USER MOD reduce.3.24.130724 H: found=0, std=0, add=1062, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1060 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 62 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 122 LYS NZ :NH3+ 161:sc= -0.0793 (180deg=-0.426) USER MOD Set 2.1: A 69 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 114 THR OG1 : rot -83:sc= 0.403 USER MOD Set 3.1: A 49 TYR OH : rot 150:sc= 0 USER MOD Set 3.2: A 132 LYS NZ :NH3+ -170:sc= -1.86 (180deg=-2.44) USER MOD Single : A 1 MET CE :methyl 158:sc= -0.119 (180deg=-0.707) USER MOD Single : A 1 MET N :NH3+ -154:sc= -0.146 (180deg=-0.772) USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= -0.288 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 27 TYR OH : rot 180:sc= 0.00999 USER MOD Single : A 33 MET CE :methyl -162:sc= -0.116 (180deg=-0.592) USER MOD Single : A 38 GLN : amide:sc= 0 X(o=0,f=-0.5) USER MOD Single : A 41 GLN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 43 ASN : amide:sc= 0 X(o=0,f=-0.047) USER MOD Single : A 45 MET CE :methyl 152:sc= -0.333 (180deg=-1.15!) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 TYR OH : rot 110:sc= -0.141 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 LYS NZ :NH3+ -165:sc= -0.0521 (180deg=-0.309) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= -1.38 K(o=-1.4,f=-0.55) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ -165:sc= 0.027 (180deg=-0.241) USER MOD Single : A 76 TYR OH : rot -8:sc= 0.675 USER MOD Single : A 80 GLN : amide:sc= -0.128 X(o=-0.13,f=-0.26) USER MOD Single : A 83 GLN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : A 89 ASN : amide:sc= -1.33! K(o=-1.3!,f=-0.031) USER MOD Single : A 90 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 94 THR OG1 : rot -82:sc= 0.153 USER MOD Single : A 95 THR OG1 : rot 81:sc= 0.987 USER MOD Single : A 96 THR OG1 : rot 81:sc= 0.848 USER MOD Single : A 98 GLN : amide:sc= -1.23 K(o=-1.2,f=-0.1) USER MOD Single : A 99 HIS : no HE2:sc= -1.56 K(o=-1.6,f=-4.5!) USER MOD Single : A 100 HIS : no HD1:sc= -0.874 K(o=-0.87,f=-4.8!) USER MOD Single : A 101 LYS NZ :NH3+ -113:sc= -1.52 (180deg=-3.6!) USER MOD Single : A 111 MET CE :methyl 141:sc= -0.149 (180deg=-1.3) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 MET CE :methyl 168:sc= -0.256 (180deg=-0.583) USER MOD Single : A 128 TYR OH : rot 180:sc= -0.326 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 36.725 -20.620 -7.009 1.00 0.00 N ATOM 2 CA MET A 1 35.750 -21.438 -7.777 1.00 0.00 C ATOM 3 C MET A 1 36.447 -22.611 -8.459 1.00 0.00 C ATOM 4 O MET A 1 35.808 -23.599 -8.823 1.00 0.00 O ATOM 5 CB MET A 1 35.046 -20.572 -8.824 1.00 0.00 C ATOM 6 CG MET A 1 33.942 -21.298 -9.576 1.00 0.00 C ATOM 7 SD MET A 1 33.170 -20.273 -10.842 1.00 0.00 S ATOM 8 CE MET A 1 34.554 -19.986 -11.942 1.00 0.00 C ATOM 0 H1 MET A 1 36.234 -20.132 -6.233 1.00 0.00 H new ATOM 0 H2 MET A 1 37.463 -21.238 -6.616 1.00 0.00 H new ATOM 0 H3 MET A 1 37.161 -19.917 -7.639 1.00 0.00 H new ATOM 0 HA MET A 1 35.010 -21.832 -7.080 1.00 0.00 H new ATOM 0 HB2 MET A 1 34.623 -19.696 -8.333 1.00 0.00 H new ATOM 0 HB3 MET A 1 35.784 -20.211 -9.540 1.00 0.00 H new ATOM 0 HG2 MET A 1 34.354 -22.194 -10.041 1.00 0.00 H new ATOM 0 HG3 MET A 1 33.182 -21.627 -8.868 1.00 0.00 H new ATOM 0 HE1 MET A 1 34.183 -19.722 -12.932 1.00 0.00 H new ATOM 0 HE2 MET A 1 35.165 -19.171 -11.554 1.00 0.00 H new ATOM 0 HE3 MET A 1 35.158 -20.891 -12.011 1.00 0.00 H new ATOM 18 N ASP A 2 37.760 -22.496 -8.629 1.00 0.00 N ATOM 19 CA ASP A 2 38.544 -23.545 -9.271 1.00 0.00 C ATOM 20 C ASP A 2 39.476 -24.226 -8.274 1.00 0.00 C ATOM 21 O ASP A 2 39.264 -25.379 -7.900 1.00 0.00 O ATOM 22 CB ASP A 2 39.354 -22.964 -10.432 1.00 0.00 C ATOM 23 CG ASP A 2 40.237 -23.999 -11.100 1.00 0.00 C ATOM 24 OD1 ASP A 2 39.713 -24.795 -11.907 1.00 0.00 O ATOM 25 OD2 ASP A 2 41.454 -24.014 -10.816 1.00 0.00 O ATOM 0 H ASP A 2 38.304 -21.686 -8.331 1.00 0.00 H new ATOM 0 HA ASP A 2 37.852 -24.294 -9.656 1.00 0.00 H new ATOM 0 HB2 ASP A 2 38.673 -22.542 -11.170 1.00 0.00 H new ATOM 0 HB3 ASP A 2 39.973 -22.146 -10.065 1.00 0.00 H new ATOM 30 N ALA A 3 40.508 -23.505 -7.847 1.00 0.00 N ATOM 31 CA ALA A 3 41.474 -24.041 -6.894 1.00 0.00 C ATOM 32 C ALA A 3 41.233 -23.486 -5.494 1.00 0.00 C ATOM 33 O ALA A 3 41.920 -23.857 -4.543 1.00 0.00 O ATOM 34 CB ALA A 3 42.892 -23.731 -7.347 1.00 0.00 C ATOM 0 H ALA A 3 40.697 -22.548 -8.146 1.00 0.00 H new ATOM 0 HA ALA A 3 41.344 -25.123 -6.856 1.00 0.00 H new ATOM 0 HB1 ALA A 3 43.601 -24.137 -6.626 1.00 0.00 H new ATOM 0 HB2 ALA A 3 43.069 -24.182 -8.323 1.00 0.00 H new ATOM 0 HB3 ALA A 3 43.024 -22.651 -7.417 1.00 0.00 H new ATOM 40 N LEU A 4 40.255 -22.593 -5.376 1.00 0.00 N ATOM 41 CA LEU A 4 39.927 -21.985 -4.093 1.00 0.00 C ATOM 42 C LEU A 4 38.763 -22.709 -3.428 1.00 0.00 C ATOM 43 O LEU A 4 38.890 -23.209 -2.310 1.00 0.00 O ATOM 44 CB LEU A 4 39.587 -20.504 -4.279 1.00 0.00 C ATOM 45 CG LEU A 4 40.701 -19.657 -4.904 1.00 0.00 C ATOM 46 CD1 LEU A 4 40.211 -18.241 -5.165 1.00 0.00 C ATOM 47 CD2 LEU A 4 41.927 -19.639 -4.003 1.00 0.00 C ATOM 0 H LEU A 4 39.677 -22.275 -6.154 1.00 0.00 H new ATOM 0 HA LEU A 4 40.799 -22.071 -3.445 1.00 0.00 H new ATOM 0 HB2 LEU A 4 38.698 -20.427 -4.905 1.00 0.00 H new ATOM 0 HB3 LEU A 4 39.331 -20.081 -3.308 1.00 0.00 H new ATOM 0 HG LEU A 4 40.981 -20.106 -5.857 1.00 0.00 H new ATOM 0 HD11 LEU A 4 41.015 -17.654 -5.609 1.00 0.00 H new ATOM 0 HD12 LEU A 4 39.363 -18.270 -5.849 1.00 0.00 H new ATOM 0 HD13 LEU A 4 39.904 -17.783 -4.225 1.00 0.00 H new ATOM 0 HD21 LEU A 4 42.708 -19.033 -4.463 1.00 0.00 H new ATOM 0 HD22 LEU A 4 41.661 -19.214 -3.035 1.00 0.00 H new ATOM 0 HD23 LEU A 4 42.292 -20.657 -3.865 1.00 0.00 H new ATOM 59 N GLU A 5 37.629 -22.764 -4.125 1.00 0.00 N ATOM 60 CA GLU A 5 36.435 -23.426 -3.607 1.00 0.00 C ATOM 61 C GLU A 5 35.980 -22.779 -2.302 1.00 0.00 C ATOM 62 O GLU A 5 36.531 -23.055 -1.235 1.00 0.00 O ATOM 63 CB GLU A 5 36.705 -24.919 -3.385 1.00 0.00 C ATOM 64 CG GLU A 5 35.445 -25.769 -3.307 1.00 0.00 C ATOM 65 CD GLU A 5 34.604 -25.469 -2.081 1.00 0.00 C ATOM 66 OE1 GLU A 5 34.888 -26.045 -1.010 1.00 0.00 O ATOM 67 OE2 GLU A 5 33.662 -24.657 -2.194 1.00 0.00 O ATOM 0 H GLU A 5 37.513 -22.356 -5.053 1.00 0.00 H new ATOM 0 HA GLU A 5 35.640 -23.316 -4.344 1.00 0.00 H new ATOM 0 HB2 GLU A 5 37.332 -25.289 -4.196 1.00 0.00 H new ATOM 0 HB3 GLU A 5 37.272 -25.042 -2.462 1.00 0.00 H new ATOM 0 HG2 GLU A 5 34.845 -25.603 -4.202 1.00 0.00 H new ATOM 0 HG3 GLU A 5 35.724 -26.823 -3.301 1.00 0.00 H new ATOM 74 N GLY A 6 34.975 -21.916 -2.394 1.00 0.00 N ATOM 75 CA GLY A 6 34.466 -21.244 -1.213 1.00 0.00 C ATOM 76 C GLY A 6 33.803 -19.921 -1.539 1.00 0.00 C ATOM 77 O GLY A 6 32.578 -19.805 -1.502 1.00 0.00 O ATOM 0 H GLY A 6 34.504 -21.670 -3.264 1.00 0.00 H new ATOM 0 HA2 GLY A 6 33.748 -21.893 -0.711 1.00 0.00 H new ATOM 0 HA3 GLY A 6 35.285 -21.074 -0.514 1.00 0.00 H new ATOM 81 N GLU A 7 34.616 -18.920 -1.862 1.00 0.00 N ATOM 82 CA GLU A 7 34.104 -17.597 -2.196 1.00 0.00 C ATOM 83 C GLU A 7 33.364 -17.622 -3.528 1.00 0.00 C ATOM 84 O GLU A 7 33.967 -17.832 -4.581 1.00 0.00 O ATOM 85 CB GLU A 7 35.248 -16.582 -2.252 1.00 0.00 C ATOM 86 CG GLU A 7 34.794 -15.168 -2.575 1.00 0.00 C ATOM 87 CD GLU A 7 35.940 -14.178 -2.583 1.00 0.00 C ATOM 88 OE1 GLU A 7 36.591 -14.032 -3.639 1.00 0.00 O ATOM 89 OE2 GLU A 7 36.188 -13.548 -1.533 1.00 0.00 O ATOM 0 H GLU A 7 35.632 -19.001 -1.899 1.00 0.00 H new ATOM 0 HA GLU A 7 33.403 -17.299 -1.417 1.00 0.00 H new ATOM 0 HB2 GLU A 7 35.766 -16.578 -1.293 1.00 0.00 H new ATOM 0 HB3 GLU A 7 35.970 -16.903 -3.003 1.00 0.00 H new ATOM 0 HG2 GLU A 7 34.305 -15.161 -3.549 1.00 0.00 H new ATOM 0 HG3 GLU A 7 34.051 -14.852 -1.843 1.00 0.00 H new ATOM 96 N SER A 8 32.053 -17.407 -3.474 1.00 0.00 N ATOM 97 CA SER A 8 31.229 -17.402 -4.677 1.00 0.00 C ATOM 98 C SER A 8 29.892 -16.718 -4.417 1.00 0.00 C ATOM 99 O SER A 8 29.295 -16.133 -5.322 1.00 0.00 O ATOM 100 CB SER A 8 30.997 -18.833 -5.166 1.00 0.00 C ATOM 101 OG SER A 8 30.200 -18.848 -6.338 1.00 0.00 O ATOM 0 H SER A 8 31.539 -17.234 -2.610 1.00 0.00 H new ATOM 0 HA SER A 8 31.758 -16.843 -5.449 1.00 0.00 H new ATOM 0 HB2 SER A 8 31.955 -19.312 -5.368 1.00 0.00 H new ATOM 0 HB3 SER A 8 30.509 -19.414 -4.383 1.00 0.00 H new ATOM 0 HG SER A 8 30.067 -19.774 -6.632 1.00 0.00 H new ATOM 107 N PHE A 9 29.425 -16.793 -3.173 1.00 0.00 N ATOM 108 CA PHE A 9 28.158 -16.181 -2.794 1.00 0.00 C ATOM 109 C PHE A 9 28.388 -14.859 -2.070 1.00 0.00 C ATOM 110 O PHE A 9 29.257 -14.757 -1.204 1.00 0.00 O ATOM 111 CB PHE A 9 27.354 -17.131 -1.903 1.00 0.00 C ATOM 112 CG PHE A 9 26.001 -16.599 -1.522 1.00 0.00 C ATOM 113 CD1 PHE A 9 24.935 -16.687 -2.404 1.00 0.00 C ATOM 114 CD2 PHE A 9 25.795 -16.011 -0.285 1.00 0.00 C ATOM 115 CE1 PHE A 9 23.689 -16.199 -2.058 1.00 0.00 C ATOM 116 CE2 PHE A 9 24.551 -15.521 0.067 1.00 0.00 C ATOM 117 CZ PHE A 9 23.497 -15.615 -0.820 1.00 0.00 C ATOM 0 H PHE A 9 29.906 -17.272 -2.412 1.00 0.00 H new ATOM 0 HA PHE A 9 27.592 -15.983 -3.704 1.00 0.00 H new ATOM 0 HB2 PHE A 9 27.228 -18.082 -2.421 1.00 0.00 H new ATOM 0 HB3 PHE A 9 27.924 -17.334 -0.996 1.00 0.00 H new ATOM 0 HD1 PHE A 9 25.080 -17.142 -3.373 1.00 0.00 H new ATOM 0 HD2 PHE A 9 26.616 -15.934 0.413 1.00 0.00 H new ATOM 0 HE1 PHE A 9 22.867 -16.274 -2.754 1.00 0.00 H new ATOM 0 HE2 PHE A 9 24.404 -15.065 1.035 1.00 0.00 H new ATOM 0 HZ PHE A 9 22.524 -15.233 -0.547 1.00 0.00 H new ATOM 127 N ALA A 10 27.601 -13.850 -2.430 1.00 0.00 N ATOM 128 CA ALA A 10 27.718 -12.532 -1.818 1.00 0.00 C ATOM 129 C ALA A 10 26.825 -12.420 -0.585 1.00 0.00 C ATOM 130 O ALA A 10 25.602 -12.500 -0.684 1.00 0.00 O ATOM 131 CB ALA A 10 27.368 -11.449 -2.827 1.00 0.00 C ATOM 0 H ALA A 10 26.875 -13.920 -3.143 1.00 0.00 H new ATOM 0 HA ALA A 10 28.752 -12.395 -1.500 1.00 0.00 H new ATOM 0 HB1 ALA A 10 27.460 -10.470 -2.356 1.00 0.00 H new ATOM 0 HB2 ALA A 10 28.049 -11.509 -3.676 1.00 0.00 H new ATOM 0 HB3 ALA A 10 26.344 -11.591 -3.173 1.00 0.00 H new ATOM 137 N LEU A 11 27.447 -12.236 0.575 1.00 0.00 N ATOM 138 CA LEU A 11 26.707 -12.116 1.826 1.00 