USER MOD reduce.3.24.130724 H: found=0, std=0, add=1131, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1127 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 10 GLN : amide:sc= 0.927 K(o=-0.22,f=-4.8!) USER MOD Set 1.2: A 109 CYS SG : rot 110:sc= -1.15 USER MOD Set 2.1: A 96 LYS NZ :NH3+ -156:sc= 1.29 (180deg=1.15) USER MOD Set 2.2: A 98 TYR OH : rot 16:sc= 1.23 USER MOD Set 3.1: A 32 THR OG1 : rot 39:sc= 0.347 USER MOD Set 3.2: A 65 ASN : amide:sc= 0.623 K(o=0.97,f=-3.6!) USER MOD Set 4.1: A 31 TYR OH : rot 165:sc= 1.23 USER MOD Set 4.2: A 50 CYS SG : rot 147:sc= 0.588 USER MOD Set 4.3: A 55 SER OG : rot 173:sc= 1.1 USER MOD Set 5.1: A 39 HIS : no HE2:sc= -1.07 K(o=-0.047,f=-9.9!) USER MOD Set 5.2: A 43 GLN : amide:sc= 1.02 K(o=-0.047,f=-4.5!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot 147:sc= 1.22 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 ASN : amide:sc= 0.36 X(o=0.36,f=0) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 SER OG : rot 180:sc= 0.0735 USER MOD Single : A 27 CYS SG : rot 68:sc= 0.646 USER MOD Single : A 30 LYS NZ :NH3+ -158:sc= 1.26 (180deg=1.02) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0.488 USER MOD Single : A 47 GLN : amide:sc= -0.551 K(o=-0.55,f=-5.2!) USER MOD Single : A 48 ASN : amide:sc= 0 K(o=0,f=-0.73) USER MOD Single : A 62 THR OG1 : rot 147:sc= 0.00272 USER MOD Single : A 64 THR OG1 : rot 15:sc= 0.896 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 69 GLN : amide:sc= -0.458 K(o=-0.46,f=-1.1) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 76 GLN :FLIP amide:sc= -0.143 F(o=-1,f=-0.14) USER MOD Single : A 79 GLN : amide:sc= -0.778 X(o=-0.78,f=-0.73) USER MOD Single : A 81 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 111:sc= 1.49 USER MOD Single : A 87 TYR OH : rot 100:sc=-0.000219 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 MET CE :methyl -156:sc= -3.85 (180deg=-6.01!) USER MOD Single : A 106 ASN :FLIP amide:sc=-0.00671 F(o=-1.2!,f=-0.0067) USER MOD Single : A 113 LYS NZ :NH3+ 162:sc= 1.25 (180deg=0.788) USER MOD Single : A 119 HIS :FLIP no HD1:sc= -0.327 F(o=-1.1,f=-0.33) USER MOD Single : A 124 MET CE :methyl 168:sc= 0 (180deg=-0.0711) USER MOD Single : A 126 CYS SG : rot 180:sc= 0 USER MOD Single : A 135 GLN : amide:sc=-0.00492 K(o=-0.0049,f=-0.59) USER MOD Single : A 136 GLN : amide:sc= -0.445 X(o=-0.44,f=-0.44) USER MOD Single : A 142 GLN : amide:sc= -0.0986 X(o=-0.099,f=0) USER MOD Single : A 143 GLN : amide:sc= -0.0204 X(o=-0.02,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 25.638 -9.272 -13.870 1.00 1.00 N ATOM 2 CA GLY A 1 25.116 -9.950 -12.679 1.00 1.00 C ATOM 3 C GLY A 1 24.881 -8.968 -11.546 1.00 1.00 C ATOM 4 O GLY A 1 25.561 -9.031 -10.522 1.00 1.00 O ATOM 0 H1 GLY A 1 25.789 -9.968 -14.628 1.00 1.00 H new ATOM 0 H2 GLY A 1 24.955 -8.556 -14.189 1.00 1.00 H new ATOM 0 H3 GLY A 1 26.541 -8.811 -13.639 1.00 1.00 H new ATOM 0 HA2 GLY A 1 24.182 -10.455 -12.925 1.00 1.00 H new ATOM 0 HA3 GLY A 1 25.819 -10.718 -12.358 1.00 1.00 H new ATOM 8 N SER A 2 23.938 -8.042 -11.715 1.00 1.00 N ATOM 9 CA SER A 2 23.443 -7.134 -10.698 1.00 1.00 C ATOM 10 C SER A 2 22.128 -6.571 -11.252 1.00 1.00 C ATOM 11 O SER A 2 22.053 -6.289 -12.452 1.00 1.00 O ATOM 12 CB SER A 2 24.491 -6.036 -10.458 1.00 1.00 C ATOM 13 OG SER A 2 24.337 -5.464 -9.176 1.00 1.00 O ATOM 0 H SER A 2 23.479 -7.903 -12.615 1.00 1.00 H new ATOM 0 HA SER A 2 23.267 -7.617 -9.737 1.00 1.00 H new ATOM 0 HB2 SER A 2 25.492 -6.456 -10.555 1.00 1.00 H new ATOM 0 HB3 SER A 2 24.394 -5.262 -11.220 1.00 1.00 H new ATOM 0 HG SER A 2 25.015 -4.769 -9.044 1.00 1.00 H new ATOM 19 N MET A 3 21.101 -6.389 -10.418 1.00 1.00 N ATOM 20 CA MET A 3 19.814 -5.817 -10.824 1.00 1.00 C ATOM 21 C MET A 3 19.321 -4.875 -9.725 1.00 1.00 C ATOM 22 O MET A 3 19.703 -5.050 -8.564 1.00 1.00 O ATOM 23 CB MET A 3 18.760 -6.916 -11.040 1.00 1.00 C ATOM 24 CG MET A 3 19.083 -7.906 -12.159 1.00 1.00 C ATOM 25 SD MET A 3 17.656 -8.929 -12.628 1.00 1.00 S ATOM 26 CE MET A 3 18.486 -10.213 -13.597 1.00 1.00 C ATOM 0 H MET A 3 21.140 -6.638 -9.430 1.00 1.00 H new ATOM 0 HA MET A 3 19.956 -5.281 -11.762 1.00 1.00 H new ATOM 0 HB2 MET A 3 18.637 -7.470 -10.109 1.00 1.00 H new ATOM 0 HB3 MET A 3 17.802 -6.443 -11.258 1.00 1.00 H new ATOM 0 HG2 MET A 3 19.434 -7.357 -13.033 1.00 1.00 H new ATOM 0 HG3 MET A 3 19.900 -8.554 -11.840 1.00 1.00 H new ATOM 0 HE1 MET A 3 17.748 -10.927 -13.962 1.00 1.00 H new ATOM 0 HE2 MET A 3 18.998 -9.756 -14.444 1.00 1.00 H new ATOM 0 HE3 MET A 3 19.212 -10.730 -12.970 1.00 1.00 H new ATOM 36 N PRO A 4 18.463 -3.886 -10.027 1.00 1.00 N ATOM 37 CA PRO A 4 17.886 -3.049 -8.997 1.00 1.00 C ATOM 38 C PRO A 4 16.816 -3.791 -8.213 1.00 1.00 C ATOM 39 O PRO A 4 15.865 -4.344 -8.778 1.00 1.00 O ATOM 40 CB PRO A 4 17.290 -1.843 -9.696 1.00 1.00 C ATOM 41 CG PRO A 4 17.024 -2.329 -11.124 1.00 1.00 C ATOM 42 CD PRO A 4 18.060 -3.430 -11.347 1.00 1.00 C ATOM 0 HA PRO A 4 18.650 -2.753 -8.278 1.00 1.00 H new ATOM 0 HB2 PRO A 4 16.371 -1.515 -9.210 1.00 1.00 H new ATOM 0 HB3 PRO A 4 17.977 -0.997 -9.685 1.00 1.00 H new ATOM 0 HG2 PRO A 4 16.009 -2.710 -11.232 1.00 1.00 H new ATOM 0 HG3 PRO A 4 17.140 -1.522 -11.847 1.00 1.00 H new ATOM 0 HD2 PRO A 4 17.637 -4.249 -11.929 1.00 1.00 H new ATOM 0 HD3 PRO A 4 18.916 -3.051 -11.905 1.00 1.00 H new ATOM 50 N ARG A 5 16.951 -3.691 -6.898 1.00 1.00 N ATOM 51 CA ARG A 5 15.903 -3.931 -5.905 1.00 1.00 C ATOM 52 C ARG A 5 15.956 -2.887 -4.799 1.00 1.00 C ATOM 53 O ARG A 5 14.935 -2.595 -4.192 1.00 1.00 O ATOM 54 CB ARG A 5 16.036 -5.330 -5.273 1.00 1.00 C ATOM 55 CG ARG A 5 15.783 -6.536 -6.191 1.00 1.00 C ATOM 56 CD ARG A 5 14.299 -6.878 -6.402 1.00 1.00 C ATOM 57 NE ARG A 5 13.579 -5.877 -7.209 1.00 1.00 N ATOM 58 CZ ARG A 5 12.550 -5.106 -6.826 1.00 1.00 C ATOM 59 NH1 ARG A 5 12.045 -5.142 -5.597 1.00 1.00 N ATOM 60 NH2 ARG A 5 12.023 -4.254 -7.696 1.00 1.00 N ATOM 0 H ARG A 5 17.838 -3.427 -6.469 1.00 1.00 H new ATOM 0 HA ARG A 5 14.949 -3.865 -6.428 1.00 1.00 H new ATOM 0 HB2 ARG A 5 17.041 -5.422 -4.862 1.00 1.00 H new ATOM 0 HB3 ARG A 5 15.342 -5.391 -4.435 1.00 1.00 H new ATOM 0 HG2 ARG A 5 16.239 -6.339 -7.161 1.00 1.00 H new ATOM 0 HG3 ARG A 5 16.287 -7.407 -5.772 1.00 1.00 H new ATOM 0 HD2 ARG A 5 14.223 -7.850 -6.889 1.00 1.00 H new ATOM 0 HD3 ARG A 5 13.813 -6.969 -5.431 1.00 1.00 H new ATOM 0 HE ARG A 5 13.900 -5.756 -8.170 1.00 1.00 H new ATOM 0 HH11 ARG A 5 12.441 -5.774 -4.901 1.00 1.00 H new ATOM 0 HH12 ARG A 5 11.262 -4.537 -5.350 1.00 1.00 H new ATOM 0 HH21 ARG A 5 12.401 -4.192 -8.642 1.00 1.00 H new ATOM 0 HH22 ARG A 5 11.240 -3.661 -7.419 1.00 1.00 H new ATOM 74 N VAL A 6 17.125 -2.298 -4.567 1.00 1.00 N ATOM 75 CA VAL A 6 17.428 -1.471 -3.407 1.00 1.00 C ATOM 76 C VAL A 6 18.431 -0.395 -3.836 1.00 1.00 C ATOM 77 O VAL A 6 19.293 -0.677 -4.675 1.00 1.00 O ATOM 78 CB VAL A 6 17.971 -2.357 -2.261 1.00 1.00 C ATOM 79 CG1 VAL A 6 16.876 -3.260 -1.675 1.00 1.00 C ATOM 80 CG2 VAL A 6 19.124 -3.286 -2.678 1.00 1.00 C ATOM 0 H VAL A 6 17.915 -2.388 -5.206 1.00 1.00 H new ATOM 0 HA VAL A 6 16.532 -0.978 -3.030 1.00 1.00 H new ATOM 0 HB VAL A 6 18.337 -1.637 -1.529 1.00 1.00 H new ATOM 0 HG11 VAL A 6 17.296 -3.867 -0.873 1.00 1.00 H new ATOM 0 HG12 VAL A 6 16.069 -2.643 -1.279 1.00 1.00 H new ATOM 0 HG13 VAL A 6 16.485 -3.911 -2.456 1.00 1.00 H new ATOM 0 HG21 VAL A 6 19.447 -3.873 -1.818 1.00 1.00 H new ATOM 0 HG22 VAL A 6 18.784 -3.956 -3.468 1.00 1.00 H new ATOM 0 HG23 VAL A 6 19.959 -2.688 -3.044 1.00 1.00 H new ATOM 90 N VAL A 7 18.341 0.821 -3.298 1.00 1.00 N ATOM 91 CA VAL A 7 19.399 1.832 -3.361 1.00 1.00 C ATOM 92 C VAL A 7 20.250 1.692 -2.085 1.00 1.00 C ATOM 93 O VAL A 7 19.777 1.050 -1.149 1.00 1.00 O ATOM 94 CB VAL A 7 18.812 3.253 -3.560 1.00 1.00 C ATOM 95 CG1 VAL A 7 17.706 3.321 -4.623 1.00 1.00 C ATOM 96 CG2 VAL A 7 18.258 3.902 -2.289 1.00 1.00 C ATOM 0 H VAL A 7 17.513 1.139 -2.795 1.00 1.00 H new ATOM 0 HA VAL A 7 20.039 1.674 -4.229 1.00 1.00 H new ATOM 0 HB VAL A 7 19.688 3.811 -3.892 1.00 1.00 H new ATOM 0 HG11 VAL A 7 17.344 4.346 -4.706 1.00 1.00 H new ATOM 0 HG12 VAL A 7 18.105 2.998 -5.584 1.00 1.00 H new ATOM 0 HG13 VAL A 7 16.883 2.668 -4.334 1.00 1.00 H new ATOM 0 HG21 VAL A 7 17.869 4.892 -2.526 1.00 1.00 H new ATOM 0 HG22 VAL A 7 17.456 3.285 -1.885 1.00 1.00 H new ATOM 0 HG23 VAL A 7 19.054 3.992 -1.550 1.00 1.00 H new ATOM 106 N PRO A 8 21.460 2.275 -1.997 1.00 1.00 N ATOM 107 CA PRO A 8 22.306 2.085 -0.828 1.00 1.00 C ATOM 108 C PRO A 8 21.704 2.822 0.363 1.00 1.00 C ATOM 109 O PRO A 8 21.213 2.223 1.314 1.00 1.00 O ATOM 110 CB PRO A 8 23.685 2.614 -1.229 1.00 1.00 C ATOM 111 CG PRO A 8 23.440 3.570 -2.394 1.00 1.00 C ATOM 112 CD PRO A 8 22.118 3.102 -2.998 1.00 1.00 C ATOM 0 HA PRO A 8 22.388 1.043 -0.520 1.00 1.00 H new ATOM 0 HB2 PRO A 8 24.164 3.128 -0.396 1.00 1.00 H new ATOM 0 HB3 PRO A 8 24.346 1.799 -1.524 1.00 1.00 H new ATOM 0 HG2 PRO A 8 23.377 4.604 -2.053 1.00 1.00 H new ATOM 0 HG3 PRO A 8 24.249 3.523 -3.123 1.00 1.00 H new ATOM 0 HD2 PRO A 8 21.493 3.954 -3.265 1.00 1.00 H new ATOM 0 HD3 PRO A 8 22.291 2.535 -3.913 1.00 1.00 H new ATOM 120 N ASP A 9 21.713 4.150 0.284 1.00 1.00 N ATOM 121 CA ASP A 9 21.235 5.066 1.319 1.00 1.00 C ATOM 122 C ASP A 9 19.695 5.160 1.292 1.00 1.00 C ATOM 123 O ASP A 9 19.129 6.239 1.085 1.00 1.00 O ATOM 124 CB ASP A 9 21.912 6.438 1.117 1.00 1.00 C ATOM 125 CG ASP A 9 22.161 7.231 2.400 1.00 1.00 C ATOM 126 OD1 ASP A 9 22.467 6.639 3.461 1.00 1.00 O ATOM 127 OD2 ASP A 9 22.119 8.482 2.330 1.00 1.00 O ATOM 0 H ASP A 9 22.068 4.639 -0.537 1.00 1.00 H new ATOM 0 HA ASP A 9 21.503 4.692 2.307 1.00 1.00 H new ATOM 0 HB2 ASP A 9 22.866 6.285 0.612 1.00 1.00 H new ATOM 0 HB3 ASP A 9 21.291 7.038 0.452 1.00 1.00 H new ATOM 132 N GLN A 10 18.993 4.026 1.445 1.00 1.00 N ATOM 133 CA GLN A 10 17.541 3.937 1.279 1.00 1.00 C ATOM 134 C GLN A 10 16.816 5.007 2.092 1.00 1.00 C ATOM 135 O GLN A 10 15.892 5.646 1.589 1.00 1.00 O ATOM 136 CB GLN A 10 16.988 2.554 1.671 1.00 1.00 C ATOM 137 CG GLN A 10 17.390 1.385 0.755 1.00 1.00 C ATOM 138 CD GLN A 10 16.438 0.185 0.856 1.00 1.00 C ATOM 139 OE1 GLN A 10 15.222 0.349 0.953 1.00 1.00 O ATOM 140 NE2 GLN A 10 16.941 -1.042 0.821 1.00 1.00 N ATOM 0 H GLN A 10 19.427 3.136 1.691 1.00 1.00 H new ATOM 0 HA GLN A 10 17.355 4.098 0.217 1.00 1.00 H new ATOM 0 HB2 GLN A 10 17.318 2.326 2.684 1.00 1.00 H new ATOM 0 HB3 GLN A 10 15.900 2.613 1.696 1.00 1.00 H new ATOM 0 HG2 GLN A 10 17.417 1.733 -0.277 1.00 1.00 H new ATOM 0 HG3 GLN A 10 18.400 1.063 1.010 1.00 1.00 H new ATOM 0 HE21 GLN A 10 17.949 -1.178 0.741 1.00 1.00 H new ATOM 0 HE22 GLN A 10 16.320 -1.849 0.874 1.00 1.00 H new ATOM 149 N ARG A 11 17.236 5.227 3.339 1.00 1.00 N ATOM 150 CA ARG A 11 16.580 6.174 4.228 1.00 1.00 C ATOM 151 C ARG A 11 16.706 7.602 3.702 1.00 1.00 C ATOM 152 O ARG A 11 15.747 8.360 3.838 1.00 1.00 O ATOM 153 CB ARG A 11 17.159 6.034 5.650 1.00 1.00 C ATOM 154 CG ARG A 11 16.145 6.239 6.784 1.00 1.00 C ATOM 155 CD ARG A 11 15.090 5.127 6.785 1.00 1.00 C ATOM 156 NE ARG A 11 14.395 4.990 8.078 1.00 1.00 N ATOM 157 CZ ARG A 11 14.699 4.131 9.062 1.00 1.00 C ATOM 158 NH1 ARG A 11 15.805 3.398 9.056 1.00 1.00 N ATOM 159 NH2 ARG A 11 13.868 3.978 10.078 1.00 1.00 N ATOM 0 H ARG A 11 18.038 4.753 3.755 1.00 1.00 H new ATOM 0 HA ARG A 11 15.515 5.947 4.267 1.00 1.00 H new ATOM 0 HB2 ARG A 11 17.600 5.042 5.751 1.00 1.00 H new ATOM 0 HB3 ARG A 11 17.967 6.755 5.770 1.00 1.00 H new ATOM 0 HG2 ARG A 11 16.664 6.254 7.742 1.00 1.00 H new ATOM 0 HG3 ARG A 11 15.658 7.207 6.670 1.00 1.00 H new ATOM 0 HD2 ARG A 11 14.356 5.330 6.005 1.00 1.00 H new ATOM 0 HD3 ARG A 11 15.568 4.180 6.534 1.00 1.00 H new ATOM 0 HE ARG A 11 13.603 5.611 8.241 1.00 1.00 H new ATOM 0 HH11 ARG A 11 16.464 3.476 8.281 1.00 1.00 H new ATOM 0 HH12 ARG A 11 15.996 2.757 9.826 1.00 1.00 H new ATOM 0 HH21 ARG A 11 13.000 4.512 10.111 1.00 1.00 H new ATOM 0 HH22 ARG A 11 14.095 3.326 10.829 1.00 1.00 H new ATOM 173 N SER A 12 17.818 7.979 3.060 1.00 1.00 N ATOM 174 CA SER A 12 17.887 9.317 2.490 1.00 1.00 C ATOM 175 C SER A 12 17.090 9.386 1.192 1.00 1.00 C ATOM 176 O SER A 12 16.475 10.411 0.929 1.00 1.00 O ATOM 177 CB SER A 12 19.331 9.732 2.253 1.00 1.00 C ATOM 178 OG SER A 12 20.055 9.654 3.465 1.00 1.00 O ATOM 0 H SER A 12 18.647 7.400 2.928 1.00 1.00 H new ATOM 0 HA SER A 12 17.447 10.014 3.204 1.00 1.00 H new ATOM 0 HB2 SER A 12 19.787 9.085 1.504 1.00 1.00 H new ATOM 0 HB3 SER A 12 19.368 10.748 1.861 1.00 1.00 H new ATOM 0 HG SER A 12 20.980 9.390 3.277 1.00 1.00 H new ATOM 184 N LYS A 13 17.034 8.334 0.371 1.00 1.00 N ATOM 185 CA LYS A 13 16.211 8.377 -0.842 1.00 1.00 C ATOM 186 C LYS A 13 14.726 8.437 -0.493 1.00 1.00 C ATOM 187 O LYS A 13 14.013 9.146 -1.191 1.00 1.00 O ATOM 188 CB LYS A 13 16.558 7.183 -1.722 1.00 1.00 C ATOM 189 CG LYS A 13 15.939 7.094 -3.127 1.00 1.00 C ATOM 190 CD LYS A 13 16.670 7.867 -4.233 1.00 1.00 C ATOM 191 CE LYS A 13 16.601 9.377 -4.023 1.00 1.00 C ATOM 192 NZ LYS A 13 17.097 10.115 -5.196 1.00 1.00 N ATOM 0 H LYS A 13 17.537 7.459 0.518 1.00 1.00 H new ATOM 0 HA LYS A 13 16.427 9.286 -1.404 1.00 1.00 H new ATOM 0 HB2 LYS A 13 17.642 7.161 -1.837 1.00 1.00 H new ATOM 0 HB3 LYS A 13 16.277 6.280 -1.180 1.00 1.00 H new ATOM 0 HG2 LYS A 13 15.891 6.044 -3.416 1.00 1.00 H new ATOM 0 HG3 LYS A 13 14.913 7.457 -3.074 1.00 1.00 H new ATOM 0 HD2 LYS A 13 17.713 7.554 -4.264 1.00 1.00 H new ATOM 0 HD3 LYS A 13 16.233 7.616 -5.199 1.00 1.00 H new ATOM 0 HE2 LYS A 13 15.571 9.669 -3.819 1.00 1.00 H new ATOM 0 HE3 LYS A 13 17.189 9.649 -3.147 1.00 1.00 H new ATOM 0 HZ1 LYS A 13 17.034 11.137 -5.015 1.00 1.00 H new ATOM 0 HZ2 LYS A 13 18.088 9.855 -5.376 1.00 1.00 H new ATOM 0 HZ3 LYS A 13 16.520 9.874 -6.027 1.00 1.00 H new ATOM 206 N PHE A 14 14.279 7.778 0.581 1.00 1.00 N ATOM 207 CA PHE A 14 12.928 7.894 1.128 1.00 1.00 C ATOM 208 C PHE A 14 12.586 9.350 1.422 1.00 1.00 C ATOM 209 O PHE A 14 11.460 9.782 1.169 1.00 1.00 O ATOM 210 CB PHE A 14 12.851 7.049 2.419 1.00 1.00 C ATOM 211 CG PHE A 14 11.719 7.367 3.378 1.00 1.00 C ATOM 212 CD1 PHE A 14 10.392 7.377 2.918 1.00 1.00 C ATOM 213 CD2 PHE A 14 11.988 7.655 4.730 1.00 1.00 C ATOM 214 CE1 PHE A 14 9.331 7.652 3.799 1.00 1.00 C ATOM 215 CE2 PHE A 14 10.931 7.932 5.613 1.00 1.00 C ATOM 216 CZ PHE A 14 9.603 7.922 5.151 1.00 1.00 C ATOM 0 H PHE A 14 14.866 7.131 1.107 1.00 1.00 H new ATOM 0 HA PHE A 14 12.205 7.528 0.399 1.00 1.00 H new ATOM 0 HB2 PHE A 14 12.770 6.000 2.134 1.00 1.00 H new ATOM 0 HB3 PHE A 14 13.793 7.162 2.956 1.00 1.00 H new ATOM 0 HD1 PHE A 14 10.185 7.172 1.878 1.00 1.00 H new ATOM 0 HD2 PHE A 14 13.007 7.663 5.088 1.00 1.00 H new ATOM 0 HE1 PHE A 14 8.313 7.656 3.439 1.00 1.00 H new ATOM 0 HE2 PHE A 14 11.139 8.153 6.649 1.00 1.00 H new ATOM 0 HZ PHE A 14 8.792 8.122 5.835 1.00 1.00 H new ATOM 226 N GLU A 15 13.533 10.111 1.970 1.00 1.00 N ATOM 227 CA GLU A 15 13.274 11.514 2.230 1.00 1.00 C ATOM 228 C GLU A 15 13.434 12.373 0.968 1.00 1.00 C ATOM 229 O GLU A 15 12.699 13.352 0.832 1.00 1.00 O ATOM 230 CB GLU A 15 14.071 12.016 3.443 1.00 1.00 C ATOM 231 CG GLU A 15 15.450 12.607 3.142 1.00 1.00 C ATOM 232 CD GLU A 15 16.057 13.197 4.398 1.00 1.00 C ATOM 233 OE1 GLU A 15 15.590 14.288 4.805 1.00 1.00 O ATOM 234 OE2 GLU A 15 16.959 12.553 4.977 1.00 1.00 O ATOM 0 H GLU A 15 14.462 9.784 2.235 1.00 1.00 H new ATOM 0 HA GLU A 15 12.225 11.620 2.507 1.00 1.00 H new ATOM 0 HB2 GLU A 15 13.477 12.773 3.955 1.00 1.00 H new ATOM 0 HB3 GLU A 15 14.197 11.186 4.138 1.00 1.00 H new ATOM 0 HG2 GLU A 15 16.105 11.833 2.743 1.00 1.00 H new ATOM 0 HG3 GLU A 15 15.363 13.377 2.376 1.00 1.00 H new ATOM 241 N ASN A 16 14.387 12.047 0.080 1.00 1.00 N ATOM 242 CA ASN A 16 14.862 12.894 -1.007 1.00 1.00 C ATOM 243 C ASN A 16 14.020 12.768 -2.264 1.00 1.00 C ATOM 244 O ASN A 16 13.795 13.794 -2.904 1.00 1.00 O ATOM 245 CB ASN A 16 16.319 12.571 -1.376 1.00 1.00 C ATOM 246 CG ASN A 16 17.304 13.420 -0.592 1.00 1.00 C ATOM 247 OD1 ASN A 16 17.859 14.384 -1.113 1.00 1.00 O ATOM 248 ND2 ASN A 16 17.534 13.083 0.660 1.00 1.00 N ATOM 0 H ASN A 16 14.863 11.145 0.108 1.00 1.00 H new ATOM 0 HA ASN A 16 14.784 13.914 -0.631 1.00 1.00 H new ATOM 0 HB2 ASN A 16 16.516 11.516 -1.185 1.00 1.00 H new ATOM 0 HB3 ASN A 16 16.468 12.735 -2.443 1.00 1.00 H new ATOM 0 HD21 ASN A 16 18.187 