USER MOD reduce.3.24.130724 H: found=0, std=0, add=694, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 688 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 89 HIS : no HE2:sc= 1.8 K(o=2.8,f=-4.3!) USER MOD Set 1.2: A 92 HIS : no HE2:sc= 0.966 K(o=2.8,f=-4.8!) USER MOD Set 2.1: A 66 TYR OH : rot -175:sc= 0.552 USER MOD Set 2.2: A 70 GLN : amide:sc= -0.148 X(o=0.36,f=0.37) USER MOD Set 2.3: A 88 HIS : no HD1:sc= -0.0395 X(o=0.36,f=0.37) USER MOD Set 3.1: A 40 GLN : amide:sc= 0.312 X(o=-1.5,f=-1.4) USER MOD Set 3.2: A 56 TYR OH : rot 180:sc= 0.3 USER MOD Set 3.3: A 60 MET CE :methyl -155:sc= -2.06 (180deg=-3.64!) USER MOD Set 4.1: A 1 MET N :NH3+ -166:sc= 1.16 (180deg=0.64) USER MOD Set 4.2: A 3 ASN : amide:sc= 1.08 K(o=2.2,f=-2.3) USER MOD Single : A 1 MET CE :methyl 177:sc= -0.0713 (180deg=-0.0813) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 74:sc= 0.601 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 ASN : amide:sc= 0 X(o=0,f=0.13) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 GLN : amide:sc= 0.733 K(o=0.73,f=0) USER MOD Single : A 37 GLN : amide:sc= -0.445 X(o=-0.45,f=-0.74) USER MOD Single : A 42 ASN : amide:sc= 0.975 K(o=0.98,f=0) USER MOD Single : A 44 THR OG1 : rot 69:sc= 1.24 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 ASN :FLIP amide:sc= -0.581 F(o=-1.9,f=-0.58) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 ASN : amide:sc= -0.272 X(o=-0.27,f=-0.21) USER MOD Single : A 57 GLN : amide:sc= -0.0938 X(o=-0.094,f=-0.094) USER MOD Single : A 58 MET CE :methyl 168:sc= 0 (180deg=-0.179) USER MOD Single : A 61 SER OG : rot 73:sc= 0.846 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 71 SER OG : rot 78:sc= 0.00661 USER MOD Single : A 72 SER OG : rot 72:sc= 0.648 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 SER OG : rot 88:sc= 0.627 USER MOD Single : A 77 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 87 HIS : no HE2:sc= 0.307 K(o=0.31,f=-1.3) USER MOD Single : A 90 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 91 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 41.317 -21.579 -2.069 1.00 10.00 N ATOM 2 CA MET A 1 40.986 -23.022 -2.216 1.00 10.00 C ATOM 3 C MET A 1 40.594 -23.362 -3.658 1.00 10.00 C ATOM 4 O MET A 1 41.373 -24.008 -4.355 1.00 10.00 O ATOM 5 CB MET A 1 39.922 -23.504 -1.204 1.00 10.00 C ATOM 6 CG MET A 1 40.482 -23.724 0.210 1.00 10.00 C ATOM 7 SD MET A 1 41.073 -22.245 1.085 1.00 10.00 S ATOM 8 CE MET A 1 41.568 -23.011 2.651 1.00 10.00 C ATOM 0 H1 MET A 1 41.800 -21.424 -1.161 1.00 10.00 H new ATOM 0 H2 MET A 1 41.941 -21.285 -2.847 1.00 10.00 H new ATOM 0 H3 MET A 1 40.442 -21.018 -2.096 1.00 10.00 H new ATOM 0 HA MET A 1 41.897 -23.572 -1.980 1.00 10.00 H new ATOM 0 HB2 MET A 1 39.116 -22.771 -1.158 1.00 10.00 H new ATOM 0 HB3 MET A 1 39.485 -24.436 -1.563 1.00 10.00 H new ATOM 0 HG2 MET A 1 39.706 -24.192 0.816 1.00 10.00 H new ATOM 0 HG3 MET A 1 41.306 -24.434 0.144 1.00 10.00 H new ATOM 0 HE1 MET A 1 42.009 -22.256 3.302 1.00 10.00 H new ATOM 0 HE2 MET A 1 40.693 -23.443 3.137 1.00 10.00 H new ATOM 0 HE3 MET A 1 42.300 -23.795 2.457 1.00 10.00 H new ATOM 20 N SER A 2 39.408 -22.946 -4.128 1.00 10.00 N ATOM 21 CA SER A 2 38.864 -23.291 -5.463 1.00 10.00 C ATOM 22 C SER A 2 39.622 -22.686 -6.660 1.00 10.00 C ATOM 23 O SER A 2 39.427 -23.119 -7.799 1.00 10.00 O ATOM 24 CB SER A 2 37.393 -22.858 -5.551 1.00 10.00 C ATOM 25 OG SER A 2 36.654 -23.364 -4.447 1.00 10.00 O ATOM 0 H SER A 2 38.784 -22.349 -3.585 1.00 10.00 H new ATOM 0 HA SER A 2 38.982 -24.372 -5.542 1.00 10.00 H new ATOM 0 HB2 SER A 2 37.329 -21.770 -5.570 1.00 10.00 H new ATOM 0 HB3 SER A 2 36.957 -23.219 -6.483 1.00 10.00 H new ATOM 0 HG SER A 2 35.720 -23.077 -4.519 1.00 10.00 H new ATOM 31 N ASN A 3 40.477 -21.685 -6.424 1.00 10.00 N ATOM 32 CA ASN A 3 41.345 -21.056 -7.426 1.00 10.00 C ATOM 33 C ASN A 3 42.326 -22.045 -8.108 1.00 10.00 C ATOM 34 O ASN A 3 42.713 -23.048 -7.496 1.00 10.00 O ATOM 35 CB ASN A 3 42.126 -19.914 -6.741 1.00 10.00 C ATOM 36 CG ASN A 3 42.999 -20.390 -5.587 1.00 10.00 C ATOM 37 OD1 ASN A 3 42.537 -20.548 -4.464 1.00 10.00 O ATOM 38 ND2 ASN A 3 44.269 -20.647 -5.808 1.00 10.00 N ATOM 0 H ASN A 3 40.588 -21.276 -5.496 1.00 10.00 H new ATOM 0 HA ASN A 3 40.709 -20.676 -8.225 1.00 10.00 H new ATOM 0 HB2 ASN A 3 42.753 -19.417 -7.481 1.00 10.00 H new ATOM 0 HB3 ASN A 3 41.420 -19.171 -6.371 1.00 10.00 H new ATOM 0 HD21 ASN A 3 44.863 -20.976 -5.047 1.00 10.00 H new ATOM 0 HD22 ASN A 3 44.661 -20.518 -6.741 1.00 10.00 H new ATOM 45 N PRO A 4 42.783 -21.755 -9.345 1.00 10.00 N ATOM 46 CA PRO A 4 43.876 -22.485 -9.995 1.00 10.00 C ATOM 47 C PRO A 4 45.162 -22.527 -9.139 1.00 10.00 C ATOM 48 O PRO A 4 45.403 -21.596 -8.359 1.00 10.00 O ATOM 49 CB PRO A 4 44.138 -21.748 -11.315 1.00 10.00 C ATOM 50 CG PRO A 4 42.809 -21.067 -11.623 1.00 10.00 C ATOM 51 CD PRO A 4 42.260 -20.730 -10.239 1.00 10.00 C ATOM 0 HA PRO A 4 43.594 -23.527 -10.145 1.00 10.00 H new ATOM 0 HB2 PRO A 4 44.945 -21.022 -11.214 1.00 10.00 H new ATOM 0 HB3 PRO A 4 44.427 -22.438 -12.108 1.00 10.00 H new ATOM 0 HG2 PRO A 4 42.946 -20.172 -12.230 1.00 10.00 H new ATOM 0 HG3 PRO A 4 42.137 -21.726 -12.173 1.00 10.00 H new ATOM 0 HD2 PRO A 4 42.578 -19.736 -9.923 1.00 10.00 H new ATOM 0 HD3 PRO A 4 41.170 -20.731 -10.240 1.00 10.00 H new ATOM 59 N PRO A 5 46.020 -23.555 -9.298 1.00 10.00 N ATOM 60 CA PRO A 5 47.306 -23.636 -8.603 1.00 10.00 C ATOM 61 C PRO A 5 48.298 -22.562 -9.080 1.00 10.00 C ATOM 62 O PRO A 5 48.236 -22.090 -10.220 1.00 10.00 O ATOM 63 CB PRO A 5 47.837 -25.045 -8.887 1.00 10.00 C ATOM 64 CG PRO A 5 47.189 -25.416 -10.222 1.00 10.00 C ATOM 65 CD PRO A 5 45.834 -24.711 -10.164 1.00 10.00 C ATOM 0 HA PRO A 5 47.181 -23.454 -7.536 1.00 10.00 H new ATOM 0 HB2 PRO A 5 48.925 -25.057 -8.953 1.00 10.00 H new ATOM 0 HB3 PRO A 5 47.558 -25.744 -8.099 1.00 10.00 H new ATOM 0 HG2 PRO A 5 47.785 -25.073 -11.068 1.00 10.00 H new ATOM 0 HG3 PRO A 5 47.077 -26.495 -10.328 1.00 10.00 H new ATOM 0 HD2 PRO A 5 45.510 -24.405 -11.159 1.00 10.00 H new ATOM 0 HD3 PRO A 5 45.065 -25.375 -9.769 1.00 10.00 H new ATOM 73 N THR A 6 49.258 -22.220 -8.218 1.00 10.00 N ATOM 74 CA THR A 6 50.336 -21.248 -8.487 1.00 10.00 C ATOM 75 C THR A 6 51.683 -21.704 -7.901 1.00 10.00 C ATOM 76 O THR A 6 51.713 -22.550 -6.998 1.00 10.00 O ATOM 77 CB THR A 6 49.991 -19.841 -7.968 1.00 10.00 C ATOM 78 OG1 THR A 6 49.815 -19.841 -6.565 1.00 10.00 O ATOM 79 CG2 THR A 6 48.727 -19.249 -8.596 1.00 10.00 C ATOM 0 H THR A 6 49.314 -22.621 -7.282 1.00 10.00 H new ATOM 0 HA THR A 6 50.431 -21.199 -9.572 1.00 10.00 H new ATOM 0 HB THR A 6 50.842 -19.223 -8.255 1.00 10.00 H new ATOM 0 HG1 THR A 6 49.598 -18.934 -6.262 1.00 10.00 H new ATOM 0 HG21 THR A 6 48.546 -18.257 -8.183 1.00 10.00 H new ATOM 0 HG22 THR A 6 48.858 -19.174 -9.676 1.00 10.00 H new ATOM 0 HG23 THR A 6 47.876 -19.894 -8.377 1.00 10.00 H new ATOM 87 N PRO A 7 52.811 -21.186 -8.430 1.00 10.00 N ATOM 88 CA PRO A 7 54.167 -21.510 -7.981 1.00 10.00 C ATOM 89 C PRO A 7 54.390 -21.322 -6.470 1.00 10.00 C ATOM 90 O PRO A 7 53.908 -20.356 -5.871 1.00 10.00 O ATOM 91 CB PRO A 7 55.094 -20.606 -8.803 1.00 10.00 C ATOM 92 CG PRO A 7 54.298 -20.331 -10.077 1.00 10.00 C ATOM 93 CD PRO A 7 52.865 -20.281 -9.568 1.00 10.00 C ATOM 0 HA PRO A 7 54.367 -22.570 -8.139 1.00 10.00 H new ATOM 0 HB2 PRO A 7 55.329 -19.684 -8.271 1.00 10.00 H new ATOM 0 HB3 PRO A 7 56.042 -21.098 -9.022 1.00 10.00 H new ATOM 0 HG2 PRO A 7 54.595 -19.393 -10.546 1.00 10.00 H new ATOM 0 HG3 PRO A 7 54.437 -21.117 -10.820 1.00 10.00 H new ATOM 0 HD2 PRO A 7 52.591 -19.268 -9.274 1.00 10.00 H new ATOM 0 HD3 PRO A 7 52.164 -20.588 -10.344 1.00 10.00 H new ATOM 101 N LEU A 8 55.158 -22.236 -5.864 1.00 10.00 N ATOM 102 CA LEU A 8 55.388 -22.311 -4.409 1.00 10.00 C ATOM 103 C LEU A 8 56.822 -22.775 -4.047 1.00 10.00 C ATOM 104 O LEU A 8 57.096 -23.151 -2.909 1.00 10.00 O ATOM 105 CB LEU A 8 54.291 -23.234 -3.821 1.00 10.00 C ATOM 106 CG LEU A 8 53.927 -22.997 -2.341 1.00 10.00 C ATOM 107 CD1 LEU A 8 53.236 -21.647 -2.120 1.00 10.00 C ATOM 108 CD2 LEU A 8 52.958 -24.088 -1.882 1.00 10.00 C ATOM 0 H LEU A 8 55.651 -22.964 -6.382 1.00 10.00 H new ATOM 0 HA LEU A 8 55.316 -21.316 -3.969 1.00 10.00 H new ATOM 0 HB2 LEU A 8 53.387 -23.118 -4.419 1.00 10.00 H new ATOM 0 HB3 LEU A 8 54.616 -24.268 -3.933 1.00 10.00 H new ATOM 0 HG LEU A 8 54.859 -23.012 -1.775 1.00 10.00 H new ATOM 0 HD11 LEU A 8 53.000 -21.528 -1.063 1.00 10.00 H new ATOM 0 HD12 LEU A 8 53.900 -20.842 -2.437 1.00 10.00 H new ATOM 0 HD13 LEU A 8 52.316 -21.609 -2.703 1.00 10.00 H new ATOM 0 HD21 LEU A 8 52.697 -23.926 -0.836 1.00 10.00 H new ATOM 0 HD22 LEU A 8 52.055 -24.052 -2.491 1.00 10.00 H new ATOM 0 HD23 LEU A 8 53.431 -25.064 -1.991 1.00 10.00 H new ATOM 120 N LEU A 9 57.745 -22.767 -5.019 1.00 10.00 N ATOM 121 CA LEU A 9 59.100 -23.340 -4.919 1.00 10.00 C ATOM 122 C LEU A 9 60.019 -22.652 -3.882 1.00 10.00 C ATOM 123 O LEU A 9 60.993 -23.255 -3.425 1.00 10.00 O ATOM 124 CB LEU A 9 59.708 -23.310 -6.339 1.00 10.00 C ATOM 125 CG LEU A 9 61.062 -24.027 -6.525 1.00 10.00 C ATOM 126 CD1 LEU A 9 60.999 -25.511 -6.153 1.00 10.00 C ATOM 127 CD2 LEU A 9 61.486 -23.930 -7.992 1.00 10.00 C ATOM 0 H LEU A 9 57.565 -22.347 -5.931 1.00 10.00 H new ATOM 0 HA LEU A 9 59.018 -24.359 -4.541 1.00 10.00 H new ATOM 0 HB2 LEU A 9 58.989 -23.755 -7.027 1.00 10.00 H new ATOM 0 HB3 LEU A 9 59.830 -22.268 -6.636 1.00 10.00 H new ATOM 0 HG LEU A 9 61.775 -23.536 -5.863 1.00 10.00 H new ATOM 0 HD11 LEU A 9 61.978 -25.966 -6.303 1.00 10.00 H new ATOM 0 HD12 LEU A 9 60.708 -25.612 -5.107 1.00 10.00 H new ATOM 0 HD13 LEU A 9 60.265 -26.013 -6.784 1.00 10.00 H new ATOM 0 HD21 LEU A 9 62.442 -24.435 -8.129 1.00 10.00 H new ATOM 0 HD22 LEU A 9 60.732 -24.404 -8.621 1.00 10.00 H new ATOM 0 HD23 LEU A 9 61.586 -22.882 -8.273 1.00 10.00 H new ATOM 139 N ALA A 10 59.712 -21.408 -3.501 1.00 10.00 N ATOM 140 CA ALA A 10 60.531 -20.562 -2.622 1.00 10.00 C ATOM 141 C ALA A 10 59.680 -19.723 -1.637 1.00 10.00 C ATOM 142 O ALA A 10 60.066 -18.616 -1.255 1.00 10.00 O ATOM 143 CB ALA A 10 61.432 -19.698 -3.522 1.00 10.00 C ATOM 0 H ALA A 10 58.856 -20.944 -3.806 1.00 10.00 H new ATOM 0 HA ALA A 10 61.148 -21.186 -1.975 1.00 10.00 H new ATOM 0 HB1 ALA A 10 62.056 -19.055 -2.902 1.00 10.00 H