 588 O GLY A 41 113.220 -4.759 11.026 1.00 0.00 O ATOM 0 H GLY A 41 111.710 -6.289 12.190 1.00 0.00 H new ATOM 0 HA2 GLY A 41 110.828 -3.556 12.881 1.00 0.00 H new ATOM 0 HA3 GLY A 41 112.295 -4.161 13.623 1.00 0.00 H new ATOM 592 N SER A 42 112.178 -2.768 10.920 1.00 0.00 N ATOM 593 CA SER A 42 112.810 -2.406 9.655 1.00 0.00 C ATOM 594 C SER A 42 113.197 -0.936 9.643 1.00 0.00 C ATOM 595 O SER A 42 112.594 -0.122 10.341 1.00 0.00 O ATOM 596 CB SER A 42 111.856 -2.683 8.494 1.00 0.00 C ATOM 597 OG SER A 42 110.774 -1.761 8.551 1.00 0.00 O ATOM 0 H SER A 42 111.560 -2.057 11.310 1.00 0.00 H new ATOM 0 HA SER A 42 113.711 -3.009 9.544 1.00 0.00 H new ATOM 0 HB2 SER A 42 112.382 -2.587 7.544 1.00 0.00 H new ATOM 0 HB3 SER A 42 111.482 -3.705 8.550 1.00 0.00 H new ATOM 0 HG SER A 42 110.400 -1.751 9.457 1.00 0.00 H new ATOM 603 N PHE A 43 114.195 -0.601 8.831 1.00 0.00 N ATOM 604 CA PHE A 43 114.604 0.788 8.667 1.00 0.00 C ATOM 605 C PHE A 43 114.758 1.103 7.185 1.00 0.00 C ATOM 606 O PHE A 43 115.217 0.260 6.411 1.00 0.00 O ATOM 607 CB PHE A 43 115.925 1.045 9.396 1.00 0.00 C ATOM 608 CG PHE A 43 117.076 0.215 8.880 1.00 0.00 C ATOM 609 CD1 PHE A 43 117.323 -1.052 9.423 1.00 0.00 C ATOM 610 CD2 PHE A 43 117.897 0.712 7.861 1.00 0.00 C ATOM 611 CE1 PHE A 43 118.391 -1.821 8.946 1.00 0.00 C ATOM 612 CE2 PHE A 43 118.964 -0.058 7.384 1.00 0.00 C ATOM 613 CZ PHE A 43 119.211 -1.325 7.927 1.00 0.00 C ATOM 0 H PHE A 43 114.733 -1.269 8.279 1.00 0.00 H new ATOM 0 HA PHE A 43 113.839 1.435 9.097 1.00 0.00 H new ATOM 0 HB2 PHE A 43 116.181 2.101 9.305 1.00 0.00 H new ATOM 0 HB3 PHE A 43 115.789 0.841 10.458 1.00 0.00 H new ATOM 0 HD1 PHE A 43 116.690 -1.436 10.209 1.00 0.00 H new ATOM 0 HD2 PHE A 43 117.707 1.690 7.443 1.00 0.00 H new ATOM 0 HE1 PHE A 43 118.582 -2.798 9.365 1.00 0.00 H new ATOM 0 HE2 PHE A 43 119.597 0.325 6.597 1.00 0.00 H new ATOM 0 HZ PHE A 43 120.034 -1.919 7.559 1.00 0.00 H new ATOM 623 N THR A 44 114.342 2.304 6.796 1.00 0.00 N ATOM 624 CA THR A 44 114.405 2.716 5.398 1.00 0.00 C ATOM 625 C THR A 44 115.067 4.080 5.256 1.00 0.00 C ATOM 626 O THR A 44 114.840 4.974 6.073 1.00 0.00 O ATOM 627 CB THR A 44 112.993 2.770 4.811 1.00 0.00 C ATOM 628 OG1 THR A 44 112.337 1.532 5.043 1.00 0.00 O ATOM 629 CG2 THR A 44 113.072 3.033 3.306 1.00 0.00 C ATOM 0 H THR A 44 113.959 3.007 7.427 1.00 0.00 H new ATOM 0 HA THR A 44 115.004 1.985 4.855 1.00 0.00 H new ATOM 0 HB THR A 44 112.433 3.574 5.289 1.00 0.00 H new ATOM 0 HG1 THR A 44 111.432 1.566 4.669 1.00 0.00 H new ATOM 0 HG21 THR A 44 112.065 3.071 2.890 1.00 0.00 H new ATOM 0 HG22 THR A 44 113.574 3.984 3.129 1.00 0.00 H new ATOM 0 HG23 THR A 44 113.633 2.231 2.826 1.00 0.00 H new ATOM 637 N TYR A 45 115.874 4.227 4.207 1.00 0.00 N ATOM 638 CA TYR A 45 116.500 5.509 3.890 1.00 0.00 C ATOM 639 C TYR A 45 116.031 5.968 2.514 1.00 0.00 C ATOM 640 O TYR A 45 116.025 5.171 1.577 1.00 0.00 O ATOM 641 CB TYR A 45 118.023 5.368 3.880 1.00 0.00 C ATOM 642 CG TYR A 45 118.618 5.050 5.232 1.00 0.00 C ATOM 643 CD1 TYR A 45 118.964 6.090 6.105 1.00 0.00 C ATOM 644 CD2 TYR A 45 118.830 3.719 5.609 1.00 0.00 C ATOM 645 CE1 TYR A 45 119.522 5.796 7.355 1.00 0.00 C ATOM 646 CE2 TYR A 45 119.386 3.427 6.861 1.00 0.00 C ATOM 647 CZ TYR A 45 119.732 4.464 7.733 1.00 0.00 C ATOM 648 OH TYR A 45 120.280 4.176 8.965 1.00 0.00 O ATOM 0 H TYR A 45 116.110 3.473 3.562 1.00 0.00 H new ATOM 0 HA TYR A 45 116.216 6.240 4.647 1.00 0.00 H new ATOM 0 HB2 TYR A 45 118.301 4.582 3.178 1.00 0.00 H new ATOM 0 HB3 TYR A 45 118.461 6.295 3.510 1.00 0.00 H new ATOM 0 HD1 TYR A 45 118.800 7.117 5.814 1.00 0.00 H new ATOM 0 HD2 TYR A 45 118.565 2.918 4.935 1.00 0.00 H new ATOM 0 HE1 TYR A 45 119.791 6.597 8.028 1.00 0.00 H new ATOM 0 HE2 TYR A 45 119.548 2.400 7.153 1.00 0.00 H new ATOM 0 HH TYR A 45 119.586 4.239 9.654 1.00 0.00 H new ATOM 658 N THR A 46 115.656 7.240 2.387 1.00 0.00 N ATOM 659 CA THR A 46 115.105 7.745 1.131 1.00 0.00 C ATOM 660 C THR A 46 116.084 8.693 0.447 1.00 0.00 C ATOM 661 O THR A 46 116.819 9.426 1.106 1.00 0.00 O ATOM 662 CB THR A 46 113.795 8.489 1.400 1.00 0.00 C ATOM 663 OG1 THR A 46 112.941 7.674 2.190 1.00 0.00 O ATOM 664 CG2 THR A 46 113.109 8.816 0.072 1.00 0.00 C ATOM 0 H THR A 46 115.723 7.934 3.131 1.00 0.00 H new ATOM 0 HA THR A 46 114.923 6.893 0.476 1.00 0.00 H new ATOM 0 HB THR A 46 114.007 9.415 1.934 1.00 0.00 H new ATOM 0 HG1 THR A 46 112.103 8.151 2.364 1.00 0.00 H new ATOM 0 HG21 THR A 46 112.176 9.346 0.265 1.00 0.00 H new ATOM 0 HG22 THR A 46 113.765 9.444 -0.531 1.00 0.00 H new ATOM 0 HG23 THR A 46 112.897 7.892 -0.465 1.00 0.00 H new ATOM 672 N GLU A 47 116.089 8.668 -0.885 1.00 0.00 N ATOM 673 CA GLU A 47 116.973 9.534 -1.657 1.00 0.00 C ATOM 674 C GLU A 47 116.203 10.197 -2.792 1.00 0.00 C ATOM 675 O GLU A 47 115.345 9.574 -3.418 1.00 0.00 O ATOM 676 CB GLU A 47 118.132 8.716 -2.231 1.00 0.00 C ATOM 677 CG GLU A 47 118.949 8.110 -1.083 1.00 0.00 C ATOM 678 CD GLU A 47 120.175 7.349 -1.598 1.00 0.00 C ATOM 679 OE1 GLU A 47 120.282 7.126 -2.797 1.00 0.00 O ATOM 680 OE2 GLU A 47 121.003 6.995 -0.775 1.00 0.00 O ATOM 0 H GLU A 47 115.494 8.060 -1.448 1.00 0.00 H new ATOM 0 HA GLU A 47 117.368 10.307 -0.998 1.00 0.00 H new ATOM 0 HB2 GLU A 47 117.749 7.925 -2.876 1.00 0.00 H new ATOM 0 HB3 GLU A 47 118.768 9.350 -2.849 1.00 0.00 H new ATOM 0 HG2 GLU A 47 119.270 8.903 -0.407 1.00 0.00 H new ATOM 0 HG3 GLU A 47 118.318 7.435 -0.505 1.00 0.00 H new ATOM 687 N LYS A 48 116.504 11.470 -3.027 1.00 0.00 N ATOM 688 CA LYS A 48 115.896 12.207 -4.128 1.00 0.00 C ATOM 689 C LYS A 48 116.906 13.192 -4.709 1.00 0.00 C ATOM 690 O LYS A 48 117.615 13.870 -3.965 1.00 0.00 O ATOM 691 CB LYS A 48 114.663 12.964 -3.634 1.00 0.00 C ATOM 692 CG LYS A 48 113.959 13.631 -4.818 1.00 0.00 C ATOM 693 CD LYS A 48 112.779 14.459 -4.312 1.00 0.00 C ATOM 694 CE LYS A 48 111.989 15.006 -5.502 1.00 0.00 C ATOM 695 NZ LYS A 48 112.750 16.118 -6.136 1.00 0.00 N ATOM 0 H LYS A 48 117.165 12.012 -2.470 1.00 0.00 H new ATOM 0 HA LYS A 48 115.593 11.502 -4.902 1.00 0.00 H new ATOM 0 HB2 LYS A 48 113.980 12.278 -3.132 1.00 0.00 H new ATOM 0 HB3 LYS A 48 114.955 13.716 -2.901 1.00 0.00 H new ATOM 0 HG2 LYS A 48 114.659 14.269 -5.358 1.00 0.00 H new ATOM 0 HG3 LYS A 48 113.610 12.874 -5.520 1.00 0.00 H new ATOM 0 HD2 LYS A 48 112.133 13.845 -3.685 1.00 0.00 H new ATOM 0 HD3 LYS A 48 113.137 15.281 -3.692 1.00 0.00 H new ATOM 0 HE2 LYS A 48 111.810 14.213 -6.228 1.00 0.00 H new ATOM 0 HE3 LYS A 48 111.013 15.361 -5.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 112.170 16.556 -6.880 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 112.987 16.831 -5.417 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 113.626 15.745 -6.555 1.00 0.00 H new ATOM 709 N SER A 49 116.967 13.273 -6.033 1.00 0.00 N ATOM 710 CA SER A 49 117.903 14.182 -6.687 1.00 0.00 C ATOM 711 C SER A 49 117.263 14.831 -7.910 1.00 0.00 C ATOM 712 O SER A 49 116.578 14.169 -8.688 1.00 0.00 O ATOM 713 CB SER A 49 119.157 13.417 -7.113 1.00 0.00 C ATOM 714 OG SER A 49 120.106 14.337 -7.639 1.00 0.00 O ATOM 0 H SER A 49 116.387 12.727 -6.670 1.00 0.00 H new ATOM 0 HA SER A 49 118.173 14.964 -5.978 1.00 0.00 H new ATOM 0 HB2 SER A 49 119.581 12.885 -6.261 1.00 0.00 H new ATOM 0 HB3 SER A 49 118.904 12.668 -7.863 1.00 0.00 H new ATOM 0 HG SER A 49 120.913 13.854 -7.913 1.00 0.00 H new ATOM 720 N ARG A 50 117.493 16.130 -8.071 1.00 0.00 N ATOM 721 CA ARG A 50 116.963 16.845 -9.226 1.00 0.00 C ATOM 722 C ARG A 50 117.995 16.874 -10.349 1.00 0.00 C ATOM 723 O ARG A 50 117.749 16.377 -11.447 1.00 0.00 O ATOM 724 CB ARG A 50 116.590 18.278 -8.838 1.00 0.00 C ATOM 725 CG ARG A 50 115.454 18.246 -7.810 1.00 0.00 C ATOM 726 CD ARG A 50 114.957 19.669 -7.534 1.00 0.00 C ATOM 727 NE ARG A 50 116.052 20.528 -7.070 1.00 0.00 N ATOM 728 CZ ARG A 50 115.862 21.620 -6.311 1.00 0.00 C ATOM 729 NH1 ARG A 50 114.674 21.989 -5.901 1.00 0.00 N ATOM 730 NH2 ARG A 50 116.899 22.336 -5.970 1.00 0.00 N ATOM 0 H ARG A 50 118.036 16.703 -7.425 1.00 0.00 H new ATOM 0 HA ARG A 50 116.071 16.324 -9.573 1.00 0.00 H new ATOM 0 HB2 ARG A 50 117.457 18.792 -8.423 1.00 0.00 H new ATOM 0 HB3 ARG A 50 116.281 18.837 -9.721 1.00 0.00 H new ATOM 0 HG2 ARG A 50 114.634 17.631 -8.181 1.00 0.00 H new ATOM 0 HG3 ARG A 50 115.803 17.788 -6.885 1.00 0.00 H new ATOM 0 HD2 ARG A 50 114.521 20.088 -8.441 1.00 0.00 H new ATOM 0 HD3 ARG A 50 114.167 19.643 -6.783 1.00 0.00 H new ATOM 0 HE ARG A 50 117.006 20.284 -7.337 1.00 0.00 H new ATOM 0 HH11 ARG A 50 113.853 21.441 -6.157 1.00 0.00 H new ATOM 0 HH12 ARG A 50 114.570 22.825 -5.326 1.00 0.00 H new ATOM 0 HH21 ARG A 50 117.832 22.063 -6.279 1.00 0.00 H new ATOM 0 HH22 ARG A 50 116.777 23.169 -5.394 1.00 0.00 H new ATOM 744 N THR A 51 119.154 17.462 -10.060 1.00 0.00 N ATOM 745 CA THR A 51 120.241 17.527 -11.032 1.00 0.00 C ATOM 746 C THR A 51 121.531 16.998 -10.414 1.00 0.00 C ATOM 747 O THR A 51 121.660 16.933 -9.191 1.00 0.00 O ATOM 748 CB THR A 51 120.455 18.970 -11.496 1.00 0.00 C ATOM 749 OG1 THR A 51 120.866 19.763 -10.392 1.00 0.00 O ATOM 750 CG2 THR A 51 119.153 19.530 -12.075 1.00 0.00 C ATOM 0 H THR A 51 119.364 17.899 -9.163 1.00 0.00 H new ATOM 0 HA THR A 51 119.972 16.911 -11.890 1.00 0.00 H new ATOM 0 HB THR A 51 121.225 18.990 -12.267 1.00 0.00 H new ATOM 0 HG1 THR A 51 121.005 20.687 -10.687 1.00 0.00 H new ATOM 0 HG21 THR A 51 119.313 20.557 -12.403 1.00 0.00 H new ATOM 0 HG22 THR A 51 118.841 18.922 -12.924 1.00 0.00 H new ATOM 0 HG23 THR A 51 118.377 19.510 -11.310 1.00 0.00 H new ATOM 758 N ALA A 52 122.482 16.620 -11.261 1.00 0.00 N ATOM 759 CA ALA A 52 123.761 16.117 -10.777 1.00 0.00 C ATOM 760 C ALA A 52 124.748 17.266 -10.587 1.00 0.00 C ATOM 761 O ALA A 52 125.314 17.775 -11.554 1.00 0.00 O ATOM 762 CB ALA A 52 124.337 15.105 -11.771 1.00 0.00 C ATOM 0 H ALA A 52 122.393 16.652 -12.277 1.00 0.00 H new ATOM 0 HA ALA A 52 123.599 15.627 -9.817 1.00 0.00 H new ATOM 0 HB1 ALA A 52 125.293 14.735 -11.401 1.00 0.00 H new ATOM 0 HB2 ALA A 52 123.644 14.271 -11.884 1.00 0.00 H new ATOM 0 HB3 ALA A 52 124.485 15.588 -12.737 1.00 0.00 H new ATOM 768 N SER A 53 124.947 17.668 -9.336 1.00 0.00 N ATOM 769 CA SER A 53 125.875 18.753 -9.022 1.00 0.00 C ATOM 770 C SER A 53 126.917 18.291 -8.011 1.00 0.00 C ATOM 771 O SER A 53 126.610 17.538 -7.086 1.00 0.00 O ATOM 772 CB SER A 53 125.105 19.945 -8.451 1.00 0.00 C ATOM 773 OG SER A 53 124.143 20.378 -9.403 1.00 0.00 O ATOM 0 H SER A 53 124.481 17.262 -8.525 1.00 0.00 H new ATOM 0 HA SER A 53 126.382 19.050 -9.940 1.00 0.00 H new ATOM 0 HB2 SER A 53 124.612 19.663 -7.520 1.00 0.00 H new ATOM 0 HB3 SER A 53 125.792 20.758 -8.215 1.00 0.00 H new ATOM 0 HG SER A 53 123.645 21.141 -9.041 1.00 0.00 H new ATOM 779 N SER A 54 128.151 18.746 -8.196 1.00 0.00 N ATOM 780 CA SER A 54 129.238 18.382 -7.290 1.00 0.00 C ATOM 781 C SER A 54 128.974 18.885 -5.873 1.00 0.00 C ATOM 782 O SER A 54 129.324 18.219 -4.898 1.00 0.00 O ATOM 783 CB SER A 54 130.556 18.964 -7.801 1.00 0.00 C ATOM 784 OG SER A 54 130.770 18.531 -9.137 1.00 0.00 O ATOM 0 H SER A 54 128.424 19.364 -8.960 1.00 0.00 H new ATOM 0 HA SER A 54 129.300 17.294 -7.260 1.00 0.00 H new ATOM 0 HB2 SER A 54 130.527 20.053 -7.759 1.00 0.00 H new ATOM 0 HB3 SER A 54 131.381 18.642 -7.165 1.00 0.00 H new ATOM 0 HG SER A 54 131.613 18.903 -9.470 1.00 0.00 H new ATOM 790 N GLY A 55 128.368 20.063 -5.761 1.00 0.00 N ATOM 791 CA GLY A 55 128.133 20.665 -4.453 1.00 0.00 C ATOM 792 C GLY A 55 126.838 20.162 -3.819 1.00 0.00 C ATOM 793 O GLY A 55 126.816 19.810 -2.640 1.00 0.00 O ATOM 0 H GLY A 55 128.034 20.615 -6.551 1.00 0.00 H new ATOM 0 HA2 GLY A 55 128.971 20.440 -3.794 1.00 0.00 H new ATOM 0 HA3 GLY A 55 128.090 21.749 -4.555 1.00 0.00 H new ATOM 797 N ASP A 56 125.766 20.127 -4.603 1.00 0.00 N ATOM 798 CA ASP A 56 124.460 19.748 -4.070 1.00 0.00 C ATOM 799 C ASP A 56 124.146 18.279 -4.344 1.00 0.00 C ATOM 800 O ASP A 56 124.022 17.863 -5.495 1.00 0.00 O ATOM 801 CB ASP A 56 123.371 20.623 -4.699 1.00 0.00 C ATOM 802 CG ASP A 56 123.579 22.088 -4.322 1.00 0.00 C ATOM 803 OD1 ASP A 56 124.086 22.342 -3.240 1.00 0.00 O ATOM 804 OD2 ASP A 56 123.224 22.937 -5.122 1.00 0.00 O ATOM 0 H ASP A 56 125.773 20.353 -5.598 1.00 0.00 H new ATOM 0 HA ASP A 56 124.485 19.897 -2.990 1.00 0.00 H new ATOM 0 HB2 ASP A 56 123.390 20.514 -5.783 1.00 0.00 H new ATOM 0 HB3 ASP A 56 122.389 20.290 -4.362 1.00 0.00 H new ATOM 809 N TYR A 57 124.018 17.500 -3.272 1.00 0.00 N ATOM 810 CA TYR A 57 123.598 16.106 -3.383 1.00 0.00 C ATOM 811 C TYR A 57 122.456 15.819 -2.412 1.00 0.00 C ATOM 812 O TYR A 57 122.569 16.087 -1.217 1.00 0.00 O ATOM 813 CB TYR A 57 124.768 15.171 -3.072 1.00 0.00 C ATOM 814 CG TYR A 57 125.836 15.153 -4.140 1.00 0.00 C ATOM 815 CD1 TYR A 57 125.566 14.582 -5.389 1.00 0.00 C ATOM 816 CD2 TYR A 57 127.099 15.699 -3.880 1.00 0.00 C ATOM 817 CE1 TYR A 57 126.556 14.556 -6.378 1.00 0.00 C ATOM 818 CE2 TYR A 57 128.089 15.675 -4.869 1.00 0.00 C ATOM 819 CZ TYR A 57 127.818 15.104 -6.119 1.00 0.00 C ATOM 820 OH TYR A 57 128.795 15.078 -7.092 1.00 0.00 O ATOM 0 H TYR A 57 124.199 17.811 -2.317 1.00 0.00 H new ATOM 0 HA TYR A 57 123.259 15.933 -4.404 1.00 0.00 H new ATOM 0 HB2 TYR A 57 125.219 15.471 -2.126 1.00 0.00 H new ATOM 0 HB3 TYR A 57 124.386 14.159 -2.937 1.00 0.00 H new ATOM 0 HD1 TYR A 57 124.592 14.161 -5.590 1.00 0.00 H new ATOM 0 HD2 TYR A 57 127.309 16.139 -2.916 1.00 0.00 H new ATOM 0 HE1 TYR A 57 126.346 14.113 -7.341 1.00 0.00 H new ATOM 0 HE2 TYR A 57 129.063 16.097 -4.668 1.00 0.00 H new ATOM 0 HH TYR A 57 128.376 15.110 -7.977 1.00 0.00 H new ATOM 830 N ASN A 58 121.357 15.273 -2.929 1.00 0.00 N ATOM 831 CA ASN A 58 120.228 14.901 -2.080 1.00 0.00 C ATOM 832 C ASN A 58 119.748 16.091 -1.254 1.00 0.00 C ATOM 833 O ASN A 58 120.208 16.307 -0.134 1.00 0.00 O ATOM 834 CB ASN A 58 120.636 13.757 -1.145 1.00 0.00 C ATOM 835 CG ASN A 58 119.411 12.958 -0.704 1.00 0.00 C ATOM 836 OD1 ASN A 58 118.273 13.393 -0.880 1.00 0.00 O ATOM 837 ND2 ASN A 58 119.582 11.796 -0.131 1.00 0.00 N ATOM 0 H ASN A 58 121.225 15.080 -3.922 1.00 0.00 H new ATOM 0 HA ASN A 58 119.410 14.576 -2.723 1.00 0.00 H new ATOM 0 HB2 ASN A 58 121.342 13.100 -1.653 1.00 0.00 H new ATOM 0 HB3 ASN A 58 121.148 14.160 -0.271 1.00 0.00 H new ATOM 0 HD21 ASN A 58 118.773 11.252 0.169 1.00 0.00 H new ATOM 0 HD22 ASN A 58 120.524 11.433 0.016 1.00 0.00 H new ATOM 844 N LYS A 59 118.823 16.860 -1.817 1.00 0.00 N ATOM 845 CA LYS A 59 118.337 18.069 -1.157 1.00 0.00 C ATOM 846 C LYS A 59 117.735 17.749 0.209 1.00 0.00 C ATOM 847 O LYS A 59 117.919 18.502 1.165 1.00 0.00 O ATOM 848 CB LYS A 59 117.283 18.760 -2.027 1.00 0.00 C ATOM 849 CG LYS A 59 117.851 19.056 -3.419 1.00 0.00 C ATOM 850 CD LYS A 59 119.018 20.042 -3.313 1.00 0.00 C ATOM 851 CE LYS A 59 119.454 20.471 -4.714 1.00 0.00 C ATOM 852 NZ LYS A 59 120.117 21.804 -4.641 1.00 0.00 N ATOM 0 H LYS A 59 118.396 16.671 -2.724 1.00 0.00 H new ATOM 0 HA LYS A 59 119.188 18.735 -1.015 1.00 0.00 H new ATOM 0 HB2 LYS A 59 116.401 18.125 -2.114 1.00 0.00 H new ATOM 0 HB3 LYS A 59 116.962 19.688 -1.553 1.00 0.00 H new ATOM 0 HG2 LYS A 59 118.188 18.131 -3.887 1.00 0.00 H new ATOM 0 HG3 LYS A 59 117.071 19.471 -4.058 1.00 0.00 H new ATOM 0 HD2 LYS A 59 118.719 20.914 -2.731 1.00 0.00 H new ATOM 0 HD3 LYS A 59 119.853 19.578 -2.787 1.00 0.00 H new ATOM 0 HE2 LYS A 59 120.139 19.735 -5.135 1.00 0.00 H new ATOM 0 HE3 LYS A 59 118.590 20.518 -5.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 120.533 22.036 -5.565 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 119.415 22.528 -4.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 120.866 21.780 -3.920 1.00 0.00 H new ATOM 866 N ASN A 60 117.017 16.631 0.300 1.00 0.00 N ATOM 867 CA ASN A 60 116.389 16.242 1.561 1.00 0.00 C ATOM 868 C ASN A 60 116.467 14.731 1.766 1.00 0.00 C ATOM 869 O ASN A 60 116.497 13.965 0.803 1.00 0.00 O ATOM 870 CB ASN A 60 114.927 16.704 1.575 1.00 0.00 C ATOM 871 CG ASN A 60 114.119 15.995 0.490 1.00 0.00 C ATOM 872 OD1 ASN A 60 114.688 15.433 -0.448 1.00 0.00 O ATOM 873 ND2 ASN A 60 112.817 15.988 0.562 1.00 0.00 N ATOM 0 H ASN A 60 116.857 15.986 -0.474 1.00 0.00 H new ATOM 0 HA ASN A 60 116.926 16.722 2.379 1.00 0.00 H new ATOM 0 HB2 ASN A 60 114.487 16.502 2.552 1.00 0.00 H new ATOM 0 HB3 ASN A 60 114.881 17.782 1.422 1.00 0.00 H new ATOM 0 HD21 ASN A 60 112.269 15.517 -0.158 1.00 0.00 H new ATOM 0 HD22 ASN A 60 112.347 16.453 1.338 1.00 0.00 H new ATOM 880 N GLN A 61 116.492 14.311 3.029 1.00 0.00 N ATOM 881 CA GLN A 61 116.582 12.889 3.357 1.00 0.00 C ATOM 882 C GLN A 61 115.449 12.492 4.296 1.00 0.00 C ATOM 883 O GLN A 61 114.992 13.309 5.091 1.00 0.00 O ATOM 884 CB GLN A 61 117.926 12.594 4.026 1.00 0.00 C ATOM 885 CG GLN A 61 119.061 12.879 3.039 1.00 0.00 C ATOM 886 CD GLN A 61 120.419 12.679 3.710 1.00 0.00 C ATOM 887 OE1 GLN A 61 120.518 12.662 4.937 1.00 0.00 O ATOM 888 NE2 GLN A 61 121.482 12.528 2.968 1.00 0.00 N ATOM 0 H GLN A 61 116.451 14.931 3.838 1.00 0.00 H new ATOM 0 HA GLN A 61 116.500 12.312 2.436 1.00 0.00 H new ATOM 0 HB2 GLN A 61 118.043 13.209 4.918 1.00 0.00 H new ATOM 0 HB3 GLN A 61 117.963 11.554 4.349 1.00 0.00 H new ATOM 0 HG2 GLN A 61 118.975 12.218 2.176 1.00 0.00 H new ATOM 0 HG3 GLN A 61 118.980 13.901 2.668 1.00 0.00 H new ATOM 0 HE21 GLN A 61 121.400 12.542 1.951 1.00 0.00 H new ATOM 0 HE22 GLN A 61 122.394 12.396 3.405 1.00 0.00 H new ATOM 897 N TYR A 62 114.994 11.243 4.201 1.00 0.00 N ATOM 898 CA TYR A 62 113.955 10.749 5.101 1.00 0.00 C ATOM 899 C TYR A 62 114.367 9.412 5.706 1.00 0.00 C ATOM 900 O TYR A 62 114.883 8.536 5.010 1.00 0.00 O ATOM 901 CB TYR A 62 112.634 10.589 4.347 1.00 0.00 C ATOM 902 CG TYR A 62 112.118 11.883 3.762 1.00 0.00 C ATOM 903 CD1 TYR A 62 111.405 12.779 4.567 1.00 0.00 C ATOM 904 CD2 TYR A 62 112.356 12.187 2.416 1.00 0.00 C ATOM 905 CE1 TYR A 62 110.927 13.978 4.025 1.00 0.00 C ATOM 906 CE2 TYR A 62 111.878 13.386 1.876 1.00 0.00 C ATOM 907 CZ TYR A 62 111.164 14.282 2.679 1.00 0.00 C ATOM 908 OH TYR A 62 110.694 15.464 2.147 1.00 0.00 O ATOM 0 H TYR A 62 115.325 10.562 3.517 1.00 0.00 H new ATOM 0 HA TYR A 62 113.822 11.474 5.904 1.00 0.00 H new ATOM 0 HB2 TYR A 62 112.768 9.864 3.545 1.00 0.00 H new ATOM 0 HB3 TYR A 62 111.884 10.180 5.025 1.00 0.00 H new ATOM 0 HD1 TYR A 62 111.224 12.545 5.606 1.00 0.00 H new ATOM 0 HD2 TYR A 62 112.908 11.497 1.795 1.00 0.00 H new ATOM 0 HE1 TYR A 62 110.375 14.669 4.645 1.00 0.00 H new ATOM 0 HE2 TYR A 62 112.061 13.620 0.838 1.00 0.00 H new ATOM 0 HH TYR A 62 110.663 16.148 2.848 1.00 0.00 H new ATOM 918 N TYR A 63 114.137 9.264 7.007 1.00 0.00 N ATOM 919 CA TYR A 63 114.459 8.022 7.701 1.00 0.00 C ATOM 920 C TYR A 63 113.238 7.531 8.464 1.00 0.00 C ATOM 921 O TYR A 63 112.575 8.308 9.149 1.00 0.00 O ATOM 922 CB TYR A 63 115.617 8.248 8.674 1.00 0.00 C ATOM 923 CG TYR A 63 115.999 7.009 9.450 1.00 0.00 C ATOM 924 CD1 TYR A 63 116.760 6.007 8.837 1.00 0.00 C ATOM 925 CD2 TYR A 63 115.595 6.866 10.783 1.00 0.00 C ATOM 926 CE1 TYR A 63 117.115 4.860 9.556 1.00 0.00 C ATOM 927 CE2 TYR A 63 115.951 5.718 11.501 1.00 0.00 C ATOM 928 CZ TYR A 63 116.711 4.715 10.889 1.00 0.00 C ATOM 929 OH TYR A 63 117.062 3.585 11.597 1.00 0.00 O ATOM 0 H TYR A 63 113.730 9.987 7.601 1.00 0.00 H new ATOM 0 HA TYR A 63 114.754 7.272 6.967 1.00 0.00 H new ATOM 0 HB2 TYR A 63 116.485 8.602 8.118 1.00 0.00 H new ATOM 0 HB3 TYR A 63 115.344 9.037 9.375 1.00 0.00 H new ATOM 0 HD1 TYR A 63 117.073 6.119 7.809 1.00 0.00 H new ATOM 0 HD2 TYR A 63 115.010 7.640 11.257 1.00 0.00 H new ATOM 0 HE1 TYR A 63 117.701 4.086 9.083 1.00 0.00 H new ATOM 0 HE2 TYR A 63 115.639 5.606 12.529 1.00 0.00 H new ATOM 0 HH TYR A 63 116.703 3.644 12.507 1.00 0.00 H new ATOM 939 N GLY A 64 112.934 6.245 8.333 1.00 0.00 N ATOM 940 CA GLY A 64 111.772 5.674 9.008 1.00 0.00 C ATOM 941 C GLY A 64 112.131 4.378 9.722 1.00 0.00 C ATOM 942 O GLY A 64 112.846 3.541 9.173 1.00 0.00 O ATOM 0 H GLY A 64 113.469 5.583 7.772 1.00 0.00 H new ATOM 0 HA2 GLY A 64 111.377 6.391 9.728 1.00 0.00 H new ATOM 0 HA3 GLY A 64 110.982 5.485 8.281 1.00 0.00 H new ATOM 946 N ILE A 65 111.639 4.227 10.949 1.00 0.00 N ATOM 947 CA ILE A 65 111.841 2.994 11.706 1.00 0.00 C ATOM 948 C ILE A 65 110.483 2.453 12.148 1.00 0.00 C ATOM 949 O ILE A 65 109.703 3.171 12.774 1.00 0.00 O ATOM 950 CB ILE A 65 112.740 3.267 12.919 1.00 0.00 C ATOM 951 CG1 ILE A 65 112.969 1.972 13.704 1.00 0.00 C ATOM 952 CG2 ILE A 65 112.086 4.306 13.835 1.00 0.00 C ATOM 953 CD1 ILE A 65 114.126 2.168 14.686 1.00 0.00 C ATOM 0 H ILE A 65 111.099 4.940 11.439 1.00 0.00 H new ATOM 0 HA ILE A 65 112.333 2.250 11.080 1.00 0.00 H new ATOM 0 HB ILE A 65 113.697 3.650 12.564 1.00 0.00 H new ATOM 0 HG12 ILE A 65 112.063 1.696 14.244 1.00 0.00 H new ATOM 0 HG13 ILE A 65 113.194 1.154 13.019 1.00 0.00 H new ATOM 0 HG21 ILE A 65 112.732 4.493 14.693 1.00 0.00 H new ATOM 0 HG22 ILE A 65 111.937 5.235 13.284 1.00 0.00 H new ATOM 0 HG23 ILE A 65 111.123 3.931 14.181 1.00 0.00 H new ATOM 0 HD11 ILE A 65 114.289 1.246 15.245 1.00 0.00 H new ATOM 0 HD12 ILE A 65 115.031 2.423 14.135 1.00 0.00 H new ATOM 0 HD13 ILE A 65 113.883 2.974 15.378 1.00 0.00 H new ATOM 965 N THR A 66 110.196 1.200 11.794 1.00 0.00 N ATOM 966 CA THR A 66 108.885 0.616 12.069 1.00 0.00 C ATOM 967 C THR A 66 109.009 -0.662 12.894 1.00 0.00 C ATOM 968 O THR A 66 110.025 -1.353 12.829 1.00 0.00 O ATOM 969 CB THR A 66 108.174 0.292 10.752 1.00 0.00 C ATOM 970 OG1 THR A 66 108.947 -0.644 10.016 1.00 0.00 O ATOM 971 CG2 THR A 66 107.982 1.564 9.920 1.00 0.00 C ATOM 0 H THR A 66 110.848 0.575 11.320 1.00 0.00 H new ATOM 0 HA THR A 66 108.308 1.345 12.639 1.00 0.00 H new ATOM 0 HB THR A 66 107.195 -0.132 10.975 1.00 0.00 H new ATOM 0 HG1 THR A 66 109.519 -0.167 9.379 1.00 0.00 H new ATOM 0 HG21 THR A 66 107.475 1.316 8.987 1.00 0.00 H new ATOM 0 HG22 THR A 66 107.380 2.278 10.481 1.00 0.00 H new ATOM 0 HG23 THR A 66 108.954 2.004 9.699 1.00 0.00 H new ATOM 979 N ALA A 67 107.945 -0.980 13.627 1.00 0.00 N ATOM 980 CA ALA A 67 107.870 -2.224 14.387 1.00 0.00 C ATOM 981 C ALA A 67 106.459 -2.787 14.261 1.00 0.00 C ATOM 982 O ALA A 67 105.508 -2.018 14.123 1.00 0.00 O ATOM 983 CB ALA A 67 108.199 -1.964 15.858 1.00 0.00 C ATOM 0 H ALA A 67 107.118 -0.389 13.711 1.00 0.00 H new ATOM 0 HA ALA A 67 108.592 -2.940 13.994 1.00 0.00 H new ATOM 0 HB1 ALA A 67 108.140 -2.899 16.415 1.00 0.00 H new ATOM 0 HB2 ALA A 67 109.207 -1.557 15.939 1.00 0.00 H new ATOM 0 HB3 ALA A 67 107.485 -1.251 16.270 1.00 0.00 H new ATOM 989 N GLY A 68 106.326 -4.113 14.280 1.00 0.00 N ATOM 990 CA GLY A 68 105.016 -4.719 14.058 1.00 0.00 C ATOM 991 C GLY A 68 104.917 -6.157 14.569 1.00 0.00 C ATOM 992 O GLY A 68 105.920 -6.740 14.984 1.00 0.00 O ATOM 0 H GLY A 68 107.087 -4.772 14.442 1.00 0.00 H new ATOM 0 HA2 GLY A 68 104.256 -4.113 14.551 1.00 0.00 H new ATOM 0 HA3 GLY A 68 104.793 -4.704 12.991 1.00 0.00 H new ATOM 996 N PRO A 69 103.730 -6.730 14.581 1.00 0.00 N ATOM 997 CA PRO A 69 103.538 -8.175 14.862 1.00 0.00 C ATOM 998 C PRO A 69 103.360 -8.988 13.579 1.00 0.00 C ATOM 999 O PRO A 69 102.554 -8.633 12.712 1.00 0.00 O ATOM 1000 CB PRO A 69 102.260 -8.193 15.703 1.00 0.00 C ATOM 1001 CG PRO A 69 101.512 -6.943 15.350 1.00 0.00 C ATOM 1002 CD PRO A 69 102.404 -6.113 14.420 1.00 0.00 C ATOM 0 HA PRO A 69 104.396 -8.624 15.362 1.00 0.00 H new ATOM 0 HB2 PRO A 69 101.663 -9.079 15.486 1.00 0.00 H new ATOM 0 HB3 PRO