13.628 1.223 1.00 1.00 H new ATOM 0 HD22 ASN A 16 17.059 12.277 1.067 1.00 1.00 H new ATOM 255 N GLU A 17 13.619 11.558 -2.678 1.00 1.00 N ATOM 256 CA GLU A 17 12.687 11.430 -3.794 1.00 1.00 C ATOM 257 C GLU A 17 11.436 12.301 -3.579 1.00 1.00 C ATOM 258 O GLU A 17 10.657 12.076 -2.650 1.00 1.00 O ATOM 259 CB GLU A 17 12.282 9.963 -3.975 1.00 1.00 C ATOM 260 CG GLU A 17 13.139 9.184 -4.954 1.00 1.00 C ATOM 261 CD GLU A 17 12.350 8.025 -5.561 1.00 1.00 C ATOM 262 OE1 GLU A 17 11.472 8.292 -6.406 1.00 1.00 O ATOM 263 OE2 GLU A 17 12.641 6.847 -5.257 1.00 1.00 O ATOM 0 H GLU A 17 13.920 10.676 -2.265 1.00 1.00 H new ATOM 0 HA GLU A 17 13.190 11.778 -4.696 1.00 1.00 H new ATOM 0 HB2 GLU A 17 12.321 9.467 -3.005 1.00 1.00 H new ATOM 0 HB3 GLU A 17 11.246 9.925 -4.311 1.00 1.00 H new ATOM 0 HG2 GLU A 17 13.488 9.846 -5.746 1.00 1.00 H new ATOM 0 HG3 GLU A 17 14.024 8.801 -4.445 1.00 1.00 H new ATOM 270 N GLU A 18 11.187 13.245 -4.494 1.00 1.00 N ATOM 271 CA GLU A 18 9.978 14.063 -4.536 1.00 1.00 C ATOM 272 C GLU A 18 8.728 13.191 -4.673 1.00 1.00 C ATOM 273 O GLU A 18 7.634 13.618 -4.306 1.00 1.00 O ATOM 274 CB GLU A 18 10.063 15.024 -5.732 1.00 1.00 C ATOM 275 CG GLU A 18 10.915 16.268 -5.465 1.00 1.00 C ATOM 276 CD GLU A 18 10.136 17.375 -4.751 1.00 1.00 C ATOM 277 OE1 GLU A 18 9.623 17.153 -3.631 1.00 1.00 O ATOM 278 OE2 GLU A 18 10.048 18.495 -5.306 1.00 1.00 O ATOM 0 H GLU A 18 11.842 13.464 -5.245 1.00 1.00 H new ATOM 0 HA GLU A 18 9.904 14.623 -3.604 1.00 1.00 H new ATOM 0 HB2 GLU A 18 10.476 14.489 -6.587 1.00 1.00 H new ATOM 0 HB3 GLU A 18 9.056 15.337 -6.007 1.00 1.00 H new ATOM 0 HG2 GLU A 18 11.778 15.989 -4.861 1.00 1.00 H new ATOM 0 HG3 GLU A 18 11.298 16.651 -6.411 1.00 1.00 H new ATOM 285 N PHE A 19 8.878 11.949 -5.146 1.00 1.00 N ATOM 286 CA PHE A 19 7.817 10.975 -5.183 1.00 1.00 C ATOM 287 C PHE A 19 7.230 10.816 -3.778 1.00 1.00 C ATOM 288 O PHE A 19 6.008 10.810 -3.625 1.00 1.00 O ATOM 289 CB PHE A 19 8.380 9.664 -5.750 1.00 1.00 C ATOM 290 CG PHE A 19 7.316 8.615 -5.975 1.00 1.00 C ATOM 291 CD1 PHE A 19 6.797 7.923 -4.871 1.00 1.00 C ATOM 292 CD2 PHE A 19 6.773 8.403 -7.254 1.00 1.00 C ATOM 293 CE1 PHE A 19 5.676 7.089 -5.029 1.00 1.00 C ATOM 294 CE2 PHE A 19 5.658 7.562 -7.413 1.00 1.00 C ATOM 295 CZ PHE A 19 5.083 6.935 -6.296 1.00 1.00 C ATOM 0 H PHE A 19 9.762 11.601 -5.517 1.00 1.00 H new ATOM 0 HA PHE A 19 7.002 11.294 -5.833 1.00 1.00 H new ATOM 0 HB2 PHE A 19 8.885 9.870 -6.694 1.00 1.00 H new ATOM 0 HB3 PHE A 19 9.131 9.271 -5.065 1.00 1.00 H new ATOM 0 HD1 PHE A 19 7.258 8.031 -3.900 1.00 1.00 H new ATOM 0 HD2 PHE A 19 7.212 8.886 -8.114 1.00 1.00 H new ATOM 0 HE1 PHE A 19 5.269 6.566 -4.176 1.00 1.00 H new ATOM 0 HE2 PHE A 19 5.243 7.398 -8.396 1.00 1.00 H new ATOM 0 HZ PHE A 19 4.190 6.338 -6.409 1.00 1.00 H new ATOM 305 N PHE A 20 8.068 10.708 -2.743 1.00 1.00 N ATOM 306 CA PHE A 20 7.580 10.556 -1.382 1.00 1.00 C ATOM 307 C PHE A 20 6.968 11.842 -0.879 1.00 1.00 C ATOM 308 O PHE A 20 5.947 11.783 -0.200 1.00 1.00 O ATOM 309 CB PHE A 20 8.700 10.121 -0.425 1.00 1.00 C ATOM 310 CG PHE A 20 9.176 8.721 -0.706 1.00 1.00 C ATOM 311 CD1 PHE A 20 10.165 8.493 -1.663 1.00 1.00 C ATOM 312 CD2 PHE A 20 8.562 7.637 -0.086 1.00 1.00 C ATOM 313 CE1 PHE A 20 10.503 7.194 -2.077 1.00 1.00 C ATOM 314 CE2 PHE A 20 8.837 6.344 -0.540 1.00 1.00 C ATOM 315 CZ PHE A 20 9.803 6.107 -1.533 1.00 1.00 C ATOM 0 H PHE A 20 9.084 10.724 -2.828 1.00 1.00 H new ATOM 0 HA PHE A 20 6.817 9.778 -1.405 1.00 1.00 H new ATOM 0 HB2 PHE A 20 9.538 10.812 -0.512 1.00 1.00 H new ATOM 0 HB3 PHE A 20 8.342 10.182 0.603 1.00 1.00 H new ATOM 0 HD1 PHE A 20 10.683 9.336 -2.096 1.00 1.00 H new ATOM 0 HD2 PHE A 20 7.880 7.793 0.737 1.00 1.00 H new ATOM 0 HE1 PHE A 20 11.288 7.035 -2.801 1.00 1.00 H new ATOM 0 HE2 PHE A 20 8.296 5.510 -0.119 1.00 1.00 H new ATOM 0 HZ PHE A 20 10.004 5.102 -1.873 1.00 1.00 H new ATOM 325 N ARG A 21 7.553 12.998 -1.188 1.00 1.00 N ATOM 326 CA ARG A 21 7.005 14.268 -0.728 1.00 1.00 C ATOM 327 C ARG A 21 5.634 14.545 -1.320 1.00 1.00 C ATOM 328 O ARG A 21 4.783 15.083 -0.616 1.00 1.00 O ATOM 329 CB ARG A 21 7.958 15.406 -1.094 1.00 1.00 C ATOM 330 CG ARG A 21 9.241 15.448 -0.263 1.00 1.00 C ATOM 331 CD ARG A 21 8.972 15.647 1.237 1.00 1.00 C ATOM 332 NE ARG A 21 10.163 16.157 1.931 1.00 1.00 N ATOM 333 CZ ARG A 21 10.653 17.399 1.871 1.00 1.00 C ATOM 334 NH1 ARG A 21 9.977 18.362 1.251 1.00 1.00 N ATOM 335 NH2 ARG A 21 11.822 17.676 2.434 1.00 1.00 N ATOM 0 H ARG A 21 8.400 13.079 -1.751 1.00 1.00 H new ATOM 0 HA ARG A 21 6.894 14.204 0.354 1.00 1.00 H new ATOM 0 HB2 ARG A 21 8.225 15.316 -2.147 1.00 1.00 H new ATOM 0 HB3 ARG A 21 7.433 16.354 -0.978 1.00 1.00 H new ATOM 0 HG2 ARG A 21 9.793 14.520 -0.408 1.00 1.00 H new ATOM 0 HG3 ARG A 21 9.876 16.257 -0.624 1.00 1.00 H new ATOM 0 HD2 ARG A 21 8.145 16.344 1.371 1.00 1.00 H new ATOM 0 HD3 ARG A 21 8.667 14.700 1.682 1.00 1.00 H new ATOM 0 HE ARG A 21 10.668 15.494 2.519 1.00 1.00 H new ATOM 0 HH11 ARG A 21 9.077 18.155 0.817 1.00 1.00 H new ATOM 0 HH12 ARG A 21 10.358 19.307 1.210 1.00 1.00 H new ATOM 0 HH21 ARG A 21 12.345 16.942 2.911 1.00 1.00 H new ATOM 0 HH22 ARG A 21 12.198 18.623 2.389 1.00 1.00 H new ATOM 349 N LYS A 22 5.382 14.136 -2.564 1.00 1.00 N ATOM 350 CA LYS A 22 4.069 14.282 -3.172 1.00 1.00 C ATOM 351 C LYS A 22 3.025 13.541 -2.346 1.00 1.00 C ATOM 352 O LYS A 22 1.972 14.096 -2.061 1.00 1.00 O ATOM 353 CB LYS A 22 4.099 13.791 -4.628 1.00 1.00 C ATOM 354 CG LYS A 22 4.691 14.866 -5.549 1.00 1.00 C ATOM 355 CD LYS A 22 4.861 14.347 -6.980 1.00 1.00 C ATOM 356 CE LYS A 22 5.161 15.505 -7.937 1.00 1.00 C ATOM 357 NZ LYS A 22 5.430 15.032 -9.308 1.00 1.00 N ATOM 0 H LYS A 22 6.077 13.699 -3.169 1.00 1.00 H new ATOM 0 HA LYS A 22 3.793 15.336 -3.187 1.00 1.00 H new ATOM 0 HB2 LYS A 22 4.691 12.879 -4.698 1.00 1.00 H new ATOM 0 HB3 LYS A 22 3.089 13.541 -4.954 1.00 1.00 H new ATOM 0 HG2 LYS A 22 4.041 15.741 -5.553 1.00 1.00 H new ATOM 0 HG3 LYS A 22 5.657 15.188 -5.160 1.00 1.00 H new ATOM 0 HD2 LYS A 22 5.671 13.619 -7.015 1.00 1.00 H new ATOM 0 HD3 LYS A 22 3.954 13.831 -7.296 1.00 1.00 H new ATOM 0 HE2 LYS A 22 4.316 16.193 -7.950 1.00 1.00 H new ATOM 0 HE3 LYS A 22 6.022 16.064 -7.571 1.00 1.00 H new ATOM 0 HZ1 LYS A 22 5.628 15.846 -9.924 1.00 1.00 H new ATOM 0 HZ2 LYS A 22 6.252 14.395 -9.301 1.00 1.00 H new ATOM 0 HZ3 LYS A 22 4.599 14.520 -9.668 1.00 1.00 H new ATOM 371 N LEU A 23 3.289 12.282 -1.994 1.00 1.00 N ATOM 372 CA LEU A 23 2.333 11.464 -1.236 1.00 1.00 C ATOM 373 C LEU A 23 2.324 11.864 0.235 1.00 1.00 C ATOM 374 O LEU A 23 1.330 11.669 0.931 1.00 1.00 O ATOM 375 CB LEU A 23 2.660 9.979 -1.390 1.00 1.00 C ATOM 376 CG LEU A 23 2.831 9.554 -2.856 1.00 1.00 C ATOM 377 CD1 LEU A 23 2.719 8.041 -3.027 1.00 1.00 C ATOM 378 CD2 LEU A 23 1.867 10.233 -3.837 1.00 1.00 C ATOM 0 H LEU A 23 4.160 11.802 -2.221 1.00 1.00 H new ATOM 0 HA LEU A 23 1.336 11.641 -1.640 1.00 1.00 H new ATOM 0 HB2 LEU A 23 3.576 9.755 -0.843 1.00 1.00 H new ATOM 0 HB3 LEU A 23 1.865 9.388 -0.936 1.00 1.00 H new ATOM 0 HG LEU A 23 3.837 9.890 -3.107 1.00 1.00 H new ATOM 0 HD11 LEU A 23 2.846 7.783 -4.078 1.00 1.00 H new ATOM 0 HD12 LEU A 23 3.493 7.550 -2.437 1.00 1.00 H new ATOM 0 HD13 LEU A 23 1.738 7.708 -2.688 1.00 1.00 H new ATOM 0 HD21 LEU A 23 2.061 9.872 -4.847 1.00 1.00 H new ATOM 0 HD22 LEU A 23 0.840 9.998 -3.559 1.00 1.00 H new ATOM 0 HD23 LEU A 23 2.014 11.313 -3.803 1.00 1.00 H new ATOM 390 N SER A 24 3.428 12.475 0.660 1.00 1.00 N ATOM 391 CA SER A 24 3.658 13.088 1.937 1.00 1.00 C ATOM 392 C SER A 24 3.439 12.127 3.114 1.00 1.00 C ATOM 393 O SER A 24 3.464 10.893 2.993 1.00 1.00 O ATOM 394 CB SER A 24 2.782 14.353 1.995 1.00 1.00 C ATOM 395 OG SER A 24 3.303 15.316 2.885 1.00 1.00 O ATOM 0 H SER A 24 4.246 12.552 0.056 1.00 1.00 H new ATOM 0 HA SER A 24 4.707 13.367 2.040 1.00 1.00 H new ATOM 0 HB2 SER A 24 2.704 14.786 0.998 1.00 1.00 H new ATOM 0 HB3 SER A 24 1.773 14.081 2.305 1.00 1.00 H new ATOM 0 HG SER A 24 2.720 16.104 2.892 1.00 1.00 H new ATOM 401 N ARG A 25 3.355 12.725 4.297 1.00 1.00 N ATOM 402 CA ARG A 25 2.885 12.129 5.544 1.00 1.00 C ATOM 403 C ARG A 25 1.375 12.408 5.607 1.00 1.00 C ATOM 404 O ARG A 25 0.862 13.061 4.699 1.00 1.00 O ATOM 405 CB ARG A 25 3.713 12.691 6.717 1.00 1.00 C ATOM 406 CG ARG A 25 5.224 12.567 6.408 1.00 1.00 C ATOM 407 CD ARG A 25 6.142 13.145 7.478 1.00 1.00 C ATOM 408 NE ARG A 25 7.529 13.224 6.973 1.00 1.00 N ATOM 409 CZ ARG A 25 8.093 14.234 6.295 1.00 1.00 C ATOM 410 NH1 ARG A 25 7.403 15.332 6.006 1.00 1.00 N ATOM 411 NH2 ARG A 25 9.356 14.139 5.896 1.00 1.00 N ATOM 0 H ARG A 25 3.630 13.700 4.419 1.00 1.00 H new ATOM 0 HA ARG A 25 3.025 11.050 5.603 1.00 1.00 H new ATOM 0 HB2 ARG A 25 3.453 13.736 6.888 1.00 1.00 H new ATOM 0 HB3 ARG A 25 3.475 12.149 7.633 1.00 1.00 H new ATOM 0 HG2 ARG A 25 5.468 11.514 6.270 1.00 1.00 H new ATOM 0 HG3 ARG A 25 5.430 13.068 5.462 1.00 1.00 H new ATOM 0 HD2 ARG A 25 5.796 14.137 7.767 1.00 1.00 H new ATOM 0 HD3 ARG A 25 6.108 12.522 8.372 1.00 1.00 H new ATOM 0 HE ARG A 25 8.125 12.418 7.162 1.00 1.00 H new ATOM 0 HH11 ARG A 25 6.430 15.415 6.301 1.00 1.00 H new ATOM 0 HH12 ARG A 25 7.846 16.092 5.490 1.00 1.00 H new ATOM 0 HH21 ARG A 25 9.895 13.299 6.105 1.00 1.00 H new ATOM 0 HH22 ARG A 25 9.787 14.906 5.380 1.00 1.00 H new ATOM 425 N GLU A 26 0.660 11.950 6.632 1.00 1.00 N ATOM 426 CA GLU A 26 -0.798 11.742 6.635 1.00 1.00 C ATOM 427 C GLU A 26 -1.639 12.733 5.792 1.00 1.00 C ATOM 428 O GLU A 26 -1.880 13.872 6.193 1.00 1.00 O ATOM 429 CB GLU A 26 -1.286 11.667 8.090 1.00 1.00 C ATOM 430 CG GLU A 26 -1.054 12.945 8.929 1.00 1.00 C ATOM 431 CD GLU A 26 -0.240 12.693 10.199 1.00 1.00 C ATOM 432 OE1 GLU A 26 1.010 12.687 10.130 1.00 1.00 O ATOM 433 OE2 GLU A 26 -0.837 12.541 11.290 1.00 1.00 O ATOM 0 H GLU A 26 1.092 11.702 7.522 1.00 1.00 H new ATOM 0 HA GLU A 26 -0.965 10.797 6.118 1.00 1.00 H new ATOM 0 HB2 GLU A 26 -2.353 11.442 8.088 1.00 1.00 H new ATOM 0 HB3 GLU A 26 -0.785 10.833 8.582 1.00 1.00 H new ATOM 0 HG2 GLU A 26 -0.539 13.685 8.316 1.00 1.00 H new ATOM 0 HG3 GLU A 26 -2.019 13.372 9.202 1.00 1.00 H new ATOM 440 N CYS A 27 -2.118 12.290 4.622 1.00 1.00 N ATOM 441 CA CYS A 27 -2.937 13.041 3.668 1.00 1.00 C ATOM 442 C CYS A 27 -4.207 12.274 3.286 1.00 1.00 C ATOM 443 O CYS A 27 -4.453 11.174 3.770 1.00 1.00 O ATOM 444 CB CYS A 27 -2.122 13.391 2.413 1.00 1.00 C ATOM 445 SG CYS A 27 -0.958 14.733 2.764 1.00 1.00 S ATOM 0 H CYS A 27 -1.932 11.341 4.299 1.00 1.00 H new ATOM 0 HA CYS A 27 -3.244 13.966 4.156 1.00 1.00 H new ATOM 0 HB2 CYS A 27 -1.578 12.511 2.069 1.00 1.00 H new ATOM 0 HB3 CYS A 27 -2.794 13.686 1.607 1.00 1.00 H new ATOM 0 HG CYS A 27 -0.044 14.310 3.586 1.00 1.00 H new ATOM 451 N GLU A 28 -5.045 12.870 2.441 1.00 1.00 N ATOM 452 CA GLU A 28 -6.255 12.246 1.909 1.00 1.00 C ATOM 453 C GLU A 28 -5.918 11.363 0.698 1.00 1.00 C ATOM 454 O GLU A 28 -5.076 11.723 -0.136 1.00 1.00 O ATOM 455 CB GLU A 28 -7.264 13.349 1.541 1.00 1.00 C ATOM 456 CG GLU A 28 -8.635 12.807 1.087 1.00 1.00 C ATOM 457 CD GLU A 28 -9.620 13.909 0.679 1.00 1.00 C ATOM 458 OE1 GLU A 28 -9.548 15.028 1.234 1.00 1.00 O ATOM 459 OE2 GLU A 28 -10.519 13.660 -0.154 1.00 1.00 O ATOM 0 H GLU A 28 -4.899 13.820 2.100 1.00 1.00 H new ATOM 0 HA GLU A 28 -6.701 11.599 2.664 1.00 1.00 H new ATOM 0 HB2 GLU A 28 -7.408 14.000 2.403 1.00 1.00 H new ATOM 0 HB3 GLU A 28 -6.844 13.963 0.744 1.00 1.00 H new ATOM 0 HG2 GLU A 28 -8.489 12.130 0.245 1.00 1.00 H new ATOM 0 HG3 GLU A 28 -9.072 12.221 1.896 1.00 1.00 H new ATOM 466 N ILE A 29 -6.620 10.233 0.571 1.00 1.00 N ATOM 467 CA ILE A 29 -6.476 9.232 -0.483 1.00 1.00 C ATOM 468 C ILE A 29 -7.842 8.788 -1.001 1.00 1.00 C ATOM 469 O ILE A 29 -8.854 8.883 -0.302 1.00 1.00 O ATOM 470 CB ILE A 29 -5.686 7.999 0.015 1.00 1.00 C ATOM 471 CG1 ILE A 29 -6.365 7.396 1.258 1.00 1.00 C ATOM 472 CG2 ILE A 29 -4.219 8.368 0.273 1.00 1.00 C ATOM 473 CD1 ILE A 29 -5.841 6.021 1.660 1.00 1.00 C ATOM 0 H ILE A 29 -7.346 9.980 1.242 1.00 1.00 H new ATOM 0 HA ILE A 29 -5.919 9.697 -1.296 1.00 1.00 H new ATOM 0 HB ILE A 29 -5.691 7.233 -0.760 1.00 1.00 H new ATOM 0 HG12 ILE A 29 -6.234 8.080 2.096 1.00 1.00 H new ATOM 0 HG13 ILE A 29 -7.436 7.322 1.072 1.00 1.00 H new ATOM 0 HG21 ILE A 29 -3.679 7.488 0.623 1.00 1.00 H new ATOM 0 HG22 ILE A 29 -3.767 8.728 -0.651 1.00 1.00 H new ATOM 0 HG23 ILE A 29 -4.168 9.150 1.031 1.00 1.00 H new ATOM 0 HD11 ILE A 29 -6.375 5.672 2.544 1.00 1.00 H new ATOM 0 HD12 ILE A 29 -5.997 5.318 0.841 1.00 1.00 H new ATOM 0 HD13 ILE A 29 -4.776 6.088 1.882 1.00 1.00 H new ATOM 485 N LYS A 30 -7.837 8.238 -2.214 1.00 1.00 N ATOM 486 CA LYS A 30 -9.021 7.667 -2.878 1.00 1.00 C ATOM 487 C LYS A 30 -8.651 6.405 -3.641 1.00 1.00 C ATOM 488 O LYS A 30 -7.670 6.424 -4.367 1.00 1.00 O ATOM 489 CB LYS A 30 -9.659 8.712 -3.823 1.00 1.00 C ATOM 490 CG LYS A 30 -10.649 9.559 -3.016 1.00 1.00 C ATOM 491 CD LYS A 30 -11.372 10.711 -3.721 1.00 1.00 C ATOM 492 CE LYS A 30 -12.223 10.307 -4.926 1.00 1.00 C ATOM 493 NZ LYS A 30 -13.502 9.708 -4.502 1.00 1.00 N ATOM 0 H LYS A 30 -6.992 8.173 -2.781 1.00 1.00 H new ATOM 0 HA LYS A 30 -9.752 7.398 -2.116 1.00 1.00 H new ATOM 0 HB2 LYS A 30 -8.888 9.346 -4.262 1.00 1.00 H new ATOM 0 HB3 LYS A 30 -10.170 8.215 -4.647 1.00 1.00 H new ATOM 0 HG2 LYS A 30 -11.408 8.888 -2.614 1.00 1.00 H new ATOM 0 HG3 LYS A 30 -10.111 9.977 -2.165 1.00 1.00 H new ATOM 0 HD2 LYS A 30 -12.013 11.214 -2.997 1.00 1.00 H new ATOM 0 HD3 LYS A 30 -10.629 11.438 -4.049 1.00 1.00 H new ATOM 0 HE2 LYS A 30 -12.417 11.182 -5.547 1.00 1.00 H new ATOM 0 HE3 LYS A 30 -11.672 9.596 -5.541 1.00 1.00 H new ATOM 0 HZ1 LYS A 30 -13.882 9.121 -5.272 1.00 1.00 H new ATOM 0 HZ2 LYS A 30 -13.347 9.117 -3.660 1.00 1.00 H new ATOM 0 HZ3 LYS A 30 -14.180 10.463 -4.275 1.00 1.00 H new ATOM 507 N TYR A 31 -9.400 5.305 -3.510 1.00 1.00 N ATOM 508 CA TYR A 31 -9.218 4.139 -4.378 1.00 1.00 C ATOM 509 C TYR A 31 -9.522 4.569 -5.819 1.00 1.00 C ATOM 510 O TYR A 31 -10.545 5.219 -6.021 1.00 1.00 O ATOM 511 CB TYR A 31 -10.141 3.002 -3.905 1.00 1.00 C ATOM 512 CG TYR A 31 -9.808 1.635 -4.485 1.00 1.00 C ATOM 513 CD1 TYR A 31 -9.868 1.395 -5.870 1.00 1.00 C ATOM 514 CD2 TYR A 31 -9.371 0.604 -3.633 1.00 1.00 C ATOM 515 CE1 TYR A 31 -9.434 0.176 -6.402 1.00 1.00 C ATOM 516 CE2 TYR A 31 -8.943 -0.631 -4.161 1.00 1.00 C ATOM 517 CZ TYR A 31 -8.980 -0.844 -5.554 1.00 1.00 C ATOM 518 OH TYR A 31 -8.686 -2.045 -6.109 1.00 1.00 O ATOM 0 H TYR A 31 -10.136 5.199 -2.812 1.00 1.00 H new ATOM 0 HA TYR A 31 -8.195 3.765 -4.334 1.00 1.00 H new ATOM 0 HB2 TYR A 31 -10.095 2.942 -2.818 1.00 1.00 H new ATOM 0 HB3 TYR A 31 -11.169 3.253 -4.167 1.00 1.00 H new ATOM 0 HD1 TYR A 31 -10.253 2.159 -6.529 1.00 1.00 H new ATOM 0 HD2 TYR A 31 -9.363 0.760 -2.564 1.00 1.00 H new ATOM 0 HE1 TYR A 31 -9.449 0.020 -7.471 1.00 1.00 H new ATOM 0 HE2 TYR A 31 -8.589 -1.410 -3.502 1.00 1.00 H new ATOM 0 HH TYR A 31 -8.164 -2.580 -5.475 1.00 1.00 H new ATOM 528 N THR A 32 -8.727 4.185 -6.824 1.00 1.00 N ATOM 529 CA THR A 32 -8.958 4.547 -8.220 1.00 1.00 C ATOM 530 C THR A 32 -8.772 3.289 -9.063 1.00 1.00 C ATOM 531 O THR A 32 -7.664 2.965 -9.479 1.00 1.00 O ATOM 532 CB THR A 32 -8.077 5.730 -8.667 1.00 1.00 C ATOM 533 OG1 THR A 32 -6.693 5.477 -8.540 1.00 1.00 O ATOM 534 CG2 THR A 32 -8.393 6.992 -7.861 1.00 1.00 C ATOM 0 H THR A 32 -7.897 3.608 -6.686 1.00 1.00 H new ATOM 0 HA THR A 32 -9.976 4.911 -8.355 1.00 1.00 H new ATOM 0 HB THR A 32 -8.312 5.872 -9.722 1.00 1.00 H new ATOM 0 HG1 THR A 32 -6.504 4.552 -8.802 1.00 1.00 H new ATOM 0 HG21 THR A 32 -7.756 7.809 -8.199 1.00 1.00 H new ATOM 0 HG22 THR A 32 -9.439 7.264 -8.006 1.00 1.00 H new ATOM 0 HG23 THR A 32 -8.210 6.803 -6.803 1.00 1.00 H new ATOM 542 N GLY A 33 -9.863 2.552 -9.245 1.00 1.00 N ATOM 543 CA GLY A 33 -9.906 1.304 -9.987 1.00 1.00 C ATOM 544 C GLY A 33 -11.349 0.845 -10.127 1.00 1.00 C ATOM 545 O GLY A 33 -12.238 1.673 -10.343 1.00 1.00 O ATOM 0 H GLY A 33 -10.771 2.819 -8.865 1.00 1.00 H new ATOM 0 HA2 GLY A 33 -9.459 1.439 -10.972 1.00 1.00 H new ATOM 0 HA3 GLY A 33 -9.320 0.543 -9.473 1.00 1.00 H new ATOM 549 N PHE A 34 -11.604 -0.460 -9.989 1.00 1.00 N ATOM 550 CA PHE A 34 -12.873 -1.096 -10.297 1.00 1.00 C ATOM 551 C PHE A 34 -14.032 -0.489 -9.486 1.00 1.00 C ATOM 552 O PHE A 34 -15.171 -0.520 -9.954 1.00 1.00 O ATOM 553 CB PHE A 34 -12.710 -2.624 -10.152 1.00 1.00 C ATOM 554 CG PHE A 34 -13.988 -3.359 -9.835 1.00 1.00 C ATOM 555 CD1 PHE A 34 -14.471 -3.272 -8.523 1.00 1.00 C ATOM 556 CD2 PHE A 34 -14.723 -4.038 -10.824 1.00 1.00 C ATOM 557 CE1 PHE A 34 -15.735 -3.798 -8.206 1.00 1.00 C ATOM 558 CE2 PHE A 34 -15.958 -4.621 -10.490 1.00 1.00 C ATOM 559 CZ PHE A 34 -16.467 -4.491 -9.185 1.00 1.00 C ATOM 0 H PHE A 34 -10.904 -1.118 -9.648 1.00 1.00 H new ATOM 0 HA PHE A 34 -13.154 -0.900 -11.332 1.00 1.00 H new ATOM 0 HB2 PHE A 34 -12.296 -3.023 -11.078 1.00 1.00 H new ATOM 0 HB3 PHE A 34 -11.984 -2.827 -9.365 1.00 1.00 H new ATOM 0 HD1 PHE A 34 -13.873 -2.802 -7.756 1.00 1.00 H new ATOM 0 HD2 PHE A 34 -14.342 -4.111 -11.832 1.00 1.00 H new ATOM 0 HE1 PHE A 34 -16.142 -3.670 -7.214 1.00 1.00 H new ATOM 0 HE2 PHE A 34 -16.516 -5.169 -11.235 1.00 1.00 H new ATOM 0 HZ PHE A 34 -17.424 -4.925 -8.935 1.00 1.00 H new ATOM 569 N ARG A 35 -13.748 0.183 -8.360 1.00 1.00 N ATOM 570 CA ARG A 35 -14.695 0.995 -7.570 1.00 1.00 C ATOM 571 C ARG A 35 -15.441 2.069 -8.371 1.00 1.00 C ATOM 572 O ARG A 35 -16.248 2.794 -7.797 1.00 1.00 O ATOM 573 CB ARG A 35 -13.988 1.675 -6.374 1.00 1.00 C ATOM 574 CG ARG A 35 -13.051 2.850 -6.751 1.00 1.00 C ATOM 575 CD ARG A 35 -13.658 4.265 -6.611 1.00 1.00 C ATOM 576 NE ARG A 35 -13.478 5.095 -7.820 1.00 1.00 N ATOM 577 CZ ARG A 35 -12.979 6.338 -7.914 1.00 1.00 C ATOM 578 NH1 ARG A 35 -12.527 7.019 -6.873 1.00 1.00 N ATOM 579 NH2 ARG A 35 -12.940 6.932 -9.097 1.00 1.00 N ATOM 0 H ARG A 35 -12.812 0.177 -7.955 1.00 1.00 H new ATOM 0 HA ARG A 35 -15.439 0.277 -7.224 1.00 1.00 H new ATOM 0 HB2 ARG A 35 -14.747 2.042 -5.683 1.00 1.00 H new ATOM 0 HB3 ARG A 35 -13.407 0.924 -5.839 1.00 1.00 H new ATOM 0 HG2 ARG A 35 -12.159 2.794 -6.126 1.00 1.00 H new ATOM 0 HG3 ARG A 35 -12.726 2.715 -7.783 1.00 1.00 H new ATOM 0 HD2 ARG A 35 -14.722 4.177 -6.393 1.00 1.00 H new ATOM 0 HD3 ARG A 35 -13.199 4.768 -5.760 1.00 1.00 H new ATOM 0 HE ARG A 35 -13.771 4.668 -8.699 1.00 1.00 H new ATOM 0 HH11 ARG A 35 -12.548 6.602 -5.943 1.00 1.00 H new ATOM 0 HH12 ARG A 35 -12.158 7.961 -7.001 1.00 1.00 H new ATOM 0 HH21 ARG A 35 -13.287 6.445 -9.924 1.00 1.00 H new ATOM 0 HH22 ARG A 35 -12.563 7.876 -9.181 1.00 1.00 H new ATOM 593 N ASP A 36 -15.177 2.224 -9.659 1.00 1.00 N ATOM 594 CA ASP A 36 -16.055 3.004 -10.546 1.00 1.00 C ATOM 595 C ASP A 36 -17.387 2.338 -10.908 1.00 1.00 C ATOM 596 O ASP A 36 -18.236 2.995 -11.510 1.00 1.00 O ATOM 597 CB ASP A 36 -15.285 3.628 -11.728 1.00 1.00 C ATOM 598 CG ASP A 36 -14.752 5.025 -11.372 1.00 1.00 C ATOM 599 OD1 ASP A 36 -14.914 5.469 -10.211 1.00 1.00 O ATOM 600 OD2 ASP A 36 -14.115 5.691 -12.216 1.00 1.00 O ATOM 0 H ASP A 36 -14.362 1.823 -10.123 1.00 1.00 H new ATOM 0 HA ASP A 36 -16.396 3.847 -9.944 1.00 1.00 H new ATOM 0 HB2 ASP A 36 -14.454 2.980 -12.007 1.00 1.00 H new ATOM 0 HB3 ASP A 36 -15.941 3.697 -12.596 1.00 1.00 H new ATOM 605 N ARG A 37 -17.657 1.113 -10.442 1.00 1.00 N ATOM 606 CA ARG A 37 -19.018 0.552 -10.394 1.00 1.00 C ATOM 607 C ARG A 37 -19.958 1.387 -9.495 1.00 1.00 C ATOM 608 O ARG A 37 -19.483 2.280 -8.779 1.00 1.00 O ATOM 609 CB ARG A 37 -18.942 -0.911 -9.889 1.00 1.00 C ATOM 610 CG ARG A 37 -18.209 -1.876 -10.831 1.00 1.00 C ATOM 611 CD ARG A 37 -18.830 -2.030 -12.225 1.00 1.00 C ATOM 612 NE ARG A 37 -17.795 -2.340 -13.222 1.00 1.00 N ATOM 613 CZ ARG A 37 -17.901 -3.127 -14.294 1.00 1.00 C ATOM 614 NH1 ARG A 37 -18.996 -3.842 -14.518 1.00 1.00 N ATOM 615 NH2 ARG A 37 -16.887 -3.191 -15.148 1.00 1.00 N ATOM 0 H ARG A 37 -16.940 0.480 -10.087 1.00 1.00 H new ATOM 0 HA ARG A 37 -19.437 0.578 -11.400 1.00 1.00 H new ATOM 0 HB2 ARG A 37 -18.443 -0.921 -8.920 1.00 1.00 H new ATOM 0 HB3 ARG A 37 -19.955 -1.279 -9.730 1.00 1.00 H new ATOM 0 HG2 ARG A 37 -17.180 -1.535 -10.945 1.00 1.00 H new ATOM 0 HG3 ARG A 37 -18.168 -2.858 -10.359 1.00 1.00 H new ATOM 0 HD2 ARG A 37 -19.577 -2.823 -12.210 1.00 1.00 H new ATOM 0 HD3 ARG A 37 -19.346 -1.111 -12.503 1.00 1.00 H new ATOM 0 HE ARG A 37 -16.886 -1.900 -13.077 1.00 1.00 H new ATOM 0 HH11 ARG A 37 -19.778 -3.796 -13.864 1.00 1.00 H new ATOM 0 HH12 ARG A 37 -19.056 -4.437 -15.344 1.00 1.00 H new ATOM 0 HH21 ARG A 37 -16.043 -2.643 -14.980 1.00 1.00 H new ATOM 0 HH22 ARG A 37 -16.952 -3.788 -15.973 1.00 1.00 H new ATOM 629 N PRO A 38 -21.273 1.079 -9.456 1.00 1.00 N ATOM 630 CA PRO A 38 -22.152 1.464 -8.351 1.00 1.00 C ATOM 631 C PRO A 38 -21.594 1.017 -6.996 1.00 1.00 C ATOM 632 O PRO A 38 -20.614 0.277 -6.936 1.00 1.00 O ATOM 633 CB PRO A 38 -23.511 0.812 -8.633 1.00 1.00 C ATOM 634 CG PRO A 38 -23.195 -0.299 -9.630 1.00 1.00 C ATOM 635 CD PRO A 38 -22.035 0.295 -10.420 1.00 1.00 C ATOM 0 HA PRO A 38 -22.239 2.549 -8.291 1.00 1.00 H new ATOM 0 HB2 PRO A 38 -23.958 0.414 -7.722 1.00 1.00 H new ATOM 0 HB3 PRO A 38 -24.218 1.530 -9.048 1.00 1.00 H new ATOM 0 HG2 PRO A 38 -22.914 -1.226 -9.130 1.00 1.00 H new ATOM 0 HG3 PRO A 38 -24.048 -0.527 -10.269 1.00 1.00 H new ATOM 0 HD2 PRO A 38 -21.420 -0.488 -10.864 1.00 1.00 H new ATOM 0 HD3 PRO A 38 -22.395 0.919 -11.238 1.00 1.00 H new ATOM 643 N HIS A 39 -22.199 1.487 -5.903 1.00 1.00 N ATOM 644 CA HIS A 39 -21.861 1.116 -4.531 1.00 1.00 C ATOM 645 C HIS A 39 -22.320 -0.297 -4.220 1.00 1.00 C ATOM 646 O HIS A 39 -22.517 -1.112 -5.118 1.00 1.00 O ATOM 647 CB HIS A 39 -22.505 2.114 -3.542 1.00 1.00 C ATOM 648 CG HIS A 39 -21.422 2.897 -2.892 1.00 1.00 C ATOM 649 ND1 HIS A 39 -20.553 2.474 -1.916 1.00 1.00 N ATOM 650 CD2 HIS A 39 -20.888 3.980 -3.497 1.00 1.00 C ATOM 651 CE1 HIS A 39 -19.484 3.285 -1.954 1.00 1.00 C ATOM 652 NE2 HIS A 39 -19.652 4.230 -2.901 1.00 1.00 N ATOM 0 H HIS A 39 -22.964 2.160 -5.953 1.00 1.00 H new ATOM 0 HA HIS A 39 -20.777 1.152 -4.423 1.00 1.00 H new ATOM 0 HB2 HIS A 39 -23.191 2.779 -4.067 1.00 1.00 H new ATOM 0 HB3 HIS A 39 -23.090 1.581 -2.792 1.00 1.00 H new ATOM 0 HD1 HIS A 39 -20.694 1.689 -1.280 1.00 1.00 H new ATOM 0 HD2 HIS A 39 -21.337 4.549 -4.297 1.00 1.00 H new ATOM 0 HE1 HIS A 39 -18.616 3.194 -1.318 1.00 1.00 H new ATOM 660 N GLU A 40 -22.346 -0.643 -2.927 1.00 1.00 N ATOM 661 CA GLU A 40 -23.157 -1.726 -2.383 1.00 1.00 C ATOM 662 C GLU A 40 -22.484 -3.091 -2.537 1.00 1.00 C ATOM 663 O GLU A 40 -22.799 -4.043 -1.824 1.00 1.00 O ATOM 664 CB GLU A 40 -24.593 -1.541 -2.923 1.00 1.00 C ATOM 665 CG GLU A 40 -25.501 -2.763 -2.814 1.00 1.00 C ATOM 666 CD GLU A 40 -26.839 -2.451 -3.474 1.00 1.00 C ATOM 667 OE1 GLU A 40 -27.704 -1.829 -2.811 1.00 1.00 O ATOM 668 OE2 GLU A 40 -27.016 -2.800 -4.666 1.00 1.00 O ATOM 0 H GLU A 40 -21.790 -0.164 -2.219 1.00 1.00 H new ATOM 0 HA GLU A 40 -23.245 -1.686 -1.297 1.00 1.00 H new ATOM 0 HB2 GLU A 40 -25.060 -0.715 -2.387 1.00 1.00 H new ATOM 0 HB3 GLU A 40 -24.533 -1.248 -3.971 1.00 1.00 H new ATOM 0 HG2 GLU A 40 -25.035 -3.622 -3.297 1.00 1.00 H new ATOM 0 HG3 GLU A 40 -25.651 -3.028 -1.767 1.00 1.00 H new ATOM 675 N GLU A 41 -21.473 -3.138 -3.391 1.00 1.00 N ATOM 676 CA GLU A 41 -20.711 -4.315 -3.774 1.00 1.00 C ATOM 677 C GLU A 41 -19.230 -3.954 -3.666 1.00 1.00 C ATOM 678 O GLU A 41 -18.473 -4.590 -2.927 1.00 1.00 O ATOM 679 CB GLU A 41 -21.166 -4.730 -5.186 1.00 1.00 C ATOM 680 CG GLU A 41 -20.875 -6.192 -5.542 1.00 1.00 C ATOM 681 CD GLU A 41 -19.551 -6.418 -6.262 1.00 1.00 C ATOM 682 OE1 GLU A 41 -18.479 -6.307 -5.636 1.00 1.00 O ATOM 683 OE2 GLU A 41 -19.571 -6.805 -7.453 1.00 1.00 O ATOM 0 H GLU A 41 -21.142 -2.298 -3.866 1.00 1.00 H new ATOM 0 HA GLU A 41 -20.877 -5.177 -3.128 1.00 1.00 H new ATOM 0 HB2 GLU A 41 -22.238 -4.554 -5.275 1.00 1.00 H new ATOM 0 HB3 GLU A 41 -20.675 -4.087 -5.916 1.00 1.00 H new ATOM 0 HG2 GLU A 41 -20.881 -6.783 -4.626 1.00 1.00 H new ATOM 0 HG3 GLU A 41 -21.683 -6.567 -6.169 1.00 1.00 H new ATOM 690 N ARG A 42 -18.832 -2.825 -4.279 1.00 1.00 N ATOM 691 CA ARG A 42 -17.426 -2.408 -4.305 1.00 1.00 C ATOM 692 C ARG A 42 -16.892 -2.185 -2.890 1.00 1.00 C ATOM 693 O ARG A 42 -15.684 -2.179 -2.697 1.00 1.00 O ATOM 694 CB ARG A 42 -17.173 -1.101 -5.072 1.00 1.00 C ATOM 695 CG ARG A 42 -18.239 -0.002 -4.949 1.00 1.00 C ATOM 696 CD ARG A 42 -17.855 1.088 -5.952 1.00 1.00 C ATOM 697 NE ARG A 42 -18.662 2.316 -5.898 1.00 1.00 N ATOM 698 CZ ARG A 42 -18.207 3.532 -5.564 1.00 1.00 C ATOM 699 NH1 ARG A 42 -17.098 3.658 -4.832 1.00 1.00 N ATOM 700 NH2 ARG A 42 -18.852 4.617 -5.975 1.00 1.00 N ATOM 0 H ARG A 42 -19.466 -2.188 -4.761 1.00 1.00 H new ATOM 0 HA ARG A 42 -16.916 -3.225 -4.815 1.00 1.00 H new ATOM 0 HB2 ARG A 42 -16.222 -0.689 -4.735 1.00 1.00 H new ATOM 0 HB3 ARG A 42 -17.058 -1.345 -6.128 1.00 1.00 H new ATOM 0 HG2 ARG A 42 -19.231 -0.398 -5.166 1.00 1.00 H new ATOM 0 HG3 ARG A 42 -18.270 0.397 -3.935 1.00 1.00 H new ATOM 0 HD2 ARG A 42 -16.810 1.354 -5.790 1.00 1.00 H new ATOM 0 HD3 ARG A 42 -17.926 0.672 -6.957 1.00 1.00 H new ATOM 0 HE ARG A 42 -19.651 2.236 -6.135 1.00 1.00 H new ATOM 0 HH11 ARG A 42 -16.593 2.827 -4.524 1.00 1.00 H new ATOM 0 HH12 ARG A 42 -16.756 4.585 -4.580 1.00 1.00 H new ATOM 0 HH21 ARG A 42 -19.693 4.525 -6.545 1.00 1.00 H new ATOM 0 HH22 ARG A 42 -18.506 5.543 -5.721 1.00 1.00 H new ATOM 714 N GLN A 43 -17.764 -1.952 -1.913 1.00 1.00 N ATOM 715 CA GLN A 43 -17.413 -1.742 -0.520 1.00 1.00 C ATOM 716 C GLN A 43 -16.589 -2.896 0.043 1.00 1.00 C ATOM 717 O GLN A 43 -15.601 -2.653 0.736 1.00 1.00 O ATOM 718 CB GLN A 43 -18.710 -1.547 0.265 1.00 1.00 C ATOM 719 CG GLN A 43 -19.078 -0.061 0.261 1.00 1.00 C ATOM 720 CD GLN A 43 -20.508 0.174 0.719 1.00 1.00 C ATOM 721 OE1 GLN A 43 -21.371 0.494 -0.098 1.00 1.00 O ATOM 722 NE2 GLN A 43 -20.781 0.034 2.000 1.00 1.00 N ATOM 0 H GLN A 43 -18.769 -1.903 -2.080 1.00 1.00 H new ATOM 0 HA GLN A 43 -16.783 -0.857 -0.432 1.00 1.00 H new ATOM 0 HB2 GLN A 43 -19.512 -2.134 -0.182 1.00 1.00 H new ATOM 0 HB3 GLN A 43 -18.587 -1.901 1.288 1.00 1.00 H new ATOM 0 HG2 GLN A 43 -18.395 0.483 0.913 1.00 1.00 H new ATOM 0 HG3 GLN A 43 -18.949 0.342 -0.744 1.00 1.00 H new ATOM 0 HE21 GLN A 43 -20.044 -0.232 2.652 1.00 1.00 H new ATOM 0 HE22 GLN A 43 -21.730 0.192 2.339 1.00 1.00 H new ATOM 731 N THR A 44 -16.989 -4.128 -0.250 1.00 1.00 N ATOM 732 CA THR A 44 -16.267 -5.336 0.135 1.00 1.00 C ATOM 733 C THR A 44 -15.332 -5.791 -0.981 1.00 1.00 C ATOM 734 O THR A 44 -14.212 -6.206 -0.677 1.00 1.00 O ATOM 735 CB THR A 44 -17.294 -6.404 0.510 1.00 1.00 C ATOM 736 OG1 THR A 44 -18.179 -5.884 1.485 1.00 1.00 O ATOM 737 CG2 THR A 44 -16.615 -7.627 1.104 1.00 1.00 C ATOM 0 H THR A 44 -17.843 -4.320 -0.773 1.00 1.00 H new ATOM 0 HA THR A 44 -15.630 -5.141 0.998 1.00 1.00 H new ATOM 0 HB THR A 44 -17.830 -6.688 -0.396 1.00 1.00 H new ATOM 0 HG1 THR A 44 -18.839 -6.567 1.725 1.00 1.00 H new ATOM 0 HG21 THR A 44 -17.368 -8.372 1.362 1.00 1.00 H new ATOM 0 HG22 THR A 44 -15.923 -8.049 0.375 1.00 1.00 H new ATOM 0 HG23 THR A 44 -16.067 -7.339 2.001 1.00 1.00 H new ATOM 745 N ARG A 45 -15.687 -5.626 -2.263 1.00 1.00 N ATOM 746 CA ARG A 45 -14.750 -5.867 -3.346 1.00 1.00 C ATOM 747 C ARG A 45 -13.465 -5.096 -3.148 1.00 1.00 C ATOM 748 O ARG A 45 -12.421 -5.582 -3.527 1.00 1.00 O ATOM 749 CB ARG A 45 -15.334 -5.438 -4.688 1.00 1.00 C ATOM 750 CG ARG A 45 -14.585 -6.113 -5.830 1.00 1.00 C ATOM 751 CD ARG A 45 -15.094 -7.511 -6.175 1.00 1.00 C ATOM 752 NE ARG A 45 -16.290 -7.469 -7.036 1.00 1.00 N ATOM 753 CZ ARG A 45 -16.358 -7.851 -8.319 1.00 1.00 C ATOM 754 NH1 ARG A 45 -15.297 -8.350 -8.951 1.00 1.00 N ATOM 755 NH2 ARG A 45 -17.498 -7.727 -8.982 1.00 1.00 N ATOM 0 H ARG A 45 -16.615 -5.328 -2.565 1.00 1.00 H new ATOM 0 HA ARG A 45 -14.551 -6.939 -3.342 1.00 1.00 H new ATOM 0 HB2 ARG A 45 -16.391 -5.699 -4.733 1.00 1.00 H new ATOM 0 HB3 ARG A 45 -15.269 -4.355 -4.791 1.00 1.00 H new ATOM 0 HG2 ARG A 45 -14.656 -5.484 -6.717 1.00 1.00 H new ATOM 0 HG3 ARG A 45 -13.529 -6.178 -5.568 1.00 1.00 H new ATOM 0 HD2 ARG A 45 -14.305 -8.070 -6.678 1.00 1.00 H new ATOM 0 HD3 ARG A 45 -15.328 -8.048 -5.256 1.00 1.00 H new ATOM 0 HE ARG A 45 -17.149 -7.115 -6.615 1.00 1.00 H new ATOM 0 HH11 ARG A 45 -14.409 -8.448 -8.458 1.00 1.00 H new ATOM 0 HH12 ARG A 45 -15.372 -8.634 -9.928 1.00 1.00 H new ATOM 0 HH21 ARG A 45 -18.320 -7.342 -8.516 1.00 1.00 H new ATOM 0 HH22 ARG A 45 -17.554 -8.016 -9.958 1.00 1.00 H new ATOM 769 N PHE A 46 -13.515 -3.915 -2.556 1.00 1.00 N ATOM 770 CA PHE A 46 -12.352 -3.126 -2.244 1.00 1.00 C ATOM 771 C PHE A 46 -11.364 -3.963 -1.434 1.00 1.00 C ATOM 772 O PHE A 46 -10.211 -4.101 -1.840 1.00 1.00 O ATOM 773 CB PHE A 46 -12.847 -1.864 -1.533 1.00 1.00 C ATOM 774 CG PHE A 46 -11.850 -1.191 -0.631 1.00 1.00 C ATOM 775 CD1 PHE A 46 -10.507 -1.088 -1.025 1.00 1.00 C ATOM 776 CD2 PHE A 46 -12.260 -0.722 0.629 1.00 1.00 C ATOM 777 CE1 PHE A 46 -9.548 -0.577 -0.147 1.00 1.00 C ATOM 778 CE2 PHE A 46 -11.309 -0.152 1.483 1.00 1.00 C ATOM 779 CZ PHE A 46 -9.950 -0.132 1.114 1.00 1.00 C ATOM 0 H PHE A 46 -14.391 -3.474 -2.275 1.00 1.00 H new ATOM 0 HA PHE A 46 -11.800 -2.816 -3.131 1.00 1.00 H new ATOM 0 HB2 PHE A 46 -13.169 -1.146 -2.288 1.00 1.00 H new ATOM 0 HB3 PHE A 46 -13.726 -2.123 -0.943 1.00 1.00 H new ATOM 0 HD1 PHE A 46 -10.213 -1.406 -2.014 1.00 1.00 H new ATOM 0 HD2 PHE A 46 -13.293 -0.800 0.933 1.00 1.00 H new ATOM 0 HE1 PHE A 46 -8.510 -0.527 -0.440 1.00 1.00 H new ATOM 0 HE2 PHE A 46 -11.618 0.273 2.427 1.00 1.00 H new ATOM 0 HZ PHE A 46 -9.211 0.231 1.813 1.00 1.00 H new ATOM 789 N GLN A 47 -11.817 -4.562 -0.333 1.00 1.00 N ATOM 790 CA GLN A 47 -10.993 -5.492 0.428 1.00 1.00 C ATOM 791 C GLN A 47 -10.592 -6.673 -0.440 1.00 1.00 C ATOM 792 O GLN A 47 -9.425 -7.046 -0.439 1.00 1.00 O ATOM 793 CB GLN A 47 -11.721 -5.985 1.666 1.00 1.00 C ATOM 794 CG GLN A 47 -11.791 -4.861 2.700 1.00 1.00 C ATOM 795 CD GLN A 47 -13.184 -4.278 2.683 1.00 1.00 C ATOM 796 OE1 GLN A 47 -14.146 -4.998 2.889 1.00 1.00 O ATOM 797 NE2 GLN A 47 -13.335 -3.004 2.387 1.00 1.00 N ATOM 0 H GLN A 47 -12.751 -4.418 0.050 1.00 1.00 H new ATOM 0 HA GLN A 47 -10.097 -4.960 0.747 1.00 1.00 H new ATOM 0 HB2 GLN A 47 -12.726 -6.314 1.403 1.00 1.00 H new ATOM 0 HB3 GLN A 47 -11.203 -6.847 2.086 1.00 1.00 H new ATOM 0 HG2 GLN A 47 -11.553 -5.244 3.692 1.00 1.00 H new ATOM 0 HG3 GLN A 47 -11.055 -4.090 2.471 1.00 1.00 H new ATOM 0 HE21 GLN A 47 -12.517 -2.419 2.218 1.00 1.00 H new ATOM 0 HE22 GLN A 47 -14.270 -2.602 2.326 1.00 1.00 H new ATOM 806 N ASN A 48 -11.528 -7.258 -1.187 1.00 1.00 N ATOM 807 CA ASN A 48 -11.237 -8.466 -1.944 1.00 1.00 C ATOM 808 C ASN A 48 -10.262 -8.203 -3.097 1.00 1.00 C ATOM 809 O ASN A 48 -9.531 -9.121 -3.435 1.00 1.00 O ATOM 810 CB ASN A 48 -12.521 -9.168 -2.414 1.00 1.00 C ATOM 811 CG ASN A 48 -13.391 -9.643 -1.250 1.00 1.00 C ATOM 812 OD1 ASN A 48 -12.900 -9.960 -0.165 1.00 1.00 O ATOM 813 ND2 ASN A 48 -14.699 -9.715 -1.433 1.00 1.00 N ATOM 0 H ASN A 48 -12.484 -6.916 -1.281 1.00 1.00 H new ATOM 0 HA ASN A 48 -10.733 -9.154 -1.265 1.00 1.00 H new ATOM 0 HB2 ASN A 48 -13.097 -8.484 -3.038 1.00 1.00 H new ATOM 0 HB3 ASN A 48 -12.256 -10.022 -3.037 1.00 1.00 H new ATOM 0 HD21 ASN A 48 -15.303 -10.033 -0.675 1.00 1.00 H new ATOM 0 HD22 ASN A 48 -15.103 -9.452 -2.332 1.00 1.00 H new ATOM 820 N ALA A 49 -10.179 -6.989 -3.655 1.00 1.00 N ATOM 821 CA ALA A 49 -9.234 -6.540 -4.682 1.00 1.00 C ATOM 822 C ALA A 49 -7.894 -6.182 -4.034 1.00 1.00 C ATOM 823 O ALA A 49 -6.842 -6.336 -4.645 1.00 1.00 O ATOM 824 CB ALA A 49 -9.827 -5.306 -5.426 1.00 1.00 C ATOM 0 H ALA A 49 -10.817 -6.242 -3.380 1.00 1.00 H new ATOM 0 HA ALA A 49 -9.067 -7.341 -5.402 1.00 1.00 H new ATOM 0 HB1 ALA A 49 -9.126 -4.970 -6.190 1.00 1.00 H new ATOM 0 HB2 ALA A 49 -10.771 -5.583 -5.896 1.00 1.00 H new ATOM 0 HB3 ALA A 49 -10.000 -4.500 -4.713 1.00 1.00 H new ATOM 830 N CYS A 50 -7.922 -5.690 -2.794 1.00 1.00 N ATOM 831 CA CYS A 50 -6.757 -5.606 -1.909 1.00 1.00 C ATOM 832 C CYS A 50 -6.238 -7.000 -1.498 1.00 1.00 C ATOM 833 O CYS A 50 -5.070 -7.135 -1.155 1.00 1.00 O ATOM 834 CB CYS A 50 -7.125 -4.660 -0.733 1.00 1.00 C ATOM 835 SG CYS A 50 -7.319 -2.990 -1.412 1.00 1.00 S ATOM 0 H CYS A 50 -8.775 -5.330 -2.366 1.00 1.00 H new ATOM 0 HA CYS A 50 -5.900 -5.173 -2.426 1.00 1.00 H new ATOM 0 HB2 CYS A 50 -8.047 -4.987 -0.253 1.00 1.00 H new ATOM 0 HB3 CYS A 50 -6.346 -4.675 0.029 1.00 1.00 H new ATOM 0 HG CYS A 50 -8.233 -2.353 -0.742 1.00 1.00 H new ATOM 841 N ARG A 51 -7.068 -8.051 -1.546 1.00 1.00 N ATOM 842 CA