new ATOM 0 HB2 ALA A 10 62.067 -20.344 -4.129 1.00 10.00 H new ATOM 0 HB3 ALA A 10 60.812 -19.082 -4.174 1.00 10.00 H new ATOM 149 N ASP A 11 58.495 -20.216 -1.252 1.00 10.00 N ATOM 150 CA ASP A 11 57.517 -19.488 -0.421 1.00 10.00 C ATOM 151 C ASP A 11 58.057 -19.025 0.953 1.00 10.00 C ATOM 152 O ASP A 11 57.685 -17.952 1.434 1.00 10.00 O ATOM 153 CB ASP A 11 56.244 -20.336 -0.257 1.00 10.00 C ATOM 154 CG ASP A 11 56.377 -21.432 0.816 1.00 10.00 C ATOM 155 OD1 ASP A 11 57.157 -22.392 0.609 1.00 10.00 O ATOM 156 OD2 ASP A 11 55.714 -21.318 1.873 1.00 10.00 O ATOM 0 H ASP A 11 58.180 -21.150 -1.513 1.00 10.00 H new ATOM 0 HA ASP A 11 57.289 -18.566 -0.955 1.00 10.00 H new ATOM 0 HB2 ASP A 11 55.411 -19.682 0.002 1.00 10.00 H new ATOM 0 HB3 ASP A 11 55.999 -20.800 -1.212 1.00 10.00 H new ATOM 161 N TYR A 12 58.963 -19.805 1.556 1.00 10.00 N ATOM 162 CA TYR A 12 59.719 -19.467 2.767 1.00 10.00 C ATOM 163 C TYR A 12 60.999 -20.318 2.851 1.00 10.00 C ATOM 164 O TYR A 12 60.963 -21.529 2.613 1.00 10.00 O ATOM 165 CB TYR A 12 58.847 -19.712 4.012 1.00 10.00 C ATOM 166 CG TYR A 12 59.539 -19.380 5.323 1.00 10.00 C ATOM 167 CD1 TYR A 12 59.577 -18.049 5.782 1.00 10.00 C ATOM 168 CD2 TYR A 12 60.156 -20.399 6.076 1.00 10.00 C ATOM 169 CE1 TYR A 12 60.220 -17.738 6.998 1.00 10.00 C ATOM 170 CE2 TYR A 12 60.811 -20.091 7.284 1.00 10.00 C ATOM 171 CZ TYR A 12 60.842 -18.758 7.750 1.00 10.00 C ATOM 172 OH TYR A 12 61.456 -18.448 8.924 1.00 10.00 O ATOM 0 H TYR A 12 59.199 -20.730 1.196 1.00 10.00 H new ATOM 0 HA TYR A 12 59.998 -18.414 2.725 1.00 10.00 H new ATOM 0 HB2 TYR A 12 57.939 -19.115 3.931 1.00 10.00 H new ATOM 0 HB3 TYR A 12 58.541 -20.758 4.029 1.00 10.00 H new ATOM 0 HD1 TYR A 12 59.113 -17.265 5.202 1.00 10.00 H new ATOM 0 HD2 TYR A 12 60.126 -21.420 5.725 1.00 10.00 H new ATOM 0 HE1 TYR A 12 60.237 -16.719 7.354 1.00 10.00 H new ATOM 0 HE2 TYR A 12 61.289 -20.874 7.854 1.00 10.00 H new ATOM 0 HH TYR A 12 61.834 -19.261 9.320 1.00 10.00 H new ATOM 182 N GLU A 13 62.125 -19.697 3.217 1.00 10.00 N ATOM 183 CA GLU A 13 63.386 -20.392 3.541 1.00 10.00 C ATOM 184 C GLU A 13 64.338 -19.525 4.388 1.00 10.00 C ATOM 185 O GLU A 13 64.941 -20.020 5.343 1.00 10.00 O ATOM 186 CB GLU A 13 64.090 -20.840 2.244 1.00 10.00 C ATOM 187 CG GLU A 13 65.323 -21.714 2.515 1.00 10.00 C ATOM 188 CD GLU A 13 65.915 -22.273 1.206 1.00 10.00 C ATOM 189 OE1 GLU A 13 65.471 -23.354 0.746 1.00 10.00 O ATOM 190 OE2 GLU A 13 66.843 -21.648 0.639 1.00 10.00 O ATOM 0 H GLU A 13 62.192 -18.683 3.299 1.00 10.00 H new ATOM 0 HA GLU A 13 63.128 -21.265 4.141 1.00 10.00 H new ATOM 0 HB2 GLU A 13 63.385 -21.394 1.625 1.00 10.00 H new ATOM 0 HB3 GLU A 13 64.390 -19.960 1.675 1.00 10.00 H new ATOM 0 HG2 GLU A 13 66.079 -21.127 3.037 1.00 10.00 H new ATOM 0 HG3 GLU A 13 65.049 -22.538 3.173 1.00 10.00 H new ATOM 197 N TRP A 14 64.441 -18.229 4.069 1.00 10.00 N ATOM 198 CA TRP A 14 65.410 -17.295 4.670 1.00 10.00 C ATOM 199 C TRP A 14 64.791 -16.019 5.268 1.00 10.00 C ATOM 200 O TRP A 14 65.491 -15.275 5.954 1.00 10.00 O ATOM 201 CB TRP A 14 66.481 -16.946 3.623 1.00 10.00 C ATOM 202 CG TRP A 14 65.996 -16.196 2.413 1.00 10.00 C ATOM 203 CD1 TRP A 14 65.683 -14.880 2.376 1.00 10.00 C ATOM 204 CD2 TRP A 14 65.763 -16.695 1.056 1.00 10.00 C ATOM 205 NE1 TRP A 14 65.245 -14.538 1.111 1.00 10.00 N ATOM 206 CE2 TRP A 14 65.268 -15.619 0.257 1.00 10.00 C ATOM 207 CE3 TRP A 14 65.920 -17.944 0.416 1.00 10.00 C ATOM 208 CZ2 TRP A 14 64.925 -15.779 -1.095 1.00 10.00 C ATOM 209 CZ3 TRP A 14 65.578 -18.117 -0.941 1.00 10.00 C ATOM 210 CH2 TRP A 14 65.079 -17.040 -1.695 1.00 10.00 C ATOM 0 H TRP A 14 63.842 -17.788 3.371 1.00 10.00 H new ATOM 0 HA TRP A 14 65.853 -17.810 5.523 1.00 10.00 H new ATOM 0 HB2 TRP A 14 67.256 -16.352 4.108 1.00 10.00 H new ATOM 0 HB3 TRP A 14 66.950 -17.871 3.289 1.00 10.00 H new ATOM 0 HD1 TRP A 14 65.764 -14.199 3.210 1.00 10.00 H new ATOM 0 HE1 TRP A 14 64.942 -13.602 0.843 1.00 10.00 H new ATOM 0 HE3 TRP A 14 66.309 -18.782 0.976 1.00 10.00 H new ATOM 0 HZ2 TRP A 14 64.548 -14.944 -1.666 1.00 10.00 H new ATOM 0 HZ3 TRP A 14 65.700 -19.085 -1.405 1.00 10.00 H new ATOM 0 HH2 TRP A 14 64.815 -17.182 -2.733 1.00 10.00 H new ATOM 221 N SER A 15 63.496 -15.752 5.053 1.00 10.00 N ATOM 222 CA SER A 15 62.816 -14.514 5.485 1.00 10.00 C ATOM 223 C SER A 15 62.868 -14.255 6.998 1.00 10.00 C ATOM 224 O SER A 15 62.786 -13.102 7.430 1.00 10.00 O ATOM 225 CB SER A 15 61.357 -14.510 5.012 1.00 10.00 C ATOM 226 OG SER A 15 61.288 -14.787 3.619 1.00 10.00 O ATOM 0 H SER A 15 62.876 -16.399 4.565 1.00 10.00 H new ATOM 0 HA SER A 15 63.373 -13.702 5.017 1.00 10.00 H new ATOM 0 HB2 SER A 15 60.786 -15.255 5.566 1.00 10.00 H new ATOM 0 HB3 SER A 15 60.903 -13.541 5.220 1.00 10.00 H new ATOM 0 HG SER A 15 60.351 -14.783 3.331 1.00 10.00 H new ATOM 232 N GLY A 16 63.069 -15.297 7.814 1.00 10.00 N ATOM 233 CA GLY A 16 63.355 -15.197 9.252 1.00 10.00 C ATOM 234 C GLY A 16 64.505 -14.241 9.601 1.00 10.00 C ATOM 235 O GLY A 16 64.446 -13.545 10.615 1.00 10.00 O ATOM 0 H GLY A 16 63.036 -16.261 7.483 1.00 10.00 H new ATOM 0 HA2 GLY A 16 62.454 -14.866 9.768 1.00 10.00 H new ATOM 0 HA3 GLY A 16 63.595 -16.190 9.633 1.00 10.00 H new ATOM 239 N TYR A 17 65.506 -14.146 8.719 1.00 10.00 N ATOM 240 CA TYR A 17 66.672 -13.252 8.821 1.00 10.00 C ATOM 241 C TYR A 17 66.315 -11.759 8.970 1.00 10.00 C ATOM 242 O TYR A 17 67.074 -11.003 9.582 1.00 10.00 O ATOM 243 CB TYR A 17 67.557 -13.476 7.585 1.00 10.00 C ATOM 244 CG TYR A 17 68.912 -12.794 7.627 1.00 10.00 C ATOM 245 CD1 TYR A 17 69.966 -13.381 8.354 1.00 10.00 C ATOM 246 CD2 TYR A 17 69.126 -11.589 6.927 1.00 10.00 C ATOM 247 CE1 TYR A 17 71.235 -12.768 8.383 1.00 10.00 C ATOM 248 CE2 TYR A 17 70.392 -10.973 6.955 1.00 10.00 C ATOM 249 CZ TYR A 17 71.451 -11.560 7.681 1.00 10.00 C ATOM 250 OH TYR A 17 72.674 -10.960 7.698 1.00 10.00 O ATOM 0 H TYR A 17 65.529 -14.716 7.873 1.00 10.00 H new ATOM 0 HA TYR A 17 67.201 -13.506 9.740 1.00 10.00 H new ATOM 0 HB2 TYR A 17 67.711 -14.548 7.458 1.00 10.00 H new ATOM 0 HB3 TYR A 17 67.019 -13.125 6.704 1.00 10.00 H new ATOM 0 HD1 TYR A 17 69.801 -14.304 8.891 1.00 10.00 H new ATOM 0 HD2 TYR A 17 68.319 -11.138 6.369 1.00 10.00 H new ATOM 0 HE1 TYR A 17 72.041 -13.221 8.941 1.00 10.00 H new ATOM 0 HE2 TYR A 17 70.553 -10.049 6.420 1.00 10.00 H new ATOM 0 HH TYR A 17 72.644 -10.140 7.162 1.00 10.00 H new ATOM 260 N LEU A 18 65.144 -11.342 8.467 1.00 10.00 N ATOM 261 CA LEU A 18 64.626 -9.968 8.577 1.00 10.00 C ATOM 262 C LEU A 18 63.260 -9.873 9.279 1.00 10.00 C ATOM 263 O LEU A 18 62.950 -8.834 9.861 1.00 10.00 O ATOM 264 CB LEU A 18 64.690 -9.268 7.202 1.00 10.00 C ATOM 265 CG LEU A 18 63.902 -9.896 6.029 1.00 10.00 C ATOM 266 CD1 LEU A 18 62.391 -9.651 6.094 1.00 10.00 C ATOM 267 CD2 LEU A 18 64.390 -9.282 4.715 1.00 10.00 C ATOM 0 H LEU A 18 64.515 -11.965 7.960 1.00 10.00 H new ATOM 0 HA LEU A 18 65.280 -9.415 9.251 1.00 10.00 H new ATOM 0 HB2 LEU A 18 64.337 -8.245 7.332 1.00 10.00 H new ATOM 0 HB3 LEU A 18 65.737 -9.208 6.906 1.00 10.00 H new ATOM 0 HG LEU A 18 64.077 -10.970 6.093 1.00 10.00 H new ATOM 0 HD11 LEU A 18 61.909 -10.122 5.237 1.00 10.00 H new ATOM 0 HD12 LEU A 18 61.993 -10.077 7.015 1.00 10.00 H new ATOM 0 HD13 LEU A 18 62.195 -8.579 6.076 1.00 10.00 H new ATOM 0 HD21 LEU A 18 63.839 -9.720 3.882 1.00 10.00 H new ATOM 0 HD22 LEU A 18 64.225 -8.205 4.733 1.00 10.00 H new ATOM 0 HD23 LEU A 18 65.454 -9.484 4.592 1.00 10.00 H new ATOM 279 N THR A 19 62.484 -10.960 9.340 1.00 10.00 N ATOM 280 CA THR A 19 61.264 -11.036 10.169 1.00 10.00 C ATOM 281 C THR A 19 61.609 -10.990 11.663 1.00 10.00 C ATOM 282 O THR A 19 60.897 -10.360 12.444 1.00 10.00 O ATOM 283 CB THR A 19 60.446 -12.301 9.848 1.00 10.00 C ATOM 284 OG1 THR A 19 60.147 -12.353 8.469 1.00 10.00 O ATOM 285 CG2 THR A 19 59.102 -12.345 10.578 1.00 10.00 C ATOM 0 H THR A 19 62.679 -11.815 8.818 1.00 10.00 H new ATOM 0 HA THR A 19 60.653 -10.166 9.929 1.00 10.00 H new ATOM 0 HB THR A 19 61.065 -13.138 10.170 1.00 10.00 H new ATOM 0 HG1 THR A 19 60.953 -12.597 7.968 1.00 10.00 H new ATOM 0 HG21 THR A 19 58.573 -13.260 10.311 1.00 10.00 H new ATOM 0 HG22 THR A 19 59.272 -12.325 11.655 1.00 10.00 H new ATOM 0 HG23 THR A 19 58.503 -11.481 10.289 1.00 10.00 H new ATOM 293 N GLY A 20 62.749 -11.581 12.044 1.00 10.00 N ATOM 294 CA GLY A 20 63.306 -11.598 13.404 1.00 10.00 C ATOM 295 C GLY A 20 63.520 -10.222 14.042 1.00 10.00 C ATOM 296 O GLY A 20 63.428 -10.091 15.265 1.00 10.00 O ATOM 0 H GLY A 20 63.337 -12.085 11.380 1.00 10.00 H new ATOM 0 HA2 GLY A 20 62.640 -12.177 14.044 1.00 10.00 H new ATOM 0 HA3 GLY A 20 64.262 -12.122 13.381 1.00 10.00 H new ATOM 300 N ILE A 21 63.747 -9.199 13.213 1.00 10.00 N ATOM 301 CA ILE A 21 63.889 -7.789 13.619 1.00 10.00 C ATOM 302 C ILE A 21 62.673 -6.935 13.226 1.00 10.00 C ATOM 303 O ILE A 21 62.245 -6.083 14.005 1.00 10.00 O ATOM 304 CB ILE A 21 65.234 -7.219 13.102 1.00 10.00 C ATOM 305 CG1 ILE A 21 65.546 -5.797 13.619 1.00 10.00 C ATOM 306 CG2 ILE A 21 65.339 -7.211 11.566 1.00 10.00 C ATOM 307 CD1 ILE A 21 65.622 -5.686 15.147 1.00 10.00 C ATOM 0 H ILE A 21 63.841 -9.329 12.206 1.00 10.00 H new ATOM 0 HA ILE A 21 63.914 -7.747 14.708 1.00 10.00 H new ATOM 0 HB ILE A 21 65.973 -7.909 13.509 1.00 10.00 H new ATOM 0 HG12 ILE A 21 66.495 -5.468 13.194 1.00 10.00 H new ATOM 0 HG13 ILE A 21 64.779 -5.113 13.254 1.00 10.00 H new ATOM 0 HG21 ILE A 21 66.304 -6.800 11.269 1.00 10.00 H new ATOM 0 HG22 ILE A 21 65.247 -8.230 11.190 1.00 10.00 H new ATOM 0 HG23 ILE A 21 64.540 -6.597 11.150 1.00 10.00 H new ATOM 0 HD11 ILE A 21 65.845 -4.656 15.426 1.00 10.00 H new ATOM 0 HD12 ILE A 21 64.667 -5.981 15.581 1.00 10.00 H new ATOM 0 HD13 ILE A 21 66.409 -6.341 15.521 1.00 10.00 H new ATOM 319 N GLY A 22 62.047 -7.209 12.077 1.00 10.00 N ATOM 320 CA GLY A 22 60.844 -6.514 11.599 1.00 10.00 C ATOM 321 C GLY A 22 59.661 -6.597 12.570 1.00 10.00 C ATOM 322 O GLY A 22 58.980 -5.597 12.810 1.00 10.00 O ATOM 0 H GLY A 22 62.369 -7.936 11.438 1.00 10.00 H new ATOM 0 HA2 GLY A 22 61.086 -5.466 11.423 1.00 10.00 H new ATOM 0 HA3 GLY A 22 60.547 -6.938 10.640 1.00 10.00 H new ATOM 326 N ARG A 23 59.468 -7.763 13.205 1.00 10.00 N ATOM 327 CA ARG A 23 58.451 -8.003 14.249 1.00 10.00 C ATOM 328 C ARG A 23 58.522 -7.041 15.444 1.00 