A 69 102.494 -8.220 16.767 1.00 0.00 H new ATOM 0 HG2 PRO A 69 100.570 -7.187 14.859 1.00 0.00 H new ATOM 0 HG3 PRO A 69 101.266 -6.378 16.249 1.00 0.00 H new ATOM 0 HD2 PRO A 69 102.061 -6.161 13.386 1.00 0.00 H new ATOM 0 HD3 PRO A 69 102.413 -5.061 14.705 1.00 0.00 H new ATOM 1010 N ALA A 70 104.225 -9.985 13.415 1.00 0.00 N ATOM 1011 CA ALA A 70 104.123 -10.960 12.334 1.00 0.00 C ATOM 1012 C ALA A 70 103.100 -12.048 12.659 1.00 0.00 C ATOM 1013 O ALA A 70 103.020 -12.499 13.804 1.00 0.00 O ATOM 1014 CB ALA A 70 105.485 -11.611 12.093 1.00 0.00 C ATOM 0 H ALA A 70 105.022 -10.140 14.033 1.00 0.00 H new ATOM 0 HA ALA A 70 103.795 -10.432 11.439 1.00 0.00 H new ATOM 0 HB1 ALA A 70 105.403 -12.338 11.285 1.00 0.00 H new ATOM 0 HB2 ALA A 70 106.211 -10.845 11.820 1.00 0.00 H new ATOM 0 HB3 ALA A 70 105.814 -12.115 13.002 1.00 0.00 H new ATOM 1020 N TYR A 71 102.375 -12.500 11.636 1.00 0.00 N ATOM 1021 CA TYR A 71 101.472 -13.638 11.766 1.00 0.00 C ATOM 1022 C TYR A 71 101.848 -14.694 10.730 1.00 0.00 C ATOM 1023 O TYR A 71 102.366 -14.348 9.665 1.00 0.00 O ATOM 1024 CB TYR A 71 100.024 -13.197 11.554 1.00 0.00 C ATOM 1025 CG TYR A 71 99.018 -14.289 11.828 1.00 0.00 C ATOM 1026 CD1 TYR A 71 98.575 -14.520 13.135 1.00 0.00 C ATOM 1027 CD2 TYR A 71 98.529 -15.072 10.776 1.00 0.00 C ATOM 1028 CE1 TYR A 71 97.643 -15.533 13.391 1.00 0.00 C ATOM 1029 CE2 TYR A 71 97.595 -16.083 11.030 1.00 0.00 C ATOM 1030 CZ TYR A 71 97.153 -16.315 12.338 1.00 0.00 C ATOM 1031 OH TYR A 71 96.235 -17.313 12.588 1.00 0.00 O ATOM 0 H TYR A 71 102.398 -12.090 10.702 1.00 0.00 H new ATOM 0 HA TYR A 71 101.563 -14.055 12.769 1.00 0.00 H new ATOM 0 HB2 TYR A 71 99.812 -12.347 12.203 1.00 0.00 H new ATOM 0 HB3 TYR A 71 99.904 -12.852 10.527 1.00 0.00 H new ATOM 0 HD1 TYR A 71 98.952 -13.916 13.947 1.00 0.00 H new ATOM 0 HD2 TYR A 71 98.873 -14.896 9.767 1.00 0.00 H new ATOM 0 HE1 TYR A 71 97.302 -15.711 14.400 1.00 0.00 H new ATOM 0 HE2 TYR A 71 97.215 -16.684 10.217 1.00 0.00 H new ATOM 0 HH TYR A 71 95.999 -17.758 11.748 1.00 0.00 H new ATOM 1041 N ARG A 72 101.427 -15.937 10.955 1.00 0.00 N ATOM 1042 CA ARG A 72 102.019 -17.076 10.260 1.00 0.00 C ATOM 1043 C ARG A 72 101.238 -17.482 9.016 1.00 0.00 C ATOM 1044 O ARG A 72 100.009 -17.561 9.015 1.00 0.00 O ATOM 1045 CB ARG A 72 102.111 -18.294 11.184 1.00 0.00 C ATOM 1046 CG ARG A 72 103.217 -18.095 12.220 1.00 0.00 C ATOM 1047 CD ARG A 72 103.388 -19.398 13.006 1.00 0.00 C ATOM 1048 NE ARG A 72 104.378 -19.238 14.075 1.00 0.00 N ATOM 1049 CZ ARG A 72 105.138 -20.251 14.531 1.00 0.00 C ATOM 1050 NH1 ARG A 72 105.013 -21.478 14.085 1.00 0.00 N ATOM 1051 NH2 ARG A 72 106.027 -20.008 15.454 1.00 0.00 N ATOM 0 H ARG A 72 100.683 -16.179 11.609 1.00 0.00 H new ATOM 0 HA ARG A 72 103.013 -16.750 9.955 1.00 0.00 H new ATOM 0 HB2 ARG A 72 101.157 -18.450 11.687 1.00 0.00 H new ATOM 0 HB3 ARG A 72 102.311 -19.190 10.596 1.00 0.00 H new ATOM 0 HG2 ARG A 72 104.151 -17.824 11.729 1.00 0.00 H new ATOM 0 HG3 ARG A 72 102.962 -17.277 12.894 1.00 0.00 H new ATOM 0 HD2 ARG A 72 102.431 -19.698 13.433 1.00 0.00 H new ATOM 0 HD3 ARG A 72 103.700 -20.196 12.332 1.00 0.00 H new ATOM 0 HE ARG A 72 104.497 -18.315 14.493 1.00 0.00 H new ATOM 0 HH11 ARG A 72 104.321 -21.692 13.367 1.00 0.00 H new ATOM 0 HH12 ARG A 72 105.608 -22.219 14.456 1.00 0.00 H new ATOM 0 HH21 ARG A 72 106.138 -19.062 15.819 1.00 0.00 H new ATOM 0 HH22 ARG A 72 106.611 -20.764 15.811 1.00 0.00 H new ATOM 1065 N ILE A 73 102.001 -17.734 7.956 1.00 0.00 N ATOM 1066 CA ILE A 73 101.458 -18.000 6.632 1.00 0.00 C ATOM 1067 C ILE A 73 100.836 -19.395 6.536 1.00 0.00 C ATOM 1068 O ILE A 73 101.444 -20.389 6.932 1.00 0.00 O ATOM 1069 CB ILE A 73 102.602 -17.866 5.614 1.00 0.00 C ATOM 1070 CG1 ILE A 73 102.056 -18.030 4.193 1.00 0.00 C ATOM 1071 CG2 ILE A 73 103.687 -18.918 5.884 1.00 0.00 C ATOM 1072 CD1 ILE A 73 103.164 -17.765 3.171 1.00 0.00 C ATOM 0 H ILE A 73 103.020 -17.759 7.994 1.00 0.00 H new ATOM 0 HA ILE A 73 100.663 -17.283 6.426 1.00 0.00 H new ATOM 0 HB ILE A 73 103.046 -16.876 5.715 1.00 0.00 H new ATOM 0 HG12 ILE A 73 101.661 -19.037 4.061 1.00 0.00 H new ATOM 0 HG13 ILE A 73 101.228 -17.340 4.031 1.00 0.00 H new ATOM 0 HG21 ILE A 73 104.489 -18.809 5.154 1.00 0.00 H new ATOM 0 HG22 ILE A 73 104.088 -18.778 6.888 1.00 0.00 H new ATOM 0 HG23 ILE A 73 103.255 -19.915 5.802 1.00 0.00 H new ATOM 0 HD11 ILE A 73 102.766 -17.884 2.163 1.00 0.00 H new ATOM 0 HD12 ILE A 73 103.538 -16.749 3.295 1.00 0.00 H new ATOM 0 HD13 ILE A 73 103.978 -18.473 3.325 1.00 0.00 H new ATOM 1084 N ASN A 74 99.618 -19.450 6.008 1.00 0.00 N ATOM 1085 CA ASN A 74 98.983 -20.725 5.693 1.00 0.00 C ATOM 1086 C ASN A 74 99.233 -21.068 4.227 1.00 0.00 C ATOM 1087 O ASN A 74 99.928 -22.033 3.912 1.00 0.00 O ATOM 1088 CB ASN A 74 97.479 -20.644 5.958 1.00 0.00 C ATOM 1089 CG ASN A 74 97.223 -20.237 7.403 1.00 0.00 C ATOM 1090 OD1 ASN A 74 96.405 -19.353 7.666 1.00 0.00 O ATOM 1091 ND2 ASN A 74 97.875 -20.832 8.364 1.00 0.00 N ATOM 0 H ASN A 74 99.052 -18.630 5.790 1.00 0.00 H new ATOM 0 HA ASN A 74 99.409 -21.503 6.326 1.00 0.00 H new ATOM 0 HB2 ASN A 74 97.021 -19.922 5.282 1.00 0.00 H new ATOM 0 HB3 ASN A 74 97.014 -21.609 5.756 1.00 0.00 H new ATOM 0 HD21 ASN A 74 97.708 -20.566 9.334 1.00 0.00 H new ATOM 0 HD22 ASN A 74 98.551 -21.563 8.145 1.00 0.00 H new ATOM 1098 N ASP A 75 98.654 -20.265 3.340 1.00 0.00 N ATOM 1099 CA ASP A 75 98.867 -20.424 1.906 1.00 0.00 C ATOM 1100 C ASP A 75 98.847 -19.057 1.229 1.00 0.00 C ATOM 1101 O ASP A 75 97.786 -18.553 0.860 1.00 0.00 O ATOM 1102 CB ASP A 75 97.770 -21.309 1.308 1.00 0.00 C ATOM 1103 CG ASP A 75 98.072 -21.595 -0.159 1.00 0.00 C ATOM 1104 OD1 ASP A 75 98.739 -22.581 -0.425 1.00 0.00 O ATOM 1105 OD2 ASP A 75 97.630 -20.825 -0.996 1.00 0.00 O ATOM 0 H ASP A 75 98.032 -19.496 3.590 1.00 0.00 H new ATOM 0 HA ASP A 75 99.835 -20.896 1.741 1.00 0.00 H new ATOM 0 HB2 ASP A 75 97.703 -22.245 1.863 1.00 0.00 H new ATOM 0 HB3 ASP A 75 96.803 -20.815 1.399 1.00 0.00 H new ATOM 1110 N TRP A 76 100.026 -18.458 1.064 1.00 0.00 N ATOM 1111 CA TRP A 76 100.121 -17.092 0.543 1.00 0.00 C ATOM 1112 C TRP A 76 99.235 -16.130 1.342 1.00 0.00 C ATOM 1113 O TRP A 76 98.660 -15.192 0.791 1.00 0.00 O ATOM 1114 CB TRP A 76 99.708 -17.071 -0.931 1.00 0.00 C ATOM 1115 CG TRP A 76 100.411 -16.023 -1.733 1.00 0.00 C ATOM 1116 CD1 TRP A 76 100.533 -14.722 -1.378 1.00 0.00 C ATOM 1117 CD2 TRP A 76 101.087 -16.162 -3.016 1.00 0.00 C ATOM 1118 NE1 TRP A 76 101.241 -14.056 -2.360 1.00 0.00 N ATOM 1119 CE2 TRP A 76 101.605 -14.898 -3.392 1.00 0.00 C ATOM 1120 CE3 TRP A 76 101.300 -17.248 -3.883 1.00 0.00 C ATOM 1121 CZ2 TRP A 76 102.309 -14.721 -4.585 1.00 0.00 C ATOM 1122 CZ3 TRP A 76 102.006 -17.075 -5.082 1.00 0.00 C ATOM 1123 CH2 TRP A 76 102.510 -15.814 -5.434 1.00 0.00 C ATOM 0 H TRP A 76 100.923 -18.892 1.281 1.00 0.00 H new ATOM 0 HA TRP A 76 101.155 -16.762 0.640 1.00 0.00 H new ATOM 0 HB2 TRP A 76 99.908 -18.048 -1.370 1.00 0.00 H new ATOM 0 HB3 TRP A 76 98.632 -16.907 -0.996 1.00 0.00 H new ATOM 0 HD1 TRP A 76 100.141 -14.278 -0.475 1.00 0.00 H new ATOM 0 HE1 TRP A 76 101.467 -13.062 -2.327 1.00 0.00 H new ATOM 0 HE3 TRP A 76 100.917 -18.224 -3.623 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 102.695 -13.748 -4.850 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 102.163 -17.918 -5.739 1.00 0.00 H new ATOM 0 HH2 TRP A 76 103.052 -15.687 -6.359 1.00 0.00 H new ATOM 1134 N ALA A 77 99.127 -16.378 2.646 1.00 0.00 N ATOM 1135 CA ALA A 77 98.261 -15.598 3.524 1.00 0.00 C ATOM 1136 C ALA A 77 99.030 -14.948 4.678 1.00 0.00 C ATOM 1137 O ALA A 77 98.425 -14.634 5.704 1.00 0.00 O ATOM 1138 CB ALA A 77 97.164 -16.500 4.096 1.00 0.00 C ATOM 0 H ALA A 77 99.636 -17.123 3.121 1.00 0.00 H new ATOM 0 HA ALA A 77 97.828 -14.798 2.923 1.00 0.00 H new ATOM 0 HB1 ALA A 77 96.518 -15.916 4.752 1.00 0.00 H new ATOM 0 HB2 ALA A 77 96.573 -16.916 3.280 1.00 0.00 H new ATOM 0 HB3 ALA A 77 97.619 -17.311 4.664 1.00 0.00 H new ATOM 1144 N SER A 78 100.342 -14.752 4.532 1.00 0.00 N ATOM 1145 CA SER A 78 101.144 -14.229 5.636 1.00 0.00 C ATOM 1146 C SER A 78 100.753 -12.780 5.887 1.00 0.00 C ATOM 1147 O SER A 78 100.403 -12.067 4.946 1.00 0.00 O ATOM 1148 CB SER A 78 102.631 -14.313 5.283 1.00 0.00 C ATOM 1149 OG SER A 78 103.380 -14.540 6.469 1.00 0.00 O ATOM 0 H SER A 78 100.863 -14.944 3.676 1.00 0.00 H new ATOM 0 HA SER A 78 100.963 -14.819 6.534 1.00 0.00 H new ATOM 0 HB2 SER A 78 102.803 -15.119 4.570 1.00 0.00 H new ATOM 0 HB3 SER A 78 102.956 -13.389 4.804 1.00 0.00 H new ATOM 0 HG SER A 78 103.909 -13.743 6.679 1.00 0.00 H new ATOM 1155 N ILE A 79 100.798 -12.340 7.147 1.00 0.00 N ATOM 1156 CA ILE A 79 100.335 -10.989 7.473 1.00 0.00 C ATOM 1157 C ILE A 79 101.348 -10.275 8.355 1.00 0.00 C ATOM 1158 O ILE A 79 101.805 -10.819 9.356 1.00 0.00 O ATOM 1159 CB ILE A 79 98.975 -11.044 8.184 1.00 0.00 C ATOM 1160 CG1 ILE A 79 97.969 -11.807 7.317 1.00 0.00 C ATOM 1161 CG2 ILE A 79 98.446 -9.625 8.418 1.00 0.00 C ATOM 1162 CD1 ILE A 79 96.670 -12.020 8.097 1.00 0.00 C ATOM 0 H ILE A 79 101.141 -12.883 7.940 1.00 0.00 H new ATOM 0 HA ILE A 79 100.226 -10.434 6.541 1.00 0.00 H new ATOM 0 HB ILE A 79 99.102 -11.550 9.141 1.00 0.00 H new ATOM 0 HG12 ILE A 79 97.767 -11.250 6.402 1.00 0.00 H new ATOM 0 HG13 ILE A 79 98.387 -12.769 7.019 1.00 0.00 H new ATOM 0 HG21 ILE A 79 97.481 -9.675 8.923 1.00 0.00 H new ATOM 0 HG22 ILE A 79 99.151 -9.071 9.038 1.00 0.00 H new ATOM 0 HG23 ILE A 79 98.329 -9.118 7.460 1.00 0.00 H new ATOM 0 HD11 ILE A 79 95.958 -12.563 7.476 1.00 0.00 H new ATOM 0 HD12 ILE A 79 96.878 -12.595 8.999 1.00 0.00 H new ATOM 0 HD13 ILE A 79 96.248 -11.053 8.372 1.00 0.00 H new ATOM 1174 N TYR A 80 101.709 -9.060 7.963 1.00 0.00 N ATOM 1175 CA TYR A 80 102.505 -8.196 8.824 1.00 0.00 C ATOM 1176 C TYR A 80 101.876 -6.811 8.865 1.00 0.00 C ATOM 1177 O TYR A 80 101.517 -6.266 7.824 1.00 0.00 O ATOM 1178 CB TYR A 80 103.930 -8.093 8.279 1.00 0.00 C ATOM 1179 CG TYR A 80 104.608 -9.432 8.106 1.00 0.00 C ATOM 1180 CD1 TYR A 80 105.317 -10.002 9.169 1.00 0.00 C ATOM 1181 CD2 TYR A 80 104.524 -10.104 6.882 1.00 0.00 C ATOM 1182 CE1 TYR A 80 105.943 -11.243 9.008 1.00 0.00 C ATOM 1183 CE2 TYR A 80 105.149 -11.347 6.720 1.00 0.00 C ATOM 1184 CZ TYR A 80 105.859 -11.917 7.785 1.00 0.00 C ATOM 1185 OH TYR A 80 106.474 -13.140 7.626 1.00 0.00 O ATOM 0 H TYR A 80 101.465 -8.653 7.060 1.00 0.00 H new ATOM 0 HA TYR A 80 102.536 -8.616 9.829 1.00 0.00 H new ATOM 0 HB2 TYR A 80 103.906 -7.580 7.318 1.00 0.00 H new ATOM 0 HB3 TYR A 80 104.525 -7.478 8.954 1.00 0.00 H new ATOM 0 HD1 TYR A 80 105.381 -9.484 10.114 1.00 0.00 H new ATOM 0 HD2 TYR A 80 103.977 -9.664 6.061 1.00 0.00 H new ATOM 0 HE1 TYR A 80 106.492 -11.681 9.829 1.00 0.00 H new ATOM 0 HE2 TYR A 80 105.084 -11.866 5.775 1.00 0.00 H new ATOM 0 HH TYR A 80 106.526 -13.358 6.672 1.00 0.00 H new ATOM 1195 N GLY A 81 101.747 -6.244 10.063 1.00 0.00 N ATOM 1196 CA GLY A 81 101.281 -4.861 10.190 1.00 0.00 C ATOM 1197 C GLY A 81 102.290 -4.050 10.989 1.00 0.00 C ATOM 1198 O GLY A 81 102.775 -4.518 12.013 1.00 0.00 O ATOM 0 H GLY A 81 101.954 -6.710 10.947 1.00 0.00 H new ATOM 0 HA2 GLY A 81 101.147 -4.420 9.202 1.00 0.00 H new ATOM 0 HA3 GLY A 81 100.310 -4.839 10.684 1.00 0.00 H new ATOM 1202 N VAL A 82 102.575 -2.823 10.554 1.00 0.00 N ATOM 1203 CA VAL A 82 103.648 -2.047 11.175 1.00 0.00 C ATOM 1204 C VAL A 82 103.276 -0.580 11.351 1.00 0.00 C ATOM 1205 O VAL A 82 102.501 -0.025 10.573 1.00 0.00 O ATOM 1206 CB VAL A 82 104.910 -2.149 10.316 1.00 0.00 C ATOM 1207 CG1 VAL A 82 105.348 -3.609 10.219 1.00 0.00 C ATOM 1208 CG2 VAL A 82 104.624 -1.616 8.909 1.00 0.00 C ATOM 0 H VAL A 82 102.090 -2.352 9.790 