ARG A 51 -6.723 -9.409 -1.113 1.00 1.00 C ATOM 843 C ARG A 51 -6.380 -10.318 -2.293 1.00 1.00 C ATOM 844 O ARG A 51 -5.620 -11.275 -2.131 1.00 1.00 O ATOM 845 CB ARG A 51 -7.891 -9.965 -0.278 1.00 1.00 C ATOM 846 CG ARG A 51 -7.496 -11.235 0.477 1.00 1.00 C ATOM 847 CD ARG A 51 -8.540 -11.653 1.524 1.00 1.00 C ATOM 848 NE ARG A 51 -9.639 -12.432 0.930 1.00 1.00 N ATOM 849 CZ ARG A 51 -10.709 -12.896 1.589 1.00 1.00 C ATOM 850 NH1 ARG A 51 -11.056 -12.410 2.775 1.00 1.00 N ATOM 851 NH2 ARG A 51 -11.449 -13.857 1.054 1.00 1.00 N ATOM 0 H ARG A 51 -8.023 -7.976 -1.897 1.00 1.00 H new ATOM 0 HA ARG A 51 -5.823 -9.374 -0.499 1.00 1.00 H new ATOM 0 HB2 ARG A 51 -8.222 -9.208 0.433 1.00 1.00 H new ATOM 0 HB3 ARG A 51 -8.736 -10.179 -0.932 1.00 1.00 H new ATOM 0 HG2 ARG A 51 -7.357 -12.048 -0.236 1.00 1.00 H new ATOM 0 HG3 ARG A 51 -6.537 -11.076 0.970 1.00 1.00 H new ATOM 0 HD2 ARG A 51 -8.056 -12.244 2.302 1.00 1.00 H new ATOM 0 HD3 ARG A 51 -8.946 -10.763 2.006 1.00 1.00 H new ATOM 0 HE ARG A 51 -9.581 -12.636 -0.068 1.00 1.00 H new ATOM 0 HH11 ARG A 51 -10.503 -11.667 3.203 1.00 1.00 H new ATOM 0 HH12 ARG A 51 -11.875 -12.779 3.258 1.00 1.00 H new ATOM 0 HH21 ARG A 51 -11.203 -14.242 0.142 1.00 1.00 H new ATOM 0 HH22 ARG A 51 -12.264 -14.211 1.554 1.00 1.00 H new ATOM 865 N ASP A 52 -6.915 -10.012 -3.477 1.00 1.00 N ATOM 866 CA ASP A 52 -6.608 -10.693 -4.735 1.00 1.00 C ATOM 867 C ASP A 52 -5.139 -10.484 -5.104 1.00 1.00 C ATOM 868 O ASP A 52 -4.521 -11.322 -5.766 1.00 1.00 O ATOM 869 CB ASP A 52 -7.525 -10.195 -5.865 1.00 1.00 C ATOM 870 CG ASP A 52 -8.219 -11.355 -6.578 1.00 1.00 C ATOM 871 OD1 ASP A 52 -7.546 -12.308 -7.010 1.00 1.00 O ATOM 872 OD2 ASP A 52 -9.473 -11.330 -6.661 1.00 1.00 O ATOM 0 H ASP A 52 -7.595 -9.260 -3.589 1.00 1.00 H new ATOM 0 HA ASP A 52 -6.786 -11.760 -4.601 1.00 1.00 H new ATOM 0 HB2 ASP A 52 -8.275 -9.518 -5.455 1.00 1.00 H new ATOM 0 HB3 ASP A 52 -6.939 -9.623 -6.585 1.00 1.00 H new ATOM 877 N GLY A 53 -4.536 -9.406 -4.602 1.00 1.00 N ATOM 878 CA GLY A 53 -3.125 -9.159 -4.727 1.00 1.00 C ATOM 879 C GLY A 53 -2.947 -7.666 -4.784 1.00 1.00 C ATOM 880 O GLY A 53 -3.440 -6.951 -3.917 1.00 1.00 O ATOM 0 H GLY A 53 -5.034 -8.677 -4.092 1.00 1.00 H new ATOM 0 HA2 GLY A 53 -2.583 -9.581 -3.881 1.00 1.00 H new ATOM 0 HA3 GLY A 53 -2.729 -9.630 -5.627 1.00 1.00 H new ATOM 884 N ARG A 54 -2.212 -7.184 -5.783 1.00 1.00 N ATOM 885 CA ARG A 54 -1.954 -5.760 -5.912 1.00 1.00 C ATOM 886 C ARG A 54 -3.285 -5.048 -6.186 1.00 1.00 C ATOM 887 O ARG A 54 -4.228 -5.646 -6.710 1.00 1.00 O ATOM 888 CB ARG A 54 -0.905 -5.466 -7.002 1.00 1.00 C ATOM 889 CG ARG A 54 0.137 -6.544 -7.362 1.00 1.00 C ATOM 890 CD ARG A 54 1.269 -6.815 -6.357 1.00 1.00 C ATOM 891 NE ARG A 54 0.878 -7.495 -5.101 1.00 1.00 N ATOM 892 CZ ARG A 54 0.366 -8.728 -4.980 1.00 1.00 C ATOM 893 NH1 ARG A 54 0.149 -9.487 -6.047 1.00 1.00 N ATOM 894 NH2 ARG A 54 0.034 -9.173 -3.773 1.00 1.00 N ATOM 0 H ARG A 54 -1.788 -7.759 -6.510 1.00 1.00 H new ATOM 0 HA ARG A 54 -1.529 -5.381 -4.983 1.00 1.00 H new ATOM 0 HB2 ARG A 54 -1.444 -5.215 -7.915 1.00 1.00 H new ATOM 0 HB3 ARG A 54 -0.359 -4.573 -6.698 1.00 1.00 H new ATOM 0 HG2 ARG A 54 -0.395 -7.481 -7.527 1.00 1.00 H new ATOM 0 HG3 ARG A 54 0.593 -6.264 -8.312 1.00 1.00 H new ATOM 0 HD2 ARG A 54 2.029 -7.419 -6.852 1.00 1.00 H new ATOM 0 HD3 ARG A 54 1.735 -5.864 -6.101 1.00 1.00 H new ATOM 0 HE ARG A 54 1.012 -6.970 -4.237 1.00 1.00 H new ATOM 0 HH11 ARG A 54 0.373 -9.134 -6.978 1.00 1.00 H new ATOM 0 HH12 ARG A 54 -0.241 -10.423 -5.936 1.00 1.00 H new ATOM 0 HH21 ARG A 54 0.170 -8.579 -2.955 1.00 1.00 H new ATOM 0 HH22 ARG A 54 -0.357 -10.109 -3.664 1.00 1.00 H new ATOM 908 N SER A 55 -3.363 -3.767 -5.859 1.00 1.00 N ATOM 909 CA SER A 55 -4.558 -2.966 -6.073 1.00 1.00 C ATOM 910 C SER A 55 -4.119 -1.602 -6.601 1.00 1.00 C ATOM 911 O SER A 55 -2.939 -1.365 -6.877 1.00 1.00 O ATOM 912 CB SER A 55 -5.364 -2.837 -4.767 1.00 1.00 C ATOM 913 OG SER A 55 -6.678 -3.315 -4.951 1.00 1.00 O ATOM 0 H SER A 55 -2.593 -3.250 -5.434 1.00 1.00 H new ATOM 0 HA SER A 55 -5.214 -3.444 -6.801 1.00 1.00 H new ATOM 0 HB2 SER A 55 -4.874 -3.399 -3.972 1.00 1.00 H new ATOM 0 HB3 SER A 55 -5.391 -1.794 -4.450 1.00 1.00 H new ATOM 0 HG SER A 55 -7.145 -3.327 -4.090 1.00 1.00 H new ATOM 919 N GLU A 56 -5.085 -0.708 -6.749 1.00 1.00 N ATOM 920 CA GLU A 56 -4.925 0.558 -7.451 1.00 1.00 C ATOM 921 C GLU A 56 -5.620 1.655 -6.652 1.00 1.00 C ATOM 922 O GLU A 56 -6.848 1.724 -6.586 1.00 1.00 O ATOM 923 CB GLU A 56 -5.420 0.415 -8.896 1.00 1.00 C ATOM 924 CG GLU A 56 -4.832 1.516 -9.786 1.00 1.00 C ATOM 925 CD GLU A 56 -5.296 1.431 -11.243 1.00 1.00 C ATOM 926 OE1 GLU A 56 -5.529 0.313 -11.772 1.00 1.00 O ATOM 927 OE2 GLU A 56 -5.331 2.492 -11.911 1.00 1.00 O ATOM 0 H GLU A 56 -6.024 -0.845 -6.376 1.00 1.00 H new ATOM 0 HA GLU A 56 -3.876 0.845 -7.527 1.00 1.00 H new ATOM 0 HB2 GLU A 56 -5.138 -0.563 -9.286 1.00 1.00 H new ATOM 0 HB3 GLU A 56 -6.509 0.466 -8.919 1.00 1.00 H new ATOM 0 HG2 GLU A 56 -5.110 2.489 -9.380 1.00 1.00 H new ATOM 0 HG3 GLU A 56 -3.744 1.456 -9.755 1.00 1.00 H new ATOM 934 N ILE A 57 -4.829 2.467 -5.958 1.00 1.00 N ATOM 935 CA ILE A 57 -5.333 3.553 -5.116 1.00 1.00 C ATOM 936 C ILE A 57 -4.659 4.832 -5.629 1.00 1.00 C ATOM 937 O ILE A 57 -3.737 4.771 -6.436 1.00 1.00 O ATOM 938 CB ILE A 57 -5.171 3.189 -3.604 1.00 1.00 C ATOM 939 CG1 ILE A 57 -5.954 1.881 -3.261 1.00 1.00 C ATOM 940 CG2 ILE A 57 -5.619 4.310 -2.652 1.00 1.00 C ATOM 941 CD1 ILE A 57 -6.134 1.474 -1.773 1.00 1.00 C ATOM 0 H ILE A 57 -3.812 2.392 -5.962 1.00 1.00 H new ATOM 0 HA ILE A 57 -6.407 3.724 -5.185 1.00 1.00 H new ATOM 0 HB ILE A 57 -4.102 3.040 -3.451 1.00 1.00 H new ATOM 0 HG12 ILE A 57 -6.948 1.969 -3.700 1.00 1.00 H new ATOM 0 HG13 ILE A 57 -5.454 1.056 -3.769 1.00 1.00 H new ATOM 0 HG21 ILE A 57 -5.479 3.989 -1.620 1.00 1.00 H new ATOM 0 HG22 ILE A 57 -5.024 5.204 -2.838 1.00 1.00 H new ATOM 0 HG23 ILE A 57 -6.672 4.533 -2.823 1.00 1.00 H new ATOM 0 HD11 ILE A 57 -6.699 0.544 -1.716 1.00 1.00 H new ATOM 0 HD12 ILE A 57 -5.156 1.333 -1.314 1.00 1.00 H new ATOM 0 HD13 ILE A 57 -6.673 2.259 -1.244 1.00 1.00 H new ATOM 953 N ALA A 58 -5.130 6.006 -5.238 1.00 1.00 N ATOM 954 CA ALA A 58 -4.469 7.265 -5.499 1.00 1.00 C ATOM 955 C ALA A 58 -4.472 8.119 -4.244 1.00 1.00 C ATOM 956 O ALA A 58 -5.240 7.890 -3.308 1.00 1.00 O ATOM 957 CB ALA A 58 -5.166 8.003 -6.644 1.00 1.00 C ATOM 0 H ALA A 58 -6.002 6.107 -4.719 1.00 1.00 H new ATOM 0 HA ALA A 58 -3.437 7.069 -5.791 1.00 1.00 H new ATOM 0 HB1 ALA A 58 -4.658 8.949 -6.830 1.00 1.00 H new ATOM 0 HB2 ALA A 58 -5.133 7.391 -7.545 1.00 1.00 H new ATOM 0 HB3 ALA A 58 -6.204 8.196 -6.374 1.00 1.00 H new ATOM 963 N PHE A 59 -3.634 9.147 -4.246 1.00 1.00 N ATOM 964 CA PHE A 59 -3.740 10.239 -3.299 1.00 1.00 C ATOM 965 C PHE A 59 -4.644 11.301 -3.869 1.00 1.00 C ATOM 966 O PHE A 59 -4.638 11.528 -5.078 1.00 1.00 O ATOM 967 CB PHE A 59 -2.346 10.828 -3.003 1.00 1.00 C ATOM 968 CG PHE A 59 -1.605 9.964 -2.036 1.00 1.00 C ATOM 969 CD1 PHE A 59 -0.988 8.795 -2.505 1.00 1.00 C ATOM 970 CD2 PHE A 59 -1.613 10.287 -0.671 1.00 1.00 C ATOM 971 CE1 PHE A 59 -0.387 7.925 -1.571 1.00 1.00 C ATOM 972 CE2 PHE A 59 -1.031 9.409 0.247 1.00 1.00 C ATOM 973 CZ PHE A 59 -0.428 8.220 -0.196 1.00 1.00 C ATOM 0 H PHE A 59 -2.863 9.244 -4.906 1.00 1.00 H new ATOM 0 HA PHE A 59 -4.160 9.868 -2.364 1.00 1.00 H new ATOM 0 HB2 PHE A 59 -1.778 10.916 -3.929 1.00 1.00 H new ATOM 0 HB3 PHE A 59 -2.449 11.834 -2.595 1.00 1.00 H new ATOM 0 HD1 PHE A 59 -0.973 8.565 -3.560 1.00 1.00 H new ATOM 0 HD2 PHE A 59 -2.066 11.207 -0.332 1.00 1.00 H new ATOM 0 HE1 PHE A 59 0.107 7.028 -1.913 1.00 1.00 H new ATOM 0 HE2 PHE A 59 -1.045 9.645 1.301 1.00 1.00 H new ATOM 0 HZ PHE A 59 0.003 7.534 0.518 1.00 1.00 H new ATOM 983 N VAL A 60 -5.373 11.981 -2.994 1.00 1.00 N ATOM 984 CA VAL A 60 -6.168 13.141 -3.363 1.00 1.00 C ATOM 985 C VAL A 60 -5.296 14.382 -3.277 1.00 1.00 C ATOM 986 O VAL A 60 -5.217 15.128 -4.253 1.00 1.00 O ATOM 987 CB VAL A 60 -7.397 13.255 -2.447 1.00 1.00 C ATOM 988 CG1 VAL A 60 -8.191 14.531 -2.734 1.00 1.00 C ATOM 989 CG2 VAL A 60 -8.296 12.039 -2.651 1.00 1.00 C ATOM 0 H VAL A 60 -5.429 11.741 -2.004 1.00 1.00 H new ATOM 0 HA VAL A 60 -6.530 13.036 -4.386 1.00 1.00 H new ATOM 0 HB VAL A 60 -7.050 13.297 -1.415 1.00 1.00 H new ATOM 0 HG11 VAL A 60 -9.053 14.580 -2.069 1.00 1.00 H new ATOM 0 HG12 VAL A 60 -7.555 15.400 -2.568 1.00 1.00 H new ATOM 0 HG13 VAL A 60 -8.531 14.523 -3.769 1.00 1.00 H new ATOM 0 HG21 VAL A 60 -9.168 12.118 -2.002 1.00 1.00 H new ATOM 0 HG22 VAL A 60 -8.620 11.996 -3.691 1.00 1.00 H new ATOM 0 HG23 VAL A 60 -7.743 11.132 -2.406 1.00 1.00 H new ATOM 999 N ALA A 61 -4.651 14.584 -2.118 1.00 1.00 N ATOM 1000 CA ALA A 61 -4.096 15.868 -1.713 1.00 1.00 C ATOM 1001 C ALA A 61 -3.234 16.455 -2.825 1.00 1.00 C ATOM 1002 O ALA A 61 -3.445 17.597 -3.227 1.00 1.00 O ATOM 1003 CB ALA A 61 -3.313 15.709 -0.406 1.00 1.00 C ATOM 0 H ALA A 61 -4.502 13.844 -1.432 1.00 1.00 H new ATOM 0 HA ALA A 61 -4.910 16.571 -1.532 1.00 1.00 H new ATOM 0 HB1 ALA A 61 -2.901 16.673 -0.109 1.00 1.00 H new ATOM 0 HB2 ALA A 61 -3.979 15.343 0.375 1.00 1.00 H new ATOM 0 HB3 ALA A 61 -2.501 14.997 -0.553 1.00 1.00 H new ATOM 1009 N THR A 62 -2.325 15.641 -3.353 1.00 1.00 N ATOM 1010 CA THR A 62 -1.408 16.018 -4.408 1.00 1.00 C ATOM 1011 C THR A 62 -1.688 15.253 -5.709 1.00 1.00 C ATOM 1012 O THR A 62 -1.249 15.712 -6.764 1.00 1.00 O ATOM 1013 CB THR A 62 -0.001 15.805 -3.839 1.00 1.00 C ATOM 1014 OG1 THR A 62 0.130 16.579 -2.662 1.00 1.00 O ATOM 1015 CG2 THR A 62 1.126 16.166 -4.795 1.00 1.00 C ATOM 0 H THR A 62 -2.208 14.675 -3.046 1.00 1.00 H new ATOM 0 HA THR A 62 -1.527 17.061 -4.701 1.00 1.00 H new ATOM 0 HB THR A 62 0.097 14.737 -3.645 1.00 1.00 H new ATOM 0 HG1 THR A 62 0.719 16.116 -2.030 1.00 1.00 H new ATOM 0 HG21 THR A 62 2.086 15.985 -4.311 1.00 1.00 H new ATOM 0 HG22 THR A 62 1.051 15.553 -5.694 1.00 1.00 H new ATOM 0 HG23 THR A 62 1.050 17.219 -5.066 1.00 1.00 H new ATOM 1023 N GLY A 63 -2.456 14.153 -5.685 1.00 1.00 N ATOM 1024 CA GLY A 63 -2.884 13.491 -6.900 1.00 1.00 C ATOM 1025 C GLY A 63 -1.789 12.585 -7.426 1.00 1.00 C ATOM 1026 O GLY A 63 -0.998 12.995 -8.276 1.00 1.00 O ATOM 0 H GLY A 63 -2.788 13.711 -4.828 1.00 1.00 H new ATOM 0 HA2 GLY A 63 -3.784 12.908 -6.705 1.00 1.00 H new ATOM 0 HA3 GLY A 63 -3.142 14.234 -7.654 1.00 1.00 H new ATOM 1030 N THR A 64 -1.688 11.360 -6.915 1.00 1.00 N ATOM 1031 CA THR A 64 -0.883 10.338 -7.576 1.00 1.00 C ATOM 1032 C THR A 64 -1.566 8.989 -7.421 1.00 1.00 C ATOM 1033 O THR A 64 -1.713 8.526 -6.290 1.00 1.00 O ATOM 1034 CB THR A 64 0.531 10.365 -7.002 1.00 1.00 C ATOM 1035 OG1 THR A 64 1.193 11.529 -7.463 1.00 1.00 O ATOM 1036 CG2 THR A 64 1.381 9.128 -7.336 1.00 1.00 C ATOM 0 H THR A 64 -2.147 11.054 -6.057 1.00 1.00 H new ATOM 0 HA THR A 64 -0.797 10.533 -8.645 1.00 1.00 H new ATOM 0 HB THR A 64 0.420 10.365 -5.918 1.00 1.00 H new ATOM 0 HG1 THR A 64 0.537 12.150 -7.842 1.00 1.00 H new ATOM 0 HG21 THR A 64 2.369 9.234 -6.888 1.00 1.00 H new ATOM 0 HG22 THR A 64 0.896 8.236 -6.940 1.00 1.00 H new ATOM 0 HG23 THR A 64 1.481 9.036 -8.418 1.00 1.00 H new ATOM 1044 N ASN A 65 -1.991 8.388 -8.536 1.00 1.00 N ATOM 1045 CA ASN A 65 -2.282 6.966 -8.643 1.00 1.00 C ATOM 1046 C ASN A 65 -1.030 6.184 -8.263 1.00 1.00 C ATOM 1047 O ASN A 65 0.049 6.435 -8.810 1.00 1.00 O ATOM 1048 CB ASN A 65 -2.723 6.594 -10.064 1.00 1.00 C ATOM 1049 CG ASN A 65 -3.269 5.167 -10.151 1.00 1.00 C ATOM 1050 OD1 ASN A 65 -2.659 4.218 -9.675 1.00 1.00 O ATOM 1051 ND2 ASN A 65 -4.367 4.955 -10.855 1.00 1.00 N ATOM 0 H ASN A 65 -2.144 8.895 -9.408 1.00 1.00 H new ATOM 0 HA ASN A 65 -3.102 6.719 -7.969 1.00 1.00 H new ATOM 0 HB2 ASN A 65 -3.489 7.294 -10.399 1.00 1.00 H new ATOM 0 HB3 ASN A 65 -1.877 6.698 -10.743 1.00 1.00 H new ATOM 0 HD21 ASN A 65 -4.704 4.003 -11.000 1.00 1.00 H new ATOM 0 HD22 ASN A 65 -4.878 5.743 -11.253 1.00 1.00 H new ATOM 1058 N LEU A 66 -1.161 5.254 -7.327 1.00 1.00 N ATOM 1059 CA LEU A 66 -0.107 4.383 -6.867 1.00 1.00 C ATOM 1060 C LEU A 66 -0.677 2.963 -6.861 1.00 1.00 C ATOM 1061 O LEU A 66 -1.778 2.695 -6.371 1.00 1.00 O ATOM 1062 CB LEU A 66 0.517 4.956 -5.574 1.00 1.00 C ATOM 1063 CG LEU A 66 0.053 4.476 -4.188 1.00 1.00 C ATOM 1064 CD1 LEU A 66 -1.419 4.739 -3.859 1.00 1.00 C ATOM 1065 CD2 LEU A 66 0.407 3.011 -3.977 1.00 1.00 C ATOM 0 H LEU A 66 -2.047 5.085 -6.851 1.00 1.00 H new ATOM 0 HA LEU A 66 0.766 4.325 -7.518 1.00 1.00 H new ATOM 0 HB2 LEU A 66 1.590 4.776 -5.631 1.00 1.00 H new ATOM 0 HB3 LEU A 66 0.373 6.036 -5.602 1.00 1.00 H new ATOM 0 HG LEU A 66 0.605 5.095 -3.481 1.00 1.00 H new ATOM 0 HD11 LEU A 66 -1.642 4.362 -2.861 1.00 1.00 H new ATOM 0 HD12 LEU A 66 -1.614 5.811 -3.894 1.00 1.00 H new ATOM 0 HD13 LEU A 66 -2.051 4.231 -4.588 1.00 1.00 H new ATOM 0 HD21 LEU A 66 0.069 2.694 -2.990 1.00 1.00 H new ATOM 0 HD22 LEU A 66 -0.082 2.405 -4.740 1.00 1.00 H new ATOM 0 HD23 LEU A 66 1.487 2.884 -4.049 1.00 1.00 H new ATOM 1077 N SER A 67 0.058 2.034 -7.458 1.00 1.00 N ATOM 1078 CA SER A 67 -0.322 0.639 -7.446 1.00 1.00 C ATOM 1079 C SER A 67 0.106 0.085 -6.095 1.00 1.00 C ATOM 1080 O SER A 67 1.302 -0.031 -5.812 1.00 1.00 O ATOM 1081 CB SER A 67 0.366 -0.113 -8.583 1.00 1.00 C ATOM 1082 OG SER A 67 0.057 0.475 -9.832 1.00 1.00 O ATOM 0 H SER A 67 0.925 2.229 -7.958 1.00 1.00 H new ATOM 0 HA SER A 67 -1.396 0.522 -7.592 1.00 1.00 H new ATOM 0 HB2 SER A 67 1.445 -0.106 -8.429 1.00 1.00 H new ATOM 0 HB3 SER A 67 0.050 -1.156 -8.579 1.00 1.00 H new ATOM 0 HG SER A 67 0.508 -0.020 -10.547 1.00 1.00 H new ATOM 1088 N LEU A 68 -0.868 -0.184 -5.237 1.00 1.00 N ATOM 1089 CA LEU A 68 -0.655 -0.765 -3.924 1.00 1.00 C ATOM 1090 C LEU A 68 -0.322 -2.225 -4.125 1.00 1.00 C ATOM 1091 O LEU A 68 -0.971 -2.885 -4.923 1.00 1.00 O ATOM 1092 CB LEU A 68 -1.924 -0.598 -3.092 1.00 1.00 C ATOM 1093 CG LEU A 68 -1.694 0.445 -1.999 1.00 1.00 C ATOM 1094 CD1 LEU A 68 -3.045 0.809 -1.455 1.00 1.00 C ATOM 1095 CD2 LEU A 68 -0.827 -0.071 -0.872 1.00 1.00 C ATOM 0 H LEU A 68 -1.850 0.001 -5.442 1.00 1.00 H new ATOM 0 HA LEU A 68 0.161 -0.273 -3.394 1.00 1.00 H new ATOM 0 HB2 LEU A 68 -2.751 -0.291 -3.732 1.00 1.00 H new ATOM 0 HB3 LEU A 68 -2.204 -1.551 -2.644 1.00 1.00 H new ATOM 0 HG LEU A 68 -1.172 1.300 -2.428 1.00 1.00 H new ATOM 0 HD11 LEU A 68 -2.932 1.554 -0.668 1.00 1.00 H new ATOM 0 HD12 LEU A 68 -3.662 1.218 -2.256 1.00 1.00 H new ATOM 0 HD13 LEU A 68 -3.524 -0.080 -1.046 1.00 1.00 H new ATOM 0 HD21 LEU A 68 -0.697 0.712 -0.125 1.00 1.00 H new ATOM 0 HD22 LEU A 68 -1.305 -0.936 -0.412 1.00 1.00 H new ATOM 0 HD23 LEU A 68 0.147 -0.361 -1.266 1.00 1.00 H new ATOM 1107 N GLN A 69 0.692 -2.746 -3.448 1.00 1.00 N ATOM 1108 CA GLN A 69 1.332 -3.964 -3.916 1.00 1.00 C ATOM 1109 C GLN A 69 1.734 -4.826 -2.727 1.00 1.00 C ATOM 1110 O GLN A 69 2.844 -4.741 -2.222 1.00 1.00 O ATOM 1111 CB GLN A 69 2.476 -3.594 -4.883 1.00 1.00 C ATOM 1112 CG GLN A 69 3.441 -2.486 -4.417 1.00 1.00 C ATOM 1113 CD GLN A 69 4.293 -1.912 -5.550 1.00 1.00 C ATOM 1114 OE1 GLN A 69 3.933 -1.939 -6.725 1.00 1.00 O ATOM 1115 NE2 GLN A 69 5.437 -1.336 -5.221 1.00 1.00 N ATOM 0 H GLN A 69 1.082 -2.353 -2.591 1.00 1.00 H new ATOM 0 HA GLN A 69 0.647 -4.585 -4.493 1.00 1.00 H new ATOM 0 HB2 GLN A 69 3.059 -4.493 -5.081 1.00 1.00 H new ATOM 0 HB3 GLN A 69 2.035 -3.285 -5.831 1.00 1.00 H new ATOM 0 HG2 GLN A 69 2.866 -1.681 -3.960 1.00 1.00 H new ATOM 0 HG3 GLN A 69 4.098 -2.886 -3.645 1.00 1.00 H new ATOM 0 HE21 GLN A 69 5.735 -1.314 -4.246 1.00 1.00 H new ATOM 0 HE22 GLN A 69 6.021 -0.914 -5.942 1.00 1.00 H new ATOM 1124 N PHE A 70 0.787 -5.634 -2.250 1.00 1.00 N ATOM 1125 CA PHE A 70 0.883 -6.308 -0.957 1.00 1.00 C ATOM 1126 C PHE A 70 1.896 -7.446 -1.041 1.00 1.00 C ATOM 1127 O PHE A 70 1.547 -8.538 -1.497 1.00 1.00 O ATOM 1128 CB PHE A 70 -0.509 -6.773 -0.478 1.00 1.00 C ATOM 1129 CG PHE A 70 -1.524 -5.644 -0.457 1.00 1.00 C ATOM 1130 CD1 PHE A 70 -2.102 -5.248 -1.665 1.00 1.00 C ATOM 1131 CD2 PHE A 70 -1.848 -4.933 0.709 1.00 1.00 C ATOM 1132 CE1 PHE A 70 -2.920 -4.123 -1.757 1.00 1.00 C ATOM 1133 CE2 PHE A 70 -2.692 -3.811 0.635 1.00 1.00 C ATOM 1134 CZ PHE A 70 -3.219 -3.395 -0.600 1.00 1.00 C ATOM 0 H PHE A 70 -0.075 -5.840 -2.755 1.00 1.00 H new ATOM 0 HA PHE A 70 1.246 -5.608 -0.204 