0.00 C ATOM 139 C LEU A 11 26.667 -10.663 2.296 1.00 0.00 C ATOM 140 O LEU A 11 26.363 -10.381 3.454 1.00 0.00 O ATOM 141 CB LEU A 11 27.343 -13.001 2.903 1.00 0.00 C ATOM 142 CG LEU A 11 26.477 -13.252 4.141 1.00 0.00 C ATOM 143 CD1 LEU A 11 25.213 -14.012 3.768 1.00 0.00 C ATOM 144 CD2 LEU A 11 27.266 -14.012 5.197 1.00 0.00 C ATOM 0 H LEU A 11 28.460 -12.167 0.675 1.00 0.00 H new ATOM 0 HA LEU A 11 25.684 -12.449 1.652 1.00 0.00 H new ATOM 0 HB2 LEU A 11 27.596 -13.963 2.456 1.00 0.00 H new ATOM 0 HB3 LEU A 11 28.278 -12.541 3.222 1.00 0.00 H new ATOM 0 HG LEU A 11 26.185 -12.288 4.556 1.00 0.00 H new ATOM 0 HD11 LEU A 11 24.612 -14.180 4.662 1.00 0.00 H new ATOM 0 HD12 LEU A 11 24.638 -13.430 3.048 1.00 0.00 H new ATOM 0 HD13 LEU A 11 25.482 -14.971 3.326 1.00 0.00 H new ATOM 0 HD21 LEU A 11 26.636 -14.182 6.070 1.00 0.00 H new ATOM 0 HD22 LEU A 11 27.589 -14.970 4.790 1.00 0.00 H new ATOM 0 HD23 LEU A 11 28.140 -13.429 5.488 1.00 0.00 H new ATOM 156 N SER A 12 26.973 -9.745 1.384 1.00 0.00 N ATOM 157 CA SER A 12 26.969 -8.320 1.702 1.00 0.00 C ATOM 158 C SER A 12 25.606 -7.891 2.234 1.00 0.00 C ATOM 159 O SER A 12 24.589 -8.515 1.935 1.00 0.00 O ATOM 160 CB SER A 12 27.330 -7.498 0.463 1.00 0.00 C ATOM 161 OG SER A 12 27.334 -6.112 0.755 1.00 0.00 O ATOM 0 H SER A 12 27.227 -9.962 0.420 1.00 0.00 H new ATOM 0 HA SER A 12 27.716 -8.141 2.475 1.00 0.00 H new ATOM 0 HB2 SER A 12 28.312 -7.799 0.096 1.00 0.00 H new ATOM 0 HB3 SER A 12 26.616 -7.703 -0.334 1.00 0.00 H new ATOM 0 HG SER A 12 27.569 -5.608 -0.052 1.00 0.00 H new ATOM 167 N PHE A 13 25.594 -6.822 3.026 1.00 0.00 N ATOM 168 CA PHE A 13 24.354 -6.312 3.599 1.00 0.00 C ATOM 169 C PHE A 13 23.389 -5.875 2.501 1.00 0.00 C ATOM 170 O PHE A 13 23.809 -5.436 1.431 1.00 0.00 O ATOM 171 CB PHE A 13 24.645 -5.141 4.542 1.00 0.00 C ATOM 172 CG PHE A 13 25.287 -3.963 3.863 1.00 0.00 C ATOM 173 CD1 PHE A 13 26.664 -3.890 3.727 1.00 0.00 C ATOM 174 CD2 PHE A 13 24.512 -2.930 3.361 1.00 0.00 C ATOM 175 CE1 PHE A 13 27.257 -2.808 3.103 1.00 0.00 C ATOM 176 CE2 PHE A 13 25.098 -1.846 2.735 1.00 0.00 C ATOM 177 CZ PHE A 13 26.472 -1.785 2.607 1.00 0.00 C ATOM 0 H PHE A 13 26.428 -6.294 3.284 1.00 0.00 H new ATOM 0 HA PHE A 13 23.887 -7.115 4.168 1.00 0.00 H new ATOM 0 HB2 PHE A 13 23.712 -4.818 5.005 1.00 0.00 H new ATOM 0 HB3 PHE A 13 25.297 -5.486 5.345 1.00 0.00 H new ATOM 0 HD1 PHE A 13 27.281 -4.688 4.113 1.00 0.00 H new ATOM 0 HD2 PHE A 13 23.437 -2.972 3.460 1.00 0.00 H new ATOM 0 HE1 PHE A 13 28.331 -2.763 3.004 1.00 0.00 H new ATOM 0 HE2 PHE A 13 24.483 -1.048 2.347 1.00 0.00 H new ATOM 0 HZ PHE A 13 26.932 -0.938 2.120 1.00 0.00 H new ATOM 187 N SER A 14 22.094 -6.001 2.773 1.00 0.00 N ATOM 188 CA SER A 14 21.071 -5.619 1.808 1.00 0.00 C ATOM 189 C SER A 14 20.524 -4.229 2.115 1.00 0.00 C ATOM 190 O SER A 14 20.849 -3.637 3.144 1.00 0.00 O ATOM 191 CB SER A 14 19.932 -6.640 1.809 1.00 0.00 C ATOM 192 OG SER A 14 18.951 -6.314 0.841 1.00 0.00 O ATOM 0 H SER A 14 21.729 -6.365 3.653 1.00 0.00 H new ATOM 0 HA SER A 14 21.530 -5.598 0.820 1.00 0.00 H new ATOM 0 HB2 SER A 14 20.331 -7.634 1.606 1.00 0.00 H new ATOM 0 HB3 SER A 14 19.474 -6.676 2.797 1.00 0.00 H new ATOM 0 HG SER A 14 18.236 -6.984 0.862 1.00 0.00 H new ATOM 198 N SER A 15 19.692 -3.714 1.214 1.00 0.00 N ATOM 199 CA SER A 15 19.096 -2.393 1.386 1.00 0.00 C ATOM 200 C SER A 15 18.074 -2.404 2.518 1.00 0.00 C ATOM 201 O SER A 15 17.706 -1.352 3.047 1.00 0.00 O ATOM 202 CB SER A 15 18.428 -1.940 0.088 1.00 0.00 C ATOM 203 OG SER A 15 17.411 -2.845 -0.306 1.00 0.00 O ATOM 0 H SER A 15 19.415 -4.192 0.357 1.00 0.00 H new ATOM 0 HA SER A 15 19.891 -1.692 1.642 1.00 0.00 H new ATOM 0 HB2 SER A 15 18.002 -0.946 0.223 1.00 0.00 H new ATOM 0 HB3 SER A 15 19.176 -1.862 -0.701 1.00 0.00 H new ATOM 0 HG SER A 15 16.998 -2.532 -1.138 1.00 0.00 H new ATOM 209 N ALA A 16 17.618 -3.600 2.880 1.00 0.00 N ATOM 210 CA ALA A 16 16.638 -3.759 3.948 1.00 0.00 C ATOM 211 C ALA A 16 17.175 -3.220 5.270 1.00 0.00 C ATOM 212 O ALA A 16 16.586 -2.321 5.869 1.00 0.00 O ATOM 213 CB ALA A 16 16.252 -5.224 4.091 1.00 0.00 C ATOM 0 H ALA A 16 17.913 -4.475 2.447 1.00 0.00 H new ATOM 0 HA ALA A 16 15.751 -3.183 3.685 1.00 0.00 H new ATOM 0 HB1 ALA A 16 15.520 -5.331 4.891 1.00 0.00 H new ATOM 0 HB2 ALA A 16 15.821 -5.580 3.155 1.00 0.00 H new ATOM 0 HB3 ALA A 16 17.138 -5.812 4.329 1.00 0.00 H new ATOM 219 N SER A 17 18.295 -3.778 5.718 1.00 0.00 N ATOM 220 CA SER A 17 18.914 -3.352 6.968 1.00 0.00 C ATOM 221 C SER A 17 19.746 -2.090 6.758 1.00 0.00 C ATOM 222 O SER A 17 20.430 -1.627 7.671 1.00 0.00 O ATOM 223 CB SER A 17 19.792 -4.471 7.535 1.00 0.00 C ATOM 224 OG SER A 17 20.815 -4.825 6.621 1.00 0.00 O ATOM 0 H SER A 17 18.792 -4.526 5.234 1.00 0.00 H new ATOM 0 HA SER A 17 18.121 -3.128 7.681 1.00 0.00 H new ATOM 0 HB2 SER A 17 20.236 -4.148 8.477 1.00 0.00 H new ATOM 0 HB3 SER A 17 19.178 -5.344 7.755 1.00 0.00 H new ATOM 0 HG SER A 17 21.364 -5.540 7.005 1.00 0.00 H new ATOM 230 N ASP A 18 19.681 -1.539 5.549 1.00 0.00 N ATOM 231 CA ASP A 18 20.427 -0.331 5.216 1.00 0.00 C ATOM 232 C ASP A 18 19.536 0.903 5.327 1.00 0.00 C ATOM 233 O ASP A 18 18.315 0.792 5.443 1.00 0.00 O ATOM 234 CB ASP A 18 21.006 -0.437 3.803 1.00 0.00 C ATOM 235 CG ASP A 18 21.929 0.718 3.465 1.00 0.00 C ATOM 236 OD1 ASP A 18 23.126 0.643 3.813 1.00 0.00 O ATOM 237 OD2 ASP A 18 21.455 1.699 2.852 1.00 0.00 O ATOM 0 H ASP A 18 19.119 -1.911 4.784 1.00 0.00 H new ATOM 0 HA ASP A 18 21.247 -0.229 5.927 1.00 0.00 H new ATOM 0 HB2 ASP A 18 21.553 -1.375 3.708 1.00 0.00 H new ATOM 0 HB3 ASP A 18 20.190 -0.469 3.081 1.00 0.00 H new ATOM 242 N ALA A 19 20.156 2.079 5.292 1.00 0.00 N ATOM 243 CA ALA A 19 19.427 3.339 5.390 1.00 0.00 C ATOM 244 C ALA A 19 18.445 3.507 4.234 1.00 0.00 C ATOM 245 O ALA A 19 17.468 4.250 4.342 1.00 0.00 O ATOM 246 CB ALA A 19 20.402 4.507 5.427 1.00 0.00 C ATOM 0 H ALA A 19 21.166 2.185 5.196 1.00 0.00 H new ATOM 0 HA ALA A 19 18.852 3.323 6.316 1.00 0.00 H new ATOM 0 HB1 ALA A 19 19.847 5.442 5.500 1.00 0.00 H new ATOM 0 HB2 ALA A 19 21.058 4.406 6.291 1.00 0.00 H new ATOM 0 HB3 ALA A 19 21.000 4.511 4.516 1.00 0.00 H new ATOM 252 N GLU A 20 18.712 2.817 3.129 1.00 0.00 N ATOM 253 CA GLU A 20 17.858 2.897 1.949 1.00 0.00 C ATOM 254 C GLU A 20 16.415 2.530 2.284 1.00 0.00 C ATOM 255 O GLU A 20 15.486 3.252 1.927 1.00 0.00 O ATOM 256 CB GLU A 20 18.389 1.978 0.847 1.00 0.00 C ATOM 257 CG GLU A 20 17.683 2.157 -0.488 1.00 0.00 C ATOM 258 CD GLU A 20 18.267 1.282 -1.580 1.00 0.00 C ATOM 259 OE1 GLU A 20 19.326 1.649 -2.133 1.00 0.00 O ATOM 260 OE2 GLU A 20 17.664 0.231 -1.886 1.00 0.00 O ATOM 0 H GLU A 20 19.514 2.195 3.026 1.00 0.00 H new ATOM 0 HA GLU A 20 17.873 3.928 1.595 1.00 0.00 H new ATOM 0 HB2 GLU A 20 19.455 2.164 0.713 1.00 0.00 H new ATOM 0 HB3 GLU A 20 18.284 0.942 1.168 1.00 0.00 H new ATOM 0 HG2 GLU A 20 16.625 1.925 -0.369 1.00 0.00 H new ATOM 0 HG3 GLU A 20 17.748 3.202 -0.792 1.00 0.00 H new ATOM 267 N PHE A 21 16.232 1.404 2.970 1.00 0.00 N ATOM 268 CA PHE A 21 14.897 0.952 3.348 1.00 0.00 C ATOM 269 C PHE A 21 14.194 1.989 4.220 1.00 0.00 C ATOM 270 O PHE A 21 13.034 2.329 3.981 1.00 0.00 O ATOM 271 CB PHE A 21 14.972 -0.385 4.090 1.00 0.00 C ATOM 272 CG PHE A 21 13.625 -0.954 4.441 1.00 0.00 C ATOM 273 CD1 PHE A 21 12.998 -0.606 5.627 1.00 0.00 C ATOM 274 CD2 PHE A 21 12.988 -1.836 3.584 1.00 0.00 C ATOM 275 CE1 PHE A 21 11.759 -1.127 5.950 1.00 0.00 C ATOM 276 CE2 PHE A 21 11.749 -2.361 3.902 1.00 0.00 C ATOM 277 CZ PHE A 21 11.134 -2.006 5.087 1.00 0.00 C ATOM 0 H PHE A 21 16.988 0.791 3.274 1.00 0.00 H new ATOM 0 HA PHE A 21 14.319 0.819 2.433 1.00 0.00 H new ATOM 0 HB2 PHE A 21 15.511 -1.104 3.473 1.00 0.00 H new ATOM 0 HB3 PHE A 21 15.551 -0.252 5.004 1.00 0.00 H new ATOM 0 HD1 PHE A 21 13.483 0.080 6.306 1.00 0.00 H new ATOM 0 HD2 PHE A 21 13.465 -2.117 2.656 1.00 0.00 H new ATOM 0 HE1 PHE A 21 11.280 -0.847 6.877 1.00 0.00 H new ATOM 0 HE2 PHE A 21 11.263 -3.048 3.225 1.00 0.00 H new ATOM 0 HZ PHE A 21 10.166 -2.415 5.338 1.00 0.00 H new ATOM 287 N ASP A 22 14.901 2.485 5.232 1.00 0.00 N ATOM 288 CA ASP A 22 14.343 3.480 6.143 1.00 0.00 C ATOM 289 C ASP A 22 13.869 4.713 5.379 1.00 0.00 C ATOM 290 O ASP A 22 12.882 5.348 5.755 1.00 0.00 O ATOM 291 CB ASP A 22 15.379 3.880 7.195 1.00 0.00 C ATOM 292 CG ASP A 22 14.858 4.935 8.151 1.00 0.00 C ATOM 293 OD1 ASP A 22 14.236 4.561 9.167 1.00 0.00 O ATOM 294 OD2 ASP A 22 15.073 6.136 7.884 1.00 0.00 O ATOM 0 H ASP A 22 15.862 2.214 5.442 1.00 0.00 H new ATOM 0 HA ASP A 22 13.484 3.035 6.644 1.00 0.00 H new ATOM 0 HB2 ASP A 22 15.677 2.997 7.761 1.00 0.00 H new ATOM 0 HB3 ASP A 22 16.272 4.256 6.696 1.00 0.00 H new ATOM 299 N ALA A 23 14.577 5.047 4.304 1.00 0.00 N ATOM 300 CA ALA A 23 14.224 6.201 3.485 1.00 0.00 C ATOM 301 C ALA A 23 12.886 5.983 2.787 1.00 0.00 C ATOM 302 O ALA A 23 12.042 6.878 2.752 1.00 0.00 O ATOM 303 CB ALA A 23 15.317 6.481 2.465 1.00 0.00 C ATOM 0 H ALA A 23 15.398 4.535 3.980 1.00 0.00 H new ATOM 0 HA ALA A 23 14.128 7.067 4.140 1.00 0.00 H new ATOM 0 HB1 ALA A 23 15.039 7.345 1.861 1.00 0.00 H new ATOM 0 HB2 ALA A 23 16.254 6.687 2.983 1.00 0.00 H new ATOM 0 HB3 ALA A 23 15.443 5.612 1.819 1.00 0.00 H new ATOM 309 N VAL A 24 12.700 4.787 2.234 1.00 0.00 N ATOM 310 CA VAL A 24 11.463 4.451 1.540 1.00 0.00 C ATOM 311 C VAL A 24 10.264 4.577 2.472 1.00 0.00 C ATOM 312 O VAL A 24 9.245 5.169 2.113 1.00 0.00 O ATOM 313 CB VAL A 24 11.504 3.020 0.966 1.00 0.00 C ATOM 314 CG1 VAL A 24 10.218 2.705 0.218 1.00 0.00 C ATOM 315 CG2 VAL A 24 12.712 2.842 0.057 1.00 0.00 C ATOM 0 H VAL A 24 13.390 4.036 2.254 1.00 0.00 H new ATOM 0 HA VAL A 24 11.361 5.158 0.717 1.00 0.00 H new ATOM 0 HB VAL A 24 11.595 2.320 1.797 1.00 0.00 H new ATOM 0 HG11 VAL A 24 10.267 1.691 -0.179 1.00 0.00 H new ATOM 0 HG12 VAL A 24 9.371 2.787 0.899 1.00 0.00 H new ATOM 0 HG13 VAL A 24 10.093 3.411 -0.603 1.00 0.00 H new ATOM 0 HG21 VAL A 24 12.723 1.826 -0.338 1.00 0.00 H new ATOM 0 HG22 VAL A 24 12.654 3.552 -0.768 1.00 0.00 H new ATOM 0 HG23 VAL A 24 13.625 3.020 0.626 1.00 0.00 H new ATOM 325 N VAL A 25 10.392 4.016 3.672 1.00 