1.00 0.00 H new ATOM 0 HA VAL A 82 103.822 -2.464 12.167 1.00 0.00 H new ATOM 0 HB VAL A 82 105.702 -1.558 10.776 1.00 0.00 H new ATOM 0 HG11 VAL A 82 106.247 -3.679 9.607 1.00 0.00 H new ATOM 0 HG12 VAL A 82 105.558 -3.993 11.217 1.00 0.00 H new ATOM 0 HG13 VAL A 82 104.552 -4.198 9.764 1.00 0.00 H new ATOM 0 HG21 VAL A 82 105.526 -1.691 8.301 1.00 0.00 H new ATOM 0 HG22 VAL A 82 103.828 -2.204 8.452 1.00 0.00 H new ATOM 0 HG23 VAL A 82 104.314 -0.573 8.971 1.00 0.00 H new ATOM 1218 N VAL A 83 103.866 0.035 12.372 1.00 0.00 N ATOM 1219 CA VAL A 83 103.764 1.475 12.572 1.00 0.00 C ATOM 1220 C VAL A 83 105.153 2.011 12.903 1.00 0.00 C ATOM 1221 O VAL A 83 105.913 1.342 13.603 1.00 0.00 O ATOM 1222 CB VAL A 83 102.790 1.793 13.711 1.00 0.00 C ATOM 1223 CG1 VAL A 83 101.390 1.309 13.332 1.00 0.00 C ATOM 1224 CG2 VAL A 83 103.241 1.086 14.992 1.00 0.00 C ATOM 0 H VAL A 83 104.423 -0.447 13.078 1.00 0.00 H new ATOM 0 HA VAL A 83 103.384 1.947 11.666 1.00 0.00 H new ATOM 0 HB VAL A 83 102.774 2.870 13.880 1.00 0.00 H new ATOM 0 HG11 VAL A 83 100.696 1.534 14.141 1.00 0.00 H new ATOM 0 HG12 VAL A 83 101.064 1.814 12.423 1.00 0.00 H new ATOM 0 HG13 VAL A 83 101.411 0.233 13.161 1.00 0.00 H new ATOM 0 HG21 VAL A 83 102.545 1.316 15.799 1.00 0.00 H new ATOM 0 HG22 VAL A 83 103.261 0.009 14.825 1.00 0.00 H new ATOM 0 HG23 VAL A 83 104.239 1.429 15.265 1.00 0.00 H new ATOM 1234 N GLY A 84 105.498 3.184 12.378 1.00 0.00 N ATOM 1235 CA GLY A 84 106.847 3.705 12.554 1.00 0.00 C ATOM 1236 C GLY A 84 106.848 5.222 12.636 1.00 0.00 C ATOM 1237 O GLY A 84 105.825 5.869 12.427 1.00 0.00 O ATOM 0 H GLY A 84 104.873 3.781 11.837 1.00 0.00 H new ATOM 0 HA2 GLY A 84 107.284 3.290 13.462 1.00 0.00 H new ATOM 0 HA3 GLY A 84 107.474 3.383 11.723 1.00 0.00 H new ATOM 1241 N VAL A 85 108.023 5.777 12.897 1.00 0.00 N ATOM 1242 CA VAL A 85 108.183 7.224 12.952 1.00 0.00 C ATOM 1243 C VAL A 85 109.053 7.666 11.786 1.00 0.00 C ATOM 1244 O VAL A 85 110.067 7.028 11.498 1.00 0.00 O ATOM 1245 CB VAL A 85 108.835 7.632 14.278 1.00 0.00 C ATOM 1246 CG1 VAL A 85 107.919 7.230 15.438 1.00 0.00 C ATOM 1247 CG2 VAL A 85 110.184 6.926 14.436 1.00 0.00 C ATOM 0 H VAL A 85 108.878 5.249 13.074 1.00 0.00 H new ATOM 0 HA VAL A 85 107.207 7.704 12.886 1.00 0.00 H new ATOM 0 HB VAL A 85 108.990 8.711 14.283 1.00 0.00 H new ATOM 0 HG11 VAL A 85 108.380 7.519 16.383 1.00 0.00 H new ATOM 0 HG12 VAL A 85 106.958 7.734 15.334 1.00 0.00 H new ATOM 0 HG13 VAL A 85 107.766 6.151 15.424 1.00 0.00 H new ATOM 0 HG21 VAL A 85 110.641 7.221 15.381 1.00 0.00 H new ATOM 0 HG22 VAL A 85 110.033 5.847 14.428 1.00 0.00 H new ATOM 0 HG23 VAL A 85 110.840 7.207 13.612 1.00 0.00 H new ATOM 1257 N GLY A 86 108.639 8.726 11.095 1.00 0.00 N ATOM 1258 CA GLY A 86 109.412 9.233 9.961 1.00 0.00 C ATOM 1259 C GLY A 86 109.917 10.646 10.228 1.00 0.00 C ATOM 1260 O GLY A 86 109.169 11.500 10.699 1.00 0.00 O ATOM 0 H GLY A 86 107.784 9.245 11.296 1.00 0.00 H new ATOM 0 HA2 GLY A 86 110.257 8.572 9.769 1.00 0.00 H new ATOM 0 HA3 GLY A 86 108.793 9.228 9.064 1.00 0.00 H new ATOM 1264 N TYR A 87 111.196 10.870 9.931 1.00 0.00 N ATOM 1265 CA TYR A 87 111.816 12.176 10.132 1.00 0.00 C ATOM 1266 C TYR A 87 112.380 12.694 8.814 1.00 0.00 C ATOM 1267 O TYR A 87 113.045 11.956 8.088 1.00 0.00 O ATOM 1268 CB TYR A 87 112.955 12.060 11.147 1.00 0.00 C ATOM 1269 CG TYR A 87 112.513 11.610 12.518 1.00 0.00 C ATOM 1270 CD1 TYR A 87 112.138 12.557 13.477 1.00 0.00 C ATOM 1271 CD2 TYR A 87 112.483 10.247 12.832 1.00 0.00 C ATOM 1272 CE1 TYR A 87 111.734 12.141 14.751 1.00 0.00 C ATOM 1273 CE2 TYR A 87 112.077 9.830 14.106 1.00 0.00 C ATOM 1274 CZ TYR A 87 111.703 10.776 15.066 1.00 0.00 C ATOM 1275 OH TYR A 87 111.305 10.366 16.322 1.00 0.00 O ATOM 0 H TYR A 87 111.823 10.162 9.550 1.00 0.00 H new ATOM 0 HA TYR A 87 111.060 12.868 10.504 1.00 0.00 H new ATOM 0 HB2 TYR A 87 113.696 11.357 10.767 1.00 0.00 H new ATOM 0 HB3 TYR A 87 113.449 13.028 11.235 1.00 0.00 H new ATOM 0 HD1 TYR A 87 112.160 13.609 13.234 1.00 0.00 H new ATOM 0 HD2 TYR A 87 112.773 9.516 12.092 1.00 0.00 H new ATOM 0 HE1 TYR A 87 111.446 12.872 15.492 1.00 0.00 H new ATOM 0 HE2 TYR A 87 112.053 8.778 14.347 1.00 0.00 H new ATOM 0 HH TYR A 87 111.340 9.388 16.373 1.00 0.00 H new ATOM 1285 N GLY A 88 112.103 13.958 8.506 1.00 0.00 N ATOM 1286 CA GLY A 88 112.656 14.589 7.311 1.00 0.00 C ATOM 1287 C GLY A 88 113.679 15.656 7.691 1.00 0.00 C ATOM 1288 O GLY A 88 113.473 16.407 8.643 1.00 0.00 O ATOM 0 H GLY A 88 111.502 14.564 9.065 1.00 0.00 H new ATOM 0 HA2 GLY A 88 113.126 13.835 6.680 1.00 0.00 H new ATOM 0 HA3 GLY A 88 111.854 15.039 6.726 1.00 0.00 H new ATOM 1292 N LYS A 89 114.785 15.717 6.951 1.00 0.00 N ATOM 1293 CA LYS A 89 115.829 16.700 7.230 1.00 0.00 C ATOM 1294 C LYS A 89 116.191 17.463 5.962 1.00 0.00 C ATOM 1295 O LYS A 89 116.355 16.865 4.898 1.00 0.00 O ATOM 1296 CB LYS A 89 117.074 15.995 7.773 1.00 0.00 C ATOM 1297 CG LYS A 89 116.716 15.229 9.047 1.00 0.00 C ATOM 1298 CD LYS A 89 117.993 14.735 9.732 1.00 0.00 C ATOM 1299 CE LYS A 89 118.702 13.717 8.835 1.00 0.00 C ATOM 1300 NZ LYS A 89 119.909 13.195 9.537 1.00 0.00 N ATOM 0 H LYS A 89 114.980 15.103 6.160 1.00 0.00 H new ATOM 0 HA LYS A 89 115.455 17.404 7.973 1.00 0.00 H new ATOM 0 HB2 LYS A 89 117.472 15.310 7.024 1.00 0.00 H new ATOM 0 HB3 LYS A 89 117.855 16.726 7.983 1.00 0.00 H new ATOM 0 HG2 LYS A 89 116.155 15.873 9.724 1.00 0.00 H new ATOM 0 HG3 LYS A 89 116.072 14.384 8.805 1.00 0.00 H new ATOM 0 HD2 LYS A 89 118.655 15.576 9.937 1.00 0.00 H new ATOM 0 HD3 LYS A 89 117.749 14.280 10.692 1.00 0.00 H new ATOM 0 HE2 LYS A 89 118.026 12.897 8.592 1.00 0.00 H new ATOM 0 HE3 LYS A 89 118.989 14.184 7.893 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 120.392 12.503 8.929 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 120.556 13.982 9.748 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 119.623 12.735 10.425 1.00 0.00 H new ATOM 1314 N PHE A 90 116.315 18.783 6.082 1.00 0.00 N ATOM 1315 CA PHE A 90 116.668 19.625 4.944 1.00 0.00 C ATOM 1316 C PHE A 90 118.106 20.120 5.068 1.00 0.00 C ATOM 1317 O PHE A 90 118.506 20.631 6.115 1.00 0.00 O ATOM 1318 CB PHE A 90 115.720 20.823 4.872 1.00 0.00 C ATOM 1319 CG PHE A 90 115.938 21.692 3.656 1.00 0.00 C ATOM 1320 CD1 PHE A 90 116.839 22.763 3.714 1.00 0.00 C ATOM 1321 CD2 PHE A 90 115.240 21.428 2.472 1.00 0.00 C ATOM 1322 CE1 PHE A 90 117.040 23.570 2.588 1.00 0.00 C ATOM 1323 CE2 PHE A 90 115.441 22.235 1.345 1.00 0.00 C ATOM 1324 CZ PHE A 90 116.342 23.305 1.404 1.00 0.00 C ATOM 0 H PHE A 90 116.176 19.291 6.955 1.00 0.00 H new ATOM 0 HA PHE A 90 116.578 19.032 4.034 1.00 0.00 H new ATOM 0 HB2 PHE A 90 114.691 20.463 4.871 1.00 0.00 H new ATOM 0 HB3 PHE A 90 115.845 21.429 5.769 1.00 0.00 H new ATOM 0 HD1 PHE A 90 117.378 22.966 4.627 1.00 0.00 H new ATOM 0 HD2 PHE A 90 114.546 20.602 2.427 1.00 0.00 H new ATOM 0 HE1 PHE A 90 117.733 24.397 2.633 1.00 0.00 H new ATOM 0 HE2 PHE A 90 114.902 22.032 0.432 1.00 0.00 H new ATOM 0 HZ PHE A 90 116.499 23.927 0.535 1.00 0.00 H new ATOM 1334 N GLN A 91 118.875 19.965 3.997 1.00 0.00 N ATOM 1335 CA GLN A 91 120.266 20.410 3.988 1.00 0.00 C ATOM 1336 C GLN A 91 120.412 21.682 3.157 1.00 0.00 C ATOM 1337 O GLN A 91 119.970 21.738 2.010 1.00 0.00 O ATOM 1338 CB GLN A 91 121.161 19.313 3.407 1.00 0.00 C ATOM 1339 CG GLN A 91 122.629 19.725 3.536 1.00 0.00 C ATOM 1340 CD GLN A 91 123.518 18.723 2.808 1.00 0.00 C ATOM 1341 OE1 GLN A 91 123.346 18.499 1.609 1.00 0.00 O ATOM 1342 NE2 GLN A 91 124.461 18.104 3.463 1.00 0.00 N ATOM 0 H GLN A 91 118.562 19.536 3.126 1.00 0.00 H new ATOM 0 HA GLN A 91 120.570 20.620 5.013 1.00 0.00 H new ATOM 0 HB2 GLN A 91 120.989 18.374 3.932 1.00 0.00 H new ATOM 0 HB3 GLN A 91 120.911 19.143 2.360 1.00 0.00 H new ATOM 0 HG2 GLN A 91 122.773 20.722 3.119 1.00 0.00 H new ATOM 0 HG3 GLN A 91 122.910 19.776 4.588 1.00 0.00 H new ATOM 0 HE21 GLN A 91 124.600 18.292 4.456 1.00 0.00 H new ATOM 0 HE22 GLN A 91 125.059 17.432 2.982 1.00 0.00 H new ATOM 1351 N THR A 92 121.037 22.699 3.743 1.00 0.00 N ATOM 1352 CA THR A 92 121.240 23.961 3.039 1.00 0.00 C ATOM 1353 C THR A 92 122.469 23.879 2.141 1.00 0.00 C ATOM 1354 O THR A 92 123.358 23.058 2.363 1.00 0.00 O ATOM 1355 CB THR A 92 121.415 25.105 4.040 1.00 0.00 C ATOM 1356 OG1 THR A 92 122.591 24.887 4.805 1.00 0.00 O ATOM 1357 CG2 THR A 92 120.201 25.174 4.970 1.00 0.00 C ATOM 0 H THR A 92 121.408 22.675 4.693 1.00 0.00 H new ATOM 0 HA THR A 92 120.361 24.153 2.423 1.00 0.00 H new ATOM 0 HB THR A 92 121.502 26.047 3.498 1.00 0.00 H new ATOM 0 HG1 THR A 92 123.238 25.600 4.621 1.00 0.00 H new ATOM 0 HG21 THR A 92 120.332 25.991 5.680 1.00 0.00 H new ATOM 0 HG22 THR A 92 119.301 25.347 4.381 1.00 0.00 H new ATOM 0 HG23 THR A 92 120.104 24.234 5.513 1.00 0.00 H new ATOM 1365 N THR A 93 122.513 24.737 1.125 1.00 0.00 N ATOM 1366 CA THR A 93 123.636 24.745 0.196 1.00 0.00 C ATOM 1367 C THR A 93 124.913 25.237 0.878 1.00 0.00 C ATOM 1368 O THR A 93 126.003 24.739 0.598 1.00 0.00 O ATOM 1369 CB THR A 93 123.321 25.646 -0.999 1.00 0.00 C ATOM 1370 OG1 THR A 93 123.129 26.979 -0.550 1.00 0.00 O ATOM 1371 CG2 THR A 93 122.051 25.152 -1.698 1.00 0.00 C ATOM 0 H THR A 93 121.791 25.429 0.926 1.00 0.00 H new ATOM 0 HA THR A 93 123.796 23.722 -0.145 1.00 0.00 H new ATOM 0 HB THR A 93 124.153 25.616 -1.702 1.00 0.00 H new ATOM 0 HG1 THR A 93 122.929 27.557 -1.316 1.00 0.00 H new ATOM 0 HG21 THR A 93 121.830 25.796 -2.549 1.00 0.00 H new ATOM 0 HG22 THR A 93 122.201 24.130 -2.046 1.00 0.00 H new ATOM 0 HG23 THR A 93 121.217 25.177 -0.997 1.00 0.00 H new ATOM 1379 N GLU A 94 124.774 26.216 1.770 1.00 0.00 N ATOM 1380 CA GLU A 94 125.926 26.779 2.469 1.00 0.00 C ATOM 1381 C GLU A 94 125.833 26.509 3.968 1.00 0.00 C ATOM 1382 O GLU A 94 124.803 26.759 4.592 1.00 0.00 O ATOM 1383 CB GLU A 94 125.988 28.288 2.225 1.00 0.00 C ATOM 1384 CG GLU A 94 127.273 28.860 2.834 1.00 0.00 C ATOM 1385 CD GLU A 94 128.503 28.396 2.055 1.00 0.00 C ATOM 1386 OE1 GLU A 94 128.372 28.092 0.880 1.00 0.00 O ATOM 1387 OE2 GLU A 94 129.567 28.350 2.651 1.00 0.00 O ATOM 0 H GLU A 94 123.879 26.634 2.025 1.00 0.00 H new ATOM 0 HA GLU A 94 126.830 26.306 2.085 1.00 0.00 H new ATOM 0 HB2 GLU A 94 125.959 28.494 1.155 1.00 0.00 H new ATOM 0 HB3 GLU A 94 125.118 28.773 2.667 1.00 0.00 H new ATOM 0 HG2 GLU A 94 127.227 29.949 2.832 1.00 0.00 H new ATOM 0 HG3 GLU A 94 127.357 28.546 3.874 1.00 0.00 H new ATOM 1394 N TYR A 95 126.922 25.996 4.538 1.00 0.00 N ATOM 1395 CA TYR A 95 126.993 25.746 5.975 1.00 0.00 C ATOM 1396 C TYR A 95 125.783 24.932 6.466 1.00 0.00 C ATOM 1397 O TYR A 95 124.929 25.457 7.186 1.00 0.00 O ATOM 1398 CB TYR A 95 127.090 27.078 6.725 1.00 0.00 C ATOM 1399 CG TYR A 95 128.501 27.607 6.827 1.00 0.00 C ATOM 1400 CD1 TYR A 95 129.259 27.803 5.665 1.00 0.00 C ATOM 1401 CD2 TYR A 95 129.051 27.901 8.079 1.00 0.00 C ATOM 1402 CE1 TYR A 95 130.568 28.293 5.758 1.00 0.00 C ATOM 1403 CE2 TYR A 95 130.359 28.390 8.172 1.00 0.00 C ATOM 1404 CZ TYR A 95 131.118 28.587 7.011 1.00 0.00 C ATOM 1405 OH TYR A 95 132.408 29.068 7.102 1.00 0.00 O ATOM 0 H TYR A 95 127.768 25.745 4.025 1.00 0.00 H new ATOM 0 HA TYR A 95 127.885 25.154 6.178 1.00 0.00 H new ATOM 0 HB2 TYR A 95 126.468 27.817 6.220 1.00 0.00 H new ATOM 0 HB3 TYR A 95 126.684 26.952 7.729 1.00 0.00 H new ATOM 0 HD1 TYR A 95 128.834 27.576 4.698 1.00 0.00 H new ATOM 0 HD2 TYR A 95 128.466 27.751 8.974 1.00 0.00 H new ATOM 0 HE1 TYR A 95 131.153 28.444 4.863 1.00 0.00 H new ATOM 0 HE2 TYR A 95 130.783 28.616 9.139 1.00 0.00 H new ATOM 0 HH TYR A 95 132.634 29.221 8.043 1.00 0.00 H new ATOM 1415 N PRO A 96 125.678 23.672 6.089 1.00 0.00 N ATOM 1416 CA PRO A 96 124.557 22.809 