10.00 C ATOM 329 O ARG A 23 57.505 -6.797 16.090 1.00 10.00 O ATOM 330 CB ARG A 23 58.517 -9.473 14.705 1.00 10.00 C ATOM 331 CG ARG A 23 59.800 -9.813 15.484 1.00 10.00 C ATOM 332 CD ARG A 23 59.941 -11.320 15.719 1.00 10.00 C ATOM 333 NE ARG A 23 61.247 -11.622 16.332 1.00 10.00 N ATOM 334 CZ ARG A 23 61.667 -12.773 16.821 1.00 10.00 C ATOM 335 NH1 ARG A 23 60.905 -13.829 16.880 1.00 10.00 N ATOM 336 NH2 ARG A 23 62.889 -12.880 17.253 1.00 10.00 N ATOM 0 H ARG A 23 60.029 -8.590 13.003 1.00 10.00 H new ATOM 0 HA ARG A 23 57.483 -7.797 13.792 1.00 10.00 H new ATOM 0 HB2 ARG A 23 57.652 -9.691 15.331 1.00 10.00 H new ATOM 0 HB3 ARG A 23 58.449 -10.121 13.831 1.00 10.00 H new ATOM 0 HG2 ARG A 23 60.667 -9.448 14.933 1.00 10.00 H new ATOM 0 HG3 ARG A 23 59.791 -9.295 16.443 1.00 10.00 H new ATOM 0 HD2 ARG A 23 59.138 -11.671 16.367 1.00 10.00 H new ATOM 0 HD3 ARG A 23 59.843 -11.853 14.773 1.00 10.00 H new ATOM 0 HE ARG A 23 61.907 -10.846 16.385 1.00 10.00 H new ATOM 0 HH11 ARG A 23 59.944 -13.784 16.540 1.00 10.00 H new ATOM 0 HH12 ARG A 23 61.269 -14.700 17.266 1.00 10.00 H new ATOM 0 HH21 ARG A 23 63.516 -12.077 17.213 1.00 10.00 H new ATOM 0 HH22 ARG A 23 63.220 -13.767 17.632 1.00 10.00 H new ATOM 350 N ALA A 24 59.696 -6.476 15.740 1.00 10.00 N ATOM 351 CA ALA A 24 59.889 -5.575 16.877 1.00 10.00 C ATOM 352 C ALA A 24 59.459 -4.117 16.614 1.00 10.00 C ATOM 353 O ALA A 24 59.365 -3.325 17.553 1.00 10.00 O ATOM 354 CB ALA A 24 61.347 -5.677 17.345 1.00 10.00 C ATOM 0 H ALA A 24 60.543 -6.632 15.194 1.00 10.00 H new ATOM 0 HA ALA A 24 59.220 -5.901 17.674 1.00 10.00 H new ATOM 0 HB1 ALA A 24 61.505 -5.010 18.193 1.00 10.00 H new ATOM 0 HB2 ALA A 24 61.562 -6.703 17.645 1.00 10.00 H new ATOM 0 HB3 ALA A 24 62.012 -5.391 16.530 1.00 10.00 H new ATOM 360 N PHE A 25 59.131 -3.780 15.363 1.00 10.00 N ATOM 361 CA PHE A 25 58.492 -2.515 14.973 1.00 10.00 C ATOM 362 C PHE A 25 56.994 -2.747 14.648 1.00 10.00 C ATOM 363 O PHE A 25 56.345 -1.959 13.957 1.00 10.00 O ATOM 364 CB PHE A 25 59.299 -1.898 13.817 1.00 10.00 C ATOM 365 CG PHE A 25 59.055 -0.416 13.591 1.00 10.00 C ATOM 366 CD1 PHE A 25 59.513 0.522 14.538 1.00 10.00 C ATOM 367 CD2 PHE A 25 58.391 0.033 12.432 1.00 10.00 C ATOM 368 CE1 PHE A 25 59.300 1.898 14.332 1.00 10.00 C ATOM 369 CE2 PHE A 25 58.179 1.408 12.227 1.00 10.00 C ATOM 370 CZ PHE A 25 58.633 2.341 13.176 1.00 10.00 C ATOM 0 H PHE A 25 59.307 -4.396 14.569 1.00 10.00 H new ATOM 0 HA PHE A 25 58.500 -1.797 15.793 1.00 10.00 H new ATOM 0 HB2 PHE A 25 60.361 -2.052 14.011 1.00 10.00 H new ATOM 0 HB3 PHE A 25 59.061 -2.435 12.899 1.00 10.00 H new ATOM 0 HD1 PHE A 25 60.029 0.184 15.424 1.00 10.00 H new ATOM 0 HD2 PHE A 25 58.044 -0.681 11.699 1.00 10.00 H new ATOM 0 HE1 PHE A 25 59.649 2.614 15.062 1.00 10.00 H new ATOM 0 HE2 PHE A 25 57.667 1.748 11.339 1.00 10.00 H new ATOM 0 HZ PHE A 25 58.470 3.397 13.017 1.00 10.00 H new ATOM 380 N ASP A 26 56.449 -3.862 15.149 1.00 10.00 N ATOM 381 CA ASP A 26 55.136 -4.434 14.827 1.00 10.00 C ATOM 382 C ASP A 26 54.472 -5.081 16.063 1.00 10.00 C ATOM 383 O ASP A 26 53.568 -5.901 15.933 1.00 10.00 O ATOM 384 CB ASP A 26 55.376 -5.480 13.723 1.00 10.00 C ATOM 385 CG ASP A 26 54.120 -5.775 12.891 1.00 10.00 C ATOM 386 OD1 ASP A 26 53.529 -4.825 12.328 1.00 10.00 O ATOM 387 OD2 ASP A 26 53.749 -6.957 12.708 1.00 10.00 O ATOM 0 H ASP A 26 56.947 -4.427 15.837 1.00 10.00 H new ATOM 0 HA ASP A 26 54.452 -3.653 14.494 1.00 10.00 H new ATOM 0 HB2 ASP A 26 56.168 -5.127 13.062 1.00 10.00 H new ATOM 0 HB3 ASP A 26 55.729 -6.405 14.178 1.00 10.00 H new ATOM 392 N ASP A 27 54.928 -4.742 17.275 1.00 10.00 N ATOM 393 CA ASP A 27 54.590 -5.400 18.550 1.00 10.00 C ATOM 394 C ASP A 27 53.090 -5.580 18.877 1.00 10.00 C ATOM 395 O ASP A 27 52.730 -6.539 19.564 1.00 10.00 O ATOM 396 CB ASP A 27 55.333 -4.698 19.698 1.00 10.00 C ATOM 397 CG ASP A 27 54.745 -3.319 20.041 1.00 10.00 C ATOM 398 OD1 ASP A 27 55.065 -2.330 19.338 1.00 10.00 O ATOM 399 OD2 ASP A 27 53.967 -3.216 21.020 1.00 10.00 O ATOM 0 H ASP A 27 55.575 -3.964 17.403 1.00 10.00 H new ATOM 0 HA ASP A 27 54.927 -6.429 18.428 1.00 10.00 H new ATOM 0 HB2 ASP A 27 55.301 -5.331 20.585 1.00 10.00 H new ATOM 0 HB3 ASP A 27 56.382 -4.582 19.427 1.00 10.00 H new ATOM 404 N GLY A 28 52.205 -4.729 18.346 1.00 10.00 N ATOM 405 CA GLY A 28 50.743 -4.857 18.499 1.00 10.00 C ATOM 406 C GLY A 28 50.075 -5.832 17.517 1.00 10.00 C ATOM 407 O GLY A 28 48.875 -6.088 17.629 1.00 10.00 O ATOM 0 H GLY A 28 52.483 -3.920 17.790 1.00 10.00 H new ATOM 0 HA2 GLY A 28 50.525 -5.182 19.516 1.00 10.00 H new ATOM 0 HA3 GLY A 28 50.291 -3.873 18.375 1.00 10.00 H new ATOM 411 N VAL A 29 50.847 -6.407 16.588 1.00 10.00 N ATOM 412 CA VAL A 29 50.429 -7.472 15.652 1.00 10.00 C ATOM 413 C VAL A 29 51.390 -8.666 15.657 1.00 10.00 C ATOM 414 O VAL A 29 51.015 -9.751 15.212 1.00 10.00 O ATOM 415 CB VAL A 29 50.250 -6.949 14.211 1.00 10.00 C ATOM 416 CG1 VAL A 29 49.464 -7.983 13.385 1.00 10.00 C ATOM 417 CG2 VAL A 29 49.501 -5.616 14.143 1.00 10.00 C ATOM 0 H VAL A 29 51.822 -6.136 16.457 1.00 10.00 H new ATOM 0 HA VAL A 29 49.460 -7.814 16.015 1.00 10.00 H new ATOM 0 HB VAL A 29 51.252 -6.791 13.811 1.00 10.00 H new ATOM 0 HG11 VAL A 29 49.337 -7.615 12.367 1.00 10.00 H new ATOM 0 HG12 VAL A 29 50.012 -8.925 13.364 1.00 10.00 H new ATOM 0 HG13 VAL A 29 48.485 -8.143 13.838 1.00 10.00 H new ATOM 0 HG21 VAL A 29 49.408 -5.303 13.103 1.00 10.00 H new ATOM 0 HG22 VAL A 29 48.508 -5.734 14.576 1.00 10.00 H new ATOM 0 HG23 VAL A 29 50.053 -4.860 14.702 1.00 10.00 H new ATOM 427 N LYS A 30 52.586 -8.524 16.244 1.00 10.00 N ATOM 428 CA LYS A 30 53.565 -9.599 16.487 1.00 10.00 C ATOM 429 C LYS A 30 52.927 -10.884 17.031 1.00 10.00 C ATOM 430 O LYS A 30 53.312 -11.982 16.642 1.00 10.00 O ATOM 431 CB LYS A 30 54.667 -9.045 17.411 1.00 10.00 C ATOM 432 CG LYS A 30 55.727 -10.076 17.832 1.00 10.00 C ATOM 433 CD LYS A 30 56.859 -9.393 18.620 1.00 10.00 C ATOM 434 CE LYS A 30 57.918 -10.378 19.134 1.00 10.00 C ATOM 435 NZ LYS A 30 57.424 -11.204 20.270 1.00 10.00 N ATOM 0 H LYS A 30 52.915 -7.618 16.578 1.00 10.00 H new ATOM 0 HA LYS A 30 54.004 -9.902 15.536 1.00 10.00 H new ATOM 0 HB2 LYS A 30 55.165 -8.217 16.906 1.00 10.00 H new ATOM 0 HB3 LYS A 30 54.200 -8.637 18.307 1.00 10.00 H new ATOM 0 HG2 LYS A 30 55.266 -10.851 18.444 1.00 10.00 H new ATOM 0 HG3 LYS A 30 56.136 -10.568 16.949 1.00 10.00 H new ATOM 0 HD2 LYS A 30 57.341 -8.652 17.982 1.00 10.00 H new ATOM 0 HD3 LYS A 30 56.431 -8.856 19.466 1.00 10.00 H new ATOM 0 HE2 LYS A 30 58.226 -11.033 18.319 1.00 10.00 H new ATOM 0 HE3 LYS A 30 58.802 -9.824 19.449 1.00 10.00 H new ATOM 0 HZ1 LYS A 30 58.176 -11.852 20.580 1.00 10.00 H new ATOM 0 HZ2 LYS A 30 57.155 -10.583 21.059 1.00 10.00 H new ATOM 0 HZ3 LYS A 30 56.596 -11.755 19.965 1.00 10.00 H new ATOM 449 N ASP A 31 51.896 -10.737 17.858 1.00 10.00 N ATOM 450 CA ASP A 31 51.022 -11.796 18.369 1.00 10.00 C ATOM 451 C ASP A 31 50.391 -12.701 17.297 1.00 10.00 C ATOM 452 O ASP A 31 50.494 -13.929 17.361 1.00 10.00 O ATOM 453 CB ASP A 31 49.926 -11.082 19.177 1.00 10.00 C ATOM 454 CG ASP A 31 48.967 -12.080 19.849 1.00 10.00 C ATOM 455 OD1 ASP A 31 49.388 -12.765 20.810 1.00 10.00 O ATOM 456 OD2 ASP A 31 47.794 -12.177 19.417 1.00 10.00 O ATOM 0 H ASP A 31 51.629 -9.819 18.213 1.00 10.00 H new ATOM 0 HA ASP A 31 51.625 -12.482 18.964 1.00 10.00 H new ATOM 0 HB2 ASP A 31 50.388 -10.453 19.938 1.00 10.00 H new ATOM 0 HB3 ASP A 31 49.361 -10.422 18.518 1.00 10.00 H new ATOM 461 N LEU A 32 49.730 -12.104 16.310 1.00 10.00 N ATOM 462 CA LEU A 32 49.099 -12.797 15.186 1.00 10.00 C ATOM 463 C LEU A 32 50.137 -13.170 14.116 1.00 10.00 C ATOM 464 O LEU A 32 50.041 -14.210 13.474 1.00 10.00 O ATOM 465 CB LEU A 32 48.007 -11.857 14.642 1.00 10.00 C ATOM 466 CG LEU A 32 46.720 -12.568 14.177 1.00 10.00 C ATOM 467 CD1 LEU A 32 45.697 -11.517 13.744 1.00 10.00 C ATOM 468 CD2 LEU A 32 46.959 -13.535 13.020 1.00 10.00 C ATOM 0 H LEU A 32 49.614 -11.092 16.267 1.00 10.00 H new ATOM 0 HA LEU A 32 48.653 -13.740 15.502 1.00 10.00 H new ATOM 0 HB2 LEU A 32 47.748 -11.136 15.417 1.00 10.00 H new ATOM 0 HB3 LEU A 32 48.417 -11.292 13.805 1.00 10.00 H new ATOM 0 HG LEU A 32 46.353 -13.155 15.019 1.00 10.00 H new ATOM 0 HD11 LEU A 32 44.784 -12.012 13.414 1.00 10.00 H new ATOM 0 HD12 LEU A 32 45.470 -10.862 14.585 1.00 10.00 H new ATOM 0 HD13 LEU A 32 46.106 -10.927 12.924 1.00 10.00 H new ATOM 0 HD21 LEU A 32 46.017 -14.004 12.738 1.00 10.00 H new ATOM 0 HD22 LEU A 32 47.363 -12.989 12.167 1.00 10.00 H new ATOM 0 HD23 LEU A 32 47.669 -14.303 13.328 1.00 10.00 H new ATOM 480 N ASN A 33 51.182 -12.355 13.971 1.00 10.00 N ATOM 481 CA ASN A 33 52.309 -12.647 13.080 1.00 10.00 C ATOM 482 C ASN A 33 53.053 -13.930 13.497 1.00 10.00 C ATOM 483 O ASN A 33 53.414 -14.740 12.646 1.00 10.00 O ATOM 484 CB ASN A 33 53.250 -11.432 13.038 1.00 10.00 C ATOM 485 CG ASN A 33 54.306 -11.575 11.955 1.00 10.00 C ATOM 486 OD1 ASN A 33 54.017 -11.549 10.768 1.00 10.00 O ATOM 487 ND2 ASN A 33 55.560 -11.733 12.319 1.00 10.00 N ATOM 0 H ASN A 33 51.273 -11.470 14.470 1.00 10.00 H new ATOM 0 HA ASN A 33 51.924 -12.832 12.077 1.00 10.00 H new ATOM 0 HB2 ASN A 33 52.668 -10.527 12.862 1.00 10.00 H new ATOM 0 HB3 ASN A 33 53.736 -11.315 14.007 1.00 10.00 H new ATOM 0 HD21 ASN A 33 56.288 -11.833 11.611 1.00 10.00 H new ATOM 0 HD22 ASN A 33 55.805 -11.755 13.309 1.00 10.00 H new ATOM 494 N LYS A 34 53.216 -14.155 14.807 1.00 10.00 N ATOM 495 CA LYS A 34 53.753 -15.398 15.390 1.00 10.00 C ATOM 496 C LYS A 34 52.847 -16.596 15.102 1.00 10.00 C ATOM 497 O LYS A 34 53.335 -17.643 14.687 1.00 10.00 O ATOM 498 CB LYS A 34 53.982 -15.193 16.899 1.00 10.00 C ATOM 499 CG LYS A 34 54.625 -16.412 17.579 1.00 10.00 C ATOM 500 CD LYS A 34 54.887 -16.132 19.068 1.00 10.00 C ATOM 501 CE LYS A 34 55.439 -17.360 19.810 1.00 10.00 C ATOM 502 NZ LYS A 34 56.833 -17.692 19.409 1.00 10.00 N ATOM 0 H LYS A 34 52.972 -13.460 15.513 1.00 10.00 H new ATOM 0 HA LYS A 34 54.710 -15.627 14.921 1.00 10.00 H new ATOM 0 HB2 LYS A 34 54.619 -14.322 17.049 1.00 10.00 H new ATOM 0 HB3 LYS A 34 53.028 -14.977 17.380 1.00 10.00 H new ATOM 0 HG2 LYS A 34 53.971 -17.278 17.477 1.00 10.00 H new ATOM 0 HG3 LYS A 34 55.562 -16.660 17.081 1.00 10.00 H new ATOM 0 HD2 LYS A 34 55.594 -15.308 19.160 1.00 10.00 H new ATOM 0 HD3 LYS A 34 53.960 -15.811 19.543 1.00 10.00 H new ATOM 0 HE2 LYS A 34 55.408 -17.175 20.884 1.00 10.00 H new ATOM 0 HE3 LYS A 34 54.795 -18.217 19.615 1.00 10.00 H new ATOM 0 HZ1 LYS A 34 57.157 -18.527 19.938 1.00 10.00 H new ATOM 0 HZ2 LYS A 34 56.862 -17.896 18.390 1.00 10.00 H new ATOM 0 HZ3 LYS A 34 57.456 -16.886 19.619 1.00 10.00 H new ATOM 516 N GLN A 35 51.532 -16.424 15.249 1.00 10.00 N ATOM 517 CA GLN A 35 50.538 -17.453 14.888 1.00 10.00 C ATOM 518 C GLN A 35 50.600 -17.823 13.398 1.00 10.00 C ATOM 519 O GLN A 35 50.522 -18.996 13.033 1.00 10.00 O ATOM 520 CB GLN A 35 49.123 -16.983 15.266 1.00 10.00 C ATOM 521 CG GLN A 35 48.912 -16.998 16.784 1.00 10.00 C ATOM 522 CD GLN A 35 47.665 -16.230 17.209 1.00 10.00 C ATOM 523 OE1 GLN A 35 46.537 -16.689 17.088 1.00 10.00 O ATOM 524 NE2 GLN A 35 47.827 -15.033 17.730 1.00 10.00 N ATOM 0 H GLN A 35 51.119 -15.569 15.622 1.00 10.00 H new ATOM 0 HA GLN A 35 50.781 -18.352 15.454 1.00 10.00 H new ATOM 0 HB2 GLN A 35 48.960 -15.975 14.885 1.00 10.00 H new ATOM 0 HB3 GLN A 35 48.385 -17.628 14.789 1.00 10.00 H new ATOM 0 HG2 GLN A 35 48.833 -18.030 17.126 1.00 10.00 H new ATOM 0 HG3 GLN A 35 49.785 -16.566 17.273 1.00 10.00 H new ATOM 0 HE21 GLN A 35 48.764 -14.645 17.834 1.00 10.00 H new ATOM 0 HE22 GLN A 35 47.015 -14.493 18.030 1.00 10.00 H new ATOM 533 N LEU A 36 50.795 -16.831 12.531 1.00 10.00 N ATOM 534 CA LEU A 36 50.920 -17.028 11.086 1.00 10.00 C ATOM 535 C LEU A 36 52.257 -17.656 10.680 1.00 10.00 C ATOM 536 O LEU A 36 52.277 -18.534 9.820 1.00 10.00 O ATOM 537 CB LEU A 36 50.665 -15.700 10.388 1.00 10.00 C ATOM 538 CG LEU A 36 50.523 -15.874 8.869 1.00 10.00 C ATOM 539 CD1 LEU A 36 49.384 -16.778 8.393 1.00 10.00 C ATOM 540 CD2 LEU A 36 50.208 -14.494 8.331 1.00 10.00 C ATOM 0 H LEU A 36 50.872 -15.854 12.815 1.00 10.00 H new ATOM 0 HA LEU A 36 50.170 -17.751 10.767 1.00 10.00 H new ATOM 0 HB2 LEU A 36 49.758 -15.247 10.789 1.00 10.00 H new ATOM 0 HB3 LEU A 36 51.485 -15.014 10.601 1.00 10.00 H new ATOM 0 HG LEU A 36 51.446 -16.339 8.523 1.00 10.00 H new ATOM 0 HD11 LEU A 36 49.386 -16.822 7.304 1.00 10.00 H new ATOM 0 HD12 LEU A 36 49.522 -17.781 8.797 1.00 10.00 H new ATOM 0 HD13 LEU A 36 48.432 -16.376 8.738 1.00 10.00 H new ATOM 0 HD21 LEU A 36 50.093 -14.543 7.248 1.00 10.00 H new ATOM 0 HD22 LEU A 36 49.282 -14.132 8.778 1.00 10.00 H new ATOM 0 HD23 LEU A 36 51.022 -13.812 8.579 1.00 10.00 H new ATOM 552 N GLN A 37 53.363 -17.273 11.320 1.00 10.00 N ATOM 553 CA GLN A 37 54.666 -17.918 11.125 1.00 10.00 C ATOM 554 C GLN A 37 54.655 -19.370 11.632 1.00 10.00 C ATOM 555 O GLN A 37 55.239 -20.242 10.998 1.00 10.00 O ATOM 556 CB GLN A 37 55.764 -17.062 11.782 1.00 10.00 C ATOM 557 CG GLN A 37 57.197 -17.419 11.338 1.00 10.00 C ATOM 558 CD GLN A 37 57.768 -18.701 11.951 1.00 10.00 C ATOM 559 OE1 GLN A 37 57.535 -19.043 13.103 1.00 10.00 O ATOM 560 NE2 GLN A 37 58.562 -19.451 11.213 1.00 10.00 N ATOM 0 H GLN A 37 53.382 -16.505 11.991 1.00 10.00 H new ATOM 0 HA GLN A 37 54.884 -17.980 10.059 1.00 10.00 H new ATOM 0 HB2 GLN A 37 55.576 -16.013 11.554 1.00 10.00 H new ATOM 0 HB3 GLN A 37 55.694 -17.170 12.864 1.00 10.00 H new ATOM 0 HG2 GLN A 37 57.210 -17.517 10.252 1.00 10.00 H new ATOM 0 HG3 GLN A 37 57.856 -16.589 11.591 1.00 10.00 H new ATOM 0 HE21 GLN A 37 58.768 -19.182 10.251 1.00 10.00 H new ATOM 0 HE22 GLN A 37 58.970 -20.300 11.604 1.00 10.00 H new ATOM 569 N ASP A 38 53.920 -19.664 12.706 1.00 10.00 N ATOM 570 CA ASP A 38 53.660 -21.038 13.154 1.00 10.00 C ATOM 571 C ASP A 38 52.831 -21.828 12.130 1.00 10.00 C ATOM 572 O ASP A 38 53.141 -22.989 11.849 1.00 10.00 O ATOM 573 CB ASP A 38 52.995 -21.027 14.539 1.00 10.00 C ATOM 574 CG ASP A 38 52.764 -22.452 15.068 1.00 10.00 C ATOM 575 OD1 ASP A 38 53.736 -23.087 15.541 1.00 10.00 O ATOM 576 OD2 ASP A 38 51.608 -22.936 15.023 1.00 10.00 O ATOM 0 H ASP A 38 53.485 -18.953 13.294 1.00 10.00 H new ATOM 0 HA ASP A 38 54.617 -21.554 13.238 1.00 10.00 H new ATOM 0 HB2 ASP A 38 53.622 -20.475 15.240 1.00 10.00 H new ATOM 0 HB3 ASP A 38 52.042 -20.501 14.481 1.00 10.00 H new ATOM 581 N ALA A 39 51.847 -21.192 11.481 1.00 10.00 N ATOM 582 CA ALA A 39 51.153 -21.798 10.341 1.00 10.00 C ATOM 583 C ALA A 39 52.127 -22.107 9.202 1.00 10.00 C ATOM 584 O ALA A 39 52.144 -23.220 8.684 1.00 10.00 O ATOM 585 CB ALA A 39 50.004 -20.918 9.821 1.00 10.00 C ATOM 0 H ALA A 39 51.515 -20.259 11.727 1.00 10.00 H new ATOM 0 HA ALA A 39 50.721 -22.731 10.704 1.00 10.00 H new ATOM 0 HB1 ALA A 39 49.522 -21.411 8.977 1.00 10.00 H new ATOM 0 HB2 ALA A 39 49.275 -20.764 10.616 1.00 10.00 H new ATOM 0 HB3 ALA A 39 50.400 -19.954 9.501 1.00 10.00 H new ATOM 591 N GLN A 40 52.979 -21.138 8.869 1.00 10.00 N ATOM 592 CA GLN A 40 53.996 -21.219 7.825 1.00 10.00 C ATOM 593 C GLN A 40 55.080 -22.257 8.142 1.00 10.00 C ATOM 594 O GLN A 40 55.701 -22.761 7.219 1.00 10.00 O ATOM 595 CB GLN A 40 54.612 -19.820 7.634 1.00 10.00 C ATOM 596 CG GLN A 40 55.273 -19.616 6.264 1.00 10.00 C ATOM 597 CD GLN A 40 55.733 -18.168 6.088 1.00 10.00 C ATOM 598 OE1 GLN A 40 56.490 -17.625 6.883 1.00 10.00 O ATOM 599 NE2 GLN A 40 55.281 -17.466 5.070 1.00 10.00 N ATOM 0 H GLN A 40 52.978 -20.234 9.342 1.00 10.00 H new ATOM 0 HA GLN A 40 53.522 -21.551 6.902 1.00 10.00 H new ATOM 0 HB2 GLN A 40 53.833 -19.069 7.767 1.00 10.00 H new ATOM 0 HB3 GLN A 40 55.354 -19.650 8.414 1.00 10.00 H new ATOM 0 HG2 GLN A 40 56.126 -20.287 6.164 1.00 10.00 H new ATOM 0 HG3 GLN A 40 54.569 -19.876 5.474 1.00 10.00 H new ATOM 0 HE21 GLN A 40 54.649 -17.896 4.394 1.00 10.00 H new ATOM 0 HE22 GLN A 40 55.563 -16.492 4.957 1.00 10.00 H new ATOM 608 N ALA A 41 55.328 -22.593 9.410 1.00 10.00 N ATOM 609 CA ALA A 41 56.177 -23.716 9.827 1.00 10.00 C ATOM 610 C ALA A 41 55.492 -25.086 9.776 1.00 10.00 C ATOM 611 O ALA A 41 56.131 -26.051 9.351 1.00 10.00 O ATOM 612 CB ALA A 41 56.802 -23.420 11.185 1.00 10.00 C ATOM 0 H ALA A 41 54.934 -22.079 10.198 1.00 10.00 H new ATOM 0 HA ALA A 41 56.972 -23.800 9.086 1.00 10.00 H new ATOM 0 HB1 ALA A 41 57.430 -24.258 11.487 1.00 10.00 H new ATOM 0 HB2 ALA A 41 57.409 -22.517 11.117 1.00 10.00 H new ATOM 0 HB3 ALA A 41 56.014 -23.273 11.924 1.00 10.00 H new ATOM 618 N ASN A 42 54.203 -25.198 10.122 1.00 10.00 N ATOM 619 CA ASN A 42 53.462 -26.435 9.853 1.00 10.00 C ATOM 620 C ASN A 42 53.398 -26.647 8.330 1.00 10.00 C ATOM 621 O ASN A 42 53.488 -27.775 7.843 1.00 10.00 O ATOM 622 CB ASN A 42 52.063 -26.428 10.499 1.00 10.00 C ATOM 623 CG ASN A 42 52.105 -26.591 12.011 1.00 10.00 C ATOM 624 OD1 ASN A 42 51.982 -27.688 12.539 1.00 10.00 O ATOM 625 ND2 ASN A 42 52.281 -25.530 12.764 1.00 10.00 N ATOM 0 H ASN A 42 53.662 -24.464 10.579 1.00 10.00 H new ATOM 0 HA ASN A 42 53.987 -27.274 10.310 1.00 10.00 H new ATOM 0 HB2 ASN A 42 51.560 -25.492 10.254 1.00 10.00 H new ATOM 0 HB3 ASN A 42 51.466 -27.232 10.069 1.00 10.00 H new ATOM 0 HD21 ASN A 42 52.314 -25.625 13.779 1.00 10.00 H new ATOM 0 HD22 ASN A 42 52.385 -24.611 12.334 1.00 10.00 H new ATOM 632 N LEU A 43 53.338 -25.542 7.579 1.00 10.00 N ATOM 633 CA LEU A 43 53.492 -25.516 6.145 1.00 10.00 C ATOM 634 C LEU A 43 54.928 -25.801 5.720 1.00 10.00 C ATOM 635 O LEU A 43 55.132 -26.549 4.790 1.00 10.00 O ATOM 636 CB LEU A 43 52.991 -24.159 5.609 1.00 10.00 C ATOM 637 CG LEU A 43 52.455 -24.289 4.195 1.00 10.00 C ATOM 638 CD1 LEU A 43 51.168 -25.086 4.264 1.00 10.00 C ATOM 639 CD2 LEU A 43 52.099 -22.957 3.559 1.00 10.00 C ATOM 0 H LEU A 43 53.175 -24.618 7.979 1.00 10.00 H new ATOM 0 HA LEU A 43 52.889 -26.313 5.710 1.00 10.00 H new ATOM 0 HB2 LEU A 43 52.209 -23.774 6.263 1.00 10.00 H new ATOM 0 HB3 LEU A 43 53.806 -23.435 5.626 1.00 10.00 H new ATOM 0 HG LEU A 43 53.237 -24.757 3.597 1.00 10.00 H new ATOM 0 HD11 LEU A 43 50.755 -25.198 3.261 1.00 10.00 H new ATOM 0 HD12 LEU A 43 51.372 -26.071 4.685 1.00 10.00 H new ATOM 0 HD13 LEU A 43 50.450 -24.563 4.896 1.00 10.00 H new ATOM 0 HD21 LEU A 43 51.723 -23.125 2.550 1.00 10.00 H new ATOM 0 HD22 LEU A 43 51.332 -22.463 4.155 1.00 10.00 H new ATOM 0 HD23 LEU A 43 52.987 -22.326 3.515 1.00 10.00 H new ATOM 651 N THR A 44 55.949 -25.320 6.415 1.00 10.00 N ATOM 652 CA THR A 44 57.348 -25.586 6.042 1.00 10.00 C ATOM 653 C THR A 44 57.659 -27.082 6.095 1.00 10.00 C ATOM 654 O THR A 44 58.381 -27.613 5.247 1.00 10.00 O ATOM 655 CB THR A 44 58.337 -24.828 6.930 1.00 10.00 C ATOM 656 OG1 THR A 44 58.290 -23.447 6.652 1.00 10.00 O ATOM 657 CG2 THR A 44 59.763 -25.292 6.692 1.00 10.00 C ATOM 0 H THR A 44 55.843 -24.739 7.247 1.00 10.00 H new ATOM 0 HA THR A 44 57.467 -25.230 5.019 1.00 10.00 H new ATOM 0 HB THR A 44 58.050 -25.026 7.963 1.00 10.00 H new ATOM 0 HG1 THR A 44 57.435 -23.080 6.961 1.00 10.00 H new ATOM 0 HG21 THR A 44 60.440 -24.734 7.338 1.00 10.00 H new ATOM 0 HG22 THR A 44 59.842 -26.356 6.917 1.00 10.00 H new ATOM 0 HG23 THR A 44 60.032 -25.120 5.650 1.00 10.00 H new ATOM 665 N LYS A 45 57.087 -27.771 7.085 1.00 10.00 N ATOM 666 CA LYS A 45 57.176 -29.230 7.219 1.00 10.00 C ATOM 667 C LYS A 45 56.566 -29.991 6.034 1.00 10.00 C ATOM 668 O LYS A 45 57.074 -31.056 5.675 1.00 10.00 O ATOM 669 CB LYS A 45 56.548 -29.643 8.552 1.00 10.00 C ATOM 670 CG LYS A 45 57.397 -29.247 9.767 1.00 10.00 C ATOM 671 CD LYS A 45 56.726 -29.709 11.067 1.00 10.00 C ATOM 672 CE LYS A 45 57.605 -29.322 12.261 1.00 10.00 C ATOM 673 NZ LYS A 45 56.978 -29.708 13.553 1.00 10.00 N ATOM 0 H LYS A 45 56.543 -27.328 7.825 1.00 10.00 H new ATOM 0 HA LYS A 45 58.230 -29.507 7.210 1.00 10.00 H new ATOM 0 HB2 LYS A 45 55.563 -29.185 8.640 1.00 10.00 H new ATOM 0 HB3 LYS A 45 56.399 -30.723 8.557 1.00 10.00 H new ATOM 0 HG2 LYS A 45 58.389 -29.692 9.685 1.00 10.00 H new ATOM 0 HG3 LYS A 45 57.533 -28.166 9.786 1.00 10.00 H new ATOM 0 HD2 LYS A 45 55.741 -29.251 11.163 1.00 10.00 H new ATOM 0 HD3 LYS A 45 56.575 -30.788 11.047 1.00 10.00 H new ATOM 0 HE2 LYS A 45 58.577 -29.806 12.169 1.00 10.00 H new ATOM 0 HE3 LYS A 45 57.782 -28.247 12.249 1.00 10.00 H new ATOM 0 HZ1 LYS A 45 57.601 -29.430 14.338 1.00 10.00 H new ATOM 0 HZ2 LYS A 45 56.062 -29.226 13.652 1.00 10.00 H new ATOM 0 HZ3 LYS A 45 56.832 -30.738 13.574 1.00 10.00 H new ATOM 687 N ASN A 46 55.532 -29.439 5.398 1.00 10.00 N ATOM 688 CA ASN A 46 54.934 -29.933 4.169 1.00 10.00 C ATOM 689 C ASN A 46 54.273 -28.793 3.360 1.00 10.00 C ATOM 690 O ASN A 46 53.080 -28.548 3.545 1.00 10.00 O ATOM 691 CB ASN A 46 53.995 -31.072 4.553 1.00 10.00 C ATOM 692 CG ASN A 46 53.649 -31.956 3.358 1.00 10.00 C ATOM 693 OD1 ASN A 46 52.975 -31.452 2.349 1.00 10.00 O flip ATOM 694 ND2 ASN A 46 54.035 -33.114 3.289 1.00 10.00 N flip ATOM 0 H ASN A 46 55.072 -28.598 5.746 1.00 10.00 H new ATOM 0 HA ASN A 46 55.686 -30.326 3.485 1.00 10.00 H new ATOM 0 HB2 ASN A 46 54.460 -31.679 5.330 1.00 10.00 H new ATOM 0 HB3 ASN A 46 53.079 -30.660 4.976 1.00 10.00 H new ATOM 0 HD21 ASN A 46 54.560 -33.524 4.062 1.00 10.00 H new ATOM 0 HD22 ASN A 46 53.832 -33.671 2.459 1.00 10.00 H new ATOM 701 N PRO A 47 55.026 -28.078 2.492 1.00 10.00 N ATOM 702 CA PRO A 47 54.595 -26.836 1.834 1.00 10.00 C ATOM 703 C PRO A 47 53.200 -26.764 1.218 1.00 10.00 C ATOM 704 O PRO A 47 52.628 -25.676 1.187 1.00 10.00 O ATOM 705 CB PRO A 47 55.684 -26.523 0.829 1.00 10.00 C ATOM 706 CG PRO A 47 56.948 -26.982 1.552 1.00 10.00 C ATOM 707 CD PRO A 47 56.479 -28.186 2.371 1.00 10.00 C ATOM 0 HA PRO A 47 54.471 -26.089 2.617 1.00 10.00 H new ATOM 0 HB2 PRO A 47 55.536 -27.059 -0.109 1.00 10.00 H new ATOM 0 HB3 PRO A 47 55.719 -25.461 0.587 1.00 10.00 H new ATOM 0 HG2 PRO A 47 57.734 -27.257 0.849 1.00 10.00 H new ATOM 0 HG3 PRO A 47 57.352 -26.196 2.190 1.00 10.00 H new ATOM 0 HD2 PRO A 47 56.757 -29.119 1.880 1.00 10.00 H new ATOM 0 HD3 PRO A 47 56.949 -28.191 3.354 1.00 10.00 H new ATOM 715 N SER A 48 52.616 -27.881 0.780 1.00 10.00 N ATOM 716 CA SER A 48 51.241 -27.943 0.319 1.00 10.00 C ATOM 717 C SER A 48 50.376 -29.020 0.972 1.00 10.00 C ATOM 718 O SER A 48 49.432 -29.541 0.376 1.00 10.00 O ATOM 719 CB SER A 48 51.266 -27.941 -1.195 1.00 10.00 C ATOM 720 OG SER A 48 51.848 -29.132 -1.712 1.00 10.00 O ATOM 0 H SER A 48 53.099 -28.778 0.738 1.00 10.00 H new ATOM 0 HA SER A 48 50.707 -27.056 0.661 1.00 10.00 H new ATOM 0 HB2 SER A 48 50.250 -27.837 -1.576 1.00 10.00 H new ATOM 0 HB3 SER A 48 51.829 -27.077 -1.549 1.00 10.00 H new ATOM 0 HG SER A 48 51.847 -29.098 -2.691 1.00 10.00 H new ATOM 726 N ASP A 49 50.702 -29.347 2.228 1.00 10.00 N ATOM 727 CA ASP A 49 49.831 -30.160 3.089 1.00 10.00 C ATOM 728 C ASP A 49 48.532 -29.351 3.229 1.00 10.00 C ATOM 729 O ASP A 49 48.579 -28.181 3.609 1.00 10.00 O ATOM 730 CB ASP A 49 50.508 -30.481 4.431 1.00 10.00 C ATOM 731 CG ASP A 49 49.562 -31.045 5.513 1.00 10.00 C ATOM 732 OD1 ASP A 49 48.543 -30.402 5.854 1.00 10.00 O ATOM 733 OD2 ASP A 49 49.838 -32.158 6.021 1.00 10.00 O ATOM 0 H ASP A 49 51.572 -29.058 2.675 1.00 10.00 H new ATOM 0 HA ASP A 49 49.620 -31.141 2.663 1.00 10.00 H new ATOM 0 HB2 ASP A 49 51.308 -31.201 4.256 1.00 10.00 H new ATOM 0 HB3 ASP A 49 50.975 -29.573 4.813 1.00 10.00 H new ATOM 738 N PRO A 50 47.369 -29.917 2.889 1.00 10.00 N ATOM 739 CA PRO A 50 46.152 -29.138 2.769 1.00 10.00 C ATOM 740 C PRO A 50 45.573 -28.615 4.075 1.00 10.00 C ATOM 741 O PRO A 50 44.919 -27.582 4.043 1.00 10.00 O ATOM 742 CB PRO A 50 45.171 -30.048 2.057 1.00 10.00 C ATOM 743 CG PRO A 50 45.643 -31.464 2.398 1.00 10.00 C ATOM 744 CD PRO A 50 47.153 -31.307 2.548 1.00 10.00 C ATOM 0 HA PRO A 50 46.370 -28.220 2.224 1.00 10.00 H new ATOM 0 HB2 PRO A 50 44.151 -29.877 2.400 1.00 10.00 H new ATOM 0 HB3 PRO A 50 45.179 -29.876 0.981 1.00 10.00 H new ATOM 0 HG2 PRO A 50 45.184 -31.830 3.316 1.00 10.00 H new ATOM 0 HG3 PRO A 50 45.389 -32.173 1.610 1.00 10.00 H new ATOM 0 HD2 PRO A 50 47.540 -31.966 3.325 1.00 10.00 H new ATOM 0 HD3 PRO A 50 47.668 -31.568 1.623 1.00 10.00 H new ATOM 752 N THR A 51 45.815 -29.258 5.217 1.00 10.00 N ATOM 753 CA THR A 51 45.452 -28.701 6.533 1.00 10.00 C ATOM 754 C THR A 51 46.445 -27.637 6.960 1.00 10.00 C ATOM 755 O THR A 51 46.019 -26.604 7.455 1.00 10.00 O ATOM 756 CB THR A 51 45.408 -29.811 7.577 1.00 10.00 C ATOM 757 OG1 THR A 51 44.219 -30.564 7.435 1.00 10.00 O ATOM 758 CG2 THR A 51 45.481 -29.312 9.018 1.00 10.00 C ATOM 0 H THR A 51 46.264 -30.173 5.264 1.00 10.00 H new ATOM 0 HA THR A 51 44.466 -28.244 6.450 1.00 10.00 H new ATOM 0 HB THR A 51 46.295 -30.418 7.393 1.00 10.00 H new ATOM 0 HG1 THR A 51 44.200 -31.276 8.108 1.00 10.00 H new ATOM 0 HG21 THR A 51 45.444 -30.162 9.700 1.00 10.00 H new ATOM 0 HG22 THR A 51 46.413 -28.767 9.168 1.00 10.00 H new ATOM 0 HG23 THR A 51 44.638 -28.650 9.217 1.00 10.00 H new ATOM 766 N ALA A 52 47.744 -27.827 6.743 1.00 10.00 N ATOM 767 CA ALA A 52 48.746 -26.782 6.933 1.00 10.00 C ATOM 768 C ALA A 52 48.436 -25.542 6.101 1.00 10.00 C ATOM 769 O ALA A 52 48.539 -24.418 6.591 1.00 10.00 O ATOM 770 CB ALA A 52 50.105 -27.401 6.575 1.00 10.00 C ATOM 0 H ALA A 52 48.133 -28.716 6.428 1.00 10.00 H new ATOM 0 HA ALA A 52 48.751 -26.434 7.966 1.00 10.00 H new ATOM 0 HB1 ALA A 52 50.889 -26.655 6.702 1.00 10.00 H new ATOM 0 HB2 ALA A 52 50.302 -28.250 7.230 1.00 10.00 H new ATOM 0 HB3 ALA A 52 50.089 -27.738 5.539 1.00 10.00 H new ATOM 776 N LEU A 53 48.014 -25.744 4.860 1.00 10.00 N ATOM 777 CA LEU A 53 47.723 -24.676 3.919 1.00 10.00 C ATOM 778 C LEU A 53 46.347 -24.065 4.194 1.00 10.00 C ATOM 779 O LEU A 53 46.200 -22.851 4.121 1.00 10.00 O ATOM 780 CB LEU A 53 47.913 -25.270 2.517 1.00 10.00 C ATOM 781 CG LEU A 53 48.143 -24.308 1.340 1.00 10.00 C ATOM 782 CD1 LEU A 53 48.702 -22.950 1.728 1.00 10.00 C ATOM 783 CD2 LEU A 53 49.185 -24.961 0.435 1.00 10.00 C ATOM 0 H LEU A 53 47.862 -26.676 4.473 1.00 10.00 H new ATOM 0 HA LEU A 53 48.399 -23.827 4.020 1.00 10.00 H new ATOM 0 HB2 LEU A 53 48.761 -25.953 2.558 1.00 10.00 H new ATOM 0 HB3 LEU A 53 47.032 -25.870 2.288 1.00 10.00 H new ATOM 0 HG LEU A 53 47.171 -24.136 0.878 1.00 10.00 H new ATOM 0 HD11 LEU A 53 48.831 -22.340 0.834 1.00 10.00 H new ATOM 0 HD12 LEU A 53 48.011 -22.453 2.409 1.00 10.00 H new ATOM 0 HD13 LEU A 53 49.666 -23.080 2.220 1.00 10.00 H new ATOM 0 HD21 LEU A 53 49.383 -24.313 -0.419 1.00 10.00 H new ATOM 0 HD22 LEU A 53 50.107 -25.115 0.995 1.00 10.00 H new ATOM 0 HD23 LEU A 53 48.810 -25.922 0.082 1.00 10.00 H new ATOM 795 N ALA A 54 45.369 -24.868 4.619 1.00 10.00 N ATOM 796 CA ALA A 54 44.090 -24.389 5.134 1.00 10.00 C ATOM 797 C ALA A 54 44.288 -23.547 6.401 1.00 10.00 C ATOM 798 O ALA A 54 43.674 -22.493 6.556 1.00 10.00 O ATOM 799 CB ALA A 54 43.187 -25.595 5.440 1.00 10.00 C ATOM 0 H ALA A 54 45.447 -25.885 4.614 1.00 10.00 H new ATOM 0 HA ALA A 54 43.621 -23.757 4.380 1.00 10.00 H new ATOM 0 HB1 ALA A 54 42.230 -25.244 5.825 1.00 10.00 H new ATOM 0 HB2 ALA A 54 43.023 -26.168 4.527 1.00 10.00 H new ATOM 0 HB3 ALA A 54 43.667 -26.229 6.185 1.00 10.00 H new ATOM 805 N ASN A 55 45.183 -23.992 7.283 1.00 10.00 N ATOM 806 CA ASN A 55 45.540 -23.335 8.530 1.00 10.00 C ATOM 807 C ASN A 55 46.215 -21.992 8.263 1.00 10.00 C ATOM 808 O ASN A 55 45.750 -20.956 8.729 1.00 10.00 O ATOM 809 CB ASN A 55 46.456 -24.286 9.314 1.00 10.00 C ATOM 810 CG ASN A 55 47.044 -23.715 10.576 1.00 10.00 C ATOM 811 OD1 ASN A 55 46.350 -23.341 11.508 1.00 10.00 O ATOM 812 ND2 ASN A 55 48.354 -23.676 10.639 1.00 10.00 N ATOM 0 H ASN A 55 45.699 -24.859 7.136 1.00 10.00 H new ATOM 0 HA ASN A 55 44.647 -23.120 9.117 1.00 10.00 H new ATOM 0 HB2 ASN A 55 45.890 -25.182 9.569 1.00 10.00 H new ATOM 0 HB3 ASN A 55 47.271 -24.599 8.662 1.00 10.00 H new ATOM 0 HD21 ASN A 55 48.814 -23.328 11.480 1.00 10.00 H new ATOM 0 HD22 ASN A 55 48.912 -23.994 9.847 1.00 10.00 H new ATOM 819 N TYR A 56 47.268 -22.004 7.446 1.00 10.00 N ATOM 820 CA TYR A 56 47.914 -20.784 6.950 1.00 10.00 C ATOM 821 C TYR A 56 46.939 -19.849 6.246 1.00 10.00 C ATOM 822 O TYR A 56 46.905 -18.682 6.602 1.00 10.00 O ATOM 823 CB TYR A 56 49.126 -21.183 6.098 1.00 10.00 C ATOM 824 CG TYR A 56 49.944 -20.126 5.378 1.00 10.00 C ATOM 825 CD1 TYR A 56 50.905 -19.378 6.087 1.00 10.00 C ATOM 826 CD2 TYR A 56 49.912 -20.061 3.970 1.00 10.00 C ATOM 827 CE1 TYR A 56 51.864 -18.616 5.395 1.00 10.00 C ATOM 828 CE2 TYR A 56 50.875 -19.306 3.272 1.00 10.00 C ATOM 829 CZ TYR A 56 51.876 -18.609 3.985 1.00 10.00 C ATOM 830 OH TYR A 56 52.850 -17.921 3.327 1.00 10.00 O ATOM 0 H TYR A 56 47.701 -22.863 7.107 1.00 10.00 H new ATOM 0 HA TYR A 56 48.274 -20.192 7.791 1.00 10.00 H new ATOM 0 HB2 TYR A 56 49.809 -21.731 6.747 1.00 10.00 H new ATOM 0 HB3 TYR A 56 48.771 -21.885 5.343 1.00 10.00 H new ATOM 0 HD1 TYR A 56 50.905 -19.390 7.167 1.00 10.00 H new ATOM 0 HD2 TYR A 56 49.146 -20.592 3.424 1.00 10.00 H new ATOM 0 HE1 TYR A 56 52.591 -18.036 5.944 1.00 10.00 H new ATOM 0 HE2 TYR A 56 50.848 -19.260 2.193 1.00 10.00 H new ATOM 0 HH TYR A 56 52.721 -18.015 2.360 1.00 10.00 H new ATOM 840 N GLN A 57 46.063 -20.326 5.365 1.00 10.00 N ATOM 841 CA GLN A 57 45.071 -19.466 4.703 1.00 10.00 C ATOM 842 C GLN A 57 44.030 -18.888 5.683 1.00 10.00 C ATOM 843 O GLN A 57 43.652 -17.723 5.556 1.00 10.00 O ATOM 844 CB GLN A 57 44.386 -20.215 3.548 1.00 10.00 C ATOM 845 CG GLN A 57 45.294 -20.330 2.310 1.00 10.00 C ATOM 846 CD GLN A 57 45.509 -18.988 1.608 1.00 10.00 C ATOM 847 OE1 GLN A 57 44.599 -18.398 1.038 1.00 10.00 O ATOM 848 NE2 GLN A 57 46.709 -18.446 1.617 1.00 10.00 N ATOM 0 H GLN A 57 46.016 -21.307 5.089 1.00 10.00 H new ATOM 0 HA GLN A 57 45.615 -18.615 4.294 1.00 10.00 H new ATOM 0 HB2 GLN A 57 44.102 -21.213 3.882 1.00 10.00 H new ATOM 0 HB3 GLN A 57 43.467 -19.696 3.275 1.00 10.00 H new ATOM 0 HG2 GLN A 57 46.260 -20.737 2.610 1.00 10.00 H new ATOM 0 HG3 GLN A 57 44.854 -21.037 1.606 1.00 10.00 H new ATOM 0 HE21 GLN A 57 47.480 -18.921 2.086 1.00 10.00 H new ATOM 0 HE22 GLN A 57 46.868 -17.551 1.155 1.00 10.00 H new ATOM 857 N MET A 58 43.597 -19.655 6.689 1.00 10.00 N ATOM 858 CA MET A 58 42.666 -19.208 7.734 1.00 10.00 C ATOM 859 C MET A 58 43.292 -18.163 8.660 1.00 10.00 C ATOM 860 O MET A 58 42.711 -17.100 8.886 1.00 10.00 O ATOM 861 CB MET A 58 42.198 -20.436 8.529 1.00 10.00 C ATOM 862 CG MET A 58 41.263 -20.103 9.698 1.00 10.00 C ATOM 863 SD MET A 58 40.798 -21.527 10.725 1.00 10.00 S ATOM 864 CE MET A 58 42.387 -21.882 11.535 1.00 10.00 C ATOM 0 H MET A 58 43.890 -20.625 6.803 1.00 10.00 H new ATOM 0 HA MET A 58 41.814 -18.722 7.259 1.00 10.00 H new ATOM 0 HB2 MET A 58 41.687 -21.121 7.852 1.00 10.00 H new ATOM 0 HB3 MET A 58 43.072 -20.961 8.914 1.00 10.00 H new ATOM 0 HG2 MET A 58 41.745 -19.358 10.331 1.00 10.00 H new ATOM 0 HG3 MET A 58 40.356 -19.646 9.302 1.00 10.00 H new ATOM 0 HE1 MET A 58 