1.00 1.00 H new ATOM 0 HB2 PHE A 70 -0.868 -7.568 -1.132 1.00 1.00 H new ATOM 0 HB3 PHE A 70 -0.422 -7.198 0.522 1.00 1.00 H new ATOM 0 HD1 PHE A 70 -1.910 -5.830 -2.554 1.00 1.00 H new ATOM 0 HD2 PHE A 70 -1.449 -5.248 1.662 1.00 1.00 H new ATOM 0 HE1 PHE A 70 -3.319 -3.816 -2.712 1.00 1.00 H new ATOM 0 HE2 PHE A 70 -2.937 -3.265 1.534 1.00 1.00 H new ATOM 0 HZ PHE A 70 -3.850 -2.520 -0.655 1.00 1.00 H new ATOM 1144 N PHE A 71 3.142 -7.187 -0.645 1.00 1.00 N ATOM 1145 CA PHE A 71 4.232 -8.137 -0.577 1.00 1.00 C ATOM 1146 C PHE A 71 4.726 -8.228 0.873 1.00 1.00 C ATOM 1147 O PHE A 71 5.777 -7.680 1.219 1.00 1.00 O ATOM 1148 CB PHE A 71 5.300 -7.723 -1.584 1.00 1.00 C ATOM 1149 CG PHE A 71 4.892 -7.934 -3.034 1.00 1.00 C ATOM 1150 CD1 PHE A 71 4.595 -9.221 -3.529 1.00 1.00 C ATOM 1151 CD2 PHE A 71 4.823 -6.832 -3.900 1.00 1.00 C ATOM 1152 CE1 PHE A 71 4.268 -9.403 -4.886 1.00 1.00 C ATOM 1153 CE2 PHE A 71 4.519 -7.011 -5.262 1.00 1.00 C ATOM 1154 CZ PHE A 71 4.244 -8.300 -5.754 1.00 1.00 C ATOM 0 H PHE A 71 3.425 -6.253 -0.348 1.00 1.00 H new ATOM 0 HA PHE A 71 3.920 -9.144 -0.853 1.00 1.00 H new ATOM 0 HB2 PHE A 71 5.539 -6.670 -1.433 1.00 1.00 H new ATOM 0 HB3 PHE A 71 6.211 -8.288 -1.387 1.00 1.00 H new ATOM 0 HD1 PHE A 71 4.619 -10.071 -2.863 1.00 1.00 H new ATOM 0 HD2 PHE A 71 5.005 -5.838 -3.518 1.00 1.00 H new ATOM 0 HE1 PHE A 71 4.036 -10.390 -5.259 1.00 1.00 H new ATOM 0 HE2 PHE A 71 4.497 -6.161 -5.928 1.00 1.00 H new ATOM 0 HZ PHE A 71 4.014 -8.441 -6.800 1.00 1.00 H new ATOM 1164 N PRO A 72 4.002 -8.947 1.753 1.00 1.00 N ATOM 1165 CA PRO A 72 4.631 -9.472 2.953 1.00 1.00 C ATOM 1166 C PRO A 72 5.832 -10.325 2.533 1.00 1.00 C ATOM 1167 O PRO A 72 5.897 -10.790 1.397 1.00 1.00 O ATOM 1168 CB PRO A 72 3.556 -10.266 3.694 1.00 1.00 C ATOM 1169 CG PRO A 72 2.560 -10.650 2.599 1.00 1.00 C ATOM 1170 CD PRO A 72 2.685 -9.536 1.558 1.00 1.00 C ATOM 0 HA PRO A 72 5.012 -8.698 3.619 1.00 1.00 H new ATOM 0 HB2 PRO A 72 3.974 -11.147 4.180 1.00 1.00 H new ATOM 0 HB3 PRO A 72 3.083 -9.667 4.472 1.00 1.00 H new ATOM 0 HG2 PRO A 72 2.798 -11.623 2.169 1.00 1.00 H new ATOM 0 HG3 PRO A 72 1.545 -10.715 2.991 1.00 1.00 H new ATOM 0 HD2 PRO A 72 2.581 -9.933 0.548 1.00 1.00 H new ATOM 0 HD3 PRO A 72 1.901 -8.790 1.689 1.00 1.00 H new ATOM 1178 N ALA A 73 6.784 -10.504 3.442 1.00 1.00 N ATOM 1179 CA ALA A 73 8.128 -11.015 3.146 1.00 1.00 C ATOM 1180 C ALA A 73 8.204 -12.352 2.374 1.00 1.00 C ATOM 1181 O ALA A 73 9.243 -12.626 1.770 1.00 1.00 O ATOM 1182 CB ALA A 73 8.934 -11.116 4.442 1.00 1.00 C ATOM 0 H ALA A 73 6.645 -10.294 4.430 1.00 1.00 H new ATOM 0 HA ALA A 73 8.553 -10.285 2.458 1.00 1.00 H new ATOM 0 HB1 ALA A 73 9.932 -11.495 4.221 1.00 1.00 H new ATOM 0 HB2 ALA A 73 9.014 -10.129 4.899 1.00 1.00 H new ATOM 0 HB3 ALA A 73 8.432 -11.795 5.131 1.00 1.00 H new ATOM 1188 N SER A 74 7.152 -13.175 2.348 1.00 1.00 N ATOM 1189 CA SER A 74 7.044 -14.352 1.480 1.00 1.00 C ATOM 1190 C SER A 74 6.898 -14.012 -0.015 1.00 1.00 C ATOM 1191 O SER A 74 7.030 -14.916 -0.843 1.00 1.00 O ATOM 1192 CB SER A 74 5.858 -15.220 1.944 1.00 1.00 C ATOM 1193 OG SER A 74 6.287 -16.517 2.327 1.00 1.00 O ATOM 0 H SER A 74 6.334 -13.039 2.942 1.00 1.00 H new ATOM 0 HA SER A 74 7.983 -14.898 1.572 1.00 1.00 H new ATOM 0 HB2 SER A 74 5.358 -14.737 2.784 1.00 1.00 H new ATOM 0 HB3 SER A 74 5.126 -15.299 1.140 1.00 1.00 H new ATOM 0 HG SER A 74 5.514 -17.044 2.618 1.00 1.00 H new ATOM 1199 N TRP A 75 6.644 -12.752 -0.380 1.00 1.00 N ATOM 1200 CA TRP A 75 6.285 -12.274 -1.706 1.00 1.00 C ATOM 1201 C TRP A 75 5.154 -13.082 -2.356 1.00 1.00 C ATOM 1202 O TRP A 75 4.423 -13.786 -1.657 1.00 1.00 O ATOM 1203 CB TRP A 75 7.551 -12.082 -2.545 1.00 1.00 C ATOM 1204 CG TRP A 75 8.293 -10.833 -2.203 1.00 1.00 C ATOM 1205 CD1 TRP A 75 8.964 -10.594 -1.057 1.00 1.00 C ATOM 1206 CD2 TRP A 75 8.399 -9.615 -2.990 1.00 1.00 C ATOM 1207 NE1 TRP A 75 9.559 -9.351 -1.117 1.00 1.00 N ATOM 1208 CE2 TRP A 75 9.226 -8.700 -2.284 1.00 1.00 C ATOM 1209 CE3 TRP A 75 7.884 -9.199 -4.233 1.00 1.00 C ATOM 1210 CZ2 TRP A 75 9.562 -7.454 -2.812 1.00 1.00 C ATOM 1211 CZ3 TRP A 75 8.201 -7.932 -4.763 1.00 1.00 C ATOM 1212 CH2 TRP A 75 9.050 -7.063 -4.058 1.00 1.00 C ATOM 0 H TRP A 75 6.689 -11.990 0.296 1.00 1.00 H new ATOM 0 HA TRP A 75 5.830 -11.287 -1.625 1.00 1.00 H new ATOM 0 HB2 TRP A 75 8.209 -12.939 -2.402 1.00 1.00 H new ATOM 0 HB3 TRP A 75 7.281 -12.060 -3.601 1.00 1.00 H new ATOM 0 HD1 TRP A 75 9.026 -11.273 -0.220 1.00 1.00 H new ATOM 0 HE1 TRP A 75 10.165 -8.965 -0.393 1.00 1.00 H new ATOM 0 HE3 TRP A 75 7.236 -9.861 -4.789 1.00 1.00 H new ATOM 0 HZ2 TRP A 75 10.215 -6.792 -2.263 1.00 1.00 H new ATOM 0 HZ3 TRP A 75 7.790 -7.628 -5.714 1.00 1.00 H new ATOM 0 HH2 TRP A 75 9.307 -6.100 -4.473 1.00 1.00 H new ATOM 1223 N GLN A 76 4.923 -12.870 -3.661 1.00 1.00 N ATOM 1224 CA GLN A 76 3.907 -13.505 -4.482 1.00 1.00 C ATOM 1225 C GLN A 76 2.566 -13.570 -3.741 1.00 1.00 C ATOM 1226 O GLN A 76 2.053 -14.632 -3.397 1.00 1.00 O ATOM 1227 CB GLN A 76 4.488 -14.829 -4.971 1.00 1.00 C ATOM 1228 CG GLN A 76 3.836 -15.349 -6.248 1.00 1.00 C ATOM 1229 CD GLN A 76 2.548 -16.110 -5.953 1.00 1.00 C ATOM 1230 OE1 GLN A 76 1.399 -15.553 -6.304 1.00 1.00 O flip ATOM 1231 NE2 GLN A 76 2.575 -17.185 -5.358 1.00 1.00 N flip ATOM 0 H GLN A 76 5.483 -12.206 -4.195 1.00 1.00 H new ATOM 0 HA GLN A 76 3.656 -12.928 -5.372 1.00 1.00 H new ATOM 0 HB2 GLN A 76 5.557 -14.705 -5.144 1.00 1.00 H new ATOM 0 HB3 GLN A 76 4.377 -15.577 -4.186 1.00 1.00 H new ATOM 0 HG2 GLN A 76 3.621 -14.513 -6.913 1.00 1.00 H new ATOM 0 HG3 GLN A 76 4.533 -16.003 -6.773 1.00 1.00 H new ATOM 0 HE21 GLN A 76 3.469 -17.600 -5.095 1.00 1.00 H new ATOM 0 HE22 GLN A 76 1.704 -17.662 -5.127 1.00 1.00 H new ATOM 1240 N GLY A 77 2.025 -12.395 -3.434 1.00 1.00 N ATOM 1241 CA GLY A 77 0.937 -12.216 -2.485 1.00 1.00 C ATOM 1242 C GLY A 77 -0.424 -12.305 -3.162 1.00 1.00 C ATOM 1243 O GLY A 77 -1.301 -11.504 -2.854 1.00 1.00 O ATOM 0 H GLY A 77 2.341 -11.519 -3.851 1.00 1.00 H new ATOM 0 HA2 GLY A 77 1.006 -12.975 -1.706 1.00 1.00 H new ATOM 0 HA3 GLY A 77 1.037 -11.247 -1.996 1.00 1.00 H new ATOM 1247 N GLU A 78 -0.562 -13.166 -4.164 1.00 1.00 N ATOM 1248 CA GLU A 78 -1.801 -13.366 -4.913 1.00 1.00 C ATOM 1249 C GLU A 78 -2.850 -14.062 -4.052 1.00 1.00 C ATOM 1250 O GLU A 78 -2.510 -15.024 -3.360 1.00 1.00 O ATOM 1251 CB GLU A 78 -1.486 -14.222 -6.147 1.00 1.00 C ATOM 1252 CG GLU A 78 -2.660 -14.465 -7.107 1.00 1.00 C ATOM 1253 CD GLU A 78 -2.259 -15.426 -8.228 1.00 1.00 C ATOM 1254 OE1 GLU A 78 -1.230 -15.193 -8.910 1.00 1.00 O ATOM 1255 OE2 GLU A 78 -2.942 -16.464 -8.406 1.00 1.00 O ATOM 0 H GLU A 78 0.202 -13.759 -4.487 1.00 1.00 H new ATOM 0 HA GLU A 78 -2.204 -12.399 -5.214 1.00 1.00 H new ATOM 0 HB2 GLU A 78 -0.680 -13.743 -6.702 1.00 1.00 H new ATOM 0 HB3 GLU A 78 -1.110 -15.188 -5.810 1.00 1.00 H new ATOM 0 HG2 GLU A 78 -3.506 -14.875 -6.556 1.00 1.00 H new ATOM 0 HG3 GLU A 78 -2.987 -13.517 -7.535 1.00 1.00 H new ATOM 1262 N GLN A 79 -4.103 -13.603 -4.159 1.00 1.00 N ATOM 1263 CA GLN A 79 -5.353 -14.225 -3.743 1.00 1.00 C ATOM 1264 C GLN A 79 -5.130 -15.002 -2.457 1.00 1.00 C ATOM 1265 O GLN A 79 -5.121 -16.235 -2.428 1.00 1.00 O ATOM 1266 CB GLN A 79 -5.977 -15.001 -4.908 1.00 1.00 C ATOM 1267 CG GLN A 79 -7.494 -15.132 -4.718 1.00 1.00 C ATOM 1268 CD GLN A 79 -7.859 -16.086 -3.586 1.00 1.00 C ATOM 1269 OE1 GLN A 79 -7.729 -17.303 -3.704 1.00 1.00 O ATOM 1270 NE2 GLN A 79 -8.257 -15.569 -2.437 1.00 1.00 N ATOM 0 H GLN A 79 -4.277 -12.692 -4.584 1.00 1.00 H new ATOM 0 HA GLN A 79 -6.107 -13.479 -3.492 1.00 1.00 H new ATOM 0 HB2 GLN A 79 -5.765 -14.490 -5.847 1.00 1.00 H new ATOM 0 HB3 GLN A 79 -5.527 -15.991 -4.975 1.00 1.00 H new ATOM 0 HG2 GLN A 79 -7.918 -14.149 -4.512 1.00 1.00 H new ATOM 0 HG3 GLN A 79 -7.944 -15.485 -5.646 1.00 1.00 H new ATOM 0 HE21 GLN A 79 -8.364 -14.559 -2.342 1.00 1.00 H new ATOM 0 HE22 GLN A 79 -8.457 -16.180 -1.645 1.00 1.00 H new ATOM 1279 N ARG A 80 -4.815 -14.242 -1.414 1.00 1.00 N ATOM 1280 CA ARG A 80 -4.312 -14.818 -0.175 1.00 1.00 C ATOM 1281 C ARG A 80 -5.444 -14.997 0.825 1.00 1.00 C ATOM 1282 O ARG A 80 -6.265 -14.096 0.995 1.00 1.00 O ATOM 1283 CB ARG A 80 -3.115 -14.009 0.327 1.00 1.00 C ATOM 1284 CG ARG A 80 -3.434 -12.678 1.006 1.00 1.00 C ATOM 1285 CD ARG A 80 -2.127 -11.952 1.342 1.00 1.00 C ATOM 1286 NE ARG A 80 -1.289 -12.703 2.301 1.00 1.00 N ATOM 1287 CZ ARG A 80 -0.106 -13.282 2.069 1.00 1.00 C ATOM 1288 NH1 ARG A 80 0.283 -13.579 0.832 1.00 1.00 N ATOM 1289 NH2 ARG A 80 0.690 -13.555 3.092 1.00 1.00 N ATOM 0 H ARG A 80 -4.900 -13.226 -1.403 1.00 1.00 H new ATOM 0 HA ARG A 80 -3.929 -15.825 -0.343 1.00 1.00 H new ATOM 0 HB2 ARG A 80 -2.556 -14.626 1.030 1.00 1.00 H new ATOM 0 HB3 ARG A 80 -2.456 -13.812 -0.519 1.00 1.00 H new ATOM 0 HG2 ARG A 80 -4.048 -12.060 0.350 1.00 1.00 H new ATOM 0 HG3 ARG A 80 -4.011 -12.850 1.914 1.00 1.00 H new ATOM 0 HD2 ARG A 80 -1.562 -11.785 0.425 1.00 1.00 H new ATOM 0 HD3 ARG A 80 -2.357 -10.971 1.757 1.00 1.00 H new ATOM 0 HE ARG A 80 -1.655 -12.789 3.249 1.00 1.00 H new ATOM 0 HH11 ARG A 80 -0.325 -13.365 0.041 1.00 1.00 H new ATOM 0 HH12 ARG A 80 1.189 -14.021 0.674 1.00 1.00 H new ATOM 0 HH21 ARG A 80 0.398 -13.324 4.041 1.00 1.00 H new ATOM 0 HH22 ARG A 80 1.595 -13.996 2.930 1.00 1.00 H new ATOM 1303 N GLN A 81 -5.486 -16.152 1.484 1.00 1.00 N ATOM 1304 CA GLN A 81 -6.559 -16.489 2.412 1.00 1.00 C ATOM 1305 C GLN A 81 -6.355 -15.740 3.728 1.00 1.00 C ATOM 1306 O GLN A 81 -7.342 -15.396 4.377 1.00 1.00 O ATOM 1307 CB GLN A 81 -6.652 -18.004 2.678 1.00 1.00 C ATOM 1308 CG GLN A 81 -5.333 -18.791 2.750 1.00 1.00 C ATOM 1309 CD GLN A 81 -5.601 -20.289 2.812 1.00 1.00 C ATOM 1310 OE1 GLN A 81 -5.398 -21.022 1.851 1.00 1.00 O ATOM 1311 NE2 GLN A 81 -6.047 -20.808 3.938 1.00 1.00 N ATOM 0 H GLN A 81 -4.777 -16.879 1.389 1.00 1.00 H new ATOM 0 HA GLN A 81 -7.498 -16.185 1.950 1.00 1.00 H new ATOM 0 HB2 GLN A 81 -7.183 -18.149 3.619 1.00 1.00 H new ATOM 0 HB3 GLN A 81 -7.266 -18.447 1.894 1.00 1.00 H new ATOM 0 HG2 GLN A 81 -4.720 -18.562 1.878 1.00 1.00 H new ATOM 0 HG3 GLN A 81 -4.767 -18.481 3.628 1.00 1.00 H new ATOM 0 HE21 GLN A 81 -6.219 -20.207 4.744 1.00 1.00 H new ATOM 0 HE22 GLN A 81 -6.220 -21.811 4.004 1.00 1.00 H new ATOM 1320 N THR A 82 -5.098 -15.472 4.100 1.00 1.00 N ATOM 1321 CA THR A 82 -4.725 -14.740 5.297 1.00 1.00 C ATOM 1322 C THR A 82 -3.713 -13.659 4.870 1.00 1.00 C ATOM 1323 O THR A 82 -2.537 -13.936 4.621 1.00 1.00 O ATOM 1324 CB THR A 82 -4.289 -15.746 6.404 1.00 1.00 C ATOM 1325 OG1 THR A 82 -5.219 -15.735 7.475 1.00 1.00 O ATOM 1326 CG2 THR A 82 -2.903 -15.567 7.032 1.00 1.00 C ATOM 0 H THR A 82 -4.292 -15.773 3.552 1.00 1.00 H new ATOM 0 HA THR A 82 -5.545 -14.199 5.769 1.00 1.00 H new ATOM 0 HB THR A 82 -4.251 -16.684 5.850 1.00 1.00 H new ATOM 0 HG1 THR A 82 -4.934 -16.373 8.162 1.00 1.00 H new ATOM 0 HG21 THR A 82 -2.742 -16.339 7.784 1.00 1.00 H new ATOM 0 HG22 THR A 82 -2.140 -15.649 6.258 1.00 1.00 H new ATOM 0 HG23 THR A 82 -2.840 -14.585 7.501 1.00 1.00 H new ATOM 1334 N PRO A 83 -4.144 -12.402 4.682 1.00 1.00 N ATOM 1335 CA PRO A 83 -3.284 -11.228 4.818 1.00 1.00 C ATOM 1336 C PRO A 83 -2.694 -11.122 6.232 1.00 1.00 C ATOM 1337 O PRO A 83 -2.837 -12.034 7.050 1.00 1.00 O ATOM 1338 CB PRO A 83 -4.188 -10.033 4.502 1.00 1.00 C ATOM 1339 CG PRO A 83 -5.319 -10.639 3.680 1.00 1.00 C ATOM 1340 CD PRO A 83 -5.498 -11.997 4.351 1.00 1.00 C ATOM 0 HA PRO A 83 -2.426 -11.278 4.147 1.00 1.00 H new ATOM 0 HB2 PRO A 83 -4.562 -9.563 5.412 1.00 1.00 H new ATOM 0 HB3 PRO A 83 -3.654 -9.265 3.943 1.00 1.00 H new ATOM 0 HG2 PRO A 83 -6.226 -10.037 3.727 1.00 1.00 H new ATOM 0 HG3 PRO A 83 -5.054 -10.735 2.627 1.00 1.00 H new ATOM 0 HD2 PRO A 83 -6.122 -11.924 5.241 1.00 1.00 H new ATOM 0 HD3 PRO A 83 -5.978 -12.713 3.683 1.00 1.00 H new ATOM 1348 N SER A 84 -2.050 -9.997 6.543 1.00 1.00 N ATOM 1349 CA SER A 84 -1.832 -9.574 7.916 1.00 1.00 C ATOM 1350 C SER A 84 -3.203 -9.134 8.486 1.00 1.00 C ATOM 1351 O SER A 84 -4.230 -9.715 8.129 1.00 1.00 O ATOM 1352 CB SER A 84 -0.743 -8.491 7.928 1.00 1.00 C ATOM 1353 OG SER A 84 0.253 -8.753 6.950 1.00 1.00 O ATOM 0 H SER A 84 -1.667 -9.357 5.847 1.00 1.00 H new ATOM 0 HA SER A 84 -1.461 -10.368 8.563 1.00 1.00 H new ATOM 0 HB2 SER A 84 -1.194 -7.516 7.740 1.00 1.00 H new ATOM 0 HB3 SER A 84 -0.284 -8.445 8.915 1.00 1.00 H new ATOM 0 HG SER A 84 0.195 -8.083 6.237 1.00 1.00 H new ATOM 1359 N ARG A 85 -3.273 -8.134 9.371 1.00 1.00 N ATOM 1360 CA ARG A 85 -4.541 -7.496 9.722 1.00 1.00 C ATOM 1361 C ARG A 85 -4.547 -6.077 9.188 1.00 1.00 C ATOM 1362 O ARG A 85 -5.401 -5.752 8.375 1.00 1.00 O ATOM 1363 CB ARG A 85 -4.821 -7.615 11.234 1.00 1.00 C ATOM 1364 CG ARG A 85 -6.279 -8.033 11.464 1.00 1.00 C ATOM 1365 CD ARG A 85 -6.631 -8.209 12.943 1.00 1.00 C ATOM 1366 NE ARG A 85 -6.736 -6.913 13.638 1.00 1.00 N ATOM 1367 CZ ARG A 85 -7.789 -6.436 14.314 1.00 1.00 C ATOM 1368 NH1 ARG A 85 -8.933 -7.102 14.387 1.00 1.00 N ATOM 1369 NH2 ARG A 85 -7.677 -5.267 14.931 1.00 1.00 N ATOM 0 H ARG A 85 -2.463 -7.750 9.857 1.00 1.00 H new ATOM 0 HA ARG A 85 -5.375 -8.013 9.247 1.00 1.00 H new ATOM 0 HB2 ARG A 85 -4.149 -8.348 11.681 1.00 1.00 H new ATOM 0 HB3 ARG A 85 -4.625 -6.662 11.725 1.00 1.00 H new ATOM 0 HG2 ARG A 85 -6.938 -7.283 11.027 1.00 1.00 H new ATOM 0 HG3 ARG A 85 -6.469 -8.969 10.938 1.00 1.00 H new ATOM 0 HD2 ARG A 85 -7.575 -8.746 13.031 1.00 1.00 H new ATOM 0 HD3 ARG A 85 -5.870 -8.821 13.428 1.00 1.00 H new ATOM 0 HE ARG A 85 -5.913 -6.311 13.600 1.00 1.00 H new ATOM 0 HH11 ARG A 85 -9.029 -8.004 13.920 1.00 1.00 H new ATOM 0 HH12 ARG A 85 -9.717 -6.712 14.910 1.00 1.00 H new ATOM 0 HH21 ARG A 85 -6.800 -4.748 14.885 1.00 1.00 H new ATOM 0 HH22 ARG A 85 -8.468 -4.887 15.451 1.00 1.00 H new ATOM 1383 N GLU A 86 -3.588 -5.233 9.578 1.00 1.00 N ATOM 1384 CA GLU A 86 -3.636 -3.838 9.140 1.00 1.00 C ATOM 1385 C GLU A 86 -3.293 -3.675 7.651 1.00 1.00 C ATOM 1386 O GLU A 86 -3.674 -2.672 7.057 1.00 1.00 O ATOM 1387 CB GLU A 86 -2.748 -2.956 10.032 1.00 1.00 C ATOM 1388 CG GLU A 86 -3.189 -1.504 9.980 1.00 1.00 C ATOM 1389 CD GLU A 86 -2.865 -0.661 11.217 1.00 1.00 C ATOM 1390 OE1 GLU A 86 -3.232 -1.074 12.344 1.00 1.00 O ATOM 1391 OE2 GLU A 86 -2.296 0.448 11.077 1.00 1.00 O ATOM 0 H GLU A 86 -2.797 -5.479 10.174 1.00 1.00 H new ATOM 0 HA GLU A 86 -4.666 -3.500 9.250 1.00 1.00 H new ATOM 0 HB2 GLU A 86 -2.790 -3.315 11.060 1.00 1.00 H new ATOM 0 HB3 GLU A 86 -1.710 -3.036 9.709 1.00 1.00 H new ATOM 0 HG2 GLU A 86 -2.725 -1.034 9.113 1.00 1.00 H new ATOM 0 HG3 GLU A 86 -4.267 -1.477 9.818 1.00 1.00 H new ATOM 1398 N TYR A 87 -2.594 -4.646 7.044 1.00 1.00 N ATOM 1399 CA TYR A 87 -2.309 -4.670 5.609 1.00 1.00 C ATOM 1400 C TYR A 87 -3.622 -4.716 4.817 1.00 1.00 C ATOM 1401 O TYR A 87 -3.906 -3.812 4.029 1.00 1.00 O ATOM 1402 CB TYR A 87 -1.390 -5.856 5.249 1.00 1.00 C ATOM 1403 CG TYR A 87 0.112 -5.724 5.511 1.00 1.00 C ATOM 1404 CD1 TYR A 87 0.667 -4.687 6.293 1.00 1.00 C ATOM 1405 CD2 TYR A 87 0.981 -6.656 4.907 1.00 1.00 C ATOM 1406 CE1 TYR A 87 2.065 -4.542 6.406 1.00 1.00 C ATOM 1407 CE2 TYR A 87 2.377 -6.505 4.992 1.00 1.00 C ATOM 1408 CZ TYR A 87 2.926 -5.442 5.739 1.00 1.00 C ATOM 1409 OH TYR A 87 4.278 -5.293 5.762 1.00 1.00 O ATOM 0 H TYR A 87 -2.208 -5.445 7.546 1.00 1.00 H new ATOM 0 HA TYR A 87 -1.778 -3.757 5.339 1.00 1.00 H new ATOM 0 HB2 TYR A 87 -1.746 -6.729 5.796 1.00 1.00 H new ATOM 0 HB3 TYR A 87 -1.524 -6.068 4.188 1.00 1.00 H new ATOM 0 HD1 TYR A 87 0.014 -3.999 6.809 1.00 1.00 H new ATOM 0 HD2 TYR A 87 0.569 -7.498 4.371 1.00 1.00 H new ATOM 0 HE1 TYR A 87 2.478 -3.742 7.003 1.00 1.00 H new ATOM 0 HE2 TYR A 87 3.028 -7.202 4.486 1.00 1.00 H new ATOM 0 HH TYR A 87 4.663 -5.901 6.427 1.00 1.00 H new ATOM 1419 N VAL A 88 -4.402 -5.785 4.998 1.00 1.00 N ATOM 1420 CA VAL A 88 -5.724 -5.969 4.418 1.00 1.00 C ATOM 1421 C VAL A 88 -6.497 -6.864 5.399 1.00 1.00 C ATOM 1422 O VAL A 88 -5.881 -7.675 6.084 1.00 1.00 O ATOM 1423 CB VAL A 88 -5.620 -6.677 3.033 1.00 1.00 C ATOM 1424 CG1 VAL A 88 -6.942 -6.589 2.249 1.00 1.00 C ATOM 1425 CG2 VAL A 88 -4.511 -6.180 2.087 1.00 1.00 C ATOM 0 H VAL A 88 -4.113 -6.574 5.576 1.00 1.00 H new ATOM 0 HA VAL A 88 -6.221 -5.011 4.262 1.00 1.00 H new ATOM 0 HB VAL A 88 -5.369 -7.698 3.321 1.00 1.00 H new ATOM 0 HG11 