6.566 1.00 0.00 C ATOM 1417 C PRO A 96 124.820 22.264 7.965 1.00 0.00 C ATOM 1418 O PRO A 96 125.386 21.183 8.126 1.00 0.00 O ATOM 1419 CB PRO A 96 124.509 21.678 5.538 1.00 0.00 C ATOM 1420 CG PRO A 96 125.907 21.542 5.040 1.00 0.00 C ATOM 1421 CD PRO A 96 126.570 22.914 5.186 1.00 0.00 C ATOM 0 HA PRO A 96 123.617 23.356 6.644 1.00 0.00 H new ATOM 0 HB2 PRO A 96 124.160 20.750 5.990 1.00 0.00 H new ATOM 0 HB3 PRO A 96 123.823 21.914 4.725 1.00 0.00 H new ATOM 0 HG2 PRO A 96 126.449 20.789 5.613 1.00 0.00 H new ATOM 0 HG3 PRO A 96 125.916 21.218 3.999 1.00 0.00 H new ATOM 0 HD2 PRO A 96 127.573 22.826 5.604 1.00 0.00 H new ATOM 0 HD3 PRO A 96 126.669 23.410 4.220 1.00 0.00 H new ATOM 1429 N THR A 97 124.405 23.021 8.980 1.00 0.00 N ATOM 1430 CA THR A 97 124.645 22.637 10.369 1.00 0.00 C ATOM 1431 C THR A 97 123.336 22.531 11.141 1.00 0.00 C ATOM 1432 O THR A 97 122.293 23.007 10.689 1.00 0.00 O ATOM 1433 CB THR A 97 125.550 23.670 11.048 1.00 0.00 C ATOM 1434 OG1 THR A 97 124.886 24.926 11.085 1.00 0.00 O ATOM 1435 CG2 THR A 97 126.863 23.803 10.274 1.00 0.00 C ATOM 0 H THR A 97 123.902 23.901 8.866 1.00 0.00 H new ATOM 0 HA THR A 97 125.132 21.662 10.370 1.00 0.00 H new ATOM 0 HB THR A 97 125.770 23.344 12.064 1.00 0.00 H new ATOM 0 HG1 THR A 97 125.462 25.588 11.521 1.00 0.00 H new ATOM 0 HG21 THR A 97 127.501 24.539 10.763 1.00 0.00 H new ATOM 0 HG22 THR A 97 127.372 22.839 10.252 1.00 0.00 H new ATOM 0 HG23 THR A 97 126.653 24.125 9.254 1.00 0.00 H new ATOM 1443 N TYR A 98 123.403 21.903 12.310 1.00 0.00 N ATOM 1444 CA TYR A 98 122.228 21.737 13.160 1.00 0.00 C ATOM 1445 C TYR A 98 121.599 23.085 13.512 1.00 0.00 C ATOM 1446 O TYR A 98 120.378 23.193 13.626 1.00 0.00 O ATOM 1447 CB TYR A 98 122.620 21.008 14.448 1.00 0.00 C ATOM 1448 CG TYR A 98 121.447 20.723 15.356 1.00 0.00 C ATOM 1449 CD1 TYR A 98 121.074 21.657 16.329 1.00 0.00 C ATOM 1450 CD2 TYR A 98 120.737 19.524 15.225 1.00 0.00 C ATOM 1451 CE1 TYR A 98 119.986 21.391 17.172 1.00 0.00 C ATOM 1452 CE2 TYR A 98 119.650 19.258 16.068 1.00 0.00 C ATOM 1453 CZ TYR A 98 119.275 20.191 17.041 1.00 0.00 C ATOM 1454 OH TYR A 98 118.205 19.930 17.873 1.00 0.00 O ATOM 0 H TYR A 98 124.259 21.500 12.691 1.00 0.00 H new ATOM 0 HA TYR A 98 121.494 21.150 12.607 1.00 0.00 H new ATOM 0 HB2 TYR A 98 123.108 20.068 14.191 1.00 0.00 H new ATOM 0 HB3 TYR A 98 123.351 21.609 14.989 1.00 0.00 H new ATOM 0 HD1 TYR A 98 121.623 22.581 16.430 1.00 0.00 H new ATOM 0 HD2 TYR A 98 121.027 18.804 14.474 1.00 0.00 H new ATOM 0 HE1 TYR A 98 119.696 22.111 17.923 1.00 0.00 H new ATOM 0 HE2 TYR A 98 119.102 18.333 15.967 1.00 0.00 H new ATOM 0 HH TYR A 98 117.822 19.056 17.649 1.00 0.00 H new ATOM 1464 N LYS A 99 122.431 24.110 13.684 1.00 0.00 N ATOM 1465 CA LYS A 99 121.946 25.426 14.088 1.00 0.00 C ATOM 1466 C LYS A 99 120.843 25.921 13.153 1.00 0.00 C ATOM 1467 O LYS A 99 119.882 26.549 13.596 1.00 0.00 O ATOM 1468 CB LYS A 99 123.105 26.426 14.086 1.00 0.00 C ATOM 1469 CG LYS A 99 122.636 27.767 14.654 1.00 0.00 C ATOM 1470 CD LYS A 99 123.774 28.785 14.569 1.00 0.00 C ATOM 1471 CE LYS A 99 123.360 30.075 15.280 1.00 0.00 C ATOM 1472 NZ LYS A 99 124.257 31.186 14.852 1.00 0.00 N ATOM 0 H LYS A 99 123.441 24.054 13.550 1.00 0.00 H new ATOM 0 HA LYS A 99 121.531 25.341 15.092 1.00 0.00 H new ATOM 0 HB2 LYS A 99 123.932 26.039 14.681 1.00 0.00 H new ATOM 0 HB3 LYS A 99 123.478 26.562 13.071 1.00 0.00 H new ATOM 0 HG2 LYS A 99 121.770 28.127 14.098 1.00 0.00 H new ATOM 0 HG3 LYS A 99 122.321 27.644 15.690 1.00 0.00 H new ATOM 0 HD2 LYS A 99 124.675 28.378 15.027 1.00 0.00 H new ATOM 0 HD3 LYS A 99 124.013 28.993 13.526 1.00 0.00 H new ATOM 0 HE2 LYS A 99 122.324 30.317 15.043 1.00 0.00 H new ATOM 0 HE3 LYS A 99 123.417 29.942 16.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 123.977 32.064 15.334 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 125.240 30.953 15.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 124.181 31.317 13.823 1.00 0.00 H new ATOM 1486 N HIS A 100 120.984 25.634 11.860 1.00 0.00 N ATOM 1487 CA HIS A 100 119.974 26.033 10.881 1.00 0.00 C ATOM 1488 C HIS A 100 119.564 24.840 10.024 1.00 0.00 C ATOM 1489 O HIS A 100 120.368 24.303 9.264 1.00 0.00 O ATOM 1490 CB HIS A 100 120.528 27.141 9.985 1.00 0.00 C ATOM 1491 CG HIS A 100 119.506 27.708 9.037 1.00 0.00 C ATOM 1492 ND1 HIS A 100 118.396 28.410 9.480 1.00 0.00 N ATOM 1493 CD2 HIS A 100 119.412 27.681 7.668 1.00 0.00 C ATOM 1494 CE1 HIS A 100 117.687 28.773 8.396 1.00 0.00 C ATOM 1495 NE2 HIS A 100 118.262 28.353 7.265 1.00 0.00 N ATOM 0 H HIS A 100 121.780 25.131 11.468 1.00 0.00 H new ATOM 0 HA HIS A 100 119.098 26.402 11.415 1.00 0.00 H new ATOM 0 HB2 HIS A 100 120.917 27.944 10.611 1.00 0.00 H new ATOM 0 HB3 HIS A 100 121.367 26.749 9.411 1.00 0.00 H new ATOM 0 HD2 HIS A 100 120.122 27.210 7.005 1.00 0.00 H new ATOM 0 HE1 HIS A 100 116.766 29.335 8.435 1.00 0.00 H new ATOM 0 HE2 HIS A 100 117.929 28.495 6.311 1.00 0.00 H new ATOM 1503 N ASP A 101 118.306 24.432 10.155 1.00 0.00 N ATOM 1504 CA ASP A 101 117.795 23.301 9.389 1.00 0.00 C ATOM 1505 C ASP A 101 116.282 23.177 9.549 1.00 0.00 C ATOM 1506 O ASP A 101 115.676 23.888 10.349 1.00 0.00 O ATOM 1507 CB ASP A 101 118.478 22.008 9.849 1.00 0.00 C ATOM 1508 CG ASP A 101 118.259 21.754 11.345 1.00 0.00 C ATOM 1509 OD1 ASP A 101 117.358 22.345 11.921 1.00 0.00 O ATOM 1510 OD2 ASP A 101 119.005 20.964 11.896 1.00 0.00 O ATOM 0 H ASP A 101 117.626 24.864 10.780 1.00 0.00 H new ATOM 0 HA ASP A 101 118.016 23.470 8.335 1.00 0.00 H new ATOM 0 HB2 ASP A 101 118.088 21.167 9.276 1.00 0.00 H new ATOM 0 HB3 ASP A 101 119.547 22.067 9.642 1.00 0.00 H new ATOM 1515 N THR A 102 115.681 22.268 8.783 1.00 0.00 N ATOM 1516 CA THR A 102 114.241 22.037 8.862 1.00 0.00 C ATOM 1517 C THR A 102 113.962 20.584 9.232 1.00 0.00 C ATOM 1518 O THR A 102 114.590 19.671 8.698 1.00 0.00 O ATOM 1519 CB THR A 102 113.587 22.358 7.516 1.00 0.00 C ATOM 1520 OG1 THR A 102 113.937 23.677 7.126 1.00 0.00 O ATOM 1521 CG2 THR A 102 112.065 22.247 7.644 1.00 0.00 C ATOM 0 H THR A 102 116.167 21.682 8.104 1.00 0.00 H new ATOM 0 HA THR A 102 113.823 22.687 9.630 1.00 0.00 H new ATOM 0 HB THR A 102 113.937 21.651 6.764 1.00 0.00 H new ATOM 0 HG1 THR A 102 113.521 23.884 6.263 1.00 0.00 H new ATOM 0 HG21 THR A 102 111.602 22.476 6.684 1.00 0.00 H new ATOM 0 HG22 THR A 102 111.798 21.233 7.943 1.00 0.00 H new ATOM 0 HG23 THR A 102 111.711 22.952 8.396 1.00 0.00 H new ATOM 1529 N SER A 103 113.018 20.376 10.144 1.00 0.00 N ATOM 1530 CA SER A 103 112.681 19.027 10.588 1.00 0.00 C ATOM 1531 C SER A 103 111.170 18.859 10.720 1.00 0.00 C ATOM 1532 O SER A 103 110.470 19.766 11.167 1.00 0.00 O ATOM 1533 CB SER A 103 113.345 18.742 11.935 1.00 0.00 C ATOM 1534 OG SER A 103 113.107 17.388 12.296 1.00 0.00 O ATOM 0 H SER A 103 112.476 21.118 10.588 1.00 0.00 H new ATOM 0 HA SER A 103 113.046 18.321 9.842 1.00 0.00 H new ATOM 0 HB2 SER A 103 114.417 18.931 11.873 1.00 0.00 H new ATOM 0 HB3 SER A 103 112.947 19.410 12.699 1.00 0.00 H new ATOM 0 HG SER A 103 113.532 17.200 13.159 1.00 0.00 H new ATOM 1540 N ASP A 104 110.677 17.688 10.328 1.00 0.00 N ATOM 1541 CA ASP A 104 109.255 17.389 10.447 1.00 0.00 C ATOM 1542 C ASP A 104 109.048 15.931 10.847 1.00 0.00 C ATOM 1543 O ASP A 104 109.778 15.050 10.392 1.00 0.00 O ATOM 1544 CB ASP A 104 108.550 17.659 9.117 1.00 0.00 C ATOM 1545 CG ASP A 104 107.043 17.493 9.281 1.00 0.00 C ATOM 1546 OD1 ASP A 104 106.405 18.441 9.711 1.00 0.00 O ATOM 1547 OD2 ASP A 104 106.549 16.421 8.975 1.00 0.00 O ATOM 0 H ASP A 104 111.237 16.936 9.928 1.00 0.00 H new ATOM 0 HA ASP A 104 108.831 18.032 11.219 1.00 0.00 H new ATOM 0 HB2 ASP A 104 108.778 18.668 8.774 1.00 0.00 H new ATOM 0 HB3 ASP A 104 108.919 16.973 8.355 1.00 0.00 H new ATOM 1552 N TYR A 105 108.058 15.694 11.702 1.00 0.00 N ATOM 1553 CA TYR A 105 107.749 14.346 12.168 1.00 0.00 C ATOM 1554 C TYR A 105 106.432 13.860 11.564 1.00 0.00 C ATOM 1555 O TYR A 105 105.495 14.642 11.403 1.00 0.00 O ATOM 1556 CB TYR A 105 107.641 14.361 13.694 1.00 0.00 C ATOM 1557 CG TYR A 105 107.258 13.032 14.300 1.00 0.00 C ATOM 1558 CD1 TYR A 105 108.246 12.113 14.669 1.00 0.00 C ATOM 1559 CD2 TYR A 105 105.908 12.723 14.498 1.00 0.00 C ATOM 1560 CE1 TYR A 105 107.885 10.886 15.236 1.00 0.00 C ATOM 1561 CE2 TYR A 105 105.546 11.495 15.063 1.00 0.00 C ATOM 1562 CZ TYR A 105 106.534 10.576 15.433 1.00 0.00 C ATOM 1563 OH TYR A 105 106.174 9.369 15.994 1.00 0.00 O ATOM 0 H TYR A 105 107.454 16.420 12.087 1.00 0.00 H new ATOM 0 HA TYR A 105 108.543 13.668 11.856 1.00 0.00 H new ATOM 0 HB2 TYR A 105 108.597 14.676 14.112 1.00 0.00 H new ATOM 0 HB3 TYR A 105 106.903 15.108 13.988 1.00 0.00 H new ATOM 0 HD1 TYR A 105 109.288 12.351 14.516 1.00 0.00 H new ATOM 0 HD2 TYR A 105 105.145 13.433 14.215 1.00 0.00 H new ATOM 0 HE1 TYR A 105 108.649 10.178 15.522 1.00 0.00 H new ATOM 0 HE2 TYR A 105 104.503 11.257 15.214 1.00 0.00 H new ATOM 0 HH TYR A 105 105.197 9.310 16.045 1.00 0.00 H new ATOM 1573 N GLY A 106 106.363 12.572 11.232 1.00 0.00 N ATOM 1574 CA GLY A 106 105.120 11.999 10.721 1.00 0.00 C ATOM 1575 C GLY A 106 104.910 10.585 11.249 1.00 0.00 C ATOM 1576 O GLY A 106 105.859 9.923 11.660 1.00 0.00 O ATOM 0 H GLY A 106 107.140 11.915 11.306 1.00 0.00 H new ATOM 0 HA2 GLY A 106 104.279 12.628 11.013 1.00 0.00 H new ATOM 0 HA3 GLY A 106 105.144 11.984 9.631 1.00 0.00 H new ATOM 1580 N PHE A 107 103.664 10.122 11.215 1.00 0.00 N ATOM 1581 CA PHE A 107 103.363 8.744 11.593 1.00 0.00 C ATOM 1582 C PHE A 107 103.144 7.915 10.336 1.00 0.00 C ATOM 1583 O PHE A 107 102.321 8.274 9.492 1.00 0.00 O ATOM 1584 CB PHE A 107 102.093 8.689 12.448 1.00 0.00 C ATOM 1585 CG PHE A 107 102.226 9.331 13.808 1.00 0.00 C ATOM 1586 CD1 PHE A 107 101.927 10.690 13.975 1.00 0.00 C ATOM 1587 CD2 PHE A 107 102.632 8.566 14.907 1.00 0.00 C ATOM 1588 CE1 PHE A 107 102.035 11.281 15.239 1.00 0.00 C ATOM 1589 CE2 PHE A 107 102.741 9.156 16.172 1.00 0.00 C ATOM 1590 CZ PHE A 107 102.441 10.512 16.338 1.00 0.00 C ATOM 0 H PHE A 107 102.854 10.674 10.933 1.00 0.00 H new ATOM 0 HA PHE A 107 104.200 8.348 12.168 1.00 0.00 H new ATOM 0 HB2 PHE A 107 101.284 9.179 11.906 1.00 0.00 H new ATOM 0 HB3 PHE A 107 101.803 7.646 12.579 1.00 0.00 H new ATOM 0 HD1 PHE A 107 101.613 11.282 13.128 1.00 0.00 H new ATOM 0 HD2 PHE A 107 102.862 7.518 14.779 1.00 0.00 H new ATOM 0 HE1 PHE A 107 101.806 12.329 15.367 1.00 0.00 H new ATOM 0 HE2 PHE A 107 103.056 8.565 17.019 1.00 0.00 H new ATOM 0 HZ PHE A 107 102.522 10.967 17.314 1.00 0.00 H new ATOM 1600 N SER A 108 103.874 6.806 10.202 1.00 0.00 N ATOM 1601 CA SER A 108 103.709 5.943 9.032 1.00 0.00 C ATOM 1602 C SER A 108 103.196 4.567 9.445 1.00 0.00 C ATOM 1603 O SER A 108 103.557 4.059 10.503 1.00 0.00 O ATOM 1604 CB SER A 108 105.047 5.786 8.310 1.00 0.00 C ATOM 1605 OG SER A 108 105.560 7.074 7.998 1.00 0.00 O ATOM 0 H SER A 108 104.572 6.489 10.875 1.00 0.00 H new ATOM 0 HA SER A 108 102.982 6.406 8.365 1.00 0.00 H new ATOM 0 HB2 SER A 108 105.752 5.242 8.939 1.00 0.00 H new ATOM 0 HB3 SER A 108 104.917 5.202 7.399 1.00 0.00 H new ATOM 0 HG SER A 108 106.419 6.981 7.536 1.00 0.00 H new ATOM 1611 N TYR A 109 102.343 3.976 8.615 1.00 0.00 N ATOM 1612 CA TYR A 109 101.843 2.631 8.882 1.00 0.00 C ATOM 1613 C TYR A 109 101.703 1.860 7.575 1.00 0.00 C ATOM 1614 O TYR A 109 101.511 2.467 6.525 1.00 0.00 O ATOM 1615 CB TYR A 109 100.498 2.705 9.612 1.00 0.00 C ATOM 1616 CG TYR A 109 99.364 3.246 8.769 1.00 0.00 C ATOM 1617 CD1 TYR A 109 99.101 4.622 8.749 1.00 0.00 C ATOM 1618 CD2 TYR A 109 98.575 2.372 8.012 1.00 0.00 C ATOM 1619 CE1 TYR A 109 98.052 5.122 7.969 1.00 0.00 C ATOM 1620 CE2 TYR A 109 97.526 2.873 7.232 1.00 0.00 C