42.230 -22.586 12.352 1.00 10.00 H new ATOM 0 HE2 MET A 58 43.076 -22.316 10.810 1.00 10.00 H new ATOM 0 HE3 MET A 58 42.809 -20.957 11.929 1.00 10.00 H new ATOM 874 N ILE A 59 44.495 -18.430 9.166 1.00 10.00 N ATOM 875 CA ILE A 59 45.237 -17.504 10.008 1.00 10.00 C ATOM 876 C ILE A 59 45.633 -16.271 9.194 1.00 10.00 C ATOM 877 O ILE A 59 45.596 -15.166 9.719 1.00 10.00 O ATOM 878 CB ILE A 59 46.439 -18.245 10.617 1.00 10.00 C ATOM 879 CG1 ILE A 59 45.973 -19.363 11.580 1.00 10.00 C ATOM 880 CG2 ILE A 59 47.344 -17.298 11.404 1.00 10.00 C ATOM 881 CD1 ILE A 59 47.131 -20.241 12.051 1.00 10.00 C ATOM 0 H ILE A 59 44.985 -19.309 8.998 1.00 10.00 H new ATOM 0 HA ILE A 59 44.624 -17.143 10.834 1.00 10.00 H new ATOM 0 HB ILE A 59 46.992 -18.673 9.781 1.00 10.00 H new ATOM 0 HG12 ILE A 59 45.485 -18.914 12.445 1.00 10.00 H new ATOM 0 HG13 ILE A 59 45.229 -19.984 11.080 1.00 10.00 H new ATOM 0 HG21 ILE A 59 48.182 -17.857 11.819 1.00 10.00 H new ATOM 0 HG22 ILE A 59 47.720 -16.519 10.741 1.00 10.00 H new ATOM 0 HG23 ILE A 59 46.776 -16.841 12.214 1.00 10.00 H new ATOM 0 HD11 ILE A 59 46.754 -21.011 12.724 1.00 10.00 H new ATOM 0 HD12 ILE A 59 47.604 -20.713 11.190 1.00 10.00 H new ATOM 0 HD13 ILE A 59 47.863 -19.627 12.576 1.00 10.00 H new ATOM 893 N MET A 60 45.939 -16.422 7.903 1.00 10.00 N ATOM 894 CA MET A 60 46.238 -15.303 7.009 1.00 10.00 C ATOM 895 C MET A 60 45.018 -14.426 6.722 1.00 10.00 C ATOM 896 O MET A 60 45.143 -13.206 6.635 1.00 10.00 O ATOM 897 CB MET A 60 46.855 -15.798 5.703 1.00 10.00 C ATOM 898 CG MET A 60 47.631 -14.673 5.032 1.00 10.00 C ATOM 899 SD MET A 60 48.634 -15.221 3.632 1.00 10.00 S ATOM 900 CE MET A 60 49.921 -16.053 4.597 1.00 10.00 C ATOM 0 H MET A 60 45.986 -17.333 7.446 1.00 10.00 H new ATOM 0 HA MET A 60 46.962 -14.678 7.532 1.00 10.00 H new ATOM 0 HB2 MET A 60 47.518 -16.640 5.901 1.00 10.00 H new ATOM 0 HB3 MET A 60 46.072 -16.159 5.036 1.00 10.00 H new ATOM 0 HG2 MET A 60 46.929 -13.912 4.690 1.00 10.00 H new ATOM 0 HG3 MET A 60 48.279 -14.200 5.770 1.00 10.00 H new ATOM 0 HE1 MET A 60 50.846 -16.082 4.021 1.00 10.00 H new ATOM 0 HE2 MET A 60 50.089 -15.508 5.526 1.00 10.00 H new ATOM 0 HE3 MET A 60 49.604 -17.070 4.826 1.00 10.00 H new ATOM 910 N SER A 61 43.831 -15.029 6.630 1.00 10.00 N ATOM 911 CA SER A 61 42.557 -14.307 6.547 1.00 10.00 C ATOM 912 C SER A 61 42.332 -13.436 7.790 1.00 10.00 C ATOM 913 O SER A 61 41.968 -12.266 7.664 1.00 10.00 O ATOM 914 CB SER A 61 41.388 -15.285 6.345 1.00 10.00 C ATOM 915 OG SER A 61 41.486 -15.923 5.083 1.00 10.00 O ATOM 0 H SER A 61 43.725 -16.043 6.611 1.00 10.00 H new ATOM 0 HA SER A 61 42.602 -13.647 5.681 1.00 10.00 H new ATOM 0 HB2 SER A 61 41.391 -16.033 7.138 1.00 10.00 H new ATOM 0 HB3 SER A 61 40.442 -14.749 6.415 1.00 10.00 H new ATOM 0 HG SER A 61 42.211 -16.582 5.105 1.00 10.00 H new ATOM 921 N GLU A 62 42.627 -13.957 8.986 1.00 10.00 N ATOM 922 CA GLU A 62 42.589 -13.181 10.237 1.00 10.00 C ATOM 923 C GLU A 62 43.711 -12.136 10.338 1.00 10.00 C ATOM 924 O GLU A 62 43.455 -10.995 10.722 1.00 10.00 O ATOM 925 CB GLU A 62 42.627 -14.123 11.454 1.00 10.00 C ATOM 926 CG GLU A 62 41.334 -14.937 11.587 1.00 10.00 C ATOM 927 CD GLU A 62 41.318 -15.746 12.898 1.00 10.00 C ATOM 928 OE1 GLU A 62 41.893 -16.860 12.941 1.00 10.00 O ATOM 929 OE2 GLU A 62 40.719 -15.275 13.897 1.00 10.00 O ATOM 0 H GLU A 62 42.900 -14.931 9.117 1.00 10.00 H new ATOM 0 HA GLU A 62 41.649 -12.629 10.229 1.00 10.00 H new ATOM 0 HB2 GLU A 62 43.475 -14.801 11.362 1.00 10.00 H new ATOM 0 HB3 GLU A 62 42.783 -13.539 12.361 1.00 10.00 H new ATOM 0 HG2 GLU A 62 40.475 -14.267 11.559 1.00 10.00 H new ATOM 0 HG3 GLU A 62 41.238 -15.614 10.738 1.00 10.00 H new ATOM 936 N TYR A 63 44.933 -12.496 9.941 1.00 10.00 N ATOM 937 CA TYR A 63 46.105 -11.618 9.889 1.00 10.00 C ATOM 938 C TYR A 63 45.837 -10.387 9.031 1.00 10.00 C ATOM 939 O TYR A 63 45.995 -9.253 9.485 1.00 10.00 O ATOM 940 CB TYR A 63 47.308 -12.416 9.357 1.00 10.00 C ATOM 941 CG TYR A 63 48.574 -11.632 9.075 1.00 10.00 C ATOM 942 CD1 TYR A 63 49.483 -11.336 10.111 1.00 10.00 C ATOM 943 CD2 TYR A 63 48.902 -11.326 7.740 1.00 10.00 C ATOM 944 CE1 TYR A 63 50.729 -10.752 9.804 1.00 10.00 C ATOM 945 CE2 TYR A 63 50.148 -10.755 7.430 1.00 10.00 C ATOM 946 CZ TYR A 63 51.071 -10.472 8.460 1.00 10.00 C ATOM 947 OH TYR A 63 52.283 -9.936 8.152 1.00 10.00 O ATOM 0 H TYR A 63 45.142 -13.446 9.634 1.00 10.00 H new ATOM 0 HA TYR A 63 46.328 -11.261 10.894 1.00 10.00 H new ATOM 0 HB2 TYR A 63 47.545 -13.196 10.080 1.00 10.00 H new ATOM 0 HB3 TYR A 63 47.005 -12.915 8.437 1.00 10.00 H new ATOM 0 HD1 TYR A 63 49.226 -11.556 11.137 1.00 10.00 H new ATOM 0 HD2 TYR A 63 48.193 -11.531 6.951 1.00 10.00 H new ATOM 0 HE1 TYR A 63 51.424 -10.518 10.597 1.00 10.00 H new ATOM 0 HE2 TYR A 63 50.400 -10.533 6.404 1.00 10.00 H new ATOM 0 HH TYR A 63 52.348 -9.811 7.182 1.00 10.00 H new ATOM 957 N ASN A 64 45.376 -10.606 7.803 1.00 10.00 N ATOM 958 CA ASN A 64 45.183 -9.534 6.837 1.00 10.00 C ATOM 959 C ASN A 64 44.021 -8.609 7.248 1.00 10.00 C ATOM 960 O ASN A 64 44.133 -7.386 7.145 1.00 10.00 O ATOM 961 CB ASN A 64 44.970 -10.152 5.446 1.00 10.00 C ATOM 962 CG ASN A 64 44.795 -9.091 4.371 1.00 10.00 C ATOM 963 OD1 ASN A 64 43.695 -8.806 3.921 1.00 10.00 O ATOM 964 ND2 ASN A 64 45.865 -8.465 3.935 1.00 10.00 N ATOM 0 H ASN A 64 45.127 -11.531 7.452 1.00 10.00 H new ATOM 0 HA ASN A 64 46.072 -8.904 6.808 1.00 10.00 H new ATOM 0 HB2 ASN A 64 45.822 -10.784 5.196 1.00 10.00 H new ATOM 0 HB3 ASN A 64 44.091 -10.796 5.466 1.00 10.00 H new ATOM 0 HD21 ASN A 64 45.777 -7.742 3.221 1.00 10.00 H new ATOM 0 HD22 ASN A 64 46.783 -8.703 4.310 1.00 10.00 H new ATOM 971 N LEU A 65 42.931 -9.185 7.772 1.00 10.00 N ATOM 972 CA LEU A 65 41.777 -8.441 8.290 1.00 10.00 C ATOM 973 C LEU A 65 42.137 -7.587 9.512 1.00 10.00 C ATOM 974 O LEU A 65 41.796 -6.406 9.558 1.00 10.00 O ATOM 975 CB LEU A 65 40.632 -9.425 8.604 1.00 10.00 C ATOM 976 CG LEU A 65 39.365 -8.775 9.200 1.00 10.00 C ATOM 977 CD1 LEU A 65 38.747 -7.720 8.278 1.00 10.00 C ATOM 978 CD2 LEU A 65 38.313 -9.850 9.474 1.00 10.00 C ATOM 0 H LEU A 65 42.825 -10.197 7.849 1.00 10.00 H new ATOM 0 HA LEU A 65 41.446 -7.743 7.521 1.00 10.00 H new ATOM 0 HB2 LEU A 65 40.359 -9.947 7.687 1.00 10.00 H new ATOM 0 HB3 LEU A 65 41.000 -10.178 9.301 1.00 10.00 H new ATOM 0 HG LEU A 65 39.673 -8.280 10.121 1.00 10.00 H new ATOM 0 HD11 LEU A 65 37.860 -7.299 8.751 1.00 10.00 H new ATOM 0 HD12 LEU A 65 39.472 -6.927 8.095 1.00 10.00 H new ATOM 0 HD13 LEU A 65 38.469 -8.183 7.331 1.00 10.00 H new ATOM 0 HD21 LEU A 65 37.420 -9.387 9.895 1.00 10.00 H new ATOM 0 HD22 LEU A 65 38.056 -10.353 8.542 1.00 10.00 H new ATOM 0 HD23 LEU A 65 38.712 -10.577 10.181 1.00 10.00 H new ATOM 990 N TYR A 66 42.856 -8.153 10.483 1.00 10.00 N ATOM 991 CA TYR A 66 43.292 -7.407 11.667 1.00 10.00 C ATOM 992 C TYR A 66 44.283 -6.291 11.314 1.00 10.00 C ATOM 993 O TYR A 66 44.164 -5.181 11.833 1.00 10.00 O ATOM 994 CB TYR A 66 43.860 -8.353 12.734 1.00 10.00 C ATOM 995 CG TYR A 66 44.398 -7.641 13.967 1.00 10.00 C ATOM 996 CD1 TYR A 66 43.610 -6.687 14.648 1.00 10.00 C ATOM 997 CD2 TYR A 66 45.711 -7.899 14.408 1.00 10.00 C ATOM 998 CE1 TYR A 66 44.151 -5.961 15.729 1.00 10.00 C ATOM 999 CE2 TYR A 66 46.240 -7.202 15.510 1.00 10.00 C ATOM 1000 CZ TYR A 66 45.470 -6.215 16.160 1.00 10.00 C ATOM 1001 OH TYR A 66 45.996 -5.500 17.190 1.00 10.00 O ATOM 0 H TYR A 66 43.150 -9.130 10.473 1.00 10.00 H new ATOM 0 HA TYR A 66 42.412 -6.920 12.087 1.00 10.00 H new ATOM 0 HB2 TYR A 66 43.080 -9.049 13.040 1.00 10.00 H new ATOM 0 HB3 TYR A 66 44.660 -8.946 12.291 1.00 10.00 H new ATOM 0 HD1 TYR A 66 42.590 -6.513 14.340 1.00 10.00 H new ATOM 0 HD2 TYR A 66 46.314 -8.635 13.898 1.00 10.00 H new ATOM 0 HE1 TYR A 66 43.555 -5.210 16.227 1.00 10.00 H new ATOM 0 HE2 TYR A 66 47.238 -7.423 15.859 1.00 10.00 H new ATOM 0 HH TYR A 66 46.939 -5.739 17.306 1.00 10.00 H new ATOM 1011 N ARG A 67 45.201 -6.525 10.368 1.00 10.00 N ATOM 1012 CA ARG A 67 46.085 -5.472 9.835 1.00 10.00 C ATOM 1013 C ARG A 67 45.309 -4.361 9.121 1.00 10.00 C ATOM 1014 O ARG A 67 45.590 -3.189 9.360 1.00 10.00 O ATOM 1015 CB ARG A 67 47.191 -6.070 8.950 1.00 10.00 C ATOM 1016 CG ARG A 67 48.215 -6.832 9.807 1.00 10.00 C ATOM 1017 CD ARG A 67 49.424 -7.309 8.994 1.00 10.00 C ATOM 1018 NE ARG A 67 50.498 -6.294 8.993 1.00 10.00 N ATOM 1019 CZ ARG A 67 51.435 -6.147 9.918 1.00 10.00 C ATOM 1020 NH1 ARG A 67 51.603 -6.997 10.888 1.00 10.00 N ATOM 1021 NH2 ARG A 67 52.226 -5.118 9.909 1.00 10.00 N ATOM 0 H ARG A 67 45.354 -7.443 9.950 1.00 10.00 H new ATOM 0 HA ARG A 67 46.570 -4.998 10.688 1.00 10.00 H new ATOM 0 HB2 ARG A 67 46.751 -6.743 8.214 1.00 10.00 H new ATOM 0 HB3 ARG A 67 47.691 -5.275 8.396 1.00 10.00 H new ATOM 0 HG2 ARG A 67 48.557 -6.187 10.617 1.00 10.00 H new ATOM 0 HG3 ARG A 67 47.729 -7.692 10.268 1.00 10.00 H new ATOM 0 HD2 ARG A 67 49.802 -8.242 9.412 1.00 10.00 H new ATOM 0 HD3 ARG A 67 49.117 -7.519 7.969 1.00 10.00 H new ATOM 0 HE ARG A 67 50.520 -5.645 8.206 1.00 10.00 H new ATOM 0 HH11 ARG A 67 51.000 -7.817 10.958 1.00 10.00 H new ATOM 0 HH12 ARG A 67 52.338 -6.844 11.579 1.00 10.00 H new ATOM 0 HH21 ARG A 67 52.131 -4.408 9.183 1.00 10.00 H new ATOM 0 HH22 ARG A 67 52.942 -5.019 10.628 1.00 10.00 H new ATOM 1035 N ASN A 68 44.282 -4.690 8.334 1.00 10.00 N ATOM 1036 CA ASN A 68 43.367 -3.697 7.753 1.00 10.00 C ATOM 1037 C ASN A 68 42.589 -2.900 8.810 1.00 10.00 C ATOM 1038 O ASN A 68 42.449 -1.681 8.683 1.00 10.00 O ATOM 1039 CB ASN A 68 42.446 -4.392 6.736 1.00 10.00 C ATOM 1040 CG ASN A 68 41.532 -3.407 6.026 1.00 10.00 C ATOM 1041 OD1 ASN A 68 40.353 -3.290 6.324 1.00 10.00 O ATOM 1042 ND2 ASN A 68 42.046 -2.658 5.074 1.00 10.00 N ATOM 0 H ASN A 68 44.059 -5.652 8.080 1.00 10.00 H new ATOM 0 HA ASN A 68 43.962 -2.947 7.232 1.00 10.00 H new ATOM 0 HB2 ASN A 68 43.052 -4.919 5.999 1.00 10.00 H new ATOM 0 HB3 ASN A 68 41.843 -5.142 7.247 1.00 10.00 H new ATOM 0 HD21 ASN A 68 41.460 -1.981 4.586 1.00 10.00 H new ATOM 0 HD22 ASN A 68 43.030 -2.755 4.824 1.00 10.00 H new ATOM 1049 N ALA A 69 42.150 -3.551 9.886 1.00 10.00 N ATOM 1050 CA ALA A 69 41.491 -2.871 10.995 1.00 10.00 C ATOM 1051 C ALA A 69 42.452 -1.969 11.800 1.00 10.00 C ATOM 1052 O ALA A 69 42.071 -0.872 12.209 1.00 10.00 O ATOM 