VAL A 88 -6.830 -7.094 1.289 1.00 1.00 H new ATOM 0 HG12 VAL A 88 -7.737 -7.068 2.821 1.00 1.00 H new ATOM 0 HG13 VAL A 88 -7.196 -5.543 2.081 1.00 1.00 H new ATOM 0 HG21 VAL A 88 -4.542 -6.750 1.158 1.00 1.00 H new ATOM 0 HG22 VAL A 88 -4.665 -5.123 1.869 1.00 1.00 H new ATOM 0 HG23 VAL A 88 -3.540 -6.315 2.563 1.00 1.00 H new ATOM 1435 N ASP A 89 -7.833 -6.804 5.369 1.00 1.00 N ATOM 1436 CA ASP A 89 -8.734 -7.853 5.874 1.00 1.00 C ATOM 1437 C ASP A 89 -8.715 -7.972 7.407 1.00 1.00 C ATOM 1438 O ASP A 89 -8.159 -8.900 7.994 1.00 1.00 O ATOM 1439 CB ASP A 89 -8.481 -9.178 5.129 1.00 1.00 C ATOM 1440 CG ASP A 89 -9.713 -10.077 5.086 1.00 1.00 C ATOM 1441 OD1 ASP A 89 -9.952 -10.849 6.041 1.00 1.00 O ATOM 1442 OD2 ASP A 89 -10.428 -10.045 4.058 1.00 1.00 O ATOM 0 H ASP A 89 -8.334 -6.004 4.983 1.00 1.00 H new ATOM 0 HA ASP A 89 -9.760 -7.561 5.652 1.00 1.00 H new ATOM 0 HB2 ASP A 89 -8.160 -8.961 4.110 1.00 1.00 H new ATOM 0 HB3 ASP A 89 -7.664 -9.712 5.614 1.00 1.00 H new ATOM 1447 N LEU A 90 -9.372 -6.995 8.040 1.00 1.00 N ATOM 1448 CA LEU A 90 -9.460 -6.737 9.479 1.00 1.00 C ATOM 1449 C LEU A 90 -10.919 -6.723 9.977 1.00 1.00 C ATOM 1450 O LEU A 90 -11.256 -6.018 10.926 1.00 1.00 O ATOM 1451 CB LEU A 90 -8.677 -5.453 9.853 1.00 1.00 C ATOM 1452 CG LEU A 90 -8.968 -4.127 9.118 1.00 1.00 C ATOM 1453 CD1 LEU A 90 -8.212 -4.020 7.791 1.00 1.00 C ATOM 1454 CD2 LEU A 90 -10.444 -3.839 8.830 1.00 1.00 C ATOM 0 H LEU A 90 -9.903 -6.304 7.510 1.00 1.00 H new ATOM 0 HA LEU A 90 -8.983 -7.565 10.003 1.00 1.00 H new ATOM 0 HB2 LEU A 90 -8.836 -5.275 10.917 1.00 1.00 H new ATOM 0 HB3 LEU A 90 -7.617 -5.670 9.721 1.00 1.00 H new ATOM 0 HG LEU A 90 -8.619 -3.383 9.834 1.00 1.00 H new ATOM 0 HD11 LEU A 90 -8.450 -3.070 7.312 1.00 1.00 H new ATOM 0 HD12 LEU A 90 -7.139 -4.074 7.978 1.00 1.00 H new ATOM 0 HD13 LEU A 90 -8.508 -4.840 7.137 1.00 1.00 H new ATOM 0 HD21 LEU A 90 -10.534 -2.884 8.312 1.00 1.00 H new ATOM 0 HD22 LEU A 90 -10.854 -4.632 8.204 1.00 1.00 H new ATOM 0 HD23 LEU A 90 -10.996 -3.796 9.769 1.00 1.00 H new ATOM 1466 N GLU A 91 -11.810 -7.451 9.299 1.00 1.00 N ATOM 1467 CA GLU A 91 -13.231 -7.642 9.626 1.00 1.00 C ATOM 1468 C GLU A 91 -14.089 -6.366 9.521 1.00 1.00 C ATOM 1469 O GLU A 91 -15.280 -6.381 9.832 1.00 1.00 O ATOM 1470 CB GLU A 91 -13.352 -8.391 10.968 1.00 1.00 C ATOM 1471 CG GLU A 91 -14.724 -9.049 11.170 1.00 1.00 C ATOM 1472 CD GLU A 91 -14.723 -10.111 12.269 1.00 1.00 C ATOM 1473 OE1 GLU A 91 -14.160 -9.885 13.368 1.00 1.00 O ATOM 1474 OE2 GLU A 91 -15.336 -11.178 12.050 1.00 1.00 O ATOM 0 H GLU A 91 -11.545 -7.956 8.453 1.00 1.00 H new ATOM 0 HA GLU A 91 -13.672 -8.271 8.853 1.00 1.00 H new ATOM 0 HB2 GLU A 91 -12.578 -9.156 11.021 1.00 1.00 H new ATOM 0 HB3 GLU A 91 -13.167 -7.693 11.785 1.00 1.00 H new ATOM 0 HG2 GLU A 91 -15.456 -8.280 11.416 1.00 1.00 H new ATOM 0 HG3 GLU A 91 -15.043 -9.505 10.233 1.00 1.00 H new ATOM 1481 N ARG A 92 -13.519 -5.289 8.968 1.00 1.00 N ATOM 1482 CA ARG A 92 -13.994 -3.922 8.916 1.00 1.00 C ATOM 1483 C ARG A 92 -13.833 -3.264 10.272 1.00 1.00 C ATOM 1484 O ARG A 92 -14.288 -3.779 11.290 1.00 1.00 O ATOM 1485 CB ARG A 92 -15.420 -3.780 8.406 1.00 1.00 C ATOM 1486 CG ARG A 92 -15.740 -4.531 7.113 1.00 1.00 C ATOM 1487 CD ARG A 92 -14.932 -4.023 5.909 1.00 1.00 C ATOM 1488 NE ARG A 92 -15.810 -3.569 4.824 1.00 1.00 N ATOM 1489 CZ ARG A 92 -16.674 -4.347 4.150 1.00 1.00 C ATOM 1490 NH1 ARG A 92 -16.660 -5.671 4.284 1.00 1.00 N ATOM 1491 NH2 ARG A 92 -17.570 -3.809 3.339 1.00 1.00 N ATOM 0 H ARG A 92 -12.618 -5.375 8.499 1.00 1.00 H new ATOM 0 HA ARG A 92 -13.373 -3.408 8.182 1.00 1.00 H new ATOM 0 HB2 ARG A 92 -16.101 -4.127 9.184 1.00 1.00 H new ATOM 0 HB3 ARG A 92 -15.627 -2.721 8.250 1.00 1.00 H new ATOM 0 HG2 ARG A 92 -15.539 -5.593 7.257 1.00 1.00 H new ATOM 0 HG3 ARG A 92 -16.804 -4.434 6.897 1.00 1.00 H new ATOM 0 HD2 ARG A 92 -14.286 -3.203 6.223 1.00 1.00 H new ATOM 0 HD3 ARG A 92 -14.282 -4.818 5.544 1.00 1.00 H new ATOM 0 HE ARG A 92 -15.760 -2.585 4.561 1.00 1.00 H new ATOM 0 HH11 ARG A 92 -15.985 -6.113 4.908 1.00 1.00 H new ATOM 0 HH12 ARG A 92 -17.325 -6.243 3.763 1.00 1.00 H new ATOM 0 HH21 ARG A 92 -17.609 -2.797 3.222 1.00 1.00 H new ATOM 0 HH22 ARG A 92 -18.222 -4.407 2.831 1.00 1.00 H new ATOM 1505 N GLU A 93 -13.162 -2.123 10.270 1.00 1.00 N ATOM 1506 CA GLU A 93 -13.192 -1.196 11.374 1.00 1.00 C ATOM 1507 C GLU A 93 -14.505 -0.411 11.295 1.00 1.00 C ATOM 1508 O GLU A 93 -15.372 -0.724 10.470 1.00 1.00 O ATOM 1509 CB GLU A 93 -11.933 -0.310 11.334 1.00 1.00 C ATOM 1510 CG GLU A 93 -11.227 -0.206 12.693 1.00 1.00 C ATOM 1511 CD GLU A 93 -11.646 1.043 13.461 1.00 1.00 C ATOM 1512 OE1 GLU A 93 -11.191 2.154 13.107 1.00 1.00 O ATOM 1513 OE2 GLU A 93 -12.462 0.914 14.401 1.00 1.00 O ATOM 0 H GLU A 93 -12.578 -1.818 9.491 1.00 1.00 H new ATOM 0 HA GLU A 93 -13.170 -1.705 12.338 1.00 1.00 H new ATOM 0 HB2 GLU A 93 -11.236 -0.712 10.599 1.00 1.00 H new ATOM 0 HB3 GLU A 93 -12.210 0.689 10.997 1.00 1.00 H new ATOM 0 HG2 GLU A 93 -11.454 -1.091 13.288 1.00 1.00 H new ATOM 0 HG3 GLU A 93 -10.148 -0.193 12.541 1.00 1.00 H new ATOM 1520 N ALA A 94 -14.640 0.609 12.144 1.00 1.00 N ATOM 1521 CA ALA A 94 -15.834 1.443 12.273 1.00 1.00 C ATOM 1522 C ALA A 94 -16.146 2.151 10.952 1.00 1.00 C ATOM 1523 O ALA A 94 -15.613 3.223 10.659 1.00 1.00 O ATOM 1524 CB ALA A 94 -15.670 2.433 13.425 1.00 1.00 C ATOM 0 H ALA A 94 -13.894 0.886 12.783 1.00 1.00 H new ATOM 0 HA ALA A 94 -16.686 0.804 12.506 1.00 1.00 H new ATOM 0 HB1 ALA A 94 -16.567 3.047 13.508 1.00 1.00 H new ATOM 0 HB2 ALA A 94 -15.517 1.886 14.355 1.00 1.00 H new ATOM 0 HB3 ALA A 94 -14.809 3.073 13.235 1.00 1.00 H new ATOM 1530 N GLY A 95 -16.947 1.499 10.115 1.00 1.00 N ATOM 1531 CA GLY A 95 -17.237 1.858 8.738 1.00 1.00 C ATOM 1532 C GLY A 95 -16.031 2.131 7.845 1.00 1.00 C ATOM 1533 O GLY A 95 -16.236 2.637 6.745 1.00 1.00 O ATOM 0 H GLY A 95 -17.440 0.653 10.402 1.00 1.00 H new ATOM 0 HA2 GLY A 95 -17.820 1.054 8.290 1.00 1.00 H new ATOM 0 HA3 GLY A 95 -17.869 2.746 8.741 1.00 1.00 H new ATOM 1537 N LYS A 96 -14.802 1.806 8.244 1.00 1.00 N ATOM 1538 CA LYS A 96 -13.621 1.974 7.408 1.00 1.00 C ATOM 1539 C LYS A 96 -12.884 0.646 7.338 1.00 1.00 C ATOM 1540 O LYS A 96 -13.184 -0.287 8.086 1.00 1.00 O ATOM 1541 CB LYS A 96 -12.721 3.127 7.899 1.00 1.00 C ATOM 1542 CG LYS A 96 -12.344 3.267 9.381 1.00 1.00 C ATOM 1543 CD LYS A 96 -11.997 4.724 9.757 1.00 1.00 C ATOM 1544 CE LYS A 96 -10.732 4.902 10.610 1.00 1.00 C ATOM 1545 NZ LYS A 96 -10.949 4.654 12.051 1.00 1.00 N ATOM 0 H LYS A 96 -14.600 1.416 9.164 1.00 1.00 H new ATOM 0 HA LYS A 96 -13.927 2.261 6.402 1.00 1.00 H new ATOM 0 HB2 LYS A 96 -11.789 3.064 7.338 1.00 1.00 H new ATOM 0 HB3 LYS A 96 -13.207 4.057 7.605 1.00 1.00 H new ATOM 0 HG2 LYS A 96 -13.172 2.921 10.000 1.00 1.00 H new ATOM 0 HG3 LYS A 96 -11.492 2.624 9.600 1.00 1.00 H new ATOM 0 HD2 LYS A 96 -11.879 5.300 8.839 1.00 1.00 H new ATOM 0 HD3 LYS A 96 -12.842 5.153 10.296 1.00 1.00 H new ATOM 0 HE2 LYS A 96 -9.960 4.224 10.246 1.00 1.00 H new ATOM 0 HE3 LYS A 96 -10.354 5.916 10.477 1.00 1.00 H new ATOM 0 HZ1 LYS A 96 -10.227 5.160 12.603 1.00 1.00 H new ATOM 0 HZ2 LYS A 96 -11.894 4.993 12.323 1.00 1.00 H new ATOM 0 HZ3 LYS A 96 -10.879 3.634 12.242 1.00 1.00 H new ATOM 1559 N VAL A 97 -11.896 0.546 6.459 1.00 1.00 N ATOM 1560 CA VAL A 97 -10.923 -0.529 6.503 1.00 1.00 C ATOM 1561 C VAL A 97 -9.556 0.122 6.569 1.00 1.00 C ATOM 1562 O VAL A 97 -9.336 1.201 6.015 1.00 1.00 O ATOM 1563 CB VAL A 97 -11.155 -1.503 5.333 1.00 1.00 C ATOM 1564 CG1 VAL A 97 -10.212 -1.362 4.143 1.00 1.00 C ATOM 1565 CG2 VAL A 97 -11.156 -2.966 5.747 1.00 1.00 C ATOM 0 H VAL A 97 -11.749 1.209 5.698 1.00 1.00 H new ATOM 0 HA VAL A 97 -11.018 -1.164 7.384 1.00 1.00 H new ATOM 0 HB VAL A 97 -12.149 -1.196 5.007 1.00 1.00 H new ATOM 0 HG11 VAL A 97 -10.472 -2.099 3.383 1.00 1.00 H new ATOM 0 HG12 VAL A 97 -10.304 -0.360 3.723 1.00 1.00 H new ATOM 0 HG13 VAL A 97 -9.185 -1.525 4.471 1.00 1.00 H new ATOM 0 HG21 VAL A 97 -11.325 -3.592 4.871 1.00 1.00 H new ATOM 0 HG22 VAL A 97 -10.194 -3.218 6.193 1.00 1.00 H new ATOM 0 HG23 VAL A 97 -11.950 -3.138 6.474 1.00 1.00 H new ATOM 1575 N TYR A 98 -8.657 -0.515 7.299 1.00 1.00 N ATOM 1576 CA TYR A 98 -7.276 -0.122 7.373 1.00 1.00 C ATOM 1577 C TYR A 98 -6.578 -0.811 6.210 1.00 1.00 C ATOM 1578 O TYR A 98 -7.067 -1.826 5.702 1.00 1.00 O ATOM 1579 CB TYR A 98 -6.724 -0.548 8.725 1.00 1.00 C ATOM 1580 CG TYR A 98 -7.223 0.197 9.960 1.00 1.00 C ATOM 1581 CD1 TYR A 98 -8.333 1.070 9.925 1.00 1.00 C ATOM 1582 CD2 TYR A 98 -6.564 -0.013 11.185 1.00 1.00 C ATOM 1583 CE1 TYR A 98 -8.788 1.689 11.097 1.00 1.00 C ATOM 1584 CE2 TYR A 98 -6.989 0.632 12.357 1.00 1.00 C ATOM 1585 CZ TYR A 98 -8.113 1.479 12.318 1.00 1.00 C ATOM 1586 OH TYR A 98 -8.536 2.100 13.451 1.00 1.00 O ATOM 0 H TYR A 98 -8.879 -1.334 7.865 1.00 1.00 H new ATOM 0 HA TYR A 98 -7.127 0.955 7.295 1.00 1.00 H new ATOM 0 HB2 TYR A 98 -6.945 -1.607 8.859 1.00 1.00 H new ATOM 0 HB3 TYR A 98 -5.639 -0.451 8.690 1.00 1.00 H new ATOM 0 HD1 TYR A 98 -8.835 1.262 8.988 1.00 1.00 H new ATOM 0 HD2 TYR A 98 -5.717 -0.682 11.224 1.00 1.00 H new ATOM 0 HE1 TYR A 98 -9.658 2.329 11.066 1.00 1.00 H new ATOM 0 HE2 TYR A 98 -6.456 0.479 13.284 1.00 1.00 H new ATOM 0 HH TYR A 98 -9.442 2.449 13.314 1.00 1.00 H new ATOM 1596 N LEU A 99 -5.514 -0.201 5.712 1.00 1.00 N ATOM 1597 CA LEU A 99 -5.005 -0.542 4.403 1.00 1.00 C ATOM 1598 C LEU A 99 -3.519 -0.207 4.411 1.00 1.00 C ATOM 1599 O LEU A 99 -3.119 0.855 4.893 1.00 1.00 O ATOM 1600 CB LEU A 99 -5.863 0.233 3.372 1.00 1.00 C ATOM 1601 CG LEU A 99 -6.156 -0.498 2.054 1.00 1.00 C ATOM 1602 CD1 LEU A 99 -4.904 -0.833 1.262 1.00 1.00 C ATOM 1603 CD2 LEU A 99 -6.989 -1.766 2.278 1.00 1.00 C ATOM 0 H LEU A 99 -4.991 0.529 6.196 1.00 1.00 H new ATOM 0 HA LEU A 99 -5.082 -1.595 4.133 1.00 1.00 H new ATOM 0 HB2 LEU A 99 -6.813 0.491 3.840 1.00 1.00 H new ATOM 0 HB3 LEU A 99 -5.357 1.170 3.140 1.00 1.00 H new ATOM 0 HG LEU A 99 -6.738 0.206 1.459 1.00 1.00 H new ATOM 0 HD11 LEU A 99 -5.182 -1.348 0.343 1.00 1.00 H new ATOM 0 HD12 LEU A 99 -4.372 0.086 1.016 1.00 1.00 H new ATOM 0 HD13 LEU A 99 -4.258 -1.478 1.858 1.00 1.00 H new ATOM 0 HD21 LEU A 99 -7.174 -2.253 1.321 1.00 1.00 H new ATOM 0 HD22 LEU A 99 -6.446 -2.447 2.933 1.00 1.00 H new ATOM 0 HD23 LEU A 99 -7.940 -1.500 2.740 1.00 1.00 H new ATOM 1615 N LYS A 100 -2.675 -1.114 3.929 1.00 1.00 N ATOM 1616 CA LYS A 100 -1.227 -0.989 4.083 1.00 1.00 C ATOM 1617 C LYS A 100 -0.511 -1.945 3.149 1.00 1.00 C ATOM 1618 O LYS A 100 -0.870 -3.122 3.077 1.00 1.00 O ATOM 1619 CB LYS A 100 -0.789 -1.286 5.539 1.00 1.00 C ATOM 1620 CG LYS A 100 -0.062 -0.094 6.163 1.00 1.00 C ATOM 1621 CD LYS A 100 0.828 -0.398 7.373 1.00 1.00 C ATOM 1622 CE LYS A 100 0.048 -0.793 8.625 1.00 1.00 C ATOM 1623 NZ LYS A 100 0.656 -0.213 9.840 1.00 1.00 N ATOM 0 H LYS A 100 -2.971 -1.950 3.425 1.00 1.00 H new ATOM 0 HA LYS A 100 -0.960 0.038 3.836 1.00 1.00 H new ATOM 0 HB2 LYS A 100 -1.664 -1.534 6.139 1.00 1.00 H new ATOM 0 HB3 LYS A 100 -0.136 -2.159 5.552 1.00 1.00 H new ATOM 0 HG2 LYS A 100 0.554 0.372 5.394 1.00 1.00 H new ATOM 0 HG3 LYS A 100 -0.808 0.642 6.463 1.00 1.00 H new ATOM 0 HD2 LYS A 100 1.515 -1.204 7.114 1.00 1.00 H new ATOM 0 HD3 LYS A 100 1.435 0.479 7.596 1.00 1.00 H new ATOM 0 HE2 LYS A 100 -0.984 -0.455 8.535 1.00 1.00 H new ATOM 0 HE3 LYS A 100 0.021 -1.879 8.712 1.00 1.00 H new ATOM 0 HZ1 LYS A 100 0.105 -0.499 10.674 1.00 1.00 H new ATOM 0 HZ2 LYS A 100 1.633 -0.556 9.937 1.00 1.00 H new ATOM 0 HZ3 LYS A 100 0.659 0.824 9.765 1.00 1.00 H new ATOM 1637 N ALA A 101 0.560 -1.485 2.509 1.00 1.00 N ATOM 1638 CA ALA A 101 1.449 -2.395 1.789 1.00 1.00 C ATOM 1639 C ALA A 101 2.883 -1.885 1.786 1.00 1.00 C ATOM 1640 O ALA A 101 3.077 -0.683 1.610 1.00 1.00 O ATOM 1641 CB ALA A 101 0.978 -2.610 0.344 1.00 1.00 C ATOM 0 H ALA A 101 0.832 -0.503 2.473 1.00 1.00 H new ATOM 0 HA ALA A 101 1.417 -3.349 2.315 1.00 1.00 H new ATOM 0 HB1 ALA A 101 1.661 -3.291 -0.164 1.00 1.00 H new ATOM 0 HB2 ALA A 101 -0.025 -3.037 0.348 1.00 1.00 H new ATOM 0 HB3 ALA A 101 0.963 -1.654 -0.180 1.00 1.00 H new ATOM 1647 N PRO A 102 3.891 -2.760 1.937 1.00 1.00 N ATOM 1648 CA PRO A 102 5.255 -2.386 1.647 1.00 1.00 C ATOM 1649 C PRO A 102 5.432 -2.233 0.129 1.00 1.00 C ATOM 1650 O PRO A 102 4.964 -3.066 -0.645 1.00 1.00 O ATOM 1651 CB PRO A 102 6.140 -3.467 2.260 1.00 1.00 C ATOM 1652 CG PRO A 102 5.239 -4.696 2.354 1.00 1.00 C ATOM 1653 CD PRO A 102 3.806 -4.167 2.290 1.00 1.00 C ATOM 0 HA PRO A 102 5.532 -1.423 2.075 1.00 1.00 H new ATOM 0 HB2 PRO A 102 7.014 -3.663 1.639 1.00 1.00 H new ATOM 0 HB3 PRO A 102 6.507 -3.169 3.242 1.00 1.00 H new ATOM 0 HG2 PRO A 102 5.437 -5.389 1.537 1.00 1.00 H new ATOM 0 HG3 PRO A 102 5.414 -5.239 3.282 1.00 1.00 H new ATOM 0 HD2 PRO A 102 3.224 -4.716 1.550 1.00 1.00 H new ATOM 0 HD3 PRO A 102 3.304 -4.295 3.249 1.00 1.00 H new ATOM 1661 N MET A 103 6.110 -1.171 -0.301 1.00 1.00 N ATOM 1662 CA MET A 103 6.349 -0.795 -1.686 1.00 1.00 C ATOM 1663 C MET A 103 7.849 -0.674 -1.891 1.00 1.00 C ATOM 1664 O MET A 103 8.569 -0.405 -0.932 1.00 1.00 O ATOM 1665 CB MET A 103 5.739 0.578 -2.005 1.00 1.00 C ATOM 1666 CG MET A 103 4.516 0.973 -1.171 1.00 1.00 C ATOM 1667 SD MET A 103 3.011 0.123 -1.675 1.00 1.00 S ATOM 1668 CE MET A 103 2.843 0.977 -3.250 1.00 1.00 C ATOM 0 H MET A 103 6.532 -0.511 0.352 1.00 1.00 H new ATOM 0 HA MET A 103 5.899 -1.551 -2.330 1.00 1.00 H new ATOM 0 HB2 MET A 103 6.509 1.337 -1.869 1.00 1.00 H new ATOM 0 HB3 MET A 103 5.458 0.594 -3.058 1.00 1.00 H new ATOM 0 HG2 MET A 103 4.714 0.756 -0.121 1.00 1.00 H new ATOM 0 HG3 MET A 103 4.362 2.049 -1.250 1.00 1.00 H new ATOM 0 HE1 MET A 103 1.800 0.956 -3.566 1.00 1.00 H new ATOM 0 HE2 MET A 103 3.168 2.011 -3.140 1.00 1.00 H new ATOM 0 HE3 MET A 103 3.459 0.481 -4.000 1.00 1.00 H new ATOM 1678 N ILE A 104 8.321 -0.784 -3.134 1.00 1.00 N ATOM 1679 CA ILE A 104 9.738 -0.709 -3.454 1.00 1.00 C ATOM 1680 C ILE A 104 9.837 0.047 -4.774 1.00 1.00 C ATOM 1681 O ILE A 104 9.443 -0.489 -5.808 1.00 1.00 O ATOM 1682 CB ILE A 104 10.385 -2.112 -3.475 1.00 1.00 C ATOM 1683 CG1 ILE A 104 10.024 -2.897 -2.191 1.00 1.00 C ATOM 1684 CG2 ILE A 104 11.907 -1.952 -3.637 1.00 1.00 C ATOM 1685 CD1 ILE A 104 10.709 -4.241 -2.063 1.00 1.00 C ATOM 0 H ILE A 104 7.723 -0.928 -3.948 1.00 1.00 H new ATOM 0 HA ILE A 104 10.305 -0.173 -2.692 1.00 1.00 H new ATOM 0 HB ILE A 104 10.001 -2.688 -4.317 1.00 1.00 H new ATOM 0 HG12 ILE A 104 10.281 -2.288 -1.324 1.00 1.00 H new ATOM 0 HG13 ILE A 104 8.945 -3.049 -2.165 1.00 1.00 H new ATOM 0 HG21 ILE A 104 12.377 -2.936 -3.653 1.00 1.00 H new ATOM 0 HG22 ILE A 104 12.121 -1.432 -4.571 1.00 1.00 H new ATOM 0 HG23 ILE A 104 12.303 -1.375 -2.802 1.00 1.00 H new ATOM 0 HD11 ILE A 104 10.398 -4.721 -1.135 1.00 1.00 H new ATOM 0 HD12 ILE A 104 10.433 -4.872 -2.908 1.00 1.00 H new ATOM 0 HD13 ILE A 104 11.790 -4.099 -2.054 1.00 1.00 H new ATOM 1697 N LEU A 105 10.240 1.321 -4.713 1.00 1.00 N ATOM 1698 CA LEU A 105 10.156 2.243 -5.852 1.00 1.00 C ATOM 1699 C LEU A 105 11.491 2.217 -6.594 1.00 1.00 C ATOM 1700 O LEU A 105 11.819 1.193 -7.188 1.00 1.00 O ATOM 1701 CB LEU A 105 9.677 3.639 -5.389 1.00 1.00 C ATOM 1702 CG LEU A 105 8.146 3.770 -5.222 1.00 1.00 C ATOM 1703 CD1 LEU A 105 7.431 3.812 -6.575 1.00 1.00 C ATOM 1704 CD2 LEU A 105 7.522 2.654 -4.371 1.00 1.00 C ATOM 0 H LEU A 105 10.634 1.743 -3.872 1.00 1.00 H new ATOM 0 HA LEU A 105 9.399 1.929 -6.570 1.00 1.00 H new ATOM 0 HB2 LEU A 105 10.155 3.876 -4.438 1.00 1.00 H new ATOM 0 HB3 LEU A 105 10.016 4.383 -6.110 1.00 1.00 H new ATOM 0 HG LEU A 105 8.005 4.714 -4.695 1.00 1.00 H new ATOM 0 HD11 LEU A 105 6.357 3.904 -6.416 1.00 1.00 H new ATOM 0 HD12 LEU A 105 7.788 4.667 -7.149 1.00 1.00 H new ATOM 0 HD13 LEU A 105 7.639 2.894 -7.125 1.00 1.00 H new ATOM 0 HD21 LEU A 105 6.446 2.811 -4.297 1.00 1.00 H new ATOM 0 HD22 LEU A 105 7.716 1.688 -4.838 1.00 1.00 H new ATOM 0 HD23 LEU A 105 7.960 2.669 -3.373 1.00 1.00 H new ATOM 1716 N ASN A 106 12.332 3.255 -6.498 1.00 1.00 N ATOM 1717 CA ASN A 106 13.679 3.220 -7.092 1.00 1.00 C ATOM 1718 C ASN A 106 14.589 2.179 -6.436 1.00 1.00 C ATOM 1719 O ASN A 106 15.682 1.902 -6.937 1.00 1.00 O ATOM 1720 CB ASN A 106 14.346 4.596 -6.998 1.00 1.00 C ATOM 1721 