0.00 N ATOM 326 CA VAL A 25 9.320 4.071 4.659 1.00 0.00 C ATOM 327 C VAL A 25 8.905 5.512 4.928 1.00 0.00 C ATOM 328 O VAL A 25 7.716 5.821 5.006 1.00 0.00 O ATOM 329 CB VAL A 25 9.739 3.405 5.985 1.00 0.00 C ATOM 330 CG1 VAL A 25 8.629 3.515 7.019 1.00 0.00 C ATOM 331 CG2 VAL A 25 10.117 1.950 5.752 1.00 0.00 C ATOM 0 H VAL A 25 11.227 3.519 3.983 1.00 0.00 H new ATOM 0 HA VAL A 25 8.474 3.523 4.245 1.00 0.00 H new ATOM 0 HB VAL A 25 10.613 3.930 6.372 1.00 0.00 H new ATOM 0 HG11 VAL A 25 8.947 3.038 7.946 1.00 0.00 H new ATOM 0 HG12 VAL A 25 8.410 4.566 7.208 1.00 0.00 H new ATOM 0 HG13 VAL A 25 7.733 3.020 6.645 1.00 0.00 H new ATOM 0 HG21 VAL A 25 10.410 1.494 6.698 1.00 0.00 H new ATOM 0 HG22 VAL A 25 9.262 1.413 5.340 1.00 0.00 H new ATOM 0 HG23 VAL A 25 10.950 1.898 5.051 1.00 0.00 H new ATOM 341 N GLY A 26 9.893 6.390 5.072 1.00 0.00 N ATOM 342 CA GLY A 26 9.606 7.790 5.320 1.00 0.00 C ATOM 343 C GLY A 26 8.783 8.408 4.208 1.00 0.00 C ATOM 344 O GLY A 26 7.794 9.098 4.466 1.00 0.00 O ATOM 0 H GLY A 26 10.885 6.157 5.021 1.00 0.00 H new ATOM 0 HA2 GLY A 26 9.071 7.888 6.264 1.00 0.00 H new ATOM 0 HA3 GLY A 26 10.542 8.338 5.426 1.00 0.00 H new ATOM 348 N TYR A 27 9.190 8.154 2.966 1.00 0.00 N ATOM 349 CA TYR A 27 8.481 8.685 1.808 1.00 0.00 C ATOM 350 C TYR A 27 7.025 8.231 1.815 1.00 0.00 C ATOM 351 O TYR A 27 6.131 8.977 1.417 1.00 0.00 O ATOM 352 CB TYR A 27 9.160 8.238 0.509 1.00 0.00 C ATOM 353 CG TYR A 27 10.587 8.726 0.353 1.00 0.00 C ATOM 354 CD1 TYR A 27 10.933 10.039 0.657 1.00 0.00 C ATOM 355 CD2 TYR A 27 11.586 7.874 -0.102 1.00 0.00 C ATOM 356 CE1 TYR A 27 12.232 10.486 0.510 1.00 0.00 C ATOM 357 CE2 TYR A 27 12.887 8.315 -0.250 1.00 0.00 C ATOM 358 CZ TYR A 27 13.206 9.621 0.058 1.00 0.00 C ATOM 359 OH TYR A 27 14.500 10.062 -0.088 1.00 0.00 O ATOM 0 H TYR A 27 10.005 7.585 2.738 1.00 0.00 H new ATOM 0 HA TYR A 27 8.510 9.773 1.864 1.00 0.00 H new ATOM 0 HB2 TYR A 27 9.154 7.149 0.465 1.00 0.00 H new ATOM 0 HB3 TYR A 27 8.572 8.594 -0.336 1.00 0.00 H new ATOM 0 HD1 TYR A 27 10.174 10.720 1.014 1.00 0.00 H new ATOM 0 HD2 TYR A 27 11.341 6.850 -0.344 1.00 0.00 H new ATOM 0 HE1 TYR A 27 12.484 11.509 0.748 1.00 0.00 H new ATOM 0 HE2 TYR A 27 13.651 7.640 -0.605 1.00 0.00 H new ATOM 0 HH TYR A 27 15.061 9.328 -0.415 1.00 0.00 H new ATOM 369 N LEU A 28 6.796 7.002 2.272 1.00 0.00 N ATOM 370 CA LEU A 28 5.447 6.451 2.337 1.00 0.00 C ATOM 371 C LEU A 28 4.566 7.290 3.253 1.00 0.00 C ATOM 372 O LEU A 28 3.448 7.655 2.890 1.00 0.00 O ATOM 373 CB LEU A 28 5.483 5.004 2.834 1.00 0.00 C ATOM 374 CG LEU A 28 6.171 4.010 1.896 1.00 0.00 C ATOM 375 CD1 LEU A 28 6.264 2.640 2.548 1.00 0.00 C ATOM 376 CD2 LEU A 28 5.425 3.921 0.572 1.00 0.00 C ATOM 0 H LEU A 28 7.526 6.371 2.602 1.00 0.00 H new ATOM 0 HA LEU A 28 5.025 6.470 1.332 1.00 0.00 H new ATOM 0 HB2 LEU A 28 5.991 4.980 3.798 1.00 0.00 H new ATOM 0 HB3 LEU A 28 4.460 4.670 3.004 1.00 0.00 H new ATOM 0 HG LEU A 28 7.182 4.367 1.698 1.00 0.00 H new ATOM 0 HD11 LEU A 28 6.756 1.946 1.867 1.00 0.00 H new ATOM 0 HD12 LEU A 28 6.841 2.714 3.470 1.00 0.00 H new ATOM 0 HD13 LEU A 28 5.262 2.276 2.775 1.00 0.00 H new ATOM 0 HD21 LEU A 28 5.929 3.209 -0.082 1.00 0.00 H new ATOM 0 HD22 LEU A 28 4.403 3.588 0.752 1.00 0.00 H new ATOM 0 HD23 LEU A 28 5.409 4.902 0.097 1.00 0.00 H new ATOM 388 N GLU A 29 5.080 7.595 4.441 1.00 0.00 N ATOM 389 CA GLU A 29 4.343 8.395 5.413 1.00 0.00 C ATOM 390 C GLU A 29 3.907 9.723 4.804 1.00 0.00 C ATOM 391 O GLU A 29 2.781 10.173 5.017 1.00 0.00 O ATOM 392 CB GLU A 29 5.201 8.643 6.654 1.00 0.00 C ATOM 393 CG GLU A 29 5.578 7.370 7.396 1.00 0.00 C ATOM 394 CD GLU A 29 6.464 7.635 8.597 1.00 0.00 C ATOM 395 OE1 GLU A 29 5.919 7.911 9.688 1.00 0.00 O ATOM 396 OE2 GLU A 29 7.702 7.567 8.449 1.00 0.00 O ATOM 0 H GLU A 29 6.005 7.300 4.754 1.00 0.00 H new ATOM 0 HA GLU A 29 3.451 7.841 5.704 1.00 0.00 H new ATOM 0 HB2 GLU A 29 6.111 9.165 6.358 1.00 0.00 H new ATOM 0 HB3 GLU A 29 4.661 9.303 7.333 1.00 0.00 H new ATOM 0 HG2 GLU A 29 4.671 6.863 7.724 1.00 0.00 H new ATOM 0 HG3 GLU A 29 6.092 6.694 6.712 1.00 0.00 H new ATOM 403 N ASP A 30 4.804 10.347 4.047 1.00 0.00 N ATOM 404 CA ASP A 30 4.505 11.622 3.404 1.00 0.00 C ATOM 405 C ASP A 30 3.349 11.478 2.418 1.00 0.00 C ATOM 406 O ASP A 30 2.539 12.392 2.260 1.00 0.00 O ATOM 407 CB ASP A 30 5.743 12.161 2.683 1.00 0.00 C ATOM 408 CG ASP A 30 6.897 12.422 3.631 1.00 0.00 C ATOM 409 OD1 ASP A 30 6.819 13.397 4.407 1.00 0.00 O ATOM 410 OD2 ASP A 30 7.882 11.654 3.593 1.00 0.00 O ATOM 0 H ASP A 30 5.742 9.991 3.864 1.00 0.00 H new ATOM 0 HA ASP A 30 4.211 12.329 4.180 1.00 0.00 H new ATOM 0 HB2 ASP A 30 6.056 11.447 1.922 1.00 0.00 H new ATOM 0 HB3 ASP A 30 5.485 13.085 2.166 1.00 0.00 H new ATOM 415 N ILE A 31 3.278 10.325 1.758 1.00 0.00 N ATOM 416 CA ILE A 31 2.218 10.062 0.787 1.00 0.00 C ATOM 417 C ILE A 31 0.878 9.846 1.482 1.00 0.00 C ATOM 418 O ILE A 31 -0.159 10.308 1.007 1.00 0.00 O ATOM 419 CB ILE A 31 2.543 8.831 -0.084 1.00 0.00 C ATOM 420 CG1 ILE A 31 3.859 9.045 -0.834 1.00 0.00 C ATOM 421 CG2 ILE A 31 1.408 8.555 -1.062 1.00 0.00 C ATOM 422 CD1 ILE A 31 4.337 7.823 -1.590 1.00 0.00 C ATOM 0 H ILE A 31 3.940 9.559 1.877 1.00 0.00 H new ATOM 0 HA ILE A 31 2.152 10.940 0.145 1.00 0.00 H new ATOM 0 HB ILE A 31 2.652 7.963 0.567 1.00 0.00 H new ATOM 0 HG12 ILE A 31 3.737 9.870 -1.536 1.00 0.00 H new ATOM 0 HG13 ILE A 31 4.628 9.344 -0.122 1.00 0.00 H new ATOM 0 HG21 ILE A 31 1.654 7.683 -1.668 1.00 0.00 H new ATOM 0 HG22 ILE A 31 0.489 8.364 -0.508 1.00 0.00 H new ATOM 0 HG23 ILE A 31 1.268 9.420 -1.710 1.00 0.00 H new ATOM 0 HD11 ILE A 31 5.275 8.052 -2.096 1.00 0.00 H new ATOM 0 HD12 ILE A 31 4.493 7.001 -0.891 1.00 0.00 H new ATOM 0 HD13 ILE A 31 3.588 7.535 -2.327 1.00 0.00 H new ATOM 434 N ILE A 32 0.904 9.137 2.606 1.00 0.00 N ATOM 435 CA ILE A 32 -0.310 8.866 3.365 1.00 0.00 C ATOM 436 C ILE A 32 -0.910 10.162 3.898 1.00 0.00 C ATOM 437 O ILE A 32 -2.127 10.278 4.059 1.00 0.00 O ATOM 438 CB ILE A 32 -0.032 7.915 4.547 1.00 0.00 C ATOM 439 CG1 ILE A 32 0.616 6.622 4.046 1.00 0.00 C ATOM 440 CG2 ILE A 32 -1.319 7.613 5.303 1.00 0.00 C ATOM 441 CD1 ILE A 32 1.080 5.707 5.158 1.00 0.00 C ATOM 0 H ILE A 32 1.752 8.740 3.011 1.00 0.00 H new ATOM 0 HA ILE A 32 -1.016 8.388 2.687 1.00 0.00 H new ATOM 0 HB ILE A 32 0.659 8.405 5.233 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -0.098 6.086 3.420 1.00 0.00 H new ATOM 0 HG13 ILE A 32 1.468 6.873 3.414 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -1.104 6.941 6.134 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -1.741 8.541 5.688 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -2.034 7.141 4.630 1.00 0.00 H new ATOM 0 HD11 ILE A 32 1.529 4.811 4.729 1.00 0.00 H new ATOM 0 HD12 ILE A 32 1.818 6.224 5.771 1.00 0.00 H new ATOM 0 HD13 ILE A 32 0.228 5.425 5.777 1.00 0.00 H new ATOM 453 N MET A 33 -0.046 11.135 4.163 1.00 0.00 N ATOM 454 CA MET A 33 -0.480 12.427 4.681 1.00 0.00 C ATOM 455 C MET A 33 -0.675 13.432 3.552 1.00 0.00 C ATOM 456 O MET A 33 -1.038 14.584 3.792 1.00 0.00 O ATOM 457 CB MET A 33 0.541 12.962 5.685 1.00 0.00 C ATOM 458 CG MET A 33 0.736 12.059 6.893 1.00 0.00 C ATOM 459 SD MET A 33 -0.783 11.822 7.836 1.00 0.00 S ATOM 460 CE MET A 33 -1.120 13.498 8.367 1.00 0.00 C ATOM 0 H MET A 33 0.962 11.053 4.027 1.00 0.00 H new ATOM 0 HA MET A 33 -1.437 12.286 5.183 1.00 0.00 H new ATOM 0 HB2 MET A 33 1.499 13.094 5.182 1.00 0.00 H new ATOM 0 HB3 MET A 33 0.222 13.947 6.026 1.00 0.00 H new ATOM 0 HG2 MET A 33 1.108 11.090 6.561 1.00 0.00 H new ATOM 0 HG3 MET A 33 1.499 12.488 7.543 1.00 0.00 H new ATOM 0 HE1 MET A 33 -1.820 13.481 9.202 1.00 0.00 H new ATOM 0 HE2 MET A 33 -0.191 13.974 8.682 1.00 0.00 H new ATOM 0 HE3 MET A 33 -1.554 14.061 7.541 1.00 0.00 H new ATOM 470 N ASP A 34 -0.433 12.990 2.323 1.00 0.00 N ATOM 471 CA ASP A 34 -0.583 13.856 1.159 1.00 0.00 C ATOM 472 C ASP A 34 -2.048 14.222 0.942 1.00 0.00 C ATOM 473 O ASP A 34 -2.924 13.356 0.958 1.00 0.00 O ATOM 474 CB ASP A 34 -0.020 13.173 -0.089 1.00 0.00 C ATOM 475 CG ASP A 34 -0.148 14.037 -1.328 1.00 0.00 C ATOM 476 OD1 ASP A 34 0.773 14.838 -1.593 1.00 0.00 O ATOM 477 OD2 ASP A 34 -1.171 13.913 -2.033 1.00 0.00 O ATOM 0 H ASP A 34 -0.133 12.039 2.107 1.00 0.00 H new ATOM 0 HA ASP A 34 -0.022 14.773 1.342 1.00 0.00 H new ATOM 0 HB2 ASP A 34 1.030 12.931 0.075 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -0.543 12.230 -0.251 1.00 0.00 H new ATOM 482 N ASP A 35 -2.305 15.510 0.739 1.00 0.00 N ATOM 483 CA ASP A 35 -3.663 16.002 0.527 1.00 0.00 C ATOM 484 C ASP A 35 -4.327 15.312 -0.661 1.00 0.00 C ATOM 485 O ASP A 35 -5.444 14.807 -0.550 1.00 0.00 O ATOM 486 CB ASP A 35 -3.648 17.515 0.303 1.00 0.00 C ATOM 487 CG ASP A 35 -3.080 18.268 1.489 1.00 0.00 C ATOM 488 OD1 ASP A 35 -3.862 18.623 2.396 1.00 0.00 O ATOM 489 OD2 ASP A 35 -1.854 18.503 1.511 1.00 0.00 O ATOM 0 H ASP A 35 -1.588 16.235 0.717 1.00 0.00 H new ATOM 0 HA ASP A 35 -4.242 15.773 1.421 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -3.058 17.742 -0.585 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -4.663 17.861 0.108 1.00 0.00 H new ATOM 494 N GLU A 36 -3.637 15.297 -1.798 1.00 0.00 N ATOM 495 CA GLU A 36 -4.166 14.672 -3.004 1.00 0.00 C ATOM 496 C GLU A 36 -4.445 13.188 -2.777 1.00 0.00 C ATOM 497 O GLU A 36 -5.297 12.600 -3.441 1.00 0.00 O ATOM 498 CB GLU A 36 -3.189 14.850 -4.169 1.00 0.00 C ATOM 499 CG GLU A 36 -3.682 14.251 -5.477 1.00 0.00 C ATOM 500 CD GLU A 36 -2.708 14.463 -6.619 1.00 0.00 C ATOM 501 OE1 GLU A 36 -1.777 13.643 -6.766 1.00 0.00 O ATOM 502 OE2 GLU A 36 -2.876 15.449 -7.368 1.00 0.00 O ATOM 0 H GLU A 36 -2.711 15.710 -1.908 1.00 0.00 H new ATOM 0 HA GLU A 36 -5.107 15.163 -3.251 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -3.001 15.914 -4.315 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -2.236 14.391 -3.906 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -3.851 13.183 -5.342 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -4.643 14.695 -5.737 1.00 0.00 H new ATOM 509 N PHE A 37 -3.724 12.591 -1.832 1.00 0.00 N ATOM 510 CA PHE A 37 -3.896 11.175 -1.522 1.00 