1053 CB ALA A 69 40.805 -3.916 11.885 1.00 10.00 C ATOM 0 H ALA A 69 42.241 -4.559 10.012 1.00 10.00 H new ATOM 0 HA ALA A 69 40.739 -2.196 10.586 1.00 10.00 H new ATOM 0 HB1 ALA A 69 40.309 -3.416 12.717 1.00 10.00 H new ATOM 0 HB2 ALA A 69 40.067 -4.464 11.300 1.00 10.00 H new ATOM 0 HB3 ALA A 69 41.551 -4.611 12.271 1.00 10.00 H new ATOM 1059 N GLN A 70 43.712 -2.382 11.971 1.00 10.00 N ATOM 1060 CA GLN A 70 44.773 -1.571 12.574 1.00 10.00 C ATOM 1061 C GLN A 70 45.109 -0.340 11.711 1.00 10.00 C ATOM 1062 O GLN A 70 45.198 0.771 12.234 1.00 10.00 O ATOM 1063 CB GLN A 70 46.003 -2.467 12.818 1.00 10.00 C ATOM 1064 CG GLN A 70 47.086 -1.819 13.694 1.00 10.00 C ATOM 1065 CD GLN A 70 46.595 -1.486 15.104 1.00 10.00 C ATOM 1066 OE1 GLN A 70 46.457 -0.332 15.488 1.00 10.00 O ATOM 1067 NE2 GLN A 70 46.301 -2.468 15.931 1.00 10.00 N ATOM 0 H GLN A 70 44.029 -3.309 11.688 1.00 10.00 H new ATOM 0 HA GLN A 70 44.430 -1.176 13.530 1.00 10.00 H new ATOM 0 HB2 GLN A 70 45.676 -3.394 13.289 1.00 10.00 H new ATOM 0 HB3 GLN A 70 46.441 -2.735 11.856 1.00 10.00 H new ATOM 0 HG2 GLN A 70 47.941 -2.492 13.762 1.00 10.00 H new ATOM 0 HG3 GLN A 70 47.437 -0.906 13.212 1.00 10.00 H new ATOM 0 HE21 GLN A 70 46.409 -3.437 15.631 1.00 10.00 H new ATOM 0 HE22 GLN A 70 45.965 -2.260 16.871 1.00 10.00 H new ATOM 1076 N SER A 71 45.207 -0.490 10.385 1.00 10.00 N ATOM 1077 CA SER A 71 45.336 0.643 9.453 1.00 10.00 C ATOM 1078 C SER A 71 44.127 1.587 9.505 1.00 10.00 C ATOM 1079 O SER A 71 44.300 2.806 9.486 1.00 10.00 O ATOM 1080 CB SER A 71 45.537 0.152 8.015 1.00 10.00 C ATOM 1081 OG SER A 71 46.781 -0.521 7.896 1.00 10.00 O ATOM 0 H SER A 71 45.199 -1.400 9.925 1.00 10.00 H new ATOM 0 HA SER A 71 46.214 1.203 9.773 1.00 10.00 H new ATOM 0 HB2 SER A 71 44.724 -0.518 7.735 1.00 10.00 H new ATOM 0 HB3 SER A 71 45.505 0.997 7.327 1.00 10.00 H new ATOM 0 HG SER A 71 46.702 -1.423 8.272 1.00 10.00 H new ATOM 1087 N SER A 72 42.908 1.052 9.646 1.00 10.00 N ATOM 1088 CA SER A 72 41.686 1.850 9.845 1.00 10.00 C ATOM 1089 C SER A 72 41.706 2.628 11.169 1.00 10.00 C ATOM 1090 O SER A 72 41.290 3.789 11.206 1.00 10.00 O ATOM 1091 CB SER A 72 40.430 0.970 9.789 1.00 10.00 C ATOM 1092 OG SER A 72 40.317 0.318 8.533 1.00 10.00 O ATOM 0 H SER A 72 42.738 0.046 9.625 1.00 10.00 H new ATOM 0 HA SER A 72 41.657 2.570 9.028 1.00 10.00 H new ATOM 0 HB2 SER A 72 40.467 0.227 10.586 1.00 10.00 H new ATOM 0 HB3 SER A 72 39.545 1.582 9.965 1.00 10.00 H new ATOM 0 HG SER A 72 40.996 -0.385 8.467 1.00 10.00 H new ATOM 1098 N ALA A 73 42.247 2.036 12.241 1.00 10.00 N ATOM 1099 CA ALA A 73 42.460 2.721 13.516 1.00 10.00 C ATOM 1100 C ALA A 73 43.482 3.863 13.400 1.00 10.00 C ATOM 1101 O ALA A 73 43.221 4.977 13.849 1.00 10.00 O ATOM 1102 CB ALA A 73 42.865 1.701 14.590 1.00 10.00 C ATOM 0 H ALA A 73 42.550 1.062 12.245 1.00 10.00 H new ATOM 0 HA ALA A 73 41.521 3.188 13.813 1.00 10.00 H new ATOM 0 HB1 ALA A 73 43.023 2.215 15.538 1.00 10.00 H new ATOM 0 HB2 ALA A 73 42.073 0.961 14.706 1.00 10.00 H new ATOM 0 HB3 ALA A 73 43.787 1.203 14.289 1.00 10.00 H new ATOM 1108 N VAL A 74 44.612 3.630 12.728 1.00 10.00 N ATOM 1109 CA VAL A 74 45.650 4.629 12.450 1.00 10.00 C ATOM 1110 C VAL A 74 45.110 5.788 11.596 1.00 10.00 C ATOM 1111 O VAL A 74 45.361 6.951 11.916 1.00 10.00 O ATOM 1112 CB VAL A 74 46.850 3.906 11.806 1.00 10.00 C ATOM 1113 CG1 VAL A 74 47.841 4.858 11.150 1.00 10.00 C ATOM 1114 CG2 VAL A 74 47.612 3.091 12.860 1.00 10.00 C ATOM 0 H VAL A 74 44.838 2.710 12.349 1.00 10.00 H new ATOM 0 HA VAL A 74 45.982 5.097 13.377 1.00 10.00 H new ATOM 0 HB VAL A 74 46.428 3.262 11.035 1.00 10.00 H new ATOM 0 HG11 VAL A 74 48.662 4.287 10.716 1.00 10.00 H new ATOM 0 HG12 VAL A 74 47.338 5.423 10.366 1.00 10.00 H new ATOM 0 HG13 VAL A 74 48.234 5.546 11.898 1.00 10.00 H new ATOM 0 HG21 VAL A 74 48.456 2.587 12.390 1.00 10.00 H new ATOM 0 HG22 VAL A 74 47.977 3.758 13.641 1.00 10.00 H new ATOM 0 HG23 VAL A 74 46.945 2.349 13.299 1.00 10.00 H new ATOM 1124 N LYS A 75 44.288 5.500 10.576 1.00 10.00 N ATOM 1125 CA LYS A 75 43.555 6.493 9.761 1.00 10.00 C ATOM 1126 C LYS A 75 42.557 7.347 10.570 1.00 10.00 C ATOM 1127 O LYS A 75 42.189 8.438 10.133 1.00 10.00 O ATOM 1128 CB LYS A 75 42.869 5.744 8.596 1.00 10.00 C ATOM 1129 CG LYS A 75 42.086 6.607 7.589 1.00 10.00 C ATOM 1130 CD LYS A 75 42.949 7.670 6.888 1.00 10.00 C ATOM 1131 CE LYS A 75 42.156 8.463 5.837 1.00 10.00 C ATOM 1132 NZ LYS A 75 41.134 9.351 6.453 1.00 10.00 N ATOM 0 H LYS A 75 44.106 4.540 10.282 1.00 10.00 H new ATOM 0 HA LYS A 75 44.271 7.218 9.374 1.00 10.00 H new ATOM 0 HB2 LYS A 75 43.633 5.191 8.049 1.00 10.00 H new ATOM 0 HB3 LYS A 75 42.185 5.009 9.019 1.00 10.00 H new ATOM 0 HG2 LYS A 75 41.641 5.957 6.835 1.00 10.00 H new ATOM 0 HG3 LYS A 75 41.265 7.102 8.108 1.00 10.00 H new ATOM 0 HD2 LYS A 75 43.351 8.358 7.632 1.00 10.00 H new ATOM 0 HD3 LYS A 75 43.800 7.186 6.409 1.00 10.00 H new ATOM 0 HE2 LYS A 75 42.845 9.063 5.242 1.00 10.00 H new ATOM 0 HE3 LYS A 75 41.667 7.769 5.154 1.00 10.00 H new ATOM 0 HZ1 LYS A 75 40.625 9.865 5.706 1.00 10.00 H new ATOM 0 HZ2 LYS A 75 40.460 8.778 7.000 1.00 10.00 H new ATOM 0 HZ3 LYS A 75 41.601 10.032 7.085 1.00 10.00 H new ATOM 1146 N SER A 76 42.166 6.888 11.761 1.00 10.00 N ATOM 1147 CA SER A 76 41.145 7.503 12.627 1.00 10.00 C ATOM 1148 C SER A 76 41.695 7.964 13.986 1.00 10.00 C ATOM 1149 O SER A 76 40.920 8.377 14.848 1.00 10.00 O ATOM 1150 CB SER A 76 39.987 6.515 12.848 1.00 10.00 C ATOM 1151 OG SER A 76 39.469 6.038 11.615 1.00 10.00 O ATOM 0 H SER A 76 42.566 6.043 12.169 1.00 10.00 H new ATOM 0 HA SER A 76 40.795 8.396 12.110 1.00 10.00 H new ATOM 0 HB2 SER A 76 40.334 5.674 13.448 1.00 10.00 H new ATOM 0 HB3 SER A 76 39.193 7.003 13.413 1.00 10.00 H new ATOM 0 HG SER A 76 39.975 5.248 11.331 1.00 10.00 H new ATOM 1157 N MET A 77 43.013 7.914 14.212 1.00 10.00 N ATOM 1158 CA MET A 77 43.623 8.128 15.536 1.00 10.00 C ATOM 1159 C MET A 77 43.279 9.480 16.191 1.00 10.00 C ATOM 1160 O MET A 77 43.121 9.545 17.412 1.00 10.00 O ATOM 1161 CB MET A 77 45.138 7.852 15.472 1.00 10.00 C ATOM 1162 CG MET A 77 45.961 8.822 14.613 1.00 10.00 C ATOM 1163 SD MET A 77 46.418 10.383 15.418 1.00 10.00 S ATOM 1164 CE MET A 77 47.392 11.132 14.084 1.00 10.00 C ATOM 0 H MET A 77 43.694 7.723 13.477 1.00 10.00 H new ATOM 0 HA MET A 77 43.170 7.403 16.212 1.00 10.00 H new ATOM 0 HB2 MET A 77 45.534 7.871 16.487 1.00 10.00 H new ATOM 0 HB3 MET A 77 45.288 6.842 15.090 1.00 10.00 H new ATOM 0 HG2 MET A 77 46.873 8.316 14.297 1.00 10.00 H new ATOM 0 HG3 MET A 77 45.394 9.051 13.710 1.00 10.00 H new ATOM 0 HE1 MET A 77 47.758 12.108 14.404 1.00 10.00 H new ATOM 0 HE2 MET A 77 48.238 10.488 13.845 1.00 10.00 H new ATOM 0 HE3 MET A 77 46.766 11.252 13.200 1.00 10.00 H new ATOM 1174 N LYS A 78 43.065 10.537 15.391 1.00 10.00 N ATOM 1175 CA LYS A 78 42.618 11.865 15.861 1.00 10.00 C ATOM 1176 C LYS A 78 41.201 11.853 16.450 1.00 10.00 C ATOM 1177 O LYS A 78 40.911 12.618 17.368 1.00 10.00 O ATOM 1178 CB LYS A 78 42.694 12.891 14.715 1.00 10.00 C ATOM 1179 CG LYS A 78 44.130 13.115 14.209 1.00 10.00 C ATOM 1180 CD LYS A 78 44.227 14.208 13.133 1.00 10.00 C ATOM 1181 CE LYS A 78 43.904 15.603 13.688 1.00 10.00 C ATOM 1182 NZ LYS A 78 44.052 16.653 12.646 1.00 10.00 N ATOM 0 H LYS A 78 43.199 10.495 14.381 1.00 10.00 H new ATOM 0 HA LYS A 78 43.296 12.150 16.666 1.00 10.00 H new ATOM 0 HB2 LYS A 78 42.071 12.551 13.888 1.00 10.00 H new ATOM 0 HB3 LYS A 78 42.281 13.841 15.056 1.00 10.00 H new ATOM 0 HG2 LYS A 78 44.767 13.385 15.051 1.00 10.00 H new ATOM 0 HG3 LYS A 78 44.516 12.180 13.804 1.00 10.00 H new ATOM 0 HD2 LYS A 78 45.232 14.211 12.711 1.00 10.00 H new ATOM 0 HD3 LYS A 78 43.540 13.975 12.319 1.00 10.00 H new ATOM 0 HE2 LYS A 78 42.885 15.614 14.075 1.00 10.00 H new ATOM 0 HE3 LYS A 78 44.566 15.824 14.525 1.00 10.00 H new ATOM 0 HZ1 LYS A 78 43.826 17.582 13.055 1.00 10.00 H new ATOM 0 HZ2 LYS A 78 45.031 16.658 12.295 1.00 10.00 H new ATOM 0 HZ3 LYS A 78 43.402 16.454 11.858 1.00 10.00 H new ATOM 1196 N ASP A 79 40.328 10.981 15.943 1.00 10.00 N ATOM 1197 CA ASP A 79 38.975 10.763 16.469 1.00 10.00 C ATOM 1198 C ASP A 79 38.991 9.806 17.674 1.00 10.00 C ATOM 1199 O ASP A 79 38.365 10.092 18.694 1.00 10.00 O ATOM 1200 CB ASP A 79 38.084 10.220 15.341 1.00 10.00 C ATOM 1201 CG ASP A 79 36.623 10.061 15.793 1.00 10.00 C ATOM 1202 OD1 ASP A 79 35.929 11.092 15.963 1.00 10.00 O ATOM 1203 OD2 ASP A 79 36.160 8.906 15.951 1.00 10.00 O ATOM 0 H ASP A 79 40.544 10.393 15.138 1.00 10.00 H new ATOM 0 HA ASP A 79 38.571 11.711 16.824 1.00 10.00 H new ATOM 0 HB2 ASP A 79 38.128 10.895 14.486 1.00 10.00 H new ATOM 0 HB3 ASP A 79 38.468 9.256 15.007 1.00 10.00 H new ATOM 1208 N ILE A 80 39.769 8.718 17.608 1.00 10.00 N ATOM 1209 CA ILE A 80 39.943 7.743 18.706 1.00 10.00 C ATOM 1210 C ILE A 80 40.481 8.408 19.985 1.00 10.00 C ATOM 1211 O ILE A 80 40.101 8.027 21.090 1.00 10.00 O ATOM 1212 CB ILE A 80 40.845 6.574 18.243 1.00 10.00 C ATOM 1213 CG1 ILE A 80 40.188 5.819 17.060 1.00 10.00 C ATOM 1214 CG2 ILE A 80 41.136 5.567 19.372 1.00 10.00 C ATOM 1215 CD1 ILE A 80 41.088 4.761 16.413 1.00 10.00 C ATOM 0 H ILE A 80 40.308 8.481 16.775 1.00 10.00 H new ATOM 0 HA ILE A 80 38.963 7.339 18.959 1.00 10.00 H new ATOM 0 HB ILE A 80 41.790 7.019 17.933 1.00 10.00 H new ATOM 0 HG12 ILE A 80 39.276 5.338 17.413 1.00 10.00 H new ATOM 0 HG13 ILE A 80 39.893 6.543 16.300 1.00 10.00 H new ATOM 0 HG21 ILE A 80 41.773 4.768 18.992 1.00 10.00 H new ATOM 0 HG22 ILE A 80 41.643 6.076 20.192 1.00 10.00 H new ATOM 0 HG23 ILE A 80 40.199 5.143 19.732 1.00 10.00 H new ATOM 0 HD11 ILE A 80 40.553 4.280 15.594 1.00 10.00 H new ATOM 0 HD12 ILE A 80 41.990 5.237 16.027 1.00 10.00 H new ATOM 0 HD13 ILE A 80 41.363 4.013 17.157 1.00 10.00 H new ATOM 1227 N ASP A 81 41.302 9.453 19.852 1.00 10.00 N ATOM 1228 CA ASP A 81 41.808 10.260 20.974 1.00 10.00 C ATOM 1229 C ASP A 81 40.706 10.981 21.796 1.00 10.00 C ATOM 1230 O ASP A 81 40.961 11.421 22.920 1.00 10.00 O ATOM 1231 CB ASP A 81 42.835 11.265 20.428 1.00 10.00 C ATOM 1232 CG ASP A 81 43.597 12.005 21.542 1.00 10.00 C ATOM 1233 OD1 ASP A 81 44.353 11.347 22.299 1.00 10.00 O ATOM 1234 OD2 ASP A 81 43.479 13.250 21.639 1.00 10.00 O ATOM 0 H ASP A 81 41.643 9.771 18.945 1.00 10.00 H new ATOM 0 