CG ASN A 106 13.941 5.441 -8.192 1.00 1.00 C ATOM 1722 OD1 ASN A 106 12.991 6.341 -8.049 1.00 1.00 O flip ATOM 1723 ND2 ASN A 106 14.459 5.238 -9.287 1.00 1.00 N flip ATOM 0 H ASN A 106 12.107 4.126 -6.018 1.00 1.00 H new ATOM 0 HA ASN A 106 13.544 2.938 -8.136 1.00 1.00 H new ATOM 0 HB2 ASN A 106 14.052 5.091 -6.073 1.00 1.00 H new ATOM 0 HB3 ASN A 106 15.430 4.485 -6.969 1.00 1.00 H new ATOM 0 HD21 ASN A 106 15.194 4.537 -9.381 1.00 1.00 H new ATOM 0 HD22 ASN A 106 14.154 5.770 -10.102 1.00 1.00 H new ATOM 1730 N GLY A 107 14.150 1.617 -5.315 1.00 1.00 N ATOM 1731 CA GLY A 107 14.895 0.725 -4.455 1.00 1.00 C ATOM 1732 C GLY A 107 14.799 1.202 -3.017 1.00 1.00 C ATOM 1733 O GLY A 107 15.790 1.217 -2.299 1.00 1.00 O ATOM 0 H GLY A 107 13.206 1.787 -4.968 1.00 1.00 H new ATOM 0 HA2 GLY A 107 14.503 -0.289 -4.539 1.00 1.00 H new ATOM 0 HA3 GLY A 107 15.939 0.690 -4.768 1.00 1.00 H new ATOM 1737 N VAL A 108 13.621 1.671 -2.627 1.00 1.00 N ATOM 1738 CA VAL A 108 13.330 2.178 -1.314 1.00 1.00 C ATOM 1739 C VAL A 108 12.130 1.407 -0.800 1.00 1.00 C ATOM 1740 O VAL A 108 11.037 1.566 -1.346 1.00 1.00 O ATOM 1741 CB VAL A 108 13.091 3.695 -1.323 1.00 1.00 C ATOM 1742 CG1 VAL A 108 13.225 4.207 0.108 1.00 1.00 C ATOM 1743 CG2 VAL A 108 14.066 4.471 -2.214 1.00 1.00 C ATOM 0 H VAL A 108 12.815 1.705 -3.252 1.00 1.00 H new ATOM 0 HA VAL A 108 14.182 2.033 -0.650 1.00 1.00 H new ATOM 0 HB VAL A 108 12.095 3.860 -1.733 1.00 1.00 H new ATOM 0 HG11 VAL A 108 13.059 5.284 0.126 1.00 1.00 H new ATOM 0 HG12 VAL A 108 12.486 3.715 0.741 1.00 1.00 H new ATOM 0 HG13 VAL A 108 14.226 3.988 0.481 1.00 1.00 H new ATOM 0 HG21 VAL A 108 13.833 5.535 -2.168 1.00 1.00 H new ATOM 0 HG22 VAL A 108 15.086 4.307 -1.866 1.00 1.00 H new ATOM 0 HG23 VAL A 108 13.974 4.124 -3.243 1.00 1.00 H new ATOM 1753 N CYS A 109 12.361 0.534 0.174 1.00 1.00 N ATOM 1754 CA CYS A 109 11.374 -0.291 0.823 1.00 1.00 C ATOM 1755 C CYS A 109 10.662 0.572 1.851 1.00 1.00 C ATOM 1756 O CYS A 109 11.158 0.872 2.935 1.00 1.00 O ATOM 1757 CB CYS A 109 12.034 -1.512 1.440 1.00 1.00 C ATOM 1758 SG CYS A 109 12.985 -2.380 0.161 1.00 1.00 S ATOM 0 H CYS A 109 13.298 0.382 0.546 1.00 1.00 H new ATOM 0 HA CYS A 109 10.641 -0.670 0.111 1.00 1.00 H new ATOM 0 HB2 CYS A 109 12.689 -1.213 2.258 1.00 1.00 H new ATOM 0 HB3 CYS A 109 11.279 -2.175 1.863 1.00 1.00 H new ATOM 0 HG CYS A 109 14.256 -2.241 0.396 1.00 1.00 H new ATOM 1764 N VAL A 110 9.506 1.029 1.428 1.00 1.00 N ATOM 1765 CA VAL A 110 8.601 1.923 2.134 1.00 1.00 C ATOM 1766 C VAL A 110 7.316 1.182 2.458 1.00 1.00 C ATOM 1767 O VAL A 110 7.120 0.068 1.987 1.00 1.00 O ATOM 1768 CB VAL A 110 8.396 3.180 1.263 1.00 1.00 C ATOM 1769 CG1 VAL A 110 9.735 3.948 1.254 1.00 1.00 C ATOM 1770 CG2 VAL A 110 7.881 2.816 -0.135 1.00 1.00 C ATOM 0 H VAL A 110 9.141 0.769 0.512 1.00 1.00 H new ATOM 0 HA VAL A 110 9.009 2.252 3.090 1.00 1.00 H new ATOM 0 HB VAL A 110 7.621 3.827 1.675 1.00 1.00 H new ATOM 0 HG11 VAL A 110 9.634 4.848 0.647 1.00 1.00 H new ATOM 0 HG12 VAL A 110 10.002 4.226 2.274 1.00 1.00 H new ATOM 0 HG13 VAL A 110 10.516 3.313 0.835 1.00 1.00 H new ATOM 0 HG21 VAL A 110 7.748 3.725 -0.722 1.00 1.00 H new ATOM 0 HG22 VAL A 110 8.602 2.167 -0.631 1.00 1.00 H new ATOM 0 HG23 VAL A 110 6.926 2.297 -0.047 1.00 1.00 H new ATOM 1780 N ILE A 111 6.414 1.805 3.206 1.00 1.00 N ATOM 1781 CA ILE A 111 5.067 1.326 3.445 1.00 1.00 C ATOM 1782 C ILE A 111 4.140 2.409 2.951 1.00 1.00 C ATOM 1783 O ILE A 111 4.188 3.532 3.443 1.00 1.00 O ATOM 1784 CB ILE A 111 4.806 1.021 4.934 1.00 1.00 C ATOM 1785 CG1 ILE A 111 5.858 0.047 5.458 1.00 1.00 C ATOM 1786 CG2 ILE A 111 3.397 0.453 5.132 1.00 1.00 C ATOM 1787 CD1 ILE A 111 5.611 -0.466 6.868 1.00 1.00 C ATOM 0 H ILE A 111 6.611 2.688 3.677 1.00 1.00 H new ATOM 0 HA ILE A 111 4.906 0.384 2.921 1.00 1.00 H new ATOM 0 HB ILE A 111 4.876 1.950 5.499 1.00 1.00 H new ATOM 0 HG12 ILE A 111 5.912 -0.806 4.781 1.00 1.00 H new ATOM 0 HG13 ILE A 111 6.831 0.537 5.431 1.00 1.00 H new ATOM 0 HG21 ILE A 111 3.234 0.245 6.189 1.00 1.00 H new ATOM 0 HG22 ILE A 111 2.660 1.179 4.787 1.00 1.00 H new ATOM 0 HG23 ILE A 111 3.293 -0.469 4.560 1.00 1.00 H new ATOM 0 HD11 ILE A 111 6.410 -1.151 7.151 1.00 1.00 H new ATOM 0 HD12 ILE A 111 5.590 0.374 7.562 1.00 1.00 H new ATOM 0 HD13 ILE A 111 4.656 -0.990 6.903 1.00 1.00 H new ATOM 1799 N TRP A 112 3.304 2.093 1.974 1.00 1.00 N ATOM 1800 CA TRP A 112 2.115 2.889 1.785 1.00 1.00 C ATOM 1801 C TRP A 112 1.190 2.472 2.911 1.00 1.00 C ATOM 1802 O TRP A 112 0.973 1.271 3.094 1.00 1.00 O ATOM 1803 CB TRP A 112 1.456 2.586 0.443 1.00 1.00 C ATOM 1804 CG TRP A 112 0.234 3.412 0.183 1.00 1.00 C ATOM 1805 CD1 TRP A 112 0.186 4.521 -0.583 1.00 1.00 C ATOM 1806 CD2 TRP A 112 -1.117 3.242 0.715 1.00 1.00 C ATOM 1807 NE1 TRP A 112 -1.107 5.005 -0.610 1.00 1.00 N ATOM 1808 CE2 TRP A 112 -1.966 4.207 0.106 1.00 1.00 C ATOM 1809 CE3 TRP A 112 -1.733 2.350 1.616 1.00 1.00 C ATOM 1810 CZ2 TRP A 112 -3.355 4.203 0.285 1.00 1.00 C ATOM 1811 CZ3 TRP A 112 -3.102 2.421 1.895 1.00 1.00 C ATOM 1812 CH2 TRP A 112 -3.929 3.316 1.207 1.00 1.00 C ATOM 0 H TRP A 112 3.424 1.317 1.323 1.00 1.00 H new ATOM 0 HA TRP A 112 2.342 3.955 1.791 1.00 1.00 H new ATOM 0 HB2 TRP A 112 2.178 2.757 -0.355 1.00 1.00 H new ATOM 0 HB3 TRP A 112 1.187 1.530 0.408 1.00 1.00 H new ATOM 0 HD1 TRP A 112 1.028 4.962 -1.096 1.00 1.00 H new ATOM 0 HE1 TRP A 112 -1.390 5.852 -1.102 1.00 1.00 H new ATOM 0 HE3 TRP A 112 -1.134 1.594 2.102 1.00 1.00 H new ATOM 0 HZ2 TRP A 112 -3.979 4.878 -0.282 1.00 1.00 H new ATOM 0 HZ3 TRP A 112 -3.526 1.777 2.651 1.00 1.00 H new ATOM 0 HH2 TRP A 112 -4.994 3.323 1.384 1.00 1.00 H new ATOM 1823 N LYS A 113 0.646 3.424 3.658 1.00 1.00 N ATOM 1824 CA LYS A 113 -0.312 3.133 4.724 1.00 1.00 C ATOM 1825 C LYS A 113 -1.557 4.015 4.649 1.00 1.00 C ATOM 1826 O LYS A 113 -1.507 5.074 4.024 1.00 1.00 O ATOM 1827 CB LYS A 113 0.420 3.264 6.064 1.00 1.00 C ATOM 1828 CG LYS A 113 0.820 4.718 6.391 1.00 1.00 C ATOM 1829 CD LYS A 113 1.330 4.931 7.819 1.00 1.00 C ATOM 1830 CE LYS A 113 2.530 4.054 8.168 1.00 1.00 C ATOM 1831 NZ LYS A 113 3.178 4.525 9.405 1.00 1.00 N ATOM 0 H LYS A 113 0.853 4.416 3.545 1.00 1.00 H new ATOM 0 HA LYS A 113 -0.687 2.116 4.610 1.00 1.00 H new ATOM 0 HB2 LYS A 113 -0.219 2.881 6.860 1.00 1.00 H new ATOM 0 HB3 LYS A 113 1.315 2.642 6.046 1.00 1.00 H new ATOM 0 HG2 LYS A 113 1.594 5.035 5.692 1.00 1.00 H new ATOM 0 HG3 LYS A 113 -0.042 5.364 6.227 1.00 1.00 H new ATOM 0 HD2 LYS A 113 1.604 5.978 7.947 1.00 1.00 H new ATOM 0 HD3 LYS A 113 0.522 4.725 8.521 1.00 1.00 H new ATOM 0 HE2 LYS A 113 2.207 3.020 8.292 1.00 1.00 H new ATOM 0 HE3 LYS A 113 3.248 4.068 7.348 1.00 1.00 H new ATOM 0 HZ1 LYS A 113 3.779 3.769 9.791 1.00 1.00 H new ATOM 0 HZ2 LYS A 113 3.762 5.359 9.195 1.00 1.00 H new ATOM 0 HZ3 LYS A 113 2.450 4.779 10.103 1.00 1.00 H new ATOM 1845 N GLY A 114 -2.632 3.645 5.348 1.00 1.00 N ATOM 1846 CA GLY A 114 -3.817 4.475 5.489 1.00 1.00 C ATOM 1847 C GLY A 114 -5.019 3.722 6.057 1.00 1.00 C ATOM 1848 O GLY A 114 -4.931 2.556 6.442 1.00 1.00 O ATOM 0 H GLY A 114 -2.699 2.751 5.835 1.00 1.00 H new ATOM 0 HA2 GLY A 114 -3.586 5.319 6.139 1.00 1.00 H new ATOM 0 HA3 GLY A 114 -4.082 4.886 4.515 1.00 1.00 H new ATOM 1852 N TRP A 115 -6.168 4.395 6.088 1.00 1.00 N ATOM 1853 CA TRP A 115 -7.481 3.802 6.248 1.00 1.00 C ATOM 1854 C TRP A 115 -8.394 4.411 5.188 1.00 1.00 C ATOM 1855 O TRP A 115 -8.542 5.629 5.079 1.00 1.00 O ATOM 1856 CB TRP A 115 -8.022 3.976 7.675 1.00 1.00 C ATOM 1857 CG TRP A 115 -8.216 5.382 8.157 1.00 1.00 C ATOM 1858 CD1 TRP A 115 -9.325 6.136 7.972 1.00 1.00 C ATOM 1859 CD2 TRP A 115 -7.245 6.263 8.794 1.00 1.00 C ATOM 1860 NE1 TRP A 115 -9.138 7.385 8.527 1.00 1.00 N ATOM 1861 CE2 TRP A 115 -7.877 7.515 9.053 1.00 1.00 C ATOM 1862 CE3 TRP A 115 -5.869 6.165 9.090 1.00 1.00 C ATOM 1863 CZ2 TRP A 115 -7.189 8.609 9.590 1.00 1.00 C ATOM 1864 CZ3 TRP A 115 -5.158 7.271 9.590 1.00 1.00 C ATOM 1865 CH2 TRP A 115 -5.824 8.475 9.868 1.00 1.00 C ATOM 0 H TRP A 115 -6.203 5.410 5.998 1.00 1.00 H new ATOM 0 HA TRP A 115 -7.429 2.723 6.103 1.00 1.00 H new ATOM 0 HB2 TRP A 115 -8.979 3.459 7.741 1.00 1.00 H new ATOM 0 HB3 TRP A 115 -7.340 3.473 8.361 1.00 1.00 H new ATOM 0 HD1 TRP A 115 -10.221 5.809 7.466 1.00 1.00 H new ATOM 0 HE1 TRP A 115 -9.847 8.118 8.544 1.00 1.00 H new ATOM 0 HE3 TRP A 115 -5.355 5.229 8.931 1.00 1.00 H new ATOM 0 HZ2 TRP A 115 -7.702 9.539 9.786 1.00 1.00 H new ATOM 0 HZ3 TRP A 115 -4.094 7.193 9.761 1.00 1.00 H new ATOM 0 HH2 TRP A 115 -5.280 9.303 10.299 1.00 1.00 H new ATOM 1876 N ILE A 116 -9.000 3.549 4.383 1.00 1.00 N ATOM 1877 CA ILE A 116 -10.018 3.917 3.421 1.00 1.00 C ATOM 1878 C ILE A 116 -11.341 3.658 4.123 1.00 1.00 C ATOM 1879 O ILE A 116 -11.686 2.513 4.432 1.00 1.00 O ATOM 1880 CB ILE A 116 -9.852 3.072 2.149 1.00 1.00 C ATOM 1881 CG1 ILE A 116 -8.643 3.503 1.286 1.00 1.00 C ATOM 1882 CG2 ILE A 116 -11.115 3.082 1.283 1.00 1.00 C ATOM 1883 CD1 ILE A 116 -8.841 4.826 0.522 1.00 1.00 C ATOM 0 H ILE A 116 -8.789 2.551 4.384 1.00 1.00 H new ATOM 0 HA ILE A 116 -9.955 4.958 3.103 1.00 1.00 H new ATOM 0 HB ILE A 116 -9.669 2.059 2.507 1.00 1.00 H new ATOM 0 HG12 ILE A 116 -7.769 3.598 1.930 1.00 1.00 H new ATOM 0 HG13 ILE A 116 -8.426 2.713 0.568 1.00 1.00 H new ATOM 0 HG21 ILE A 116 -10.952 2.472 0.395 1.00 1.00 H new ATOM 0 HG22 ILE A 116 -11.951 2.676 1.853 1.00 1.00 H new ATOM 0 HG23 ILE A 116 -11.343 4.105 0.984 1.00 1.00 H new ATOM 0 HD11 ILE A 116 -7.944 5.050 -0.056 1.00 1.00 H new ATOM 0 HD12 ILE A 116 -9.693 4.733 -0.151 1.00 1.00 H new ATOM 0 HD13 ILE A 116 -9.026 5.632 1.232 1.00 1.00 H new ATOM 1895 N ASP A 117 -12.078 4.722 4.397 1.00 1.00 N ATOM 1896 CA ASP A 117 -13.475 4.625 4.743 1.00 1.00 C ATOM 1897 C ASP A 117 -14.284 3.976 3.626 1.00 1.00 C ATOM 1898 O ASP A 117 -14.056 4.190 2.432 1.00 1.00 O ATOM 1899 CB ASP A 117 -14.040 6.000 5.074 1.00 1.00 C ATOM 1900 CG ASP A 117 -15.251 5.845 5.986 1.00 1.00 C ATOM 1901 OD1 ASP A 117 -16.300 5.387 5.487 1.00 1.00 O ATOM 1902 OD2 ASP A 117 -15.123 6.127 7.201 1.00 1.00 O ATOM 0 H ASP A 117 -11.718 5.676 4.384 1.00 1.00 H new ATOM 0 HA ASP A 117 -13.553 3.989 5.625 1.00 1.00 H new ATOM 0 HB2 ASP A 117 -13.280 6.610 5.562 1.00 1.00 H new ATOM 0 HB3 ASP A 117 -14.325 6.518 4.158 1.00 1.00 H new ATOM 1907 N LEU A 118 -15.270 3.182 4.025 1.00 1.00 N ATOM 1908 CA LEU A 118 -16.138 2.434 3.136 1.00 1.00 C ATOM 1909 C LEU A 118 -17.204 3.354 2.510 1.00 1.00 C ATOM 1910 O LEU A 118 -18.066 2.843 1.798 1.00 1.00 O ATOM 1911 CB LEU A 118 -16.746 1.227 3.881 1.00 1.00 C ATOM 1912 CG LEU A 118 -15.716 0.336 4.625 1.00 1.00 C ATOM 1913 CD1 LEU A 118 -16.410 -0.463 5.734 1.00 1.00 C ATOM 1914 CD2 LEU A 118 -14.855 -0.556 3.717 1.00 1.00 C ATOM 0 H LEU A 118 -15.491 3.039 5.010 1.00 1.00 H new ATOM 0 HA LEU A 118 -15.552 2.037 2.307 1.00 1.00 H new ATOM 0 HB2 LEU A 118 -17.476 1.593 4.602 1.00 1.00 H new ATOM 0 HB3 LEU A 118 -17.288 0.610 3.164 1.00 1.00 H new ATOM 0 HG LEU A 118 -14.996 1.019 5.074 1.00 1.00 H new ATOM 0 HD11 LEU A 118 -15.677 -1.084 6.248 1.00 1.00 H new ATOM 0 HD12 LEU A 118 -16.867 0.224 6.446 1.00 1.00 H new ATOM 0 HD13 LEU A 118 -17.181 -1.098 5.297 1.00 1.00 H new ATOM 0 HD21 LEU A 118 -14.167 -1.140 4.328 1.00 1.00 H new ATOM 0 HD22 LEU A 118 -15.499 -1.229 3.151 1.00 1.00 H new ATOM 0 HD23 LEU A 118 -14.287 0.068 3.027 1.00 1.00 H new ATOM 1926 N HIS A 119 -17.113 4.688 2.673 1.00 1.00 N ATOM 1927 CA HIS A 119 -18.136 5.645 2.250 1.00 1.00 C ATOM 1928 C HIS A 119 -18.270 5.565 0.727 1.00 1.00 C ATOM 1929 O HIS A 119 -19.348 5.296 0.199 1.00 1.00 O ATOM 1930 CB HIS A 119 -17.693 7.102 2.534 1.00 1.00 C ATOM 1931 CG HIS A 119 -17.540 7.615 3.938 1.00 1.00 C ATOM 1932 ND1 HIS A 119 -16.440 8.293 4.410 1.00 1.00 N flip ATOM 1933 CD2 HIS A 119 -18.528 7.695 4.894 1.00 1.00 C flip ATOM 1934 CE1 HIS A 119 -16.770 8.801 5.670 1.00 1.00 C flip ATOM 1935 NE2 HIS A 119 -18.025 8.386 5.926 1.00 1.00 N flip ATOM 0 H HIS A 119 -16.307 5.133 3.112 1.00 1.00 H new ATOM 0 HA HIS A 119 -19.055 5.405 2.785 1.00 1.00 H new ATOM 0 HB2 HIS A 119 -16.733 7.244 2.038 1.00 1.00 H new ATOM 0 HB3 HIS A 119 -18.409 7.754 2.034 1.00 1.00 H new ATOM 0 HD2 HIS A 119 -19.522 7.279 4.825 1.00 1.00 H new ATOM 0 HE1 HIS A 119 -16.144 9.405 6.310 1.00 1.00 H new ATOM 0 HE2 HIS A 119 -18.528 8.573 6.793 1.00 1.00 H new ATOM 1943 N ARG A 120 -17.157 5.812 0.030 1.00 1.00 N ATOM 1944 CA ARG A 120 -16.970 5.777 -1.420 1.00 1.00 C ATOM 1945 C ARG A 120 -15.651 5.107 -1.772 1.00 1.00 C ATOM 1946 O ARG A 120 -15.363 4.960 -2.960 1.00 1.00 O ATOM 1947 CB ARG A 120 -17.017 7.185 -2.036 1.00 1.00 C ATOM 1948 CG ARG A 120 -17.945 8.236 -1.404 1.00 1.00 C ATOM 1949 CD ARG A 120 -19.449 8.072 -1.655 1.00 1.00 C ATOM 1950 NE ARG A 120 -19.807 8.028 -3.078 1.00 1.00 N ATOM 1951 CZ ARG A 120 -19.651 8.996 -3.986 1.00 1.00 C ATOM 1952 NH1 ARG A 120 -19.107 10.163 -3.663 1.00 1.00 N ATOM 1953 NH2 ARG A 120 -20.035 8.771 -5.234 1.00 1.00 N ATOM 0 H ARG A 120 -16.292 6.063 0.508 1.00 1.00 H new ATOM 0 HA ARG A 120 -17.793 5.197 -1.837 1.00 1.00 H new ATOM 0 HB2 ARG A 120 -16.004 7.587 -2.021 1.00 1.00 H new ATOM 0 HB3 ARG A 120 -17.302 7.079 -3.083 1.00 1.00 H new ATOM 0 HG2 ARG A 120 -17.778 8.232 -0.327 1.00 1.00 H new ATOM 0 HG3 ARG A 120 -17.645 9.218 -1.770 1.00 1.00 H new ATOM 0 HD2 ARG A 120 -19.791 7.155 -1.175 1.00 1.00 H new ATOM 0 HD3 ARG A 120 -19.980 8.898 -1.181 1.00 1.00 H new ATOM 0 HE ARG A 120 -20.223 7.159 -3.412 1.00 1.00 H new ATOM 0 HH11 ARG A 120 -18.799 10.334 -2.706 1.00 1.00 H new ATOM 0 HH12 ARG A 120 -18.997 10.888 -4.372 1.00 1.00 H new ATOM 0 HH21 ARG A 120 -20.442 7.871 -5.488 1.00 1.00 H new ATOM 0 HH22 ARG A 120 -19.924 9.498 -5.941 1.00 1.00 H new ATOM 1967 N LEU A 121 -14.912 4.642 -0.758 1.00 1.00 N ATOM 1968 CA LEU A 121 -13.542 4.176 -0.812 1.00 1.00 C ATOM 1969 C LEU A 121 -12.609 5.374 -0.965 1.00 1.00 C ATOM 1970 O LEU A 121 -11.772 5.421 -1.870 1.00 1.00 O ATOM 1971 CB LEU A 121 -13.296 3.023 -1.800 1.00 1.00 C ATOM 1972 CG LEU A 121 -14.158 1.757 -1.618 1.00 1.00 C ATOM 1973 CD1 LEU A 121 -14.637 1.466 -0.190 1.00 1.00 C ATOM 1974 CD2 LEU A 121 -15.354 1.686 -2.565 1.00 1.00 C ATOM 0 H LEU A 121 -15.294 4.582 0.186 1.00 1.00 H new ATOM 0 HA LEU A 121 -13.307 3.695 0.137 1.00 1.00 H new ATOM 0 HB2 LEU A 121 -13.456 3.401 -2.810 1.00 1.00 H new ATOM 0 HB3 LEU A 121 -12.248 2.733 -1.730 1.00 1.00 H new ATOM 0 HG LEU A 121 -13.442 0.977 -1.875 1.00 1.00 H new ATOM 0 HD11 LEU A 121 -15.233 0.553 -0.185 1.00 1.00 H new ATOM 0 HD12 LEU A 121 -13.775 1.340 0.464 1.00 1.00 H new ATOM 0 HD13 LEU A 121 -15.244 2.298 0.167 1.00 1.00 H new ATOM 0 HD21 LEU A 121 -15.912 0.769 -2.378 1.00 1.00 H new ATOM 0 HD22 LEU A 121 -16.002 2.546 -2.397 1.00 1.00 H new ATOM 0 HD23 LEU A 121 -15.002 1.693 -3.597 1.00 1.00 H new ATOM 1986 N ASP A 122 -12.759 6.325 -0.042 1.00 1.00 N ATOM 1987 CA ASP A 122 -11.904 7.492 0.161 1.00 1.00 C ATOM 1988 C ASP A 122 -11.512 7.477 1.636 1.00 1.00 C ATOM 1989 O ASP A 122 -12.148 6.784 2.432 1.00 1.00 O ATOM 1990 CB ASP A 122 -12.592 8.841 -0.164 1.00 1.00 C ATOM 1991 CG ASP A 122 -13.748 8.806 -1.160 1.00 1.00 C ATOM 1992 OD1 ASP A 122 -13.633 8.208 -2.254 1.00 1.00 O ATOM 1993 OD2 ASP A 122 -14.795 9.422 -0.869 1.00 1.00 O ATOM 0 H ASP A 122 -13.530 6.298 0.625 1.00 1.00 H new ATOM 0 HA ASP A 122 -11.054 7.423 -0.518 1.00 1.00 H new ATOM 0 HB2 ASP A 122 -12.961 9.267 0.769 1.00 1.00 H new ATOM 0 HB3 ASP A 122 -11.834 9.524 -0.548 1.00 1.00 H new ATOM 1998 N GLY A 123 -10.507 8.247 2.040 1.00 1.00 N ATOM 1999 CA GLY A 123 -10.128 8.342 3.440 1.00 1.00 C ATOM 2000 C GLY A 123 -8.722 8.918 3.563 1.00 1.00 C ATOM 2001 O GLY A 123 -8.392 9.862 2.847 1.00 1.00 O ATOM 0 H GLY A 123 -9.939 8.816 1.412 1.00 1.00 H new ATOM 0 HA2 GLY A 123 -10.837 8.974 3.975 1.00 1.00 H new ATOM 0 HA3 GLY A 123 -10.168 7.356 3.903 1.00 1.00 H new ATOM 2005 N MET A 124 -7.913 8.402 4.483 1.00 1.00 N ATOM 2006 CA MET A 124 -6.613 8.957 4.864 1.00 1.00 C ATOM 2007 C MET A 124 -5.500 7.958 4.560 1.00 1.00 C ATOM 2008 O MET A 124 -5.703 6.760 4.727 1.00 1.00 O ATOM 2009 CB MET A 124 -6.621 9.215 6.373 1.00 1.00 C ATOM 2010 CG MET A 124 -7.357 10.487 6.805 1.00 1.00 C ATOM 2011 SD MET A 124 -6.399 11.580 7.898 1.00 1.00 S ATOM 2012 CE MET A 124 -5.084 12.105 6.769 