0.00 C ATOM 511 C PHE A 37 -5.145 10.945 -0.676 1.00 0.00 C ATOM 512 O PHE A 37 -5.842 9.946 -0.843 1.00 0.00 O ATOM 513 CB PHE A 37 -2.663 10.635 -0.795 1.00 0.00 C ATOM 514 CG PHE A 37 -2.796 9.200 -0.368 1.00 0.00 C ATOM 515 CD1 PHE A 37 -2.653 8.173 -1.287 1.00 0.00 C ATOM 516 CD2 PHE A 37 -3.067 8.879 0.953 1.00 0.00 C ATOM 517 CE1 PHE A 37 -2.777 6.853 -0.898 1.00 0.00 C ATOM 518 CE2 PHE A 37 -3.193 7.561 1.348 1.00 0.00 C ATOM 519 CZ PHE A 37 -3.048 6.547 0.422 1.00 0.00 C ATOM 0 H PHE A 37 -3.017 13.064 -1.269 1.00 0.00 H new ATOM 0 HA PHE A 37 -4.017 10.638 -2.463 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -1.795 10.732 -1.448 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -2.471 11.251 0.084 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -2.442 8.407 -2.320 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -3.181 9.668 1.682 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -2.662 6.062 -1.624 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -3.405 7.324 2.380 1.00 0.00 H new ATOM 0 HZ PHE A 37 -3.146 5.516 0.729 1.00 0.00 H new ATOM 529 N GLN A 38 -5.420 11.872 0.235 1.00 0.00 N ATOM 530 CA GLN A 38 -6.586 11.764 1.105 1.00 0.00 C ATOM 531 C GLN A 38 -7.879 11.953 0.317 1.00 0.00 C ATOM 532 O GLN A 38 -8.814 11.165 0.447 1.00 0.00 O ATOM 533 CB GLN A 38 -6.504 12.794 2.234 1.00 0.00 C ATOM 534 CG GLN A 38 -5.368 12.533 3.211 1.00 0.00 C ATOM 535 CD GLN A 38 -5.250 13.612 4.271 1.00 0.00 C ATOM 536 OE1 GLN A 38 -6.238 14.243 4.646 1.00 0.00 O ATOM 537 NE2 GLN A 38 -4.034 13.828 4.760 1.00 0.00 N ATOM 0 H GLN A 38 -4.853 12.705 0.390 1.00 0.00 H new ATOM 0 HA GLN A 38 -6.592 10.763 1.536 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -6.380 13.787 1.801 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -7.448 12.800 2.779 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -5.524 11.569 3.695 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -4.429 12.465 2.661 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -3.243 13.281 4.420 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -3.891 14.541 5.476 1.00 0.00 H new ATOM 546 N LEU A 39 -7.922 13.000 -0.499 1.00 0.00 N ATOM 547 CA LEU A 39 -9.102 13.294 -1.307 1.00 0.00 C ATOM 548 C LEU A 39 -9.365 12.176 -2.311 1.00 0.00 C ATOM 549 O LEU A 39 -10.511 11.779 -2.525 1.00 0.00 O ATOM 550 CB LEU A 39 -8.919 14.628 -2.040 1.00 0.00 C ATOM 551 CG LEU A 39 -10.174 15.175 -2.729 1.00 0.00 C ATOM 552 CD1 LEU A 39 -10.120 16.693 -2.802 1.00 0.00 C ATOM 553 CD2 LEU A 39 -10.323 14.586 -4.124 1.00 0.00 C ATOM 0 H LEU A 39 -7.154 13.660 -0.619 1.00 0.00 H new ATOM 0 HA LEU A 39 -9.963 13.367 -0.643 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -8.564 15.371 -1.325 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -8.137 14.508 -2.789 1.00 0.00 H new ATOM 0 HG LEU A 39 -11.042 14.883 -2.138 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -11.018 17.066 -3.294 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -10.061 17.104 -1.794 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -9.242 16.999 -3.370 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -11.220 14.988 -4.595 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -9.451 14.846 -4.724 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -10.405 13.501 -4.054 1.00 0.00 H new ATOM 565 N LEU A 40 -8.299 11.673 -2.925 1.00 0.00 N ATOM 566 CA LEU A 40 -8.414 10.607 -3.913 1.00 0.00 C ATOM 567 C LEU A 40 -8.860 9.295 -3.270 1.00 0.00 C ATOM 568 O LEU A 40 -9.744 8.611 -3.786 1.00 0.00 O ATOM 569 CB LEU A 40 -7.077 10.418 -4.636 1.00 0.00 C ATOM 570 CG LEU A 40 -7.000 9.213 -5.577 1.00 0.00 C ATOM 571 CD1 LEU A 40 -6.202 9.561 -6.824 1.00 0.00 C ATOM 572 CD2 LEU A 40 -6.377 8.022 -4.865 1.00 0.00 C ATOM 0 H LEU A 40 -7.344 11.988 -2.755 1.00 0.00 H new ATOM 0 HA LEU A 40 -9.176 10.897 -4.636 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -6.864 11.319 -5.211 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -6.290 10.323 -3.888 1.00 0.00 H new ATOM 0 HG LEU A 40 -8.013 8.946 -5.878 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -6.158 8.693 -7.482 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -6.685 10.387 -7.346 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -5.191 9.853 -6.539 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -6.330 7.174 -5.548 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -5.370 8.280 -4.537 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -6.984 7.757 -3.999 1.00 0.00 H new ATOM 584 N GLN A 41 -8.247 8.952 -2.141 1.00 0.00 N ATOM 585 CA GLN A 41 -8.576 7.718 -1.433 1.00 0.00 C ATOM 586 C GLN A 41 -10.051 7.678 -1.040 1.00 0.00 C ATOM 587 O GLN A 41 -10.744 6.694 -1.297 1.00 0.00 O ATOM 588 CB GLN A 41 -7.700 7.575 -0.186 1.00 0.00 C ATOM 589 CG GLN A 41 -7.877 6.250 0.538 1.00 0.00 C ATOM 590 CD GLN A 41 -7.022 6.149 1.786 1.00 0.00 C ATOM 591 OE1 GLN A 41 -6.720 7.154 2.430 1.00 0.00 O ATOM 592 NE2 GLN A 41 -6.625 4.929 2.136 1.00 0.00 N ATOM 0 H GLN A 41 -7.519 9.511 -1.696 1.00 0.00 H new ATOM 0 HA GLN A 41 -8.383 6.884 -2.108 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -6.654 7.685 -0.473 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -7.929 8.388 0.503 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -8.925 6.126 0.809 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -7.624 5.434 -0.139 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -6.898 4.123 1.574 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -6.047 4.799 2.967 1.00 0.00 H new ATOM 601 N ARG A 42 -10.525 8.753 -0.419 1.00 0.00 N ATOM 602 CA ARG A 42 -11.917 8.838 0.017 1.00 0.00 C ATOM 603 C ARG A 42 -12.870 8.883 -1.174 1.00 0.00 C ATOM 604 O ARG A 42 -13.990 8.374 -1.103 1.00 0.00 O ATOM 605 CB ARG A 42 -12.117 10.076 0.893 1.00 0.00 C ATOM 606 CG ARG A 42 -11.201 10.120 2.105 1.00 0.00 C ATOM 607 CD ARG A 42 -11.588 9.075 3.139 1.00 0.00 C ATOM 608 NE ARG A 42 -12.854 9.396 3.795 1.00 0.00 N ATOM 609 CZ ARG A 42 -13.184 8.970 5.011 1.00 0.00 C ATOM 610 NH1 ARG A 42 -12.344 8.212 5.702 1.00 0.00 N ATOM 611 NH2 ARG A 42 -14.353 9.304 5.536 1.00 0.00 N ATOM 0 H ARG A 42 -9.966 9.579 -0.205 1.00 0.00 H new ATOM 0 HA ARG A 42 -12.143 7.943 0.597 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -11.950 10.968 0.290 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -13.153 10.108 1.230 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -10.171 9.956 1.789 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -11.242 11.111 2.556 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -11.666 8.100 2.657 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -10.801 8.998 3.889 1.00 0.00 H new ATOM 0 HE ARG A 42 -13.522 9.980 3.292 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -11.442 7.954 5.301 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -12.600 7.887 6.634 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -15.001 9.888 5.008 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -14.605 8.977 6.469 1.00 0.00 H new ATOM 625 N ASN A 43 -12.420 9.492 -2.266 1.00 0.00 N ATOM 626 CA ASN A 43 -13.237 9.617 -3.469 1.00 0.00 C ATOM 627 C ASN A 43 -13.602 8.253 -4.047 1.00 0.00 C ATOM 628 O ASN A 43 -14.763 8.001 -4.374 1.00 0.00 O ATOM 629 CB ASN A 43 -12.505 10.447 -4.525 1.00 0.00 C ATOM 630 CG ASN A 43 -13.344 10.668 -5.769 1.00 0.00 C ATOM 631 OD1 ASN A 43 -13.297 9.880 -6.713 1.00 0.00 O ATOM 632 ND2 ASN A 43 -14.120 11.746 -5.774 1.00 0.00 N ATOM 0 H ASN A 43 -11.492 9.908 -2.343 1.00 0.00 H new ATOM 0 HA ASN A 43 -14.160 10.122 -3.186 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -12.230 11.412 -4.099 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -11.578 9.944 -4.800 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -14.708 11.947 -6.583 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -14.128 12.373 -4.969 1.00 0.00 H new ATOM 639 N PHE A 44 -12.611 7.376 -4.171 1.00 0.00 N ATOM 640 CA PHE A 44 -12.838 6.044 -4.723 1.00 0.00 C ATOM 641 C PHE A 44 -13.469 5.107 -3.695 1.00 0.00 C ATOM 642 O PHE A 44 -14.355 4.322 -4.030 1.00 0.00 O ATOM 643 CB PHE A 44 -11.527 5.450 -5.243 1.00 0.00 C ATOM 644 CG PHE A 44 -11.091 6.031 -6.558 1.00 0.00 C ATOM 645 CD1 PHE A 44 -11.566 5.510 -7.750 1.00 0.00 C ATOM 646 CD2 PHE A 44 -10.210 7.100 -6.602 1.00 0.00 C ATOM 647 CE1 PHE A 44 -11.170 6.042 -8.963 1.00 0.00 C ATOM 648 CE2 PHE A 44 -9.810 7.636 -7.810 1.00 0.00 C ATOM 649 CZ PHE A 44 -10.291 7.107 -8.993 1.00 0.00 C ATOM 0 H PHE A 44 -11.646 7.562 -3.898 1.00 0.00 H new ATOM 0 HA PHE A 44 -13.537 6.148 -5.553 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -10.743 5.614 -4.503 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -11.642 4.371 -5.351 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -12.254 4.678 -7.732 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -9.832 7.519 -5.681 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -11.547 5.626 -9.885 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -9.122 8.468 -7.831 1.00 0.00 H new ATOM 0 HZ PHE A 44 -9.980 7.526 -9.939 1.00 0.00 H new ATOM 659 N MET A 45 -13.014 5.191 -2.447 1.00 0.00 N ATOM 660 CA MET A 45 -13.548 4.338 -1.387 1.00 0.00 C ATOM 661 C MET A 45 -15.047 4.556 -1.209 1.00 0.00 C ATOM 662 O MET A 45 -15.761 3.668 -0.744 1.00 0.00 O ATOM 663 CB MET A 45 -12.823 4.599 -0.066 1.00 0.00 C ATOM 664 CG MET A 45 -11.440 3.971 0.005 1.00 0.00 C ATOM 665 SD MET A 45 -10.746 4.000 1.669 1.00 0.00 S ATOM 666 CE MET A 45 -11.964 3.039 2.565 1.00 0.00 C ATOM 0 H MET A 45 -12.283 5.835 -2.146 1.00 0.00 H new ATOM 0 HA MET A 45 -13.382 3.302 -1.682 1.00 0.00 H new ATOM 0 HB2 MET A 45 -12.732 5.675 0.082 1.00 0.00 H new ATOM 0 HB3 MET A 45 -13.430 4.214 0.754 1.00 0.00 H new ATOM 0 HG2 MET A 45 -11.496 2.940 -0.343 1.00 0.00 H new ATOM 0 HG3 MET A 45 -10.770 4.500 -0.673 1.00 0.00 H new ATOM 0 HE1 MET A 45 -11.488 2.551 3.415 1.00 0.00 H new ATOM 0 HE2 MET A 45 -12.756 3.697 2.921 1.00 0.00 H new ATOM 0 HE3 MET A 45 -12.389 2.284 1.904 1.00 0.00 H new ATOM 676 N ASP A 46 -15.516 5.742 -1.580 1.00 0.00 N ATOM 677 CA ASP A 46 -16.932 6.075 -1.466 