HA ASP A 81 42.272 9.574 21.682 1.00 10.00 H new ATOM 0 HB2 ASP A 81 43.549 10.740 19.793 1.00 10.00 H new ATOM 0 HB3 ASP A 81 42.324 11.993 19.798 1.00 10.00 H new ATOM 1239 N SER A 82 39.476 11.067 21.270 1.00 10.00 N ATOM 1240 CA SER A 82 38.305 11.706 21.903 1.00 10.00 C ATOM 1241 C SER A 82 37.070 10.782 21.985 1.00 10.00 C ATOM 1242 O SER A 82 36.201 10.965 22.843 1.00 10.00 O ATOM 1243 CB SER A 82 37.975 12.985 21.123 1.00 10.00 C ATOM 1244 OG SER A 82 37.098 13.827 21.856 1.00 10.00 O ATOM 0 H SER A 82 39.257 10.678 20.353 1.00 10.00 H new ATOM 0 HA SER A 82 38.564 11.937 22.936 1.00 10.00 H new ATOM 0 HB2 SER A 82 38.896 13.524 20.898 1.00 10.00 H new ATOM 0 HB3 SER A 82 37.518 12.723 20.169 1.00 10.00 H new ATOM 0 HG SER A 82 36.907 14.634 21.334 1.00 10.00 H new ATOM 1250 N SER A 83 37.031 9.734 21.155 1.00 10.00 N ATOM 1251 CA SER A 83 35.927 8.773 20.979 1.00 10.00 C ATOM 1252 C SER A 83 36.462 7.330 20.956 1.00 10.00 C ATOM 1253 O SER A 83 36.185 6.551 20.041 1.00 10.00 O ATOM 1254 CB SER A 83 35.135 9.106 19.704 1.00 10.00 C ATOM 1255 OG SER A 83 34.534 10.393 19.794 1.00 10.00 O ATOM 0 H SER A 83 37.820 9.517 20.546 1.00 10.00 H new ATOM 0 HA SER A 83 35.247 8.854 21.827 1.00 10.00 H new ATOM 0 HB2 SER A 83 35.799 9.071 18.840 1.00 10.00 H new ATOM 0 HB3 SER A 83 34.364 8.352 19.544 1.00 10.00 H new ATOM 0 HG SER A 83 34.038 10.581 18.970 1.00 10.00 H new ATOM 1261 N ILE A 84 37.300 6.999 21.947 1.00 10.00 N ATOM 1262 CA ILE A 84 38.005 5.716 22.115 1.00 10.00 C ATOM 1263 C ILE A 84 37.091 4.487 21.921 1.00 10.00 C ATOM 1264 O ILE A 84 36.058 4.345 22.580 1.00 10.00 O ATOM 1265 CB ILE A 84 38.775 5.710 23.462 1.00 10.00 C ATOM 1266 CG1 ILE A 84 39.586 4.420 23.719 1.00 10.00 C ATOM 1267 CG2 ILE A 84 37.871 5.957 24.687 1.00 10.00 C ATOM 1268 CD1 ILE A 84 40.675 4.140 22.676 1.00 10.00 C ATOM 0 H ILE A 84 37.518 7.655 22.697 1.00 10.00 H new ATOM 0 HA ILE A 84 38.738 5.626 21.313 1.00 10.00 H new ATOM 0 HB ILE A 84 39.468 6.544 23.347 1.00 10.00 H new ATOM 0 HG12 ILE A 84 40.050 4.487 24.703 1.00 10.00 H new ATOM 0 HG13 ILE A 84 38.900 3.573 23.747 1.00 10.00 H new ATOM 0 HG21 ILE A 84 38.475 5.940 25.594 1.00 10.00 H new ATOM 0 HG22 ILE A 84 37.387 6.929 24.592 1.00 10.00 H new ATOM 0 HG23 ILE A 84 37.111 5.177 24.742 1.00 10.00 H new ATOM 0 HD11 ILE A 84 41.195 3.217 22.932 1.00 10.00 H new ATOM 0 HD12 ILE A 84 40.218 4.038 21.692 1.00 10.00 H new ATOM 0 HD13 ILE A 84 41.386 4.966 22.662 1.00 10.00 H new ATOM 1280 N LEU A 85 37.486 3.596 21.003 1.00 10.00 N ATOM 1281 CA LEU A 85 36.775 2.362 20.651 1.00 10.00 C ATOM 1282 C LEU A 85 37.758 1.324 20.085 1.00 10.00 C ATOM 1283 O LEU A 85 38.397 1.553 19.054 1.00 10.00 O ATOM 1284 CB LEU A 85 35.674 2.706 19.624 1.00 10.00 C ATOM 1285 CG LEU A 85 34.857 1.500 19.116 1.00 10.00 C ATOM 1286 CD1 LEU A 85 34.102 0.787 20.239 1.00 10.00 C ATOM 1287 CD2 LEU A 85 33.838 1.973 18.078 1.00 10.00 C ATOM 0 H LEU A 85 38.343 3.720 20.464 1.00 10.00 H new ATOM 0 HA LEU A 85 36.315 1.927 21.538 1.00 10.00 H new ATOM 0 HB2 LEU A 85 34.990 3.425 20.074 1.00 10.00 H new ATOM 0 HB3 LEU A 85 36.137 3.198 18.769 1.00 10.00 H new ATOM 0 HG LEU A 85 35.567 0.796 18.682 1.00 10.00 H new ATOM 0 HD11 LEU A 85 33.544 -0.053 19.826 1.00 10.00 H new ATOM 0 HD12 LEU A 85 34.813 0.421 20.980 1.00 10.00 H new ATOM 0 HD13 LEU A 85 33.411 1.484 20.712 1.00 10.00 H new ATOM 0 HD21 LEU A 85 33.261 1.120 17.720 1.00 10.00 H new ATOM 0 HD22 LEU A 85 33.166 2.700 18.533 1.00 10.00 H new ATOM 0 HD23 LEU A 85 34.360 2.436 17.240 1.00 10.00 H new ATOM 1299 N GLU A 86 37.883 0.175 20.748 1.00 10.00 N ATOM 1300 CA GLU A 86 38.676 -0.959 20.262 1.00 10.00 C ATOM 1301 C GLU A 86 38.139 -1.504 18.922 1.00 10.00 C ATOM 1302 O GLU A 86 36.934 -1.694 18.746 1.00 10.00 O ATOM 1303 CB GLU A 86 38.799 -2.053 21.343 1.00 10.00 C ATOM 1304 CG GLU A 86 37.543 -2.874 21.700 1.00 10.00 C ATOM 1305 CD GLU A 86 36.394 -2.087 22.372 1.00 10.00 C ATOM 1306 OE1 GLU A 86 36.633 -1.016 22.982 1.00 10.00 O ATOM 1307 OE2 GLU A 86 35.234 -2.564 22.327 1.00 10.00 O ATOM 0 H GLU A 86 37.433 0.001 21.647 1.00 10.00 H new ATOM 0 HA GLU A 86 39.684 -0.599 20.058 1.00 10.00 H new ATOM 0 HB2 GLU A 86 39.572 -2.751 21.023 1.00 10.00 H new ATOM 0 HB3 GLU A 86 39.157 -1.578 22.257 1.00 10.00 H new ATOM 0 HG2 GLU A 86 37.160 -3.332 20.788 1.00 10.00 H new ATOM 0 HG3 GLU A 86 37.839 -3.686 22.364 1.00 10.00 H new ATOM 1314 N HIS A 87 39.041 -1.747 17.964 1.00 10.00 N ATOM 1315 CA HIS A 87 38.694 -2.174 16.599 1.00 10.00 C ATOM 1316 C HIS A 87 38.626 -3.709 16.427 1.00 10.00 C ATOM 1317 O HIS A 87 38.255 -4.195 15.354 1.00 10.00 O ATOM 1318 CB HIS A 87 39.678 -1.524 15.608 1.00 10.00 C ATOM 1319 CG HIS A 87 39.390 -0.066 15.319 1.00 10.00 C ATOM 1320 ND1 HIS A 87 39.070 0.927 16.225 1.00 10.00 N ATOM 1321 CD2 HIS A 87 39.367 0.511 14.076 1.00 10.00 C ATOM 1322 CE1 HIS A 87 38.856 2.065 15.544 1.00 10.00 C ATOM 1323 NE2 HIS A 87 39.026 1.863 14.225 1.00 10.00 N ATOM 0 H HIS A 87 40.045 -1.652 18.114 1.00 10.00 H new ATOM 0 HA HIS A 87 37.681 -1.832 16.388 1.00 10.00 H new ATOM 0 HB2 HIS A 87 40.689 -1.612 16.006 1.00 10.00 H new ATOM 0 HB3 HIS A 87 39.655 -2.081 14.671 1.00 10.00 H new ATOM 0 HD1 HIS A 87 39.007 0.815 17.237 1.00 10.00 H new ATOM 0 HD2 HIS A 87 39.576 0.010 13.142 1.00 10.00 H new ATOM 0 HE1 HIS A 87 38.585 3.009 15.993 1.00 10.00 H new ATOM 1331 N HIS A 88 38.953 -4.485 17.468 1.00 10.00 N ATOM 1332 CA HIS A 88 38.798 -5.946 17.493 1.00 10.00 C ATOM 1333 C HIS A 88 37.323 -6.356 17.304 1.00 10.00 C ATOM 1334 O HIS A 88 36.442 -5.862 18.015 1.00 10.00 O ATOM 1335 CB HIS A 88 39.337 -6.502 18.822 1.00 10.00 C ATOM 1336 CG HIS A 88 40.754 -6.094 19.152 1.00 10.00 C ATOM 1337 ND1 HIS A 88 41.895 -6.449 18.468 1.00 10.00 N ATOM 1338 CD2 HIS A 88 41.146 -5.327 20.218 1.00 10.00 C ATOM 1339 CE1 HIS A 88 42.950 -5.906 19.102 1.00 10.00 C ATOM 1340 NE2 HIS A 88 42.542 -5.206 20.176 1.00 10.00 N ATOM 0 H HIS A 88 39.340 -4.108 18.333 1.00 10.00 H new ATOM 0 HA HIS A 88 39.370 -6.365 16.665 1.00 10.00 H new ATOM 0 HB2 HIS A 88 38.682 -6.174 19.629 1.00 10.00 H new ATOM 0 HB3 HIS A 88 39.285 -7.590 18.792 1.00 10.00 H new ATOM 0 HD2 HIS A 88 40.494 -4.892 20.961 1.00 10.00 H new ATOM 0 HE1 HIS A 88 43.979 -6.016 18.793 1.00 10.00 H new ATOM 0 HE2 HIS A 88 43.131 -4.690 20.830 1.00 10.00 H new ATOM 1348 N HIS A 89 37.049 -7.260 16.359 1.00 10.00 N ATOM 1349 CA HIS A 89 35.695 -7.720 16.017 1.00 10.00 C ATOM 1350 C HIS A 89 35.689 -9.108 15.343 1.00 10.00 C ATOM 1351 O HIS A 89 36.741 -9.669 15.020 1.00 10.00 O ATOM 1352 CB HIS A 89 35.016 -6.666 15.113 1.00 10.00 C ATOM 1353 CG HIS A 89 35.643 -6.502 13.748 1.00 10.00 C ATOM 1354 ND1 HIS A 89 36.732 -5.717 13.438 1.00 10.00 N ATOM 1355 CD2 HIS A 89 35.223 -7.081 12.580 1.00 10.00 C ATOM 1356 CE1 HIS A 89 36.966 -5.824 12.120 1.00 10.00 C ATOM 1357 NE2 HIS A 89 36.065 -6.644 11.548 1.00 10.00 N ATOM 0 H HIS A 89 37.776 -7.703 15.797 1.00 10.00 H new ATOM 0 HA HIS A 89 35.133 -7.832 16.945 1.00 10.00 H new ATOM 0 HB2 HIS A 89 33.968 -6.938 14.985 1.00 10.00 H new ATOM 0 HB3 HIS A 89 35.035 -5.703 15.624 1.00 10.00 H new ATOM 0 HD1 HIS A 89 37.268 -5.152 14.096 1.00 10.00 H new ATOM 0 HD2 HIS A 89 34.388 -7.757 12.473 1.00 10.00 H new ATOM 0 HE1 HIS A 89 37.765 -5.323 11.593 1.00 10.00 H new ATOM 1365 N HIS A 90 34.487 -9.637 15.092 1.00 10.00 N ATOM 1366 CA HIS A 90 34.236 -10.839 14.282 1.00 10.00 C ATOM 1367 C HIS A 90 33.041 -10.606 13.339 1.00 10.00 C ATOM 1368 O HIS A 90 33.157 -10.803 12.127 1.00 10.00 O ATOM 1369 CB HIS A 90 34.016 -12.038 15.218 1.00 10.00 C ATOM 1370 CG HIS A 90 33.725 -13.326 14.486 1.00 10.00 C ATOM 1371 ND1 HIS A 90 32.482 -13.883 14.272 1.00 10.00 N ATOM 1372 CD2 HIS A 90 34.644 -14.160 13.908 1.00 10.00 C ATOM 1373 CE1 HIS A 90 32.647 -15.025 13.580 1.00 10.00 C ATOM 1374 NE2 HIS A 90 33.954 -15.237 13.333 1.00 10.00 N ATOM 0 H HIS A 90 33.629 -9.226 15.460 1.00 10.00 H new ATOM 0 HA HIS A 90 35.098 -11.056 13.651 1.00 10.00 H new ATOM 0 HB2 HIS A 90 34.903 -12.173 15.837 1.00 10.00 H new ATOM 0 HB3 HIS A 90 33.188 -11.817 15.891 1.00 10.00 H new ATOM 0 HD2 HIS A 90 35.714 -14.014 13.897 1.00 10.00 H new ATOM 0 HE1 HIS A 90 31.846 -15.678 13.267 1.00 10.00 H new ATOM 0 HE2 HIS A 90 34.361 -16.024 12.828 1.00 10.00 H new ATOM 1382 N HIS A 91 31.915 -10.120 13.876 1.00 10.00 N ATOM 1383 CA HIS A 91 30.779 -9.631 13.086 1.00 10.00 C ATOM 1384 C HIS A 91 31.154 -8.294 12.410 1.00 10.00 C ATOM 1385 O HIS A 91 31.837 -7.463 13.020 1.00 10.00 O ATOM 1386 CB HIS A 91 29.568 -9.464 14.016 1.00 10.00 C ATOM 1387 CG HIS A 91 28.316 -9.022 13.302 1.00 10.00 C ATOM 1388 ND1 HIS A 91 27.854 -7.728 13.184 1.00 10.00 N ATOM 1389 CD2 HIS A 91 27.422 -9.829 12.647 1.00 10.00 C ATOM 1390 CE1 HIS A 91 26.713 -7.752 12.474 1.00 10.00 C ATOM 1391 NE2 HIS A 91 26.407 -9.016 12.124 1.00 10.00 N ATOM 0 H HIS A 91 31.766 -10.055 14.883 1.00 10.00 H new ATOM 0 HA HIS A 91 30.525 -10.344 12.301 1.00 10.00 H new ATOM 0 HB2 HIS A 91 29.374 -10.411 14.520 1.00 10.00 H new ATOM 0 HB3 HIS A 91 29.812 -8.736 14.789 1.00 10.00 H new ATOM 0 HD2 HIS A 91 27.488 -10.903 12.551 1.00 10.00 H new ATOM 0 HE1 HIS A 91 26.126 -6.882 12.220 1.00 10.00 H new ATOM 0 HE2 HIS A 91 25.597 -9.321 11.585 1.00 10.00 H new ATOM 1399 N HIS A 92 30.714 -8.077 11.164 1.00 10.00 N ATOM 1400 CA HIS A 92 31.076 -6.914 10.337 1.00 10.00 C ATOM 1401 C HIS A 92 29.912 -6.481 9.422 1.00 10.00 C ATOM 1402 O HIS A 92 29.419 -7.315 8.627 1.00 10.00 O ATOM 1403 CB HIS A 92 32.351 -7.252 9.539 1.00 10.00 C ATOM 1404 CG HIS A 92 33.059 -6.051 8.961 1.00 10.00 C ATOM 1405 ND1 HIS A 92 34.297 -5.585 9.342 1.00 10.00 N ATOM 1406 CD2 HIS A 92 32.623 -5.237 7.947 1.00 10.00 C ATOM 1407 CE1 HIS A 92 34.602 -4.519 8.585 1.00 10.00 C ATOM 1408 NE2 HIS A 92 33.607 -4.264 7.714 1.00 10.00 N ATOM 1409 OXT HIS A 92 29.487 -5.306 9.515 1.00 10.00 O ATOM 0 H HIS A 92 30.080 -8.720 10.689 1.00 10.00 H new ATOM 0 HA HIS A 92 31.280 -6.059 10.982 1.00 10.00 H new ATOM 0 HB2 HIS A 92 33.042 -7.788 10.190 1.00 10.00 H new ATOM 0 HB3 HIS A 92 32.088 -7.930 8.727 1.00 10.00 H new ATOM 0 HD1 HIS A 92 34.884 -5.983 10.076 1.00 10.00 H new ATOM 0 HD2 HIS A 92 31.685 -5.329 7.419 1.00 10.00 H new ATOM 0 HE1 HIS A 92 35.515 -3.947 8.663 1.00 10.00 H new TER 1417 HIS A 92