ATOM 1621 CZ TYR A 109 97.264 4.248 7.212 1.00 0.00 C ATOM 1622 OH TYR A 109 96.228 4.742 6.445 1.00 0.00 O ATOM 0 H TYR A 109 101.986 4.402 7.760 1.00 0.00 H new ATOM 0 HA TYR A 109 102.553 2.106 9.521 1.00 0.00 H new ATOM 0 HB2 TYR A 109 100.232 1.708 9.962 1.00 0.00 H new ATOM 0 HB3 TYR A 109 100.611 3.333 10.496 1.00 0.00 H new ATOM 0 HD1 TYR A 109 99.707 5.297 9.335 1.00 0.00 H new ATOM 0 HD2 TYR A 109 98.776 1.311 8.030 1.00 0.00 H new ATOM 0 HE1 TYR A 109 97.851 6.183 7.951 1.00 0.00 H new ATOM 0 HE2 TYR A 109 96.919 2.199 6.646 1.00 0.00 H new ATOM 0 HH TYR A 109 95.783 4.002 5.981 1.00 0.00 H new ATOM 1632 N GLY A 110 101.801 0.534 7.636 1.00 0.00 N ATOM 1633 CA GLY A 110 101.717 -0.270 6.417 1.00 0.00 C ATOM 1634 C GLY A 110 101.340 -1.717 6.709 1.00 0.00 C ATOM 1635 O GLY A 110 101.243 -2.127 7.864 1.00 0.00 O ATOM 0 H GLY A 110 101.936 0.002 8.496 1.00 0.00 H new ATOM 0 HA2 GLY A 110 100.979 0.168 5.745 1.00 0.00 H new ATOM 0 HA3 GLY A 110 102.676 -0.243 5.899 1.00 0.00 H new ATOM 1639 N ALA A 111 101.156 -2.481 5.638 1.00 0.00 N ATOM 1640 CA ALA A 111 100.844 -3.902 5.753 1.00 0.00 C ATOM 1641 C ALA A 111 101.397 -4.656 4.550 1.00 0.00 C ATOM 1642 O ALA A 111 101.474 -4.106 3.451 1.00 0.00 O ATOM 1643 CB ALA A 111 99.327 -4.099 5.831 1.00 0.00 C ATOM 0 H ALA A 111 101.217 -2.140 4.679 1.00 0.00 H new ATOM 0 HA ALA A 111 101.304 -4.291 6.661 1.00 0.00 H new ATOM 0 HB1 ALA A 111 99.102 -5.162 5.917 1.00 0.00 H new ATOM 0 HB2 ALA A 111 98.936 -3.574 6.703 1.00 0.00 H new ATOM 0 HB3 ALA A 111 98.862 -3.701 4.929 1.00 0.00 H new ATOM 1649 N GLY A 112 101.774 -5.915 4.755 1.00 0.00 N ATOM 1650 CA GLY A 112 102.363 -6.701 3.675 1.00 0.00 C ATOM 1651 C GLY A 112 101.955 -8.169 3.750 1.00 0.00 C ATOM 1652 O GLY A 112 101.548 -8.659 4.803 1.00 0.00 O ATOM 0 H GLY A 112 101.684 -6.407 5.644 1.00 0.00 H new ATOM 0 HA2 GLY A 112 102.054 -6.287 2.715 1.00 0.00 H new ATOM 0 HA3 GLY A 112 103.449 -6.624 3.721 1.00 0.00 H new ATOM 1656 N LEU A 113 102.086 -8.855 2.616 1.00 0.00 N ATOM 1657 CA LEU A 113 101.783 -10.280 2.528 1.00 0.00 C ATOM 1658 C LEU A 113 103.030 -11.019 2.063 1.00 0.00 C ATOM 1659 O LEU A 113 103.813 -10.465 1.290 1.00 0.00 O ATOM 1660 CB LEU A 113 100.635 -10.526 1.544 1.00 0.00 C ATOM 1661 CG LEU A 113 99.359 -9.850 2.057 1.00 0.00 C ATOM 1662 CD1 LEU A 113 99.339 -8.385 1.613 1.00 0.00 C ATOM 1663 CD2 LEU A 113 98.134 -10.570 1.485 1.00 0.00 C ATOM 0 H LEU A 113 102.403 -8.441 1.739 1.00 0.00 H new ATOM 0 HA LEU A 113 101.477 -10.645 3.508 1.00 0.00 H new ATOM 0 HB2 LEU A 113 100.896 -10.133 0.561 1.00 0.00 H new ATOM 0 HB3 LEU A 113 100.468 -11.597 1.426 1.00 0.00 H new ATOM 0 HG LEU A 113 99.337 -9.900 3.146 1.00 0.00 H new ATOM 0 HD11 LEU A 113 98.431 -7.906 1.979 1.00 0.00 H new ATOM 0 HD12 LEU A 113 100.210 -7.870 2.019 1.00 0.00 H new ATOM 0 HD13 LEU A 113 99.363 -8.334 0.524 1.00 0.00 H new ATOM 0 HD21 LEU A 113 97.226 -10.089 1.850 1.00 0.00 H new ATOM 0 HD22 LEU A 113 98.158 -10.521 0.396 1.00 0.00 H new ATOM 0 HD23 LEU A 113 98.144 -11.613 1.801 1.00 0.00 H new ATOM 1675 N GLN A 114 103.221 -12.259 2.515 1.00 0.00 N ATOM 1676 CA GLN A 114 104.460 -12.976 2.209 1.00 0.00 C ATOM 1677 C GLN A 114 104.191 -14.408 1.761 1.00 0.00 C ATOM 1678 O GLN A 114 103.308 -15.086 2.285 1.00 0.00 O ATOM 1679 CB GLN A 114 105.369 -12.992 3.441 1.00 0.00 C ATOM 1680 CG GLN A 114 106.745 -13.540 3.053 1.00 0.00 C ATOM 1681 CD GLN A 114 107.700 -13.518 4.248 1.00 0.00 C ATOM 1682 OE1 GLN A 114 107.384 -12.964 5.302 1.00 0.00 O ATOM 1683 NE2 GLN A 114 108.868 -14.092 4.142 1.00 0.00 N ATOM 0 H GLN A 114 102.551 -12.779 3.082 1.00 0.00 H new ATOM 0 HA GLN A 114 104.949 -12.451 1.388 1.00 0.00 H new ATOM 0 HB2 GLN A 114 105.468 -11.985 3.846 1.00 0.00 H new ATOM 0 HB3 GLN A 114 104.928 -13.609 4.224 1.00 0.00 H new ATOM 0 HG2 GLN A 114 106.643 -14.560 2.683 1.00 0.00 H new ATOM 0 HG3 GLN A 114 107.161 -12.946 2.239 1.00 0.00 H new ATOM 0 HE21 GLN A 114 109.133 -14.552 3.271 1.00 0.00 H new ATOM 0 HE22 GLN A 114 109.515 -14.081 4.930 1.00 0.00 H new ATOM 1692 N PHE A 115 104.967 -14.847 0.777 1.00 0.00 N ATOM 1693 CA PHE A 115 104.956 -16.237 0.348 1.00 0.00 C ATOM 1694 C PHE A 115 106.403 -16.699 0.294 1.00 0.00 C ATOM 1695 O PHE A 115 107.180 -16.180 -0.509 1.00 0.00 O ATOM 1696 CB PHE A 115 104.305 -16.373 -1.029 1.00 0.00 C ATOM 1697 CG PHE A 115 104.146 -17.804 -1.482 1.00 0.00 C ATOM 1698 CD1 PHE A 115 103.037 -18.551 -1.064 1.00 0.00 C ATOM 1699 CD2 PHE A 115 105.104 -18.384 -2.322 1.00 0.00 C ATOM 1700 CE1 PHE A 115 102.889 -19.878 -1.485 1.00 0.00 C ATOM 1701 CE2 PHE A 115 104.955 -19.711 -2.744 1.00 0.00 C ATOM 1702 CZ PHE A 115 103.848 -20.459 -2.325 1.00 0.00 C ATOM 0 H PHE A 115 105.616 -14.254 0.259 1.00 0.00 H new ATOM 0 HA PHE A 115 104.378 -16.846 1.042 1.00 0.00 H new ATOM 0 HB2 PHE A 115 103.325 -15.896 -1.007 1.00 0.00 H new ATOM 0 HB3 PHE A 115 104.906 -15.833 -1.761 1.00 0.00 H new ATOM 0 HD1 PHE A 115 102.297 -18.103 -0.417 1.00 0.00 H new ATOM 0 HD2 PHE A 115 105.958 -17.808 -2.645 1.00 0.00 H new ATOM 0 HE1 PHE A 115 102.035 -20.454 -1.162 1.00 0.00 H new ATOM 0 HE2 PHE A 115 105.694 -20.157 -3.393 1.00 0.00 H new ATOM 0 HZ PHE A 115 103.734 -21.483 -2.649 1.00 0.00 H new ATOM 1712 N ASN A 116 106.783 -17.640 1.158 1.00 0.00 N ATOM 1713 CA ASN A 116 108.205 -17.920 1.360 1.00 0.00 C ATOM 1714 C ASN A 116 108.536 -19.414 1.372 1.00 0.00 C ATOM 1715 O ASN A 116 107.961 -20.171 2.154 1.00 0.00 O ATOM 1716 CB ASN A 116 108.624 -17.331 2.709 1.00 0.00 C ATOM 1717 CG ASN A 116 107.786 -17.940 3.830 1.00 0.00 C ATOM 1718 OD1 ASN A 116 106.560 -17.840 3.814 1.00 0.00 O ATOM 1719 ND2 ASN A 116 108.380 -18.567 4.808 1.00 0.00 N ATOM 0 H ASN A 116 106.146 -18.208 1.716 1.00 0.00 H new ATOM 0 HA ASN A 116 108.742 -17.474 0.523 1.00 0.00 H new ATOM 0 HB2 ASN A 116 109.681 -17.527 2.887 1.00 0.00 H new ATOM 0 HB3 ASN A 116 108.498 -16.248 2.697 1.00 0.00 H new ATOM 0 HD21 ASN A 116 107.828 -18.976 5.562 1.00 0.00 H new ATOM 0 HD22 ASN A 116 109.397 -18.648 4.819 1.00 0.00 H new ATOM 1726 N PRO A 117 109.444 -19.851 0.532 1.00 0.00 N ATOM 1727 CA PRO A 117 110.216 -21.096 0.770 1.00 0.00 C ATOM 1728 C PRO A 117 111.583 -20.735 1.349 1.00 0.00 C ATOM 1729 O PRO A 117 111.903 -19.553 1.475 1.00 0.00 O ATOM 1730 CB PRO A 117 110.345 -21.717 -0.626 1.00 0.00 C ATOM 1731 CG PRO A 117 110.053 -20.623 -1.607 1.00 0.00 C ATOM 1732 CD PRO A 117 109.765 -19.348 -0.810 1.00 0.00 C ATOM 0 HA PRO A 117 109.747 -21.781 1.477 1.00 0.00 H new ATOM 0 HB2 PRO A 117 111.346 -22.120 -0.780 1.00 0.00 H new ATOM 0 HB3 PRO A 117 109.646 -22.545 -0.749 1.00 0.00 H new ATOM 0 HG2 PRO A 117 110.900 -20.473 -2.276 1.00 0.00 H new ATOM 0 HG3 PRO A 117 109.198 -20.886 -2.230 1.00 0.00 H new ATOM 0 HD2 PRO A 117 110.627 -18.681 -0.794 1.00 0.00 H new ATOM 0 HD3 PRO A 117 108.935 -18.786 -1.238 1.00 0.00 H new ATOM 1740 N MET A 118 112.383 -21.736 1.697 1.00 0.00 N ATOM 1741 CA MET A 118 113.704 -21.474 2.270 1.00 0.00 C ATOM 1742 C MET A 118 114.533 -20.591 1.340 1.00 0.00 C ATOM 1743 O MET A 118 114.138 -20.332 0.204 1.00 0.00 O ATOM 1744 CB MET A 118 114.439 -22.794 2.508 1.00 0.00 C ATOM 1745 CG MET A 118 113.704 -23.606 3.576 1.00 0.00 C ATOM 1746 SD MET A 118 114.640 -25.112 3.937 1.00 0.00 S ATOM 1747 CE MET A 118 113.453 -25.850 5.088 1.00 0.00 C ATOM 0 H MET A 118 112.148 -22.723 1.596 1.00 0.00 H new ATOM 0 HA MET A 118 113.568 -20.954 3.218 1.00 0.00 H new ATOM 0 HB2 MET A 118 114.496 -23.363 1.580 1.00 0.00 H new ATOM 0 HB3 MET A 118 115.463 -22.599 2.826 1.00 0.00 H new ATOM 0 HG2 MET A 118 113.586 -23.012 4.482 1.00 0.00 H new ATOM 0 HG3 MET A 118 112.703 -23.861 3.229 1.00 0.00 H new ATOM 0 HE1 MET A 118 113.836 -26.807 5.442 1.00 0.00 H new ATOM 0 HE2 MET A 118 113.305 -25.182 5.936 1.00 0.00 H new ATOM 0 HE3 MET A 118 112.502 -26.006 4.579 1.00 0.00 H new ATOM 1757 N GLU A 119 115.664 -20.107 1.847 1.00 0.00 N ATOM 1758 CA GLU A 119 116.616 -19.333 1.046 1.00 0.00 C ATOM 1759 C GLU A 119 116.032 -17.996 0.581 1.00 0.00 C ATOM 1760 O GLU A 119 114.908 -17.635 0.930 1.00 0.00 O ATOM 1761 CB GLU A 119 117.070 -20.160 -0.162 1.00 0.00 C ATOM 1762 CG GLU A 119 117.755 -21.441 0.325 1.00 0.00 C ATOM 1763 CD GLU A 119 118.313 -22.268 -0.838 1.00 0.00 C ATOM 1764 OE1 GLU A 119 118.012 -21.967 -1.983 1.00 0.00 O ATOM 1765 OE2 GLU A 119 119.045 -23.205 -0.560 1.00 0.00 O ATOM 0 H GLU A 119 115.948 -20.238 2.818 1.00 0.00 H new ATOM 0 HA GLU A 119 117.472 -19.106 1.681 1.00 0.00 H new ATOM 0 HB2 GLU A 119 116.214 -20.408 -0.789 1.00 0.00 H new ATOM 0 HB3 GLU A 119 117.757 -19.579 -0.777 1.00 0.00 H new ATOM 0 HG2 GLU A 119 118.564 -21.183 1.008 1.00 0.00 H new ATOM 0 HG3 GLU A 119 117.042 -22.042 0.889 1.00 0.00 H new ATOM 1772 N ASN A 120 116.818 -17.281 -0.224 1.00 0.00 N ATOM 1773 CA ASN A 120 116.478 -15.939 -0.708 1.00 0.00 C ATOM 1774 C ASN A 120 115.181 -15.880 -1.524 1.00 0.00 C ATOM 1775 O ASN A 120 114.678 -14.794 -1.807 1.00 0.00 O ATOM 1776 CB ASN A 120 117.627 -15.400 -1.566 1.00 0.00 C ATOM 1777 CG ASN A 120 118.888 -15.219 -0.724 1.00 0.00 C ATOM 1778 OD1 ASN A 120 118.823 -15.166 0.505 1.00 0.00 O ATOM 1779 ND2 ASN A 120 120.044 -15.116 -1.319 1.00 0.00 N ATOM 0 H ASN A 120 117.719 -17.619 -0.563 1.00 0.00 H new ATOM 0 HA ASN A 120 116.319 -15.327 0.180 1.00 0.00 H new ATOM 0 HB2 ASN A 120 117.828 -16.087 -2.388 1.00 0.00 H new ATOM 0 HB3 ASN A 120 117.340 -14.447 -2.010 1.00 0.00 H new ATOM 0 HD21 ASN A 120 120.893 -14.992 -0.767 1.00 0.00 H new ATOM 0 HD22 ASN A 120 120.100 -15.160 -2.337 1.00 0.00 H new ATOM 1786 N VAL A 121 114.644 -17.035 -1.903 1.00 0.00 N ATOM 1787 CA VAL A 121 113.543 -17.104 -2.861 1.00 0.00 C ATOM 1788 C VAL A 121 112.179 -16.766 -2.248 1.00 0.00 C ATOM 1789 O VAL A 121 111.151 -17.101 -2.839 1.00 0.00 O ATOM 1790 CB VAL A 121 113.487 -18.496 -3.502 1.00 0.00 C ATOM 1791 CG1 VAL A 121 114.770 -18.735 -4.302 1.00 0.00 C ATOM 1792 CG2 VAL A 121 113.363 -19.568 -2.416 1.00 0.00 C ATOM 0 H VAL A 121 114.955 -17.943 -1.559 1.00 0.00 H new ATOM 0 HA VAL A 121 113.748 -16.345 -3.617 1.00 0.00 H new ATOM 0 HB VAL A 121 112.621 -18.552 -4.162 1.00 0.00 H new ATOM 0 HG11 VAL A 121 114.735 -19.724 -4.760 1.00 0.00 H new ATOM 0 HG12 VAL A 121 114.860 -17.978 -5.081 1.00 0.00 H new ATOM 0 HG13 VAL A 121 115.631 -18.674 -3.636 1.00 0.00 H new ATOM 0 HG21 VAL A 121 113.324 -20.553 -2.880 1.00 0.00 H new ATOM 0 HG22 VAL A 121 114.225 -19.514 -1.751 1.00 0.00 H new ATOM 0 HG23 VAL A 121 112.451 -19.401 -1.842 1.00 0.00 H new ATOM 1802 N ALA A 122 112.153 -16.111 -1.084 1.00 0.00 N ATOM 1803 CA ALA A 122 110.880 -15.765 -0.450 1.00 0.00 C ATOM 1804 C ALA A 122 110.592 -14.277 -0.642 1.00 0.00 C ATOM 1805 O ALA A 122 111.485 -13.444 -0.482 1.00 0.00 O ATOM 1806 CB ALA A 122 110.965 -16.067 1.046 1.00 0.00 C ATOM 0 H ALA A 122 112.983 -15.815 -0.570 1.00 0.00 H new ATOM 0 HA ALA A 122 110.081 -16.350 -0.905 1.00 0.00 H new ATOM 0 HB1 ALA A 122 110.019 -15.811 1.523 1.00 0.00 H new ATOM 0 HB2 ALA A 122 111.170 -17.128 1.192 1.00 0.00 H new ATOM 0 HB3 ALA A 122 111.767 -15.478 1.491 1.00 0.00 H new ATOM 1812 N LEU A 123 109.339 -13.949 -0.976 1.00 0.00 N ATOM 1813 CA LEU A 123 108.991 -12.598 -1.418 1.00 0.00 C ATOM 1814 C LEU A 123 107.960 -11.955 -0.493 1.00 0.00 C ATOM 1815 O LEU A 123 107.042 -12.622 -0.021 1.00 0.00 O ATOM 1816 CB LEU A 123 108.410 -12.647 -2.833 1.00 0.00 C ATOM 1817 CG LEU A 123 109.396 -13.320 -3.792 1.00 0.00 C ATOM 1818 CD1 LEU A 123 108.755 -13.451 -5.173 1.00 0.00 C ATOM 1819 CD2 LEU A 123 110.660 -12.465 -3.904 1.00 0.00 C ATOM 0 H LEU A 123 108.553 -14.599 -0.948 1.00 0.00 H new ATOM 0 HA LEU A 123 109.903 -12.002 -1.399 1.00 0.00 H new ATOM 0 HB2 LEU A 123 107.467 -13.194 -2.827 1.00 0.00 H new ATOM 0 HB3 LEU A 123 108.190 -11.637 -3.178 1.00 0.00 H new ATOM 0 HG LEU A 123 109.653 -14.309 -3.412 1.00 0.00 H new ATOM 0 HD11 LEU A 123 109.457 -13.930 -5.856 1.00 0.00 H new ATOM 0 HD12 LEU A 123 107.851 -14.055 -5.099 1.00 0.00 H new ATOM 0 HD13 LEU A 123 108.499 -12.461 -5.551 1.00 0.00 H new ATOM 0 HD21 LEU A 123 111.363 -12.943 -4.586 1.00 0.00 H new ATOM 0 HD22 LEU A 123 110.399 -11.478 -4.285 1.00 0.00 H new ATOM 0 HD23 LEU A 123 111.120 -12.365 -2.921 1.00 0.00 H new ATOM 1831 N ASP A 124 108.106 -10.650 -0.268 1.00 0.00 N ATOM 1832 CA ASP A 124 107.141 -9.904 0.536 1.00 0.00 C ATOM 1833 C ASP A 124 106.805 -8.575 -0.138 1.00 0.00 C ATOM 1834 O ASP A 124 107.698 -7.893 -0.638 1.00 0.00 O ATOM 1835 CB ASP A 124 107.717 -9.641 1.929 1.00 0.00 C ATOM 1836 CG ASP A 124 106.688 -8.944 2.816 1.00 0.00 C ATOM 1837 OD1 ASP A 124 105.504 -9.167 2.619 1.00 0.00 O ATOM 1838 OD2 ASP A 124 107.101 -8.192 3.685 1.00 0.00 O ATOM 0 H ASP A 124 108.879 -10.091 -0.629 1.00 0.00 H new ATOM 0 HA ASP A 124 106.230 -10.496 0.627 1.00 0.00 H new ATOM 0 HB2 ASP A 124 108.020 -10.583 2.386 1.00 0.00 H new ATOM 0 HB3 ASP A 124 108.612 -9.024 1.847 1.00 0.00 H new ATOM 1843 N PHE A 125 105.520 -8.221 -0.166 1.00 0.00 N ATOM 1844 CA PHE A 125 105.092 -6.959 -0.767 1.00 0.00 C ATOM 1845 C PHE A 125 104.278 -6.158 0.241 1.00 0.00 C ATOM 1846 O PHE A 125 103.404 -6.716 0.903 1.00 0.00 O ATOM 1847 CB PHE A 125 104.243 -7.233 -2.009 1.00 0.00 C ATOM 1848 CG PHE A 125 104.981 -7.987 -3.090 1.00 0.00 C ATOM 1849 CD1 PHE A 125 104.958 -9.387 -3.108 1.00 0.00 C ATOM 1850 CD2 PHE A 125 105.689 -7.287 -4.074 1.00 0.00 C ATOM 1851 CE1 PHE A 125 105.642 -10.085 -4.109 1.00 0.00 C ATOM 1852 CE2 PHE A 125 106.375 -7.985 -5.075 1.00 0.00 C ATOM 1853 CZ PHE A 125 106.350 -9.386 -5.093 1.00 0.00 C ATOM 0 H PHE A 125 104.763 -8.786 0.218 1.00 0.00 H new ATOM 0 HA PHE A 125 105.974 -6.387 -1.056 1.00 0.00 H new ATOM 0 HB2 PHE A 125 103.361 -7.803 -1.718 1.00 0.00 H new ATOM 0 HB3 PHE A 125 103.890 -6.285 -2.415 1.00 0.00 H new ATOM 0 HD1 PHE A 125 104.412 -9.928 -2.349 1.00 0.00 H new ATOM 0 HD2 PHE A 125 105.706 -6.207 -4.061 1.00 0.00 H new ATOM 0 HE1 PHE A 125 105.624 -11.165 -4.122 1.00 0.00 H new ATOM 0 HE2 PHE A 125 106.923 -7.444 -5.833 1.00 0.00 H new ATOM 0 HZ PHE A 125 106.877 -9.926 -5.866 1.00 0.00 H new ATOM 1863 N SER A 126 104.557 -4.861 0.360 1.00 0.00 N ATOM 1864 CA SER A 126 103.880 -4.044 1.366 1.00 0.00 C ATOM 1865 C SER A 126 103.529 -2.665 0.819 1.00 0.00 C ATOM 1866 O SER A 126 104.179 -2.167 -0.098 1.00 0.00 O ATOM 1867 CB SER A 126 104.769 -3.894 2.599 1.00 0.00 C ATOM 1868 OG SER A 126 105.098 -5.182 3.098 1.00 0.00 O ATOM 0 H SER A 126 105.234 -4.360 -0.216 1.00 0.00 H new ATOM 0 HA SER A 126 102.953 -4.549 1.639 1.00 0.00 H new ATOM 0 HB2 SER A 126 105.677 -3.347 2.343 1.00 0.00 H new ATOM 0 HB3 SER A 126 104.254 -3.315 3.365 1.00 0.00 H new ATOM 0 HG SER A 126 105.670 -5.090 3.889 1.00 0.00 H new ATOM 1874 N TYR A 127 102.494 -2.060 1.394 1.00 0.00 N ATOM 1875 CA TYR A 127 102.133 -0.682 1.075 1.00 0.00 C ATOM 1876 C TYR A 127 102.188 0.153 2.350 1.00 0.00 C ATOM 1877 O TYR A 127 101.813 -0.328 3.420 1.00 0.00 O ATOM 1878 CB TYR A 127 100.728 -0.635 0.461 1.00 0.00 C ATOM 1879 CG TYR A 127 99.622 -1.022 1.417 1.00 0.00 C ATOM 1880 CD1 TYR A 127 99.219 -2.357 1.520 1.00 0.00 C ATOM 1881 CD2 TYR A 127 99.000 -0.039 2.199 1.00 0.00 C ATOM 1882 CE1 TYR A 127 98.195 -2.713 2.405 1.00 0.00 C ATOM 1883 CE2 TYR A 127 97.973 -0.396 3.084 1.00 0.00 C ATOM 1884 CZ TYR A 127 97.573 -1.733 3.187 1.00 0.00 C ATOM 1885 OH TYR A 127 96.563 -2.085 4.059 1.00 0.00 O ATOM 0 H TYR A 127 101.889 -2.503 2.085 1.00 0.00 H new ATOM 0 HA TYR A 127 102.836 -0.275 0.348 1.00 0.00 H new ATOM 0 HB2 TYR A 127 100.538 0.373 0.092 1.00 0.00 H new ATOM 0 HB3 TYR A 127 100.698 -1.301 -0.401 1.00 0.00 H new ATOM 0 HD1 TYR A 127 99.698 -3.114 0.916 1.00 0.00 H new ATOM 0 HD2 TYR A 127 99.312 0.992 2.120 1.00 0.00 H new ATOM 0 HE1 TYR A 127 97.885 -3.744 2.485 1.00 0.00 H new ATOM 0 HE2 TYR A 127 97.491 0.360 3.686 1.00 0.00 H new ATOM 0 HH TYR A 127 96.240 -1.286 4.526 1.00 0.00 H new ATOM 1895 N GLU A 128 102.664 1.390 2.234 1.00 0.00 N ATOM 1896 CA GLU A 128 102.858 2.239 3.404 1.00 0.00 C ATOM 1897 C GLU A 128 102.234 3.610 3.170 1.00 0.00 C ATOM 1898 O GLU A 128 102.310 4.159 2.070 1.00 0.00 O ATOM 1899 CB GLU A 128 104.355 2.383 3.685 1.00 0.00 C ATOM 1900 CG GLU A 128 104.580 3.057 5.044 1.00 0.00 C ATOM 1901 CD GLU A 128 106.070 3.283 5.327 1.00 0.00 C ATOM 1902 OE1 GLU A 128 106.895 2.982 4.474 1.00 0.00 O ATOM 1903 OE2 GLU A 128 106.372 3.753 6.410 1.00 0.00 O ATOM 0 H GLU A 128 102.921 1.824 1.347 1.00 0.00 H new ATOM 0 HA GLU A 128 102.372 1.780 4.265 1.00 0.00 H new ATOM 0 HB2 GLU A 128 104.830 1.402 3.675 1.00 0.00 H new ATOM 0 HB3 GLU A 128 104.825 2.972 2.897 1.00 0.00 H new ATOM 0 HG2 GLU A 128 104.056 4.013 5.067 1.00 0.00 H new ATOM 0 HG3 GLU A 128 104.150 2.439 5.832 1.00 0.00 H new ATOM 1910 N GLN A 129 101.614 4.159 4.212 1.00 0.00 N ATOM 1911 CA GLN A 129 100.904 5.428 4.103 1.00 0.00 C ATOM 1912 C GLN A 129 101.406 6.433 5.128 1.00 0.00 C ATOM 1913 O GLN A 129 101.630 6.100 6.290 1.00 0.00 O ATOM 1914 CB GLN A 129 99.405 5.198 4.315 1.00 0.00 C ATOM 1915 CG GLN A 129 98.793 4.546 3.074 1.00 0.00 C ATOM 1916 CD GLN A 129 98.867 5.510 1.894 1.00 0.00 C ATOM 1917 OE1 GLN A 129 98.460 6.664 2.013 1.00 0.00 O ATOM 1918 NE2 GLN A 129 99.368 5.108 0.759 1.00 0.00 N ATOM 0 H GLN A 129 101.590 3.743 5.143 1.00 0.00 H new ATOM 0 HA GLN A 129 101.086 5.832 3.107 1.00 0.00 H new ATOM 0 HB2 GLN A 129 99.246 4.562 5.186 1.00 0.00 H new ATOM 0 HB3 GLN A 129 98.909 6.147 4.519 1.00 0.00 H new ATOM 0 HG2 GLN A 129 99.325 3.625 2.836 1.00 0.00 H new ATOM 0 HG3 GLN A 129 97.756 4.274 3.269 1.00 0.00 H new ATOM 0 HE21 GLN A 129 99.705 4.150 0.661 1.00 0.00 H new ATOM 0 HE22 GLN A 129 99.422 5.751 -0.031 1.00 0.00 H new ATOM 1927 N SER A 130 101.592 7.659 4.655 1.00 0.00 N ATOM 1928 CA SER A 130 101.848 8.801 5.521 1.00 0.00 C ATOM 1929 C SER A 130 100.565 9.610 5.600 1.00 0.00 C ATOM 1930 O SER A 130 99.915 9.818 4.572 1.00 0.00 O ATOM 1931 CB SER A 130 102.979 9.673 4.977 1.00 0.00 C ATOM 1932 OG SER A 130 104.089 8.848 4.649 1.00 0.00 O ATOM 0 H SER A 130 101.570 7.889 3.661 1.00 0.00 H new ATOM 0 HA SER A 130 102.156 8.451 6.507 1.00 0.00 H new ATOM 0 HB2 SER A 130 102.642 10.218 4.095 1.00 0.00 H new ATOM 0 HB3 SER A 130 103.270 10.417 5.719 1.00 0.00 H new ATOM 0 HG SER A 130 104.817 9.403 4.298 1.00 0.00 H new ATOM 1938 N ARG A 131 100.301 10.194 6.766 1.00 0.00 N ATOM 1939 CA ARG A 131 98.952 10.596 7.150 1.00 0.00 C ATOM 1940 C ARG A 131 98.689 12.015 6.673 1.00 0.00 C ATOM 1941 O ARG A 131 99.591 12.851 6.642 1.00 0.00 O ATOM 1942 CB ARG A 131 98.796 10.518 8.671 1.00 0.00 C ATOM 1943 CG ARG A 131 97.347 10.812 9.060 1.00 0.00 C ATOM 1944 CD ARG A 131 97.218 10.822 10.584 1.00 0.00 C ATOM 1945 NE ARG A 131 97.578 9.510 11.131 1.00 0.00 N ATOM 1946 CZ ARG A 131 97.265 9.115 12.374 1.00 0.00 C ATOM 1947 NH1 ARG A 131 96.605 9.882 13.207 1.00 0.00 N ATOM 1948 NH2 ARG A 131 97.629 7.925 12.766 1.00 0.00 N ATOM 0 H ARG A 131 101.012 10.401 7.467 1.00 0.00 H new ATOM 0 HA ARG A 131 98.231 9.922 6.688 1.00 0.00 H new ATOM 0 HB2 ARG A 131 99.083 9.528 9.025 1.00 0.00 H new ATOM 0 HB3 ARG A 131 99.463 11.234 9.151 1.00 0.00 H new ATOM 0 HG2 ARG A 131 97.038 11.775 8.652 1.00 0.00 H new ATOM 0 HG3 ARG A 131 96.685 10.058 8.634 1.00 0.00 H new ATOM 0 HD2 ARG A 131 97.866 11.590 11.006 1.00 0.00 H new ATOM 0 HD3 ARG A 131 96.197 11.075 10.868 1.00 0.00 H new ATOM 0 HE ARG A 131 98.094 8.863 10.534 1.00 0.00 H new ATOM 0 HH11 ARG A 131 96.311 10.815 12.918 1.00 0.00 H new ATOM 0 HH12 ARG A 131 96.385 9.546 14.145 1.00 0.00 H new ATOM 0 HH21 ARG A 131 98.142 7.314 12.131 1.00 0.00 H new ATOM 0 HH22 ARG A 131 97.400 7.606 13.708 1.00 0.00 H new ATOM 1962 N ILE A 132 97.439 12.277 6.299 1.00 0.00 N ATOM 1963 CA ILE A 132 97.167 13.196 5.203 1.00 0.00 C ATOM 1964 C ILE A 132 97.063 14.647 5.668 1.00 0.00 C ATOM 1965 O ILE A 132 96.027 15.126 6.125 1.00 0.00 O ATOM 1966 CB ILE A 132 95.859 12.787 4.502 1.00 0.00 C ATOM 1967 CG1 ILE A 132 95.941 11.332 4.035 1.00 0.00 C ATOM 1968 CG2 ILE A 132 95.609 13.675 3.276 1.00 0.00 C ATOM 1969 CD1 ILE A 132 94.571 10.873 3.532 1.00 0.00 C ATOM 0 H ILE A 132 96.610 11.871 6.733 1.00 0.00 H new ATOM 0 HA ILE A 132 98.007 13.135 4.511 1.00 0.00 H new ATOM 0 HB ILE A 132 95.044 12.904 5.216 1.00 0.00 H new ATOM 0 HG12 ILE A 132 96.681 11.236 3.241 1.00 0.00 H new ATOM 0 HG13 ILE A 132 96.270 10.695 4.856 1.00 0.00 H new ATOM 0 HG21 ILE A 132 94.681 13.373 2.791 1.00 0.00 H new ATOM 0 HG22 ILE A 132 95.533 14.716 3.590 1.00 0.00 H new ATOM 0 HG23 ILE A 132 96.436 13.568 2.574 1.00 0.00 H new ATOM 0 HD11 ILE A 132 94.634 9.837 3.200 1.00 0.00 H new ATOM 0 HD12 ILE A 132 93.842 10.953 4.338 1.00 0.00 H new ATOM 0 HD13 ILE A 132 94.260 11.502 2.698 1.00 0.00 H new ATOM 1981 N ARG A 133 98.204 15.304 5.516 1.00 0.00 N ATOM 1982 CA ARG A 133 98.297 16.754 5.417 1.00 0.00 C ATOM 1983 C ARG A 133 98.179 17.108 3.925 1.00 0.00 C ATOM 1984 O ARG A 133 97.944 16.222 3.091 1.00 0.00 O ATOM 1985 CB ARG A 133 99.644 17.221 5.991 1.00 0.00 C ATOM 1986 CG ARG A 133 99.494 18.564 6.714 1.00 0.00 C ATOM 1987 CD ARG A 133 100.824 18.943 7.365 1.00 0.00 C ATOM 1988 NE ARG A 133 101.816 19.277 6.338 1.00 0.00 N ATOM 1989 CZ ARG A 133 102.873 20.072 6.560 1.00 0.00 C ATOM 1990 NH1 ARG A 133 103.105 20.619 7.728 1.00 0.00 N ATOM 1991 NH2 ARG A 133 103.699 20.312 5.578 1.00 0.00 N ATOM 0 H ARG A 133 99.108 14.836 5.457 1.00 0.00 H new ATOM 0 HA ARG A 133 97.508 17.249 5.984 1.00 0.00 H new ATOM 0 HB2 ARG A 133 100.028 16.472 6.683 1.00 0.00 H new ATOM 0 HB3 ARG A 133 100.373 17.316 5.187 1.00 0.00 H new ATOM 0 HG2 ARG A 133 99.189 19.337 6.009 1.00 0.00 H new ATOM 0 HG3 ARG A 133 98.712 18.497 7.471 1.00 0.00 H new ATOM 0 HD2 ARG A 133 100.681 19.793 8.032 1.00 0.00 H new ATOM 0 HD3 ARG A 133 101.187 18.116 7.975 1.00 0.00 H new ATOM 0 HE ARG A 133 101.696 18.884 5.405 1.00 0.00 H new ATOM 0 HH11 ARG A 133 102.470 20.445 8.507 1.00 0.00 H new ATOM 0 HH12 ARG A 133 103.920 21.218 7.858 1.00 0.00 H new ATOM 0 HH21 ARG A 133 103.535 19.897 4.661 1.00 0.00 H new ATOM 0 HH22 ARG A 133 104.508 20.914 5.728 1.00 0.00 H new ATOM 2005 N SER A 134 98.300 18.386 3.565 1.00 0.00 N ATOM 2006 CA SER A 134 98.109 18.792 2.167 1.00 0.00 C ATOM 2007 C SER A 134 98.970 17.970 1.191 1.00 0.00 C ATOM 2008 O SER A 134 98.741 18.021 -0.017 1.00 0.00 O ATOM 2009 CB SER A 134 98.450 20.274 2.013 1.00 0.00 C ATOM 2010 OG SER A 134 99.845 20.455 2.210 1.00 0.00 O ATOM 0 H SER A 134 98.525 19.147 4.206 1.00 0.00 H new ATOM 0 HA SER A 134 97.064 18.610 1.918 1.00 0.00 H new ATOM 0 HB2 SER A 134 98.162 20.625 1.022 1.00 0.00 H new ATOM 0 HB3 SER A 134 97.889 20.866 2.736 1.00 0.00 H new ATOM 0 HG SER A 134 100.069 21.404 2.111 1.00 0.00 H new ATOM 2016 N VAL A 135 99.954 17.215 1.691 1.00 0.00 N ATOM 2017 CA VAL A 135 100.660 16.230 0.872 1.00 0.00 C ATOM 2018 C VAL A 135 100.470 14.825 1.457 1.00 0.00 C ATOM 2019 O VAL A 135 100.679 14.609 2.650 1.00 0.00 O ATOM 2020 CB VAL A 135 102.151 16.570 0.810 1.00 0.00 C ATOM 2021 CG1 VAL A 135 102.332 17.944 0.162 1.00 0.00 C ATOM 2022 CG2 VAL A 135 102.739 16.599 2.224 1.00 0.00 C ATOM 0 H VAL A 135 100.277 17.269 2.657 1.00 0.00 H new ATOM 0 HA VAL A 135 100.248 16.253 -0.137 1.00 0.00 H new ATOM 0 HB VAL A 135 102.666 15.812 0.220 1.00 0.00 H new ATOM 0 HG11 VAL A 135 103.393 18.188 0.117 1.00 0.00 H new ATOM 0 HG12 VAL A 135 101.920 17.927 -0.847 1.00 0.00 H new ATOM 0 HG13 VAL A 135 101.811 18.697 