1.00 0.00 C ATOM 678 C ASP A 46 -17.776 5.164 -2.352 1.00 0.00 C ATOM 679 O ASP A 46 -18.929 4.870 -2.037 1.00 0.00 O ATOM 680 CB ASP A 46 -17.165 7.538 -1.847 1.00 0.00 C ATOM 681 CG ASP A 46 -18.613 7.955 -1.682 1.00 0.00 C ATOM 682 OD1 ASP A 46 -18.992 8.355 -0.562 1.00 0.00 O ATOM 683 OD2 ASP A 46 -19.368 7.881 -2.675 1.00 0.00 O ATOM 0 H ASP A 46 -14.937 6.489 -1.962 1.00 0.00 H new ATOM 0 HA ASP A 46 -17.234 5.925 -0.430 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -16.533 8.176 -1.229 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -16.861 7.694 -2.882 1.00 0.00 H new ATOM 688 N LYS A 47 -17.197 4.727 -3.464 1.00 0.00 N ATOM 689 CA LYS A 47 -17.892 3.851 -4.400 1.00 0.00 C ATOM 690 C LYS A 47 -17.606 2.385 -4.093 1.00 0.00 C ATOM 691 O LYS A 47 -18.509 1.549 -4.091 1.00 0.00 O ATOM 692 CB LYS A 47 -17.463 4.169 -5.832 1.00 0.00 C ATOM 693 CG LYS A 47 -18.394 3.602 -6.891 1.00 0.00 C ATOM 694 CD LYS A 47 -19.760 4.266 -6.845 1.00 0.00 C ATOM 695 CE LYS A 47 -20.694 3.691 -7.897 1.00 0.00 C ATOM 696 NZ LYS A 47 -22.035 4.338 -7.864 1.00 0.00 N ATOM 0 H LYS A 47 -16.245 4.966 -3.740 1.00 0.00 H new ATOM 0 HA LYS A 47 -18.963 4.024 -4.294 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -17.406 5.251 -5.953 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -16.459 3.777 -5.996 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -17.953 3.743 -7.878 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -18.505 2.528 -6.742 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -20.198 4.132 -5.856 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -19.650 5.339 -7.002 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -20.252 3.822 -8.885 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -20.805 2.619 -7.737 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -22.642 3.917 -8.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -22.468 4.192 -6.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -21.933 5.358 -8.042 1.00 0.00 H new ATOM 710 N TYR A 48 -16.338 2.085 -3.838 1.00 0.00 N ATOM 711 CA TYR A 48 -15.910 0.721 -3.536 1.00 0.00 C ATOM 712 C TYR A 48 -16.684 0.128 -2.359 1.00 0.00 C ATOM 713 O TYR A 48 -17.219 -0.977 -2.457 1.00 0.00 O ATOM 714 CB TYR A 48 -14.411 0.691 -3.230 1.00 0.00 C ATOM 715 CG TYR A 48 -13.533 0.670 -4.462 1.00 0.00 C ATOM 716 CD1 TYR A 48 -13.603 1.681 -5.411 1.00 0.00 C ATOM 717 CD2 TYR A 48 -12.629 -0.366 -4.672 1.00 0.00 C ATOM 718 CE1 TYR A 48 -12.798 1.661 -6.535 1.00 0.00 C ATOM 719 CE2 TYR A 48 -11.821 -0.392 -5.792 1.00 0.00 C ATOM 720 CZ TYR A 48 -11.909 0.623 -6.721 1.00 0.00 C ATOM 721 OH TYR A 48 -11.107 0.600 -7.837 1.00 0.00 O ATOM 0 H TYR A 48 -15.583 2.771 -3.834 1.00 0.00 H new ATOM 0 HA TYR A 48 -16.118 0.114 -4.417 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -14.156 1.564 -2.629 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -14.191 -0.188 -2.625 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -14.297 2.496 -5.269 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -12.558 -1.163 -3.947 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -12.865 2.455 -7.264 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -11.124 -1.203 -5.939 1.00 0.00 H new ATOM 0 HH TYR A 48 -10.178 0.769 -7.576 1.00 0.00 H new ATOM 731 N TYR A 49 -16.745 0.862 -1.251 1.00 0.00 N ATOM 732 CA TYR A 49 -17.440 0.384 -0.057 1.00 0.00 C ATOM 733 C TYR A 49 -18.914 0.099 -0.345 1.00 0.00 C ATOM 734 O TYR A 49 -19.571 -0.621 0.407 1.00 0.00 O ATOM 735 CB TYR A 49 -17.288 1.391 1.094 1.00 0.00 C ATOM 736 CG TYR A 49 -18.499 2.271 1.337 1.00 0.00 C ATOM 737 CD1 TYR A 49 -18.700 3.430 0.601 1.00 0.00 C ATOM 738 CD2 TYR A 49 -19.434 1.941 2.312 1.00 0.00 C ATOM 739 CE1 TYR A 49 -19.801 4.237 0.826 1.00 0.00 C ATOM 740 CE2 TYR A 49 -20.535 2.743 2.544 1.00 0.00 C ATOM 741 CZ TYR A 49 -20.714 3.888 1.799 1.00 0.00 C ATOM 742 OH TYR A 49 -21.810 4.690 2.026 1.00 0.00 O ATOM 0 H TYR A 49 -16.324 1.786 -1.154 1.00 0.00 H new ATOM 0 HA TYR A 49 -16.979 -0.556 0.246 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -17.066 0.843 2.010 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -16.429 2.029 0.888 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -17.985 3.707 -0.160 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -19.297 1.044 2.897 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -19.945 5.135 0.243 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -21.252 2.474 3.306 1.00 0.00 H new ATOM 0 HH TYR A 49 -22.558 4.141 2.342 1.00 0.00 H new ATOM 752 N LEU A 50 -19.425 0.661 -1.436 1.00 0.00 N ATOM 753 CA LEU A 50 -20.819 0.453 -1.819 1.00 0.00 C ATOM 754 C LEU A 50 -20.990 -0.877 -2.548 1.00 0.00 C ATOM 755 O LEU A 50 -21.929 -1.627 -2.278 1.00 0.00 O ATOM 756 CB LEU A 50 -21.310 1.598 -2.710 1.00 0.00 C ATOM 757 CG LEU A 50 -21.507 2.940 -2.001 1.00 0.00 C ATOM 758 CD1 LEU A 50 -21.862 4.026 -3.006 1.00 0.00 C ATOM 759 CD2 LEU A 50 -22.589 2.828 -0.938 1.00 0.00 C ATOM 0 H LEU A 50 -18.898 1.262 -2.069 1.00 0.00 H new ATOM 0 HA LEU A 50 -21.416 0.432 -0.907 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -20.596 1.736 -3.522 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -22.256 1.303 -3.164 1.00 0.00 H new ATOM 0 HG LEU A 50 -20.571 3.212 -1.514 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -21.999 4.974 -2.485 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -21.057 4.125 -3.734 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -22.785 3.758 -3.520 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -22.715 3.792 -0.444 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -23.529 2.534 -1.405 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -22.299 2.078 -0.202 1.00 0.00 H new ATOM 771 N GLU A 51 -20.076 -1.163 -3.470 1.00 0.00 N ATOM 772 CA GLU A 51 -20.127 -2.402 -4.243 1.00 0.00 C ATOM 773 C GLU A 51 -19.861 -3.615 -3.355 1.00 0.00 C ATOM 774 O GLU A 51 -20.451 -4.679 -3.552 1.00 0.00 O ATOM 775 CB GLU A 51 -19.108 -2.359 -5.383 1.00 0.00 C ATOM 776 CG GLU A 51 -19.311 -1.191 -6.335 1.00 0.00 C ATOM 777 CD GLU A 51 -18.280 -1.158 -7.446 1.00 0.00 C ATOM 778 OE1 GLU A 51 -17.166 -0.646 -7.207 1.00 0.00 O ATOM 779 OE2 GLU A 51 -18.587 -1.644 -8.555 1.00 0.00 O ATOM 0 H GLU A 51 -19.291 -0.554 -3.701 1.00 0.00 H new ATOM 0 HA GLU A 51 -21.129 -2.495 -4.661 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -18.105 -2.303 -4.961 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -19.165 -3.290 -5.946 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -20.308 -1.252 -6.771 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -19.265 -0.258 -5.774 1.00 0.00 H new ATOM 786 N PHE A 52 -18.975 -3.451 -2.379 1.00 0.00 N ATOM 787 CA PHE A 52 -18.635 -4.539 -1.468 1.00 0.00 C ATOM 788 C PHE A 52 -19.799 -4.860 -0.537 1.00 0.00 C ATOM 789 O PHE A 52 -19.933 -4.267 0.534 1.00 0.00 O ATOM 790 CB PHE A 52 -17.390 -4.186 -0.650 1.00 0.00 C ATOM 791 CG PHE A 52 -16.099 -4.540 -1.336 1.00 0.00 C ATOM 792 CD1 PHE A 52 -15.628 -3.782 -2.395 1.00 0.00 C ATOM 793 CD2 PHE A 52 -15.359 -5.635 -0.920 1.00 0.00 C ATOM 794 CE1 PHE A 52 -14.443 -4.108 -3.027 1.00 0.00 C ATOM 795 CE2 PHE A 52 -14.173 -5.966 -1.547 1.00 0.00 C ATOM 796 CZ PHE A 52 -13.714 -5.202 -2.602 1.00 0.00 C ATOM 0 H PHE A 52 -18.480 -2.578 -2.198 1.00 0.00 H new ATOM 0 HA PHE A 52 -18.423 -5.423 -2.069 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -17.397 -3.117 -0.436 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -17.436 -4.703 0.308 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -16.194 -2.926 -2.731 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -15.713 -6.237 -0.096 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -14.087 -3.508 -3.852 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -13.605 -6.822 -1.212 1.00 0.00 H new ATOM 0 HZ PHE A 52 -12.787 -5.459 -3.094 1.00 0.00 H new ATOM 806 N GLU A 53 -20.641 -5.800 -0.957 1.00 0.00 N ATOM 807 CA GLU A 53 -21.792 -6.211 -0.161 1.00 0.00 C ATOM 808 C GLU A 53 -21.438 -7.406 0.720 1.00 0.00 C ATOM 809 O GLU A 53 -20.716 -8.308 0.296 1.00 0.00 O ATOM 810 CB GLU A 53 -22.973 -6.565 -1.070 1.00 0.00 C ATOM 811 CG GLU A 53 -24.221 -6.990 -0.313 1.00 0.00 C ATOM 812 CD GLU A 53 -24.786 -5.880 0.553 1.00 0.00 C ATOM 813 OE1 GLU A 53 -25.630 -5.107 0.052 1.00 0.00 O ATOM 814 OE2 GLU A 53 -24.384 -5.785 1.731 1.00 0.00 O ATOM 0 H GLU A 53 -20.547 -6.292 -1.846 1.00 0.00 H new ATOM 0 HA GLU A 53 -22.077 -5.376 0.480 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -23.212 -5.703 -1.692 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -22.675 -7.370 -1.742 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -24.981 -7.312 -1.025 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -23.986 -7.850 0.314 1.00 0.00 H new ATOM 821 N ASP A 54 -21.948 -7.404 1.946 1.00 0.00 N ATOM 822 CA ASP A 54 -21.686 -8.489 2.884 1.00 0.00 C ATOM 823 C ASP A 54 -22.593 -9.683 2.601 1.00 0.00 C ATOM 824 O ASP A 54 -23.742 -9.720 3.042 1.00 0.00 O ATOM 825 CB ASP A 54 -21.886 -8.009 4.323 1.00 0.00 C ATOM 826 CG ASP A 54 -21.597 -9.095 5.341 1.00 0.00 C ATOM 827 OD1 ASP A 54 -20.422 -9.240 5.737 1.00 0.00 O ATOM 828 OD2 ASP A 54 -22.547 -9.798 5.744 1.00 0.00 O ATOM 0 H ASP A 54 -22.545 -6.663 2.314 1.00 0.00 H new ATOM 0 HA ASP A 54 -20.650 -8.804 2.756 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -21.235 -7.155 4.512 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -22.912 -7.662 4.448 1.00 0.00 H new ATOM 833 N THR A 55 -22.072 -10.653 1.856 1.00 0.00 N ATOM 834 CA THR A 55 -22.833 -11.848 1.512 1.00 0.00 C ATOM 835 C THR A 55 -21.944 -13.087 1.524 1.00 0.00 C ATOM 836 O THR A 55 -20.809 -13.043 2.000 1.00 0.00 O ATOM 837 CB THR A 55 -23.493 -11.714 0.126 1.00 0.00 C ATOM 838 OG1 THR A 55 -22.499 -11.425 -0.865 1.00 0.00 O ATOM 839 CG2 THR A 55 -24.545 -10.616 0.131 1.00 0.00 C ATOM 0 H THR A 55 -21.125 -10.634 1.479 1.00 0.00 H new ATOM 0 HA THR A 55 -23.612 -11.956 2.267 1.00 0.00 H new ATOM 0 HB THR A 55 -23.979 -12.660 -0.113 1.00 0.00 H new ATOM 0 HG1 THR A 55 -22.927 -11.343 -1.743 1.00 0.00 H new ATOM 0 HG21 THR A 55 -24.997 -10.540 -0.858 1.00 0.00 H new ATOM 0 HG22 THR A 55 -25.315 -10.854 0.865 1.00 0.00 H new ATOM 0 HG23 THR A 55 -24.078 -9.666 0.390 1.00 0.00 H new ATOM 847 N GLU A 56 -22.466 -14.190 0.997 1.00 0.00 N ATOM 848 CA GLU A 56 -21.719 -15.442 0.953 1.00 0.00 C ATOM 849 C GLU A 56 -21.412 -15.845 -0.488 1.00 0.00 C ATOM 850 O GLU A 56 -20.479 -16.608 -0.742 1.00 0.00 O ATOM 851 CB GLU A 56 -22.500 -16.558 1.656 1.00 0.00 C ATOM 852 CG GLU A 56 -23.792 -16.952 0.954 1.00 0.00 C ATOM 853 CD GLU A 56 -24.841 -15.857 0.992 1.00 0.00 C ATOM 854 OE1 GLU A 56 -25.526 -15.729 2.028 1.00 0.00 O ATOM 855 OE2 GLU A 56 -24.978 -15.131 -0.014 1.00 0.00 O ATOM 0 H GLU A 56 -23.402 -14.242 0.595 1.00 0.00 H new ATOM 0 HA GLU A 56 -20.775 -15.288 1.476 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -21.861 -17.437 1.738 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -22.734 -16.238 2.671 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -23.574 -17.203 -0.084 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -24.195 -17.850 1.422 1.00 0.00 H new ATOM 862 N GLU A 57 -22.199 -15.326 -1.424 1.00 0.00 N ATOM 863 CA GLU A 57 -22.009 -15.632 -2.838 1.00 0.00 C ATOM 864 C GLU A 57 -20.933 -14.738 -3.446 1.00 0.00 C ATOM 865 O GLU A 57 -20.968 -13.517 -3.294 1.00 0.00 O ATOM 866 CB GLU A 57 -23.324 -15.460 -3.600 1.00 0.00 C ATOM 867 CG GLU A 57 -23.238 -15.862 -5.063 1.00 0.00 C ATOM 868 CD GLU A 57 -22.875 -17.323 -5.245 1.00 0.00 C ATOM 869 OE1 GLU A 57 -23.794 -18.168 -5.245 1.00 0.00 O ATOM 870 OE2 GLU A 57 -21.669 -17.622 -5.386 1.00 0.00 O ATOM 0 H GLU A 57 -22.974 -14.692 -1.230 1.00 0.00 H new ATOM 0 HA GLU A 57 -21.684 -16.669 -2.921 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -24.096 -16.055 -3.113 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -23.637 -14.418 -3.536 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -24.195 -15.666 -5.547 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -22.495 -15.241 -5.564 1.00 0.00 H new ATOM 877 N ASN A 58 -19.977 -15.355 -4.133 1.00 0.00 N ATOM 878 CA ASN A 58 -18.889 -14.615 -4.762 1.00 0.00 C ATOM 879 C ASN A 58 -19.280 -14.152 -6.161 1.00 0.00 C ATOM 880 O ASN A 58 -19.581 -14.965 -7.035 1.00 0.00 O ATOM 881 CB ASN A 58 -17.631 -15.485 -4.831 1.00 0.00 C ATOM 882 CG ASN A 58 -17.221 -16.011 -3.470 1.00 0.00 C ATOM 883 OD1 ASN A 58 -17.668 -17.076 -3.041 1.00 0.00 O ATOM 884 ND2 ASN A 58 -16.364 -15.266 -2.781 1.00 0.00 N ATOM 0 H ASN A 58 -19.934 -16.365 -4.268 1.00 0.00 H new ATOM 0 HA ASN A 58 -18.682 -13.733 -4.155 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -17.808 -16.324 -5.504 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -16.812 -14.904 -5.255 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -16.051 -15.569 -1.859 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -16.019 -14.390 -3.174 1.00 0.00 H new ATOM 891 N LYS A 59 -19.273 -12.838 -6.367 1.00 0.00 N ATOM 892 CA LYS A 59 -19.628 -12.261 -7.659 1.00 0.00 C ATOM 893 C LYS A 59 -18.388 -12.049 -8.522 1.00 0.00 C ATOM 894 O LYS A 59 -17.276 -11.930 -8.009 1.00 0.00 O ATOM 895 CB LYS A 59 -20.358 -10.930 -7.468 1.00 0.00 C ATOM 896 CG LYS A 59 -21.630 -11.046 -6.643 1.00 0.00 C ATOM 897 CD LYS A 59 -22.345 -9.708 -6.536 1.00 0.00 C ATOM 898 CE LYS A 59 -23.622 -9.824 -5.720 1.00 0.00 C ATOM 899 NZ LYS A 59 -24.570 -10.810 -6.309 1.00 0.00 N ATOM 0 H LYS A 59 -19.025 -12.152 -5.654 1.00 0.00 H new ATOM 0 HA LYS A 59 -20.290 -12.962 -8.167 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -19.685 -10.222 -6.985 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -20.606 -10.517 -8.446 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -22.295 -11.780 -7.098 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -21.387 -11.411 -5.645 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -21.682 -8.976 -6.075 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -22.582 -9.340 -7.534 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -23.376 -10.121 -4.701 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -24.104 -8.848 -5.660 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -25.512 -10.681 -5.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -24.629 -10.664 -7.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -24.233 -11.774 -6.115 1.00 0.00 H new ATOM 913 N LEU A 60 -18.588 -12.010 -9.836 1.00 0.00 N ATOM 914 CA LEU A 60 -17.489 -11.811 -10.773 1.00 0.00 C ATOM 915 C LEU A 60 -17.112 -10.334 -10.877 1.00 0.00 C ATOM 916 O LEU A 60 -16.098 -9.986 -11.482 1.00 0.00 O ATOM 917 CB LEU A 60 -17.867 -12.348 -12.156 1.00 0.00 C ATOM 918 CG LEU A 60 -18.169 -13.847 -12.216 1.00 0.00 C ATOM 919 CD1 LEU A 60 -18.582 -14.250 -13.622 1.00 0.00 C ATOM 920 CD2 LEU A 60 -16.962 -14.657 -11.763 1.00 0.00 C ATOM 0 H LEU A 60 -19.502 -12.114 -10.276 1.00 0.00 H new ATOM 0 HA LEU A 60 -16.626 -12.360 -10.397 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -18.741 -11.804 -12.512 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -17.053 -12.130 -12.847 1.00 0.00 H new ATOM 0 HG LEU A 60 -18.996 -14.057 -11.538 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -18.793 -15.319 -13.647 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -19.476 -13.697 -13.911 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -17.774 -14.023 -14.318 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -17.198 -15.720 -11.813 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -16.115 -14.442 -12.414 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -16.709 -14.390 -10.737 1.00 0.00 H new ATOM 932 N ILE A 61 -17.934 -9.472 -10.286 1.00 0.00 N ATOM 933 CA ILE A 61 -17.691 -8.032 -10.321 1.00 0.00 C ATOM 934 C ILE A 61 -16.490 -7.653 -9.456 1.00 0.00 C ATOM 935 O ILE A 61 -15.926 -6.565 -9.597 1.00 0.00 O ATOM 936 CB ILE A 61 -18.933 -7.245 -9.849 1.00 0.00 C ATOM 937 CG1 ILE A 61 -18.765 -5.747 -10.122 1.00 0.00 C ATOM 938 CG2 ILE A 61 -19.187 -7.491 -8.369 1.00 0.00 C ATOM 939 CD1 ILE A 61 -18.742 -5.396 -11.595 1.00 0.00 C ATOM 0 H ILE A 61 -18.775 -9.745 -9.777 1.00 0.00 H new ATOM 0 HA ILE A 61 -17.478 -7.768 -11.357 1.00 0.00 H new ATOM 0 HB ILE A 61 -19.796 -7.599 -10.413 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -19.580 -5.205 -9.641 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -17.839 -5.404 -9.661 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -20.066 -6.929 -8.052 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -19.356 -8.555 -8.201 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -18.321 -7.166 -7.792 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -18.620 -4.319 -11.711 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -17.911 -5.909 -12.078 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -19.679 -5.707 -12.058 1.00 0.00 H new ATOM 951 N TYR A 62 -16.097 -8.558 -8.566 1.00 0.00 N ATOM 952 CA TYR A 62 -14.964 -8.315 -7.680 1.00 0.00 C ATOM 953 C TYR A 62 -13.646 -8.337 -8.450 1.00 0.00 C ATOM 954 O TYR A 62 -12.639 -7.805 -7.983 1.00 0.00 O ATOM 955 CB TYR A 62 -14.931 -9.356 -6.559 1.00 0.00 C ATOM 956 CG TYR A 62 -16.022 -9.173 -5.526 1.00 0.00 C ATOM 957 CD1 TYR A 62 -17.306 -9.655 -5.751 1.00 0.00 C ATOM 958 CD2 TYR A 62 -15.766 -8.519 -4.328 1.00 0.00 C ATOM 959 CE1 TYR A 62 -18.304 -9.489 -4.808 1.00 0.00 C ATOM 960 CE2 TYR A 62 -16.758 -8.349 -3.382 1.00 0.00 C ATOM 961 CZ TYR A 62 -18.025 -8.836 -3.626 1.00 0.00 C ATOM 962 OH TYR A 62 -19.016 -8.669 -2.686 1.00 0.00 O ATOM 0 H TYR A 62 -16.545 -9.465 -8.439 1.00 0.00 H new ATOM 0 HA TYR A 62 -15.088 -7.324 -7.244 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -15.020 -10.351 -6.996 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -13.962 -9.312 -6.062 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -17.528 -10.167 -6.676 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -14.775 -8.137 -4.133 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -19.297 -9.869 -4.997 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -16.542 -7.837 -2.456 1.00 0.00 H new ATOM 0 HH TYR A 62 -18.655 -8.190 -1.911 1.00 0.00 H new ATOM 972 N THR A 63 -13.654 -8.951 -9.632 1.00 0.00 N ATOM 973 CA THR A 63 -12.449 -9.033 -10.452 1.00 0.00 C ATOM 974 C THR A 63 -12.114 -7.685 -11.101 1.00 0.00 C ATOM 975 O THR A 63 -10.990 -7.200 -10.966 1.00 0.00 O ATOM 976 CB THR A 63 -12.573 -10.117 -11.543 1.00 0.00 C ATOM 977 OG1 THR A 63 -12.866 -11.384 -10.943 1.00 0.00 O ATOM 978 CG2 THR A 63 -11.290 -10.222 -12.356 1.00 0.00 C ATOM 0 H THR A 63 -14.476 -9.396 -10.040 1.00 0.00 H new ATOM 0 HA THR A 63 -11.636 -9.308 -9.780 1.00 0.00 H new ATOM 0 HB THR A 63 -13.385 -9.833 -12.212 1.00 0.00 H new ATOM 0 HG1 THR A 63 -12.945 -12.066 -11.642 1.00 0.00 H new ATOM 0 HG21 THR A 63 -11.404 -10.993 -13.118 1.00 0.00 H new ATOM 0 HG22 THR A 63 -11.084 -9.265 -12.836 1.00 0.00 H new ATOM 0 HG23 THR A 63 -10.462 -10.483 -11.697 1.00 0.00 H new ATOM 986 N PRO A 64 -13.072 -7.051 -11.815 1.00 0.00 N ATOM 987 CA PRO A 64 -12.835 -5.752 -12.457 1.00 0.00 C ATOM 988 C PRO A 64 -12.574 -4.651 -11.435 1.00 0.00 C ATOM 989 O PRO A 64 -11.709 -3.797 -11.636 1.00 0.00 O ATOM 990 CB PRO A 64 -14.133 -5.475 -13.221 1.00 0.00 C ATOM 991 CG PRO A 64 -15.161 -6.314 -12.548 1.00 0.00 C ATOM 992 CD PRO A 64 -14.440 -7.541 -12.070 1.00 0.00 C ATOM 0 HA PRO A 64 -11.953 -5.771 -13.098 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -14.397 -4.418 -13.180 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -14.035 -5.739 -14.274 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -15.618 -5.780 -11.715 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -15.964 -6.576 -13.237 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -14.896 -7.950 -11.168 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -14.451 -8.332 -12.820 1.00 0.00 H new ATOM 1000 N ILE A 65 -13.329 -4.676 -10.340 1.00 0.00 N ATOM 1001 CA ILE A 65 -13.174 -3.684 -9.283 1.00 0.00 C ATOM 1002 C ILE A 65 -11.765 -3.724 -8.700 1.00 0.00 C ATOM 1003 O ILE A 65 -11.127 -2.685 -8.522 1.00 0.00 O ATOM 1004 CB ILE A 65 -14.202 -3.900 -8.152 1.00 0.00 C ATOM 1005 CG1 ILE A 65 -15.622 -3.678 -8.679 1.00 0.00 C ATOM 1006 CG2 ILE A 65 -13.914 -2.969 -6.981 1.00 0.00 C ATOM 1007 CD1 ILE A 65 -16.704 -4.078 -7.698 1.00 0.00 C ATOM 0 H ILE A 65 -14.053 -5.372 -10.163 1.00 0.00 H new ATOM 0 HA ILE A 65 -13.349 -2.707 -9.733 1.00 0.00 H new ATOM 0 HB ILE A 65 -14.119 -4.928 -7.798 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -15.745 -2.625 -8.933 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -15.751 -4.246 -9.600 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -14.649 -3.136 -6.194 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -12.915 -3.170 -6.593 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -13.971 -1.934 -7.317 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -17.683 -3.892 -8.140 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -16.607 -5.138 -7.462 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -16.602 -3.492 -6.785 1.00 0.00 H new ATOM 1019 N PHE A 66 -11.284 -4.929 -8.407 1.00 0.00 N ATOM 1020 CA PHE A 66 -9.949 -5.103 -7.847 1.00 0.00 C ATOM 1021 C PHE A 66 -8.885 -4.605 -8.821 1.00 0.00 C ATOM 1022 O PHE A 66 -7.879 -4.026 -8.412 1.00 0.00 O ATOM 1023 CB PHE A 66 -9.703 -6.575 -7.506 1.00 0.00 C ATOM 1024 CG PHE A 66 -8.389 -6.823 -6.824 1.00 0.00 C ATOM 1025 CD1 PHE A 66 -8.220 -6.515 -5.483 1.00 0.00 C ATOM 1026 CD2 PHE A 66 -7.321 -7.363 -7.523 1.00 0.00 C ATOM 1027 CE1 PHE A 66 -7.012 -6.743 -4.853 1.00 0.00 C ATOM 1028 CE2 PHE A 66 -6.111 -7.593 -6.898 1.00 0.00 C ATOM 1029 CZ PHE A 66 -5.956 -7.282 -5.560 1.00 0.00 C ATOM 0 H PHE A 66 -11.799 -5.798 -8.548 1.00 0.00 H new ATOM 0 HA PHE A 66 -9.883 -4.513 -6.933 1.00 0.00 H new ATOM 0 HB2 PHE A 66 -10.509 -6.930 -6.864 1.00 0.00 H new ATOM 0 HB3 PHE A 66 -9.744 -7.163 -8.423 1.00 0.00 H new ATOM 0 HD1 PHE A 66 -9.042 -6.092 -4.925 1.00 0.00 H new ATOM 0 HD2 PHE A 66 -7.436 -7.607 -8.569 1.00 0.00 H new ATOM 0 HE1 PHE A 66 -6.894 -6.500 -3.807 1.00 0.00 H new ATOM 0 HE2 PHE A 66 -5.287 -8.015 -7.454 1.00 0.00 H new ATOM 0 HZ PHE A 66 -5.011 -7.460 -5.069 1.00 0.00 H new ATOM 1039 N ASN A 67 -9.114 -4.834 -10.111 1.00 0.00 N ATOM 1040 CA ASN A 67 -8.178 -4.405 -11.144 1.00 0.00 C ATOM 1041 C ASN A 67 -8.047 -2.886 -11.160 1.00 0.00 C ATOM 1042 O ASN A 67 -6.968 -2.347 -11.408 1.00 0.00 O ATOM 1043 CB ASN A 67 -8.638 -4.901 -12.517 1.00 0.00 C ATOM 1044 CG ASN A 67 -8.645 -6.414 -12.618 1.00 0.00 C ATOM 1045 OD1 ASN A 67 -9.478 -6.997 -13.313 1.00 0.00 O ATOM 1046 ND2 ASN A 67 -7.712 -7.061 -11.929 1.00 0.00 N ATOM 0 H ASN A 67 -9.941 -5.315 -10.466 1.00 0.00 H new ATOM 0 HA ASN A 67 -7.203 -4.836 -10.917 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -9.640 -4.522 -12.719 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -7.982 -4.492 -13.285 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -7.667 -8.079 -11.964 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -7.041 -6.539 -11.365 1.00 0.00 H new ATOM 1053 N GLU A 68 -9.154 -2.203 -10.891 1.00 0.00 N ATOM 1054 CA GLU A 68 -9.170 -0.745 -10.872 1.00 0.00 C ATOM 1055 C GLU A 68 -8.413 -0.209 -9.663 1.00 0.00 C ATOM 1056 O GLU A 68 -7.779 0.842 -9.732 1.00 0.00 O ATOM 1057 CB GLU A 68 -10.611 -0.232 -10.854 1.00 0.00 C ATOM 1058 CG GLU A 68 -10.717 1.283 -10.804 1.00 0.00 C ATOM 1059 CD GLU A 68 -12.154 1.767 -10.825 1.00 0.00 C ATOM 1060 OE1 GLU A 68 -12.696 1.968 -11.932 1.00 0.00 O ATOM 1061 OE2 GLU A 68 -12.737 1.945 -9.735 1.00 0.00 O ATOM 0 H GLU A 68 -10.054 -2.636 -10.683 1.00 0.00 H new ATOM 0 HA GLU A 68 -8.675 -0.388 -11.775 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -11.128 -0.595 -11.742 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -11.127 -0.653 -9.991 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -10.227 1.648 -9.901 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -10.181 1.709 -11.652 1.00 0.00 H new ATOM 1068 N TYR A 69 -8.487 -0.940 -8.556 1.00 0.00 N ATOM 1069 CA TYR A 69 -7.812 -0.537 -7.328 1.00 0.00 C ATOM 1070 C TYR A 69 -6.297 -0.641 -7.478 1.00 0.00 C ATOM 1071 O TYR A 69 -5.555 0.223 -7.010 1.00 0.00 O ATOM 1072 CB TYR A 69 -8.280 -1.404 -6.159 1.00 0.00 C ATOM 1073 CG TYR A 69 -7.770 -0.936 -4.816 1.00 0.00 C ATOM 1074 CD1 TYR A 69 -8.470 0.010 -4.080 1.00 0.00 C ATOM 1075 CD2 TYR A 69 -6.589 -1.440 -4.284 1.00 0.00 C ATOM 1076 CE1 TYR A 69 -8.009 0.443 -2.852 1.00 0.00 C ATOM 1077 CE2 TYR A 69 -6.121 -1.013 -3.056 1.00 0.00 C ATOM 1078 CZ TYR A 69 -6.834 -0.072 -2.344 1.00 0.00 C ATOM 1079 OH TYR A 69 -6.370 0.355 -1.121 1.00 0.00 O ATOM 0 H TYR A 69 -9.007 -1.814 -8.484 1.00 0.00 H new ATOM 0 HA TYR A 69 -8.067 0.503 -7.127 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -9.370 -1.416 -6.140 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -7.953 -2.430 -6.325 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -9.391 0.414 -4.474 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -6.028 -2.177 -4.839 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -8.565 1.181 -2.293 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -5.202 -1.414 -2.656 1.00 0.00 H new ATOM 0 HH TYR A 69 -5.532 -0.107 -0.910 1.00 0.00 H new ATOM 1089 N ILE A 70 -5.847 -1.705 -8.132 1.00 0.00 N ATOM 1090 CA ILE A 70 -4.422 -1.930 -8.344 1.00 0.00 C ATOM 1091 C ILE A 70 -3.863 -0.978 -9.398 1.00 0.00 C ATOM 1092 O ILE A 70 -2.689 -0.618 -9.363 1.00 0.00 O ATOM 1093 CB ILE A 70 -4.146 -3.386 -8.769 1.00 0.00 C ATOM 1094 CG1 ILE A 70 -4.735 -4.361 -7.743 1.00 0.00 C ATOM 1095 CG2 ILE A 70 -2.649 -3.620 -8.938 1.00 0.00 C ATOM 1096 CD1 ILE A 70 -4.128 -4.240 -6.360 1.00 0.00 C ATOM 0 H ILE A 70 -6.450 -2.427 -8.526 1.00 0.00 H new ATOM 0 HA ILE A 70 -3.922 -1.738 -7.395 1.00 0.00 H new ATOM 0 HB ILE A 70 -4.628 -3.565 -9.730 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -5.810 -4.193 -7.673 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -4.594 -5.380 -8.103 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -2.474 -4.653 -9.238 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -2.260 -2.949 -9.704 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -2.141 -3.426 -7.993 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -4.597 -4.963 -5.692 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -3.057 -4.438 -6.414 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -4.292 -3.233 -5.978 1.00 0.00 H new ATOM 1108 N SER A 71 -4.707 -0.576 -10.338 1.00 0.00 N ATOM 1109 CA SER A 71 -4.281 0.331 -11.397 1.00 0.00 C ATOM 1110 C SER A 71 -4.323 1.785 -10.931 1.00 0.00 C ATOM 1111 O SER A 71 -3.530 2.611 -11.379 1.00 0.00 O ATOM 1112 CB SER A 71 -5.164 0.157 -12.633 1.00 0.00 C ATOM 1113 OG SER A 71 -4.760 1.030 -13.675 1.00 0.00 O ATOM 0 H SER A 71 -5.685 -0.861 -10.390 1.00 0.00 H new ATOM 0 HA SER A 71 -3.251 0.083 -11.653 1.00 0.00 H new ATOM 0 HB2 SER A 71 -5.112 -0.875 -12.979 1.00 0.00 H new ATOM 0 HB3 SER A 71 -6.204 0.354 -12.372 1.00 0.00 H new ATOM 0 HG SER A 71 -5.339 0.899 -14.455 1.00 0.00 H new ATOM 1119 N LEU A 72 -5.261 2.096 -10.041 1.00 0.00 N ATOM 1120 CA LEU A 72 -5.410 3.457 -9.530 1.00 0.00 C ATOM 1121 C LEU A 72 -4.570 3.696 -8.272 1.00 0.00 C ATOM 1122 O LEU A 72 -3.660 4.525 -8.271 1.00 0.00 O ATOM 1123 CB LEU A 72 -6.891 3.741 -9.240 1.00 0.00 C ATOM 1124 CG LEU A 72 -7.273 5.215 -9.020 1.00 0.00 C ATOM 1125 CD1 LEU A 72 -6.884 5.679 -7.625 1.00 0.00 C ATOM 1126 CD2 LEU A 72 -6.635 6.107 -10.077 1.00 0.00 C ATOM 0 H LEU A 72 -5.929 1.426 -9.659 1.00 0.00 H new ATOM 0 HA LEU A 72 -5.046 4.142 -10.296 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -7.482 3.355 -10.070 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -7.180 3.177 -8.353 1.00 0.00 H new ATOM 0 HG LEU A 72 -8.356 5.294 -9.114 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -7.166 6.724 -7.497 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -7.400 5.071 -6.882 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -5.807 5.575 -7.494 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -6.921 7.144 -9.899 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -5.550 6.015 -10.024 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -6.977 5.801 -11.066 1.00 0.00 H new ATOM 1138 N VAL A 73 -4.874 2.954 -7.208 1.00 0.00 N ATOM 1139 CA VAL A 73 -4.178 3.114 -5.930 1.00 0.00 C ATOM 1140 C VAL A 73 -2.751 2.568 -5.951 1.00 0.00 C ATOM 1141 O VAL A 73 -1.796 3.314 -5.728 1.00 0.00 O ATOM 1142 CB VAL A 73 -4.955 2.436 -4.786 1.00 0.00 C ATOM 1143 CG1 VAL A 73 -4.246 2.646 -3.455 1.00 0.00 C ATOM 1144 CG2 VAL A 73 -6.379 2.966 -4.724 1.00 0.00 C ATOM 0 H VAL A 73 -5.598 2.235 -7.205 1.00 0.00 H new ATOM 0 HA VAL A 73 -4.123 4.189 -5.759 1.00 0.00 H new ATOM 0 HB VAL A 73 -4.994 1.365 -4.985 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -4.812 2.159 -2.661 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -3.245 2.216 -3.504 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -4.173 3.713 -3.246 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -6.914 2.477 -3.910 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -6.360 4.042 -4.550 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -6.885 2.760 -5.667 1.00 0.00 H new ATOM 1154 N GLU A 74 -2.605 1.272 -6.208 1.00 0.00 N ATOM 1155 CA GLU A 74 -1.287 0.640 -6.225 1.00 0.00 C ATOM 1156 C GLU A 74 -0.321 1.399 -7.130 1.00 0.00 C ATOM 1157 O GLU A 74 0.818 1.666 -6.748 1.00 0.00 O ATOM 1158 CB GLU A 74 -1.397 -0.819 -6.675 1.00 0.00 C ATOM 1159 CG GLU A 74 -0.191 -1.670 -6.310 1.00 0.00 C ATOM 1160 CD GLU A 74 1.038 -1.333 -7.132 1.00 0.00 C ATOM 1161 OE1 GLU A 74 1.060 -1.674 -8.333 1.00 0.00 O ATOM 1162 OE2 GLU A 74 1.978 -0.728 -6.575 1.00 0.00 O ATOM 0 H GLU A 74 -3.380 0.639 -6.407 1.00 0.00 H new ATOM 0 HA GLU A 74 -0.892 0.667 -5.209 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -2.289 -1.260 -6.229 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -1.534 -0.846 -7.756 1.00 0.00 H new ATOM 0 HG2 GLU A 74 0.037 -1.535 -5.253 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -0.439 -2.722 -6.450 1.00 0.00 H new ATOM 1169 N LYS A 75 -0.779 1.751 -8.328 1.00 0.00 N ATOM 1170 CA LYS A 75 0.058 2.482 -9.275 1.00 0.00 C ATOM 1171 C LYS A 75 0.363 3.887 -8.765 1.00 0.00 C ATOM 1172 O LYS A 75 1.435 4.429 -9.031 1.00 0.00 O ATOM 1173 CB LYS A 75 -0.618 2.558 -10.644 1.00 0.00 C ATOM 1174 CG LYS A 75 -0.787 1.203 -11.316 1.00 0.00 C ATOM 1175 CD LYS A 75 0.556 0.572 -11.649 1.00 0.00 C ATOM 1176 CE LYS A 75 0.387 -0.807 -12.264 1.00 0.00 C ATOM 1177 NZ LYS A 75 -0.288 -1.753 -11.335 1.00 0.00 N ATOM 0 H LYS A 75 -1.719 1.544 -8.665 1.00 0.00 H new ATOM 0 HA LYS A 75 0.998 1.940 -9.376 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -1.597 3.023 -10.531 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -0.031 3.206 -11.294 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -1.349 0.538 -10.660 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -1.371 1.319 -12.229 1.00 0.00 H new ATOM 0 HD2 LYS A 75 1.100 1.216 -12.340 1.00 0.00 H new ATOM 0 HD3 LYS A 75 1.158 0.496 -10.743 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -0.193 -0.725 -13.183 1.00 0.00 H new ATOM 0 HE3 LYS A 75 1.364 -1.204 -12.538 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -0.160 -2.727 -11.