1.00 1.00 C ATOM 0 H MET A 124 -8.150 7.557 5.003 1.00 1.00 H new ATOM 0 HA MET A 124 -6.439 9.876 4.305 1.00 1.00 H new ATOM 0 HB2 MET A 124 -7.079 8.360 6.871 1.00 1.00 H new ATOM 0 HB3 MET A 124 -5.590 9.272 6.723 1.00 1.00 H new ATOM 0 HG2 MET A 124 -7.643 11.046 5.914 1.00 1.00 H new ATOM 0 HG3 MET A 124 -8.279 10.203 7.313 1.00 1.00 H new ATOM 0 HE1 MET A 124 -4.536 12.937 7.211 1.00 1.00 H new ATOM 0 HE2 MET A 124 -4.402 11.273 6.593 1.00 1.00 H new ATOM 0 HE3 MET A 124 -5.522 12.421 5.822 1.00 1.00 H new ATOM 2022 N GLY A 125 -4.311 8.421 4.181 1.00 1.00 N ATOM 2023 CA GLY A 125 -3.128 7.595 4.023 1.00 1.00 C ATOM 2024 C GLY A 125 -1.901 8.435 3.708 1.00 1.00 C ATOM 2025 O GLY A 125 -1.979 9.659 3.633 1.00 1.00 O ATOM 0 H GLY A 125 -4.145 9.405 3.971 1.00 1.00 H new ATOM 0 HA2 GLY A 125 -2.956 7.025 4.936 1.00 1.00 H new ATOM 0 HA3 GLY A 125 -3.291 6.873 3.223 1.00 1.00 H new ATOM 2029 N CYS A 126 -0.751 7.787 3.566 1.00 1.00 N ATOM 2030 CA CYS A 126 0.553 8.396 3.331 1.00 1.00 C ATOM 2031 C CYS A 126 1.575 7.306 3.031 1.00 1.00 C ATOM 2032 O CYS A 126 1.232 6.126 2.931 1.00 1.00 O ATOM 2033 CB CYS A 126 0.966 9.247 4.540 1.00 1.00 C ATOM 2034 SG CYS A 126 0.965 8.317 6.099 1.00 1.00 S ATOM 0 H CYS A 126 -0.700 6.769 3.614 1.00 1.00 H new ATOM 0 HA CYS A 126 0.501 9.060 2.468 1.00 1.00 H new ATOM 0 HB2 CYS A 126 1.962 9.654 4.367 1.00 1.00 H new ATOM 0 HB3 CYS A 126 0.287 10.095 4.629 1.00 1.00 H new ATOM 0 HG CYS A 126 1.326 9.100 7.072 1.00 1.00 H new ATOM 2040 N LEU A 127 2.838 7.695 2.885 1.00 1.00 N ATOM 2041 CA LEU A 127 3.943 6.750 2.909 1.00 1.00 C ATOM 2042 C LEU A 127 4.556 6.723 4.306 1.00 1.00 C ATOM 2043 O LEU A 127 4.269 7.582 5.142 1.00 1.00 O ATOM 2044 CB LEU A 127 4.980 7.122 1.837 1.00 1.00 C ATOM 2045 CG LEU A 127 4.430 7.003 0.403 1.00 1.00 C ATOM 2046 CD1 LEU A 127 5.481 7.496 -0.588 1.00 1.00 C ATOM 2047 CD2 LEU A 127 4.052 5.557 0.062 1.00 1.00 C ATOM 0 H LEU A 127 3.120 8.666 2.748 1.00 1.00 H new ATOM 0 HA LEU A 127 3.580 5.748 2.678 1.00 1.00 H new ATOM 0 HB2 LEU A 127 5.320 8.144 2.007 1.00 1.00 H new ATOM 0 HB3 LEU A 127 5.851 6.475 1.941 1.00 1.00 H new ATOM 0 HG LEU A 127 3.530 7.615 0.336 1.00 1.00 H new ATOM 0 HD11 LEU A 127 5.092 7.412 -1.603 1.00 1.00 H new ATOM 0 HD12 LEU A 127 5.720 8.538 -0.376 1.00 1.00 H new ATOM 0 HD13 LEU A 127 6.382 6.891 -0.494 1.00 1.00 H new ATOM 0 HD21 LEU A 127 3.668 5.512 -0.957 1.00 1.00 H new ATOM 0 HD22 LEU A 127 4.933 4.921 0.146 1.00 1.00 H new ATOM 0 HD23 LEU A 127 3.286 5.208 0.754 1.00 1.00 H new ATOM 2059 N GLU A 128 5.417 5.740 4.532 1.00 1.00 N ATOM 2060 CA GLU A 128 6.410 5.615 5.604 1.00 1.00 C ATOM 2061 C GLU A 128 7.593 4.795 5.064 1.00 1.00 C ATOM 2062 O GLU A 128 7.485 4.254 3.968 1.00 1.00 O ATOM 2063 CB GLU A 128 5.755 4.899 6.793 1.00 1.00 C ATOM 2064 CG GLU A 128 6.466 5.097 8.136 1.00 1.00 C ATOM 2065 CD GLU A 128 6.109 6.450 8.746 1.00 1.00 C ATOM 2066 OE1 GLU A 128 6.783 7.460 8.413 1.00 1.00 O ATOM 2067 OE2 GLU A 128 5.126 6.456 9.521 1.00 1.00 O ATOM 0 H GLU A 128 5.445 4.930 3.913 1.00 1.00 H new ATOM 0 HA GLU A 128 6.767 6.591 5.932 1.00 1.00 H new ATOM 0 HB2 GLU A 128 4.727 5.249 6.888 1.00 1.00 H new ATOM 0 HB3 GLU A 128 5.710 3.832 6.576 1.00 1.00 H new ATOM 0 HG2 GLU A 128 6.185 4.298 8.822 1.00 1.00 H new ATOM 0 HG3 GLU A 128 7.545 5.030 7.994 1.00 1.00 H new ATOM 2074 N PHE A 129 8.696 4.645 5.799 1.00 1.00 N ATOM 2075 CA PHE A 129 9.717 3.636 5.501 1.00 1.00 C ATOM 2076 C PHE A 129 9.242 2.250 5.978 1.00 1.00 C ATOM 2077 O PHE A 129 8.327 2.177 6.803 1.00 1.00 O ATOM 2078 CB PHE A 129 11.022 4.034 6.205 1.00 1.00 C ATOM 2079 CG PHE A 129 12.267 3.345 5.679 1.00 1.00 C ATOM 2080 CD1 PHE A 129 12.669 3.553 4.347 1.00 1.00 C ATOM 2081 CD2 PHE A 129 13.053 2.536 6.521 1.00 1.00 C ATOM 2082 CE1 PHE A 129 13.829 2.933 3.855 1.00 1.00 C ATOM 2083 CE2 PHE A 129 14.241 1.957 6.036 1.00 1.00 C ATOM 2084 CZ PHE A 129 14.622 2.142 4.699 1.00 1.00 C ATOM 0 H PHE A 129 8.908 5.218 6.616 1.00 1.00 H new ATOM 0 HA PHE A 129 9.888 3.583 4.426 1.00 1.00 H new ATOM 0 HB2 PHE A 129 11.154 5.112 6.112 1.00 1.00 H new ATOM 0 HB3 PHE A 129 10.925 3.816 7.269 1.00 1.00 H new ATOM 0 HD1 PHE A 129 12.084 4.191 3.701 1.00 1.00 H new ATOM 0 HD2 PHE A 129 12.744 2.359 7.541 1.00 1.00 H new ATOM 0 HE1 PHE A 129 14.112 3.066 2.821 1.00 1.00 H new ATOM 0 HE2 PHE A 129 14.861 1.368 6.696 1.00 1.00 H new ATOM 0 HZ PHE A 129 15.521 1.678 4.321 1.00 1.00 H new ATOM 2094 N ASP A 130 9.881 1.156 5.545 1.00 1.00 N ATOM 2095 CA ASP A 130 9.788 -0.165 6.179 1.00 1.00 C ATOM 2096 C ASP A 130 11.205 -0.639 6.451 1.00 1.00 C ATOM 2097 O ASP A 130 11.853 -1.178 5.559 1.00 1.00 O ATOM 2098 CB ASP A 130 9.071 -1.227 5.323 1.00 1.00 C ATOM 2099 CG ASP A 130 8.704 -2.465 6.164 1.00 1.00 C ATOM 2100 OD1 ASP A 130 9.427 -2.808 7.132 1.00 1.00 O ATOM 2101 OD2 ASP A 130 7.653 -3.085 5.890 1.00 1.00 O ATOM 0 H ASP A 130 10.490 1.165 4.727 1.00 1.00 H new ATOM 0 HA ASP A 130 9.193 -0.051 7.085 1.00 1.00 H new ATOM 0 HB2 ASP A 130 8.168 -0.799 4.888 1.00 1.00 H new ATOM 0 HB3 ASP A 130 9.714 -1.524 4.494 1.00 1.00 H new ATOM 2106 N GLU A 131 11.727 -0.419 7.655 1.00 1.00 N ATOM 2107 CA GLU A 131 13.085 -0.774 7.967 1.00 1.00 C ATOM 2108 C GLU A 131 13.305 -2.281 7.863 1.00 1.00 C ATOM 2109 O GLU A 131 14.335 -2.714 7.363 1.00 1.00 O ATOM 2110 CB GLU A 131 13.373 -0.202 9.356 1.00 1.00 C ATOM 2111 CG GLU A 131 14.871 -0.125 9.602 1.00 1.00 C ATOM 2112 CD GLU A 131 15.235 0.649 10.874 1.00 1.00 C ATOM 2113 OE1 GLU A 131 14.476 1.558 11.293 1.00 1.00 O ATOM 2114 OE2 GLU A 131 16.318 0.391 11.440 1.00 1.00 O ATOM 0 H GLU A 131 11.215 0.007 8.428 1.00 1.00 H new ATOM 0 HA GLU A 131 13.789 -0.352 7.250 1.00 1.00 H new ATOM 0 HB2 GLU A 131 12.933 0.791 9.445 1.00 1.00 H new ATOM 0 HB3 GLU A 131 12.906 -0.827 10.117 1.00 1.00 H new ATOM 0 HG2 GLU A 131 15.274 -1.136 9.672 1.00 1.00 H new ATOM 0 HG3 GLU A 131 15.349 0.350 8.746 1.00 1.00 H new ATOM 2121 N GLU A 132 12.331 -3.093 8.268 1.00 1.00 N ATOM 2122 CA GLU A 132 12.492 -4.536 8.245 1.00 1.00 C ATOM 2123 C GLU A 132 12.453 -5.052 6.816 1.00 1.00 C ATOM 2124 O GLU A 132 13.285 -5.865 6.425 1.00 1.00 O ATOM 2125 CB GLU A 132 11.374 -5.182 9.071 1.00 1.00 C ATOM 2126 CG GLU A 132 11.672 -6.645 9.416 1.00 1.00 C ATOM 2127 CD GLU A 132 12.614 -6.789 10.611 1.00 1.00 C ATOM 2128 OE1 GLU A 132 13.833 -6.521 10.491 1.00 1.00 O ATOM 2129 OE2 GLU A 132 12.121 -7.200 11.682 1.00 1.00 O ATOM 0 H GLU A 132 11.427 -2.773 8.614 1.00 1.00 H new ATOM 0 HA GLU A 132 13.459 -4.796 8.676 1.00 1.00 H new ATOM 0 HB2 GLU A 132 11.233 -4.616 9.992 1.00 1.00 H new ATOM 0 HB3 GLU A 132 10.438 -5.126 8.516 1.00 1.00 H new ATOM 0 HG2 GLU A 132 10.736 -7.161 9.632 1.00 1.00 H new ATOM 0 HG3 GLU A 132 12.114 -7.136 8.549 1.00 1.00 H new ATOM 2136 N ARG A 133 11.483 -4.615 6.012 1.00 1.00 N ATOM 2137 CA ARG A 133 11.442 -5.032 4.626 1.00 1.00 C ATOM 2138 C ARG A 133 12.626 -4.453 3.860 1.00 1.00 C ATOM 2139 O ARG A 133 13.093 -5.147 2.970 1.00 1.00 O ATOM 2140 CB ARG A 133 10.117 -4.596 4.030 1.00 1.00 C ATOM 2141 CG ARG A 133 9.763 -5.236 2.688 1.00 1.00 C ATOM 2142 CD ARG A 133 9.260 -6.690 2.752 1.00 1.00 C ATOM 2143 NE ARG A 133 7.935 -6.815 3.401 1.00 1.00 N ATOM 2144 CZ ARG A 133 7.688 -7.147 4.677 1.00 1.00 C ATOM 2145 NH1 ARG A 133 8.677 -7.470 5.504 1.00 1.00 N ATOM 2146 NH2 ARG A 133 6.437 -7.179 5.116 1.00 1.00 N ATOM 0 H ARG A 133 10.733 -3.985 6.297 1.00 1.00 H new ATOM 0 HA ARG A 133 11.520 -6.117 4.556 1.00 1.00 H new ATOM 0 HB2 ARG A 133 9.324 -4.823 4.743 1.00 1.00 H new ATOM 0 HB3 ARG A 133 10.132 -3.513 3.905 1.00 1.00 H new ATOM 0 HG2 ARG A 133 8.997 -4.627 2.207 1.00 1.00 H new ATOM 0 HG3 ARG A 133 10.644 -5.204 2.048 1.00 1.00 H new ATOM 0 HD2 ARG A 133 9.203 -7.094 1.741 1.00 1.00 H new ATOM 0 HD3 ARG A 133 9.984 -7.296 3.297 1.00 1.00 H new ATOM 0 HE ARG A 133 7.122 -6.628 2.814 1.00 1.00 H new ATOM 0 HH11 ARG A 133 9.641 -7.468 5.171 1.00 1.00 H new ATOM 0 HH12 ARG A 133 8.472 -7.720 6.471 1.00 1.00 H new ATOM 0 HH21 ARG A 133 5.669 -6.952 4.484 1.00 1.00 H new ATOM 0 HH22 ARG A 133 6.243 -7.431 6.085 1.00 1.00 H new ATOM 2160 N ALA A 134 13.132 -3.260 4.191 1.00 1.00 N ATOM 2161 CA ALA A 134 14.350 -2.746 3.579 1.00 1.00 C ATOM 2162 C ALA A 134 15.499 -3.694 3.867 1.00 1.00 C ATOM 2163 O ALA A 134 16.213 -4.049 2.933 1.00 1.00 O ATOM 2164 CB ALA A 134 14.675 -1.312 4.045 1.00 1.00 C ATOM 0 H ALA A 134 12.712 -2.636 4.880 1.00 1.00 H new ATOM 0 HA ALA A 134 14.194 -2.689 2.502 1.00 1.00 H new ATOM 0 HB1 ALA A 134 15.591 -0.971 3.562 1.00 1.00 H new ATOM 0 HB2 ALA A 134 13.854 -0.647 3.776 1.00 1.00 H new ATOM 0 HB3 ALA A 134 14.810 -1.303 5.127 1.00 1.00 H new ATOM 2170 N GLN A 135 15.646 -4.154 5.115 1.00 1.00 N ATOM 2171 CA GLN A 135 16.660 -5.141 5.442 1.00 1.00 C ATOM 2172 C GLN A 135 16.409 -6.452 4.694 1.00 1.00 C ATOM 2173 O GLN A 135 17.375 -7.069 4.244 1.00 1.00 O ATOM 2174 CB GLN A 135 16.687 -5.365 6.960 1.00 1.00 C ATOM 2175 CG GLN A 135 17.120 -4.119 7.744 1.00 1.00 C ATOM 2176 CD GLN A 135 18.618 -3.872 7.689 1.00 1.00 C ATOM 2177 OE1 GLN A 135 19.150 -3.434 6.678 1.00 1.00 O ATOM 2178 NE2 GLN A 135 19.325 -4.113 8.775 1.00 1.00 N ATOM 0 H GLN A 135 15.075 -3.855 5.906 1.00 1.00 H new ATOM 0 HA GLN A 135 17.634 -4.768 5.125 1.00 1.00 H new ATOM 0 HB2 GLN A 135 15.696 -5.671 7.294 1.00 1.00 H new ATOM 0 HB3 GLN A 135 17.367 -6.185 7.188 1.00 1.00 H new ATOM 0 HG2 GLN A 135 16.599 -3.248 7.347 1.00 1.00 H new ATOM 0 HG3 GLN A 135 16.813 -4.227 8.784 1.00 1.00 H new ATOM 0 HE21 GLN A 135 18.868 -4.478 9.611 1.00 1.00 H new ATOM 0 HE22 GLN A 135 20.329 -3.934 8.780 1.00 1.00 H new ATOM 2187 N GLN A 136 15.150 -6.891 4.539 1.00 1.00 N ATOM 2188 CA GLN A 136 14.907 -8.159 3.861 1.00 1.00 C ATOM 2189 C GLN A 136 15.161 -8.045 2.362 1.00 1.00 C ATOM 2190 O GLN A 136 15.660 -8.996 1.768 1.00 1.00 O ATOM 2191 CB GLN A 136 13.498 -8.703 4.155 1.00 1.00 C ATOM 2192 CG GLN A 136 13.363 -9.253 5.586 1.00 1.00 C ATOM 2193 CD GLN A 136 14.431 -10.307 5.877 1.00 1.00 C ATOM 2194 OE1 GLN A 136 14.435 -11.388 5.293 1.00 1.00 O ATOM 2195 NE2 GLN A 136 15.373 -10.012 6.748 1.00 1.00 N ATOM 0 H GLN A 136 14.316 -6.402 4.863 1.00 1.00 H new ATOM 0 HA GLN A 136 15.619 -8.881 4.261 1.00 1.00 H new ATOM 0 HB2 GLN A 136 12.767 -7.909 4.005 1.00 1.00 H new ATOM 0 HB3 GLN A 136 13.261 -9.493 3.442 1.00 1.00 H new ATOM 0 HG2 GLN A 136 13.450 -8.436 6.302 1.00 1.00 H new ATOM 0 HG3 GLN A 136 12.373 -9.689 5.719 1.00 1.00 H new ATOM 0 HE21 GLN A 136 15.361 -9.112 7.227 1.00 1.00 H new ATOM 0 HE22 GLN A 136 16.115 -10.684 6.943 1.00 1.00 H new ATOM 2204 N GLU A 137 14.859 -6.911 1.739 1.00 1.00 N ATOM 2205 CA GLU A 137 15.095 -6.711 0.329 1.00 1.00 C ATOM 2206 C GLU A 137 16.587 -6.549 0.065 1.00 1.00 C ATOM 2207 O GLU A 137 17.062 -7.051 -0.950 1.00 1.00 O ATOM 2208 CB GLU A 137 14.348 -5.453 -0.123 1.00 1.00 C ATOM 2209 CG GLU A 137 14.120 -5.499 -1.636 1.00 1.00 C ATOM 2210 CD GLU A 137 13.043 -6.493 -2.100 1.00 1.00 C ATOM 2211 OE1 GLU A 137 12.506 -7.283 -1.292 1.00 1.00 O ATOM 2212 OE2 GLU A 137 12.741 -6.486 -3.318 1.00 1.00 O ATOM 0 H GLU A 137 14.442 -6.106 2.207 1.00 1.00 H new ATOM 0 HA GLU A 137 14.736 -7.576 -0.228 1.00 1.00 H new ATOM 0 HB2 GLU A 137 13.392 -5.381 0.396 1.00 1.00 H new ATOM 0 HB3 GLU A 137 14.922 -4.564 0.140 1.00 1.00 H new ATOM 0 HG2 GLU A 137 13.844 -4.501 -1.977 1.00 1.00 H new ATOM 0 HG3 GLU A 137 15.062 -5.753 -2.123 1.00 1.00 H new ATOM 2219 N ASP A 138 17.323 -5.883 0.963 1.00 1.00 N ATOM 2220 CA ASP A 138 18.777 -5.733 0.890 1.00 1.00 C ATOM 2221 C ASP A 138 19.423 -7.110 0.942 1.00 1.00 C ATOM 2222 O ASP A 138 20.276 -7.414 0.108 1.00 1.00 O ATOM 2223 CB ASP A 138 19.324 -4.869 2.041 1.00 1.00 C ATOM 2224 CG ASP A 138 19.756 -3.460 1.640 1.00 1.00 C ATOM 2225 OD1 ASP A 138 19.149 -2.812 0.760 1.00 1.00 O ATOM 2226 OD2 ASP A 138 20.695 -2.933 2.274 1.00 1.00 O ATOM 0 H ASP A 138 16.913 -5.425 1.777 1.00 1.00 H new ATOM 0 HA ASP A 138 19.018 -5.230 -0.047 1.00 1.00 H new ATOM 0 HB2 ASP A 138 18.559 -4.792 2.813 1.00 1.00 H new ATOM 0 HB3 ASP A 138 20.177 -5.381 2.487 1.00 1.00 H new ATOM 2231 N ALA A 139 18.993 -7.947 1.894 1.00 1.00 N ATOM 2232 CA ALA A 139 19.399 -9.339 2.015 1.00 1.00 C ATOM 2233 C ALA A 139 19.108 -10.085 0.710 1.00 1.00 C ATOM 2234 O ALA A 139 19.986 -10.728 0.127 1.00 1.00 O ATOM 2235 CB ALA A 139 18.685 -9.975 3.212 1.00 1.00 C ATOM 0 H ALA A 139 18.335 -7.660 2.618 1.00 1.00 H new ATOM 0 HA ALA A 139 20.473 -9.401 2.192 1.00 1.00 H new ATOM 0 HB1 ALA A 139 18.988 -11.018 3.304 1.00 1.00 H new ATOM 0 HB2 ALA A 139 18.952 -9.438 4.122 1.00 1.00 H new ATOM 0 HB3 ALA A 139 17.607 -9.922 3.062 1.00 1.00 H new ATOM 2241 N LEU A 140 17.863 -10.025 0.242 1.00 1.00 N ATOM 2242 CA LEU A 140 17.414 -10.704 -0.961 1.00 1.00 C ATOM 2243 C LEU A 140 18.104 -10.197 -2.221 1.00 1.00 C ATOM 2244 O LEU A 140 18.242 -10.946 -3.191 1.00 1.00 O ATOM 2245 CB LEU A 140 15.885 -10.577 -1.073 1.00 1.00 C ATOM 2246 CG LEU A 140 15.106 -11.563 -0.185 1.00 1.00 C ATOM 2247 CD1 LEU A 140 13.615 -11.481 -0.534 1.00 1.00 C ATOM 2248 CD2 LEU A 140 15.609 -13.001 -0.338 1.00 1.00 C ATOM 0 H LEU A 140 17.126 -9.490 0.702 1.00 1.00 H new ATOM 0 HA LEU A 140 17.690 -11.755 -0.876 1.00 1.00 H new ATOM 0 HB2 LEU A 140 15.595 -9.560 -0.809 1.00 1.00 H new ATOM 0 HB3 LEU A 140 15.593 -10.732 -2.112 1.00 1.00 H new ATOM 0 HG LEU A 140 15.264 -11.281 0.856 1.00 1.00 H new ATOM 0 HD11 LEU A 140 13.056 -12.177 0.091 1.00 1.00 H new ATOM 0 HD12 LEU A 140 13.256 -10.467 -0.359 1.00 1.00 H new ATOM 0 HD13 LEU A 140 13.472 -11.740 -1.583 1.00 1.00 H new ATOM 0 HD21 LEU A 140 15.029 -13.660 0.308 1.00 1.00 H new ATOM 0 HD22 LEU A 140 15.496 -13.318 -1.375 1.00 1.00 H new ATOM 0 HD23 LEU A 140 16.661 -13.050 -0.056 1.00 1.00 H new ATOM 2260 N ALA A 141 18.572 -8.951 -2.225 1.00 1.00 N ATOM 2261 CA ALA A 141 19.371 -8.336 -3.275 1.00 1.00 C ATOM 2262 C ALA A 141 20.806 -8.858 -3.209 1.00 1.00 C ATOM 2263 O ALA A 141 21.755 -8.072 -3.201 1.00 1.00 O ATOM 2264 CB ALA A 141 19.290 -6.808 -3.185 1.00 1.00 C ATOM 0 H ALA A 141 18.392 -8.311 -1.452 1.00 1.00 H new ATOM 0 HA ALA A 141 18.971 -8.612 -4.251 1.00 1.00 H new ATOM 0 HB1 ALA A 141 19.893 -6.364 -3.977 1.00 1.00 H new ATOM 0 HB2 ALA A 141 18.253 -6.491 -3.298 1.00 1.00 H new ATOM 0 HB3 ALA A 141 19.666 -6.480 -2.216 1.00 1.00 H new ATOM 2270 N GLN A 142 20.960 -10.186 -3.215 1.00 1.00 N ATOM 2271 CA GLN A 142 22.222 -10.886 -3.288 1.00 1.00 C ATOM 2272 C GLN A 142 23.180 -10.349 -2.216 1.00 1.00 C ATOM 2273 O GLN A 142 24.271 -9.849 -2.516 1.00 1.00 O ATOM 2274 CB GLN A 142 22.695 -10.746 -4.738 1.00 1.00 C ATOM 2275 CG GLN A 142 23.909 -11.597 -5.088 1.00 1.00 C ATOM 2276 CD GLN A 142 24.545 -11.102 -6.377 1.00 1.00 C ATOM 2277 OE1 GLN A 142 24.605 -11.809 -7.379 1.00 1.00 O ATOM 2278 NE2 GLN A 142 24.991 -9.859 -6.419 1.00 1.00 N ATOM 0 H GLN A 142 20.163 -10.821 -3.166 1.00 1.00 H new ATOM 0 HA GLN A 142 22.153 -11.950 -3.061 1.00 1.00 H new ATOM 0 HB2 GLN A 142 21.874 -11.015 -5.403 1.00 1.00 H new ATOM 0 HB3 GLN A 142 22.932 -9.700 -4.931 1.00 1.00 H new ATOM 0 HG2 GLN A 142 24.636 -11.557 -4.277 1.00 1.00 H new ATOM 0 HG3 GLN A 142 23.611 -12.640 -5.198 1.00 1.00 H new ATOM 0 HE21 GLN A 142 24.941 -9.271 -5.587 1.00 1.00 H new ATOM 0 HE22 GLN A 142 25.385 -9.487 -7.283 1.00 1.00 H new ATOM 2287 N GLN A 143 22.749 -10.424 -0.959 1.00 1.00 N ATOM 2288 CA GLN A 143 23.577 -10.159 0.203 1.00 1.00 C ATOM 2289 C GLN A 143 23.391 -11.377 1.079 1.00 1.00 C ATOM 2290 O GLN A 143 23.881 -12.444 0.657 1.00 1.00 O ATOM 2291 CB GLN A 143 23.174 -8.808 0.812 1.00 1.00 C ATOM 2292 CG GLN A 143 24.167 -8.238 1.829 1.00 1.00 C ATOM 2293 CD GLN A 143 23.651 -6.946 2.480 1.00 1.00 C ATOM 2294 OE1 GLN A 143 23.650 -6.809 3.705 1.00 1.00 O ATOM 2295 NE2 GLN A 143 23.224 -5.966 1.697 1.00 1.00 N ATOM 0 H GLN A 143 21.790 -10.677 -0.720 1.00 1.00 H new ATOM 0 HA GLN A 143 24.642 -10.038 0.008 1.00 1.00 H new ATOM 0 HB2 GLN A 143 23.047 -8.086 0.006 1.00 1.00 H new ATOM 0 HB3 GLN A 143 22.204 -8.919 1.296 1.00 1.00 H new ATOM 0 HG2 GLN A 143 24.359 -8.981 2.603 1.00 1.00 H new ATOM 0 HG3 GLN A 143 25.118 -8.039 1.334 1.00 1.00 H new ATOM 0 HE21 GLN A 143 23.227 -6.085 0.684 1.00 1.00 H new ATOM 0 HE22 GLN A 143 22.892 -5.093 2.107 1.00 1.00 H new TER 2304 GLN A 143