0.754 1.00 0.00 H new ATOM 0 HG21 VAL A 135 103.800 16.842 2.172 1.00 0.00 H new ATOM 0 HG22 VAL A 135 102.223 17.354 2.817 1.00 0.00 H new ATOM 0 HG23 VAL A 135 102.613 15.622 2.691 1.00 0.00 H new ATOM 2032 N ASP A 136 100.069 13.879 0.608 1.00 0.00 N ATOM 2033 CA ASP A 136 99.819 12.502 1.043 1.00 0.00 C ATOM 2034 C ASP A 136 100.810 11.543 0.388 1.00 0.00 C ATOM 2035 O ASP A 136 101.113 11.686 -0.796 1.00 0.00 O ATOM 2036 CB ASP A 136 98.393 12.088 0.671 1.00 0.00 C ATOM 2037 CG ASP A 136 98.081 10.696 1.215 1.00 0.00 C ATOM 2038 OD1 ASP A 136 98.614 10.347 2.256 1.00 0.00 O ATOM 2039 OD2 ASP A 136 97.310 9.995 0.579 1.00 0.00 O ATOM 0 H ASP A 136 99.910 14.040 -0.387 1.00 0.00 H new ATOM 0 HA ASP A 136 99.944 12.456 2.125 1.00 0.00 H new ATOM 0 HB2 ASP A 136 97.682 12.810 1.073 1.00 0.00 H new ATOM 0 HB3 ASP A 136 98.277 12.096 -0.413 1.00 0.00 H new ATOM 2044 N VAL A 137 101.319 10.565 1.144 1.00 0.00 N ATOM 2045 CA VAL A 137 102.368 9.682 0.615 1.00 0.00 C ATOM 2046 C VAL A 137 101.832 8.279 0.337 1.00 0.00 C ATOM 2047 O VAL A 137 101.117 7.703 1.158 1.00 0.00 O ATOM 2048 CB VAL A 137 103.548 9.572 1.590 1.00 0.00 C ATOM 2049 CG1 VAL A 137 104.702 8.827 0.911 1.00 0.00 C ATOM 2050 CG2 VAL A 137 104.034 10.965 2.007 1.00 0.00 C ATOM 0 H VAL A 137 101.032 10.366 2.102 1.00 0.00 H new ATOM 0 HA VAL A 137 102.708 10.129 -0.319 1.00 0.00 H new ATOM 0 HB VAL A 137 103.217 9.029 2.476 1.00 0.00 H new ATOM 0 HG11 VAL A 137 105.541 8.748 1.602 1.00 0.00 H new ATOM 0 HG12 VAL A 137 104.372 7.828 0.625 1.00 0.00 H new ATOM 0 HG13 VAL A 137 105.015 9.374 0.022 1.00 0.00 H new ATOM 0 HG21 VAL A 137 104.871 10.867 2.698 1.00 0.00 H new ATOM 0 HG22 VAL A 137 104.356 11.517 1.124 1.00 0.00 H new ATOM 0 HG23 VAL A 137 103.221 11.503 2.495 1.00 0.00 H new ATOM 2060 N GLY A 138 102.184 7.735 -0.826 1.00 0.00 N ATOM 2061 CA GLY A 138 101.882 6.341 -1.145 1.00 0.00 C ATOM 2062 C GLY A 138 103.164 5.611 -1.532 1.00 0.00 C ATOM 2063 O GLY A 138 103.856 6.040 -2.455 1.00 0.00 O ATOM 0 H GLY A 138 102.678 8.238 -1.563 1.00 0.00 H new ATOM 0 HA2 GLY A 138 101.420 5.854 -0.286 1.00 0.00 H new ATOM 0 HA3 GLY A 138 101.164 6.293 -1.964 1.00 0.00 H new ATOM 2067 N THR A 139 103.506 4.543 -0.812 1.00 0.00 N ATOM 2068 CA THR A 139 104.741 3.806 -1.089 1.00 0.00 C ATOM 2069 C THR A 139 104.463 2.321 -1.302 1.00 0.00 C ATOM 2070 O THR A 139 103.721 1.710 -0.534 1.00 0.00 O ATOM 2071 CB THR A 139 105.719 3.982 0.074 1.00 0.00 C ATOM 2072 OG1 THR A 139 105.894 5.367 0.338 1.00 0.00 O ATOM 2073 CG2 THR A 139 107.067 3.356 -0.287 1.00 0.00 C ATOM 0 H THR A 139 102.953 4.171 -0.040 1.00 0.00 H new ATOM 0 HA THR A 139 105.177 4.207 -2.004 1.00 0.00 H new ATOM 0 HB THR A 139 105.320 3.489 0.960 1.00 0.00 H new ATOM 0 HG1 THR A 139 106.519 5.481 1.084 1.00 0.00 H new ATOM 0 HG21 THR A 139 107.761 3.483 0.544 1.00 0.00 H new ATOM 0 HG22 THR A 139 106.932 2.293 -0.488 1.00 0.00 H new ATOM 0 HG23 THR A 139 107.469 3.845 -1.174 1.00 0.00 H new ATOM 2081 N TRP A 140 105.061 1.752 -2.344 1.00 0.00 N ATOM 2082 CA TRP A 140 104.956 0.314 -2.598 1.00 0.00 C ATOM 2083 C TRP A 140 106.354 -0.295 -2.592 1.00 0.00 C ATOM 2084 O TRP A 140 107.250 0.233 -3.250 1.00 0.00 O ATOM 2085 CB TRP A 140 104.293 0.069 -3.954 1.00 0.00 C ATOM 2086 CG TRP A 140 103.988 -1.372 -4.215 1.00 0.00 C ATOM 2087 CD1 TRP A 140 104.812 -2.239 -4.846 1.00 0.00 C ATOM 2088 CD2 TRP A 140 102.787 -2.124 -3.870 1.00 0.00 C ATOM 2089 NE1 TRP A 140 104.198 -3.477 -4.908 1.00 0.00 N ATOM 2090 CE2 TRP A 140 102.948 -3.458 -4.323 1.00 0.00 C ATOM 2091 CE3 TRP A 140 101.589 -1.786 -3.218 1.00 0.00 C ATOM 2092 CZ2 TRP A 140 101.952 -4.420 -4.132 1.00 0.00 C ATOM 2093 CZ3 TRP A 140 100.587 -2.748 -3.026 1.00 0.00 C ATOM 2094 CH2 TRP A 140 100.768 -4.062 -3.480 1.00 0.00 C ATOM 0 H TRP A 140 105.623 2.261 -3.026 1.00 0.00 H new ATOM 0 HA TRP A 140 104.348 -0.149 -1.821 1.00 0.00 H new ATOM 0 HB2 TRP A 140 103.368 0.644 -4.007 1.00 0.00 H new ATOM 0 HB3 TRP A 140 104.946 0.443 -4.742 1.00 0.00 H new ATOM 0 HD1 TRP A 140 105.790 -2.003 -5.238 1.00 0.00 H new ATOM 0 HE1 TRP A 140 104.618 -4.303 -5.334 1.00 0.00 H new ATOM 0 HE3 TRP A 140 101.439 -0.777 -2.862 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 102.096 -5.431 -4.485 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 99.670 -2.475 -2.525 1.00 0.00 H new ATOM 0 HH2 TRP A 140 99.993 -4.798 -3.326 1.00 0.00 H new ATOM 2105 N ILE A 141 106.553 -1.386 -1.849 1.00 0.00 N ATOM 2106 CA ILE A 141 107.892 -1.953 -1.686 1.00 0.00 C ATOM 2107 C ILE A 141 107.887 -3.459 -1.940 1.00 0.00 C ATOM 2108 O ILE A 141 106.927 -4.149 -1.595 1.00 0.00 O ATOM 2109 CB ILE A 141 108.399 -1.650 -0.268 1.00 0.00 C ATOM 2110 CG1 ILE A 141 109.833 -2.161 -0.105 1.00 0.00 C ATOM 2111 CG2 ILE A 141 107.497 -2.317 0.774 1.00 0.00 C ATOM 2112 CD1 ILE A 141 110.438 -1.581 1.175 1.00 0.00 C ATOM 0 H ILE A 141 105.814 -1.888 -1.357 1.00 0.00 H new ATOM 0 HA ILE A 141 108.559 -1.498 -2.418 1.00 0.00 H new ATOM 0 HB ILE A 141 108.380 -0.571 -0.116 1.00 0.00 H new ATOM 0 HG12 ILE A 141 109.840 -3.250 -0.062 1.00 0.00 H new ATOM 0 HG13 ILE A 141 110.434 -1.872 -0.967 1.00 0.00 H new ATOM 0 HG21 ILE A 141 107.869 -2.093 1.774 1.00 0.00 H new ATOM 0 HG22 ILE A 141 106.480 -1.937 0.672 1.00 0.00 H new ATOM 0 HG23 ILE A 141 107.499 -3.396 0.619 1.00 0.00 H new ATOM 0 HD11 ILE A 141 111.459 -1.944 1.292 1.00 0.00 H new ATOM 0 HD12 ILE A 141 110.445 -0.493 1.114 1.00 0.00 H new ATOM 0 HD13 ILE A 141 109.842 -1.892 2.033 1.00 0.00 H new ATOM 2124 N ALA A 142 108.972 -3.958 -2.529 1.00 0.00 N ATOM 2125 CA ALA A 142 109.126 -5.391 -2.754 1.00 0.00 C ATOM 2126 C ALA A 142 110.497 -5.829 -2.254 1.00 0.00 C ATOM 2127 O ALA A 142 111.499 -5.177 -2.550 1.00 0.00 O ATOM 2128 CB ALA A 142 108.992 -5.709 -4.245 1.00 0.00 C ATOM 0 H ALA A 142 109.754 -3.392 -2.858 1.00 0.00 H new ATOM 0 HA ALA A 142 108.347 -5.928 -2.212 1.00 0.00 H new ATOM 0 HB1 ALA A 142 109.109 -6.782 -4.400 1.00 0.00 H new ATOM 0 HB2 ALA A 142 108.009 -5.396 -4.597 1.00 0.00 H new ATOM 0 HB3 ALA A 142 109.763 -5.176 -4.801 1.00 0.00 H new ATOM 2134 N GLY A 143 110.540 -6.921 -1.495 1.00 0.00 N ATOM 2135 CA GLY A 143 111.790 -7.355 -0.876 1.00 0.00 C ATOM 2136 C GLY A 143 111.980 -8.864 -0.983 1.00 0.00 C ATOM 2137 O GLY A 143 111.010 -9.618 -1.054 1.00 0.00 O ATOM 0 H GLY A 143 109.735 -7.515 -1.295 1.00 0.00 H new ATOM 0 HA2 GLY A 143 112.628 -6.848 -1.355 1.00 0.00 H new ATOM 0 HA3 GLY A 143 111.797 -7.061 0.174 1.00 0.00 H new ATOM 2141 N VAL A 144 113.242 -9.284 -0.974 1.00 0.00 N ATOM 2142 CA VAL A 144 113.587 -10.699 -1.041 1.00 0.00 C ATOM 2143 C VAL A 144 114.343 -11.080 0.226 1.00 0.00 C ATOM 2144 O VAL A 144 115.163 -10.301 0.709 1.00 0.00 O ATOM 2145 CB VAL A 144 114.465 -10.969 -2.269 1.00 0.00 C ATOM 2146 CG1 VAL A 144 113.678 -10.654 -3.545 1.00 0.00 C ATOM 2147 CG2 VAL A 144 115.721 -10.091 -2.216 1.00 0.00 C ATOM 0 H VAL A 144 114.047 -8.659 -0.921 1.00 0.00 H new ATOM 0 HA VAL A 144 112.678 -11.294 -1.125 1.00 0.00 H new ATOM 0 HB VAL A 144 114.759 -12.019 -2.272 1.00 0.00 H new ATOM 0 HG11 VAL A 144 114.305 -10.847 -4.416 1.00 0.00 H new ATOM 0 HG12 VAL A 144 112.790 -11.285 -3.590 1.00 0.00 H new ATOM 0 HG13 VAL A 144 113.379 -9.606 -3.538 1.00 0.00 H new ATOM 0 HG21 VAL A 144 116.340 -10.288 -3.091 1.00 0.00 H new ATOM 0 HG22 VAL A 144 115.430 -9.040 -2.206 1.00 0.00 H new ATOM 0 HG23 VAL A 144 116.287 -10.319 -1.313 1.00 0.00 H new ATOM 2157 N GLY A 145 114.056 -12.260 0.767 1.00 0.00 N ATOM 2158 CA GLY A 145 114.692 -12.677 2.010 1.00 0.00 C ATOM 2159 C GLY A 145 114.773 -14.193 2.139 1.00 0.00 C ATOM 2160 O GLY A 145 114.301 -14.935 1.273 1.00 0.00 O ATOM 0 H GLY A 145 113.399 -12.933 0.372 1.00 0.00 H new ATOM 0 HA2 GLY A 145 115.696 -12.256 2.060 1.00 0.00 H new ATOM 0 HA3 GLY A 145 114.134 -12.272 2.854 1.00 0.00 H new ATOM 2164 N TYR A 146 115.383 -14.625 3.239 1.00 0.00 N ATOM 2165 CA TYR A 146 115.540 -16.043 3.533 1.00 0.00 C ATOM 2166 C TYR A 146 115.335 -16.287 5.026 1.00 0.00 C ATOM 2167 O TYR A 146 115.428 -15.357 5.827 1.00 0.00 O ATOM 2168 CB TYR A 146 116.931 -16.515 3.093 1.00 0.00 C ATOM 2169 CG TYR A 146 118.070 -15.959 3.919 1.00 0.00 C ATOM 2170 CD1 TYR A 146 118.613 -14.706 3.607 1.00 0.00 C ATOM 2171 CD2 TYR A 146 118.580 -16.694 4.995 1.00 0.00 C ATOM 2172 CE1 TYR A 146 119.666 -14.191 4.371 1.00 0.00 C ATOM 2173 CE2 TYR A 146 119.634 -16.179 5.758 1.00 0.00 C ATOM 2174 CZ TYR A 146 120.177 -14.927 5.448 1.00 0.00 C ATOM 2175 OH TYR A 146 121.215 -14.419 6.201 1.00 0.00 O ATOM 0 H TYR A 146 115.779 -14.006 3.946 1.00 0.00 H new ATOM 0 HA TYR A 146 114.791 -16.612 2.982 1.00 0.00 H new ATOM 0 HB2 TYR A 146 116.963 -17.604 3.138 1.00 0.00 H new ATOM 0 HB3 TYR A 146 117.084 -16.235 2.051 1.00 0.00 H new ATOM 0 HD1 TYR A 146 118.219 -14.138 2.777 1.00 0.00 H new ATOM 0 HD2 TYR A 146 118.160 -17.659 5.237 1.00 0.00 H new ATOM 0 HE1 TYR A 146 120.085 -13.225 4.130 1.00 0.00 H new ATOM 0 HE2 TYR A 146 120.029 -16.748 6.587 1.00 0.00 H new ATOM 0 HH TYR A 146 121.448 -15.055 6.909 1.00 0.00 H new ATOM 2185 N ARG A 147 115.077 -17.541 5.390 1.00 0.00 N ATOM 2186 CA ARG A 147 114.838 -17.900 6.786 1.00 0.00 C ATOM 2187 C ARG A 147 115.854 -18.936 7.253 1.00 0.00 C ATOM 2188 O ARG A 147 116.270 -19.802 6.484 1.00 0.00 O ATOM 2189 CB ARG A 147 113.424 -18.466 6.937 1.00 0.00 C ATOM 2190 CG ARG A 147 113.119 -18.698 8.419 1.00 0.00 C ATOM 2191 CD ARG A 147 111.679 -19.186 8.574 1.00 0.00 C ATOM 2192 NE ARG A 147 111.540 -20.540 8.028 1.00 0.00 N ATOM 2193 CZ ARG A 147 110.358 -21.119 7.777 1.00 0.00 C ATOM 2194 NH1 ARG A 147 109.218 -20.512 8.006 1.00 0.00 N ATOM 2195 NH2 ARG A 147 110.338 -22.331 7.290 1.00 0.00 N ATOM 0 H ARG A 147 115.028 -18.325 4.739 1.00 0.00 H new ATOM 0 HA ARG A 147 114.942 -17.005 7.399 1.00 0.00 H new ATOM 0 HB2 ARG A 147 112.697 -17.775 6.510 1.00 0.00 H new ATOM 0 HB3 ARG A 147 113.336 -19.402 6.386 1.00 0.00 H new ATOM 0 HG2 ARG A 147 113.810 -19.433 8.832 1.00 0.00 H new ATOM 0 HG3 ARG A 147 113.263 -17.774 8.980 1.00 0.00 H new ATOM 0 HD2 ARG A 147 111.397 -19.180 9.627 1.00 0.00 H new ATOM 0 HD3 ARG A 147 111.000 -18.507 8.058 1.00 0.00 H new ATOM 0 HE ARG A 147 112.389 -21.069 7.829 1.00 0.00 H new ATOM 0 HH11 ARG A 147 109.212 -19.566 8.388 1.00 0.00 H new ATOM 0 HH12 ARG A 147 108.338 -20.986 7.802 1.00 0.00 H new ATOM 0 HH21 ARG A 147 111.213 -22.822 7.107 1.00 0.00 H new ATOM 0 HH22 ARG A 147 109.447 -22.787 7.093 1.00 0.00 H new ATOM 2209 N PHE A 148 116.246 -18.842 8.520 1.00 0.00 N ATOM 2210 CA PHE A 148 117.224 -19.769 9.077 1.00 0.00 C ATOM 2211 C PHE A 148 116.529 -21.008 9.635 1.00 0.00 C ATOM 2212 O PHE A 148 115.330 -20.944 9.847 1.00 0.00 O ATOM 2213 CB PHE A 148 118.019 -19.083 10.190 1.00 0.00 C ATOM 2214 CG PHE A 148 119.153 -19.925 10.726 1.00 0.00 C ATOM 2215 CD1 PHE A 148 120.398 -19.907 10.090 1.00 0.00 C ATOM 2216 CD2 PHE A 148 118.956 -20.721 11.861 1.00 0.00 C ATOM 2217 CE1 PHE A 148 121.450 -20.686 10.589 1.00 0.00 C ATOM 2218 CE2 PHE A 148 120.006 -21.501 12.359 1.00 0.00 C ATOM 2219 CZ PHE A 148 121.254 -21.482 11.723 1.00 0.00 C ATOM 2220 OXT PHE A 148 117.207 -22.001 9.842 1.00 0.00 O ATOM 0 H PHE A 148 115.904 -18.139 9.175 1.00 0.00 H new ATOM 0 HA PHE A 148 117.903 -20.074 8.281 1.00 0.00 H new ATOM 0 HB2 PHE A 148 118.422 -18.143 9.812 1.00 0.00 H new ATOM 0 HB3 PHE A 148 117.343 -18.834 11.008 1.00 0.00 H new ATOM 0 HD1 PHE A 148 120.549 -19.293 9.214 1.00 0.00 H new ATOM 0 HD2 PHE A 148 117.994 -20.733 12.352 1.00 0.00 H new ATOM 0 HE1 PHE A 148 122.412 -20.672 10.099 1.00 0.00 H new ATOM 0 HE2 PHE A 148 119.854 -22.117 13.233 1.00 0.00 H new ATOM 0 HZ PHE A 148 122.065 -22.082 12.108 1.00 0.00 H new TER 2230 PHE A 148