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 0.127 -1.662 -10.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -1.303 -1.532 -11.292 1.00 0.00 H new ATOM 1191 N TYR A 76 -0.583 4.475 -8.037 1.00 0.00 N ATOM 1192 CA TYR A 76 -0.400 5.818 -7.493 1.00 0.00 C ATOM 1193 C TYR A 76 0.850 5.884 -6.619 1.00 0.00 C ATOM 1194 O TYR A 76 1.737 6.705 -6.854 1.00 0.00 O ATOM 1195 CB TYR A 76 -1.628 6.242 -6.683 1.00 0.00 C ATOM 1196 CG TYR A 76 -1.554 7.662 -6.169 1.00 0.00 C ATOM 1197 CD1 TYR A 76 -1.910 8.732 -6.979 1.00 0.00 C ATOM 1198 CD2 TYR A 76 -1.125 7.933 -4.875 1.00 0.00 C ATOM 1199 CE1 TYR A 76 -1.841 10.032 -6.515 1.00 0.00 C ATOM 1200 CE2 TYR A 76 -1.054 9.230 -4.403 1.00 0.00 C ATOM 1201 CZ TYR A 76 -1.413 10.276 -5.228 1.00 0.00 C ATOM 1202 OH TYR A 76 -1.342 11.569 -4.764 1.00 0.00 O ATOM 0 H TYR A 76 -1.480 4.045 -7.811 1.00 0.00 H new ATOM 0 HA TYR A 76 -0.275 6.506 -8.329 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -2.517 6.135 -7.304 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -1.747 5.564 -5.838 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -2.246 8.545 -7.988 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -0.842 7.116 -4.227 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -2.121 10.853 -7.158 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -0.720 9.424 -3.395 1.00 0.00 H new ATOM 0 HH TYR A 76 -1.499 12.191 -5.504 1.00 0.00 H new ATOM 1212 N ILE A 77 0.914 5.017 -5.614 1.00 0.00 N ATOM 1213 CA ILE A 77 2.056 4.981 -4.706 1.00 0.00 C ATOM 1214 C ILE A 77 3.351 4.698 -5.461 1.00 0.00 C ATOM 1215 O ILE A 77 4.372 5.345 -5.224 1.00 0.00 O ATOM 1216 CB ILE A 77 1.878 3.907 -3.612 1.00 0.00 C ATOM 1217 CG1 ILE A 77 0.576 4.139 -2.840 1.00 0.00 C ATOM 1218 CG2 ILE A 77 3.072 3.914 -2.667 1.00 0.00 C ATOM 1219 CD1 ILE A 77 0.281 3.064 -1.813 1.00 0.00 C ATOM 0 H ILE A 77 0.189 4.330 -5.407 1.00 0.00 H new ATOM 0 HA ILE A 77 2.112 5.964 -4.238 1.00 0.00 H new ATOM 0 HB ILE A 77 1.821 2.929 -4.090 1.00 0.00 H new ATOM 0 HG12 ILE A 77 0.628 5.105 -2.338 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -0.252 4.191 -3.547 1.00 0.00 H new ATOM 0 HG21 ILE A 77 2.934 3.152 -1.900 1.00 0.00 H new ATOM 0 HG22 ILE A 77 3.982 3.703 -3.229 1.00 0.00 H new ATOM 0 HG23 ILE A 77 3.156 4.893 -2.195 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -0.656 3.293 -1.305 1.00 0.00 H new ATOM 0 HD12 ILE A 77 0.196 2.098 -2.311 1.00 0.00 H new ATOM 0 HD13 ILE A 77 1.090 3.026 -1.083 1.00 0.00 H new ATOM 1231 N GLU A 78 3.299 3.729 -6.368 1.00 0.00 N ATOM 1232 CA GLU A 78 4.469 3.349 -7.152 1.00 0.00 C ATOM 1233 C GLU A 78 5.036 4.538 -7.922 1.00 0.00 C ATOM 1234 O GLU A 78 6.230 4.815 -7.855 1.00 0.00 O ATOM 1235 CB GLU A 78 4.109 2.221 -8.123 1.00 0.00 C ATOM 1236 CG GLU A 78 5.289 1.723 -8.941 1.00 0.00 C ATOM 1237 CD GLU A 78 4.900 0.629 -9.917 1.00 0.00 C ATOM 1238 OE1 GLU A 78 4.508 0.962 -11.056 1.00 0.00 O ATOM 1239 OE2 GLU A 78 4.984 -0.558 -9.541 1.00 0.00 O ATOM 0 H GLU A 78 2.458 3.191 -6.579 1.00 0.00 H new ATOM 0 HA GLU A 78 5.235 3.000 -6.460 1.00 0.00 H new ATOM 0 HB2 GLU A 78 3.691 1.387 -7.559 1.00 0.00 H new ATOM 0 HB3 GLU A 78 3.330 2.571 -8.800 1.00 0.00 H new ATOM 0 HG2 GLU A 78 5.724 2.558 -9.491 1.00 0.00 H new ATOM 0 HG3 GLU A 78 6.060 1.348 -8.269 1.00 0.00 H new ATOM 1246 N GLU A 79 4.175 5.243 -8.646 1.00 0.00 N ATOM 1247 CA GLU A 79 4.605 6.396 -9.432 1.00 0.00 C ATOM 1248 C GLU A 79 5.270 7.455 -8.557 1.00 0.00 C ATOM 1249 O GLU A 79 6.318 7.993 -8.911 1.00 0.00 O ATOM 1250 CB GLU A 79 3.415 7.010 -10.172 1.00 0.00 C ATOM 1251 CG GLU A 79 2.856 6.124 -11.273 1.00 0.00 C ATOM 1252 CD GLU A 79 3.874 5.829 -12.357 1.00 0.00 C ATOM 1253 OE1 GLU A 79 3.975 6.631 -13.311 1.00 0.00 O ATOM 1254 OE2 GLU A 79 4.574 4.800 -12.253 1.00 0.00 O ATOM 0 H GLU A 79 3.178 5.038 -8.706 1.00 0.00 H new ATOM 0 HA GLU A 79 5.339 6.044 -10.156 1.00 0.00 H new ATOM 0 HB2 GLU A 79 2.624 7.225 -9.454 1.00 0.00 H new ATOM 0 HB3 GLU A 79 3.720 7.963 -10.605 1.00 0.00 H new ATOM 0 HG2 GLU A 79 2.511 5.186 -10.839 1.00 0.00 H new ATOM 0 HG3 GLU A 79 1.987 6.608 -11.718 1.00 0.00 H new ATOM 1261 N GLN A 80 4.661 7.741 -7.412 1.00 0.00 N ATOM 1262 CA GLN A 80 5.180 8.753 -6.494 1.00 0.00 C ATOM 1263 C GLN A 80 6.603 8.442 -6.033 1.00 0.00 C ATOM 1264 O GLN A 80 7.438 9.343 -5.934 1.00 0.00 O ATOM 1265 CB GLN A 80 4.264 8.881 -5.276 1.00 0.00 C ATOM 1266 CG GLN A 80 2.878 9.409 -5.605 1.00 0.00 C ATOM 1267 CD GLN A 80 2.912 10.800 -6.209 1.00 0.00 C ATOM 1268 OE1 GLN A 80 2.988 10.958 -7.427 1.00 0.00 O ATOM 1269 NE2 GLN A 80 2.858 11.817 -5.356 1.00 0.00 N ATOM 0 H GLN A 80 3.805 7.286 -7.095 1.00 0.00 H new ATOM 0 HA GLN A 80 5.206 9.696 -7.040 1.00 0.00 H new ATOM 0 HB2 GLN A 80 4.168 7.905 -4.801 1.00 0.00 H new ATOM 0 HB3 GLN A 80 4.732 9.544 -4.549 1.00 0.00 H new ATOM 0 HG2 GLN A 80 2.389 8.727 -6.300 1.00 0.00 H new ATOM 0 HG3 GLN A 80 2.275 9.426 -4.697 1.00 0.00 H new ATOM 0 HE21 GLN A 80 2.795 11.639 -4.354 1.00 0.00 H new ATOM 0 HE22 GLN A 80 2.879 12.776 -5.703 1.00 0.00 H new ATOM 1278 N LEU A 81 6.881 7.173 -5.754 1.00 0.00 N ATOM 1279 CA LEU A 81 8.203 6.771 -5.283 1.00 0.00 C ATOM 1280 C LEU A 81 9.200 6.690 -6.431 1.00 0.00 C ATOM 1281 O LEU A 81 10.371 7.041 -6.283 1.00 0.00 O ATOM 1282 CB LEU A 81 8.123 5.418 -4.571 1.00 0.00 C ATOM 1283 CG LEU A 81 7.253 5.393 -3.312 1.00 0.00 C ATOM 1284 CD1 LEU A 81 7.132 3.974 -2.777 1.00 0.00 C ATOM 1285 CD2 LEU A 81 7.826 6.318 -2.247 1.00 0.00 C ATOM 0 H LEU A 81 6.213 6.408 -5.845 1.00 0.00 H new ATOM 0 HA LEU A 81 8.551 7.530 -4.582 1.00 0.00 H new ATOM 0 HB2 LEU A 81 7.739 4.678 -5.273 1.00 0.00 H new ATOM 0 HB3 LEU A 81 9.132 5.107 -4.302 1.00 0.00 H new ATOM 0 HG LEU A 81 6.257 5.749 -3.575 1.00 0.00 H new ATOM 0 HD11 LEU A 81 6.510 3.974 -1.882 1.00 0.00 H new ATOM 0 HD12 LEU A 81 6.676 3.337 -3.535 1.00 0.00 H new ATOM 0 HD13 LEU A 81 8.123 3.592 -2.530 1.00 0.00 H new ATOM 0 HD21 LEU A 81 7.194 6.287 -1.360 1.00 0.00 H new ATOM 0 HD22 LEU A 81 8.833 5.993 -1.987 1.00 0.00 H new ATOM 0 HD23 LEU A 81 7.862 7.337 -2.631 1.00 0.00 H new ATOM 1297 N LEU A 82 8.719 6.232 -7.575 1.00 0.00 N ATOM 1298 CA LEU A 82 9.556 6.073 -8.756 1.00 0.00 C ATOM 1299 C LEU A 82 9.996 7.421 -9.317 1.00 0.00 C ATOM 1300 O LEU A 82 11.005 7.508 -10.017 1.00 0.00 O ATOM 1301 CB LEU A 82 8.806 5.266 -9.821 1.00 0.00 C ATOM 1302 CG LEU A 82 8.557 3.779 -9.503 1.00 0.00 C ATOM 1303 CD1 LEU A 82 9.428 2.897 -10.383 1.00 0.00 C ATOM 1304 CD2 LEU A 82 8.816 3.453 -8.036 1.00 0.00 C ATOM 0 H LEU A 82 7.745 5.961 -7.713 1.00 0.00 H new ATOM 0 HA LEU A 82 10.456 5.532 -8.464 1.00 0.00 H new ATOM 0 HB2 LEU A 82 7.842 5.744 -9.996 1.00 0.00 H new ATOM 0 HB3 LEU A 82 9.367 5.327 -10.754 1.00 0.00 H new ATOM 0 HG LEU A 82 7.505 3.580 -9.709 1.00 0.00 H new ATOM 0 HD11 LEU A 82 9.241 1.849 -10.147 1.00 0.00 H new ATOM 0 HD12 LEU A 82 9.190 3.081 -11.431 1.00 0.00 H new ATOM 0 HD13 LEU A 82 10.478 3.128 -10.203 1.00 0.00 H new ATOM 0 HD21 LEU A 82 8.627 2.394 -7.860 1.00 0.00 H new ATOM 0 HD22 LEU A 82 9.853 3.683 -7.790 1.00 0.00 H new ATOM 0 HD23 LEU A 82 8.153 4.049 -7.408 1.00 0.00 H new ATOM 1316 N GLN A 83 9.236 8.470 -9.011 1.00 0.00 N ATOM 1317 CA GLN A 83 9.562 9.812 -9.485 1.00 0.00 C ATOM 1318 C GLN A 83 10.983 10.202 -9.084 1.00 0.00 C ATOM 1319 O GLN A 83 11.576 11.109 -9.669 1.00 0.00 O ATOM 1320 CB GLN A 83 8.566 10.836 -8.937 1.00 0.00 C ATOM 1321 CG GLN A 83 7.251 10.876 -9.699 1.00 0.00 C ATOM 1322 CD GLN A 83 6.308 11.947 -9.185 1.00 0.00 C ATOM 1323 OE1 GLN A 83 6.333 12.298 -8.004 1.00 0.00 O ATOM 1324 NE2 GLN A 83 5.469 12.471 -10.070 1.00 0.00 N ATOM 0 H GLN A 83 8.393 8.417 -8.439 1.00 0.00 H new ATOM 0 HA GLN A 83 9.497 9.806 -10.573 1.00 0.00 H new ATOM 0 HB2 GLN A 83 8.363 10.608 -7.891 1.00 0.00 H new ATOM 0 HB3 GLN A 83 9.023 11.825 -8.965 1.00 0.00 H new ATOM 0 HG2 GLN A 83 7.453 11.053 -10.755 1.00 0.00 H new ATOM 0 HG3 GLN A 83 6.764 9.904 -9.626 1.00 0.00 H new ATOM 0 HE21 GLN A 83 5.483 12.150 -11.038 1.00 0.00 H new ATOM 0 HE22 GLN A 83 4.810 13.195 -9.782 1.00 0.00 H new ATOM 1333 N ARG A 84 11.523 9.510 -8.084 1.00 0.00 N ATOM 1334 CA ARG A 84 12.876 9.781 -7.608 1.00 0.00 C ATOM 1335 C ARG A 84 13.742 8.528 -7.690 1.00 0.00 C ATOM 1336 O ARG A 84 14.950 8.610 -7.908 1.00 0.00 O ATOM 1337 CB ARG A 84 12.840 10.296 -6.167 1.00 0.00 C ATOM 1338 CG ARG A 84 14.205 10.700 -5.632 1.00 0.00 C ATOM 1339 CD ARG A 84 14.125 11.148 -4.181 1.00 0.00 C ATOM 1340 NE ARG A 84 13.207 12.271 -4.002 1.00 0.00 N ATOM 1341 CZ ARG A 84 12.979 12.858 -2.831 1.00 0.00 C ATOM 1342 NH1 ARG A 84 13.602 12.433 -1.739 1.00 0.00 N ATOM 1343 NH2 ARG A 84 12.127 13.872 -2.750 1.00 0.00 N ATOM 0 H ARG A 84 11.044 8.758 -7.588 1.00 0.00 H new ATOM 0 HA ARG A 84 13.313 10.547 -8.249 1.00 0.00 H new ATOM 0 HB2 ARG A 84 12.169 11.153 -6.113 1.00 0.00 H new ATOM 0 HB3 ARG A 84 12.421 9.522 -5.524 1.00 0.00 H new ATOM 0 HG2 ARG A 84 14.893 9.859 -5.717 1.00 0.00 H new ATOM 0 HG3 ARG A 84 14.611 11.507 -6.241 1.00 0.00 H new ATOM 0 HD2 ARG A 84 13.800 10.312 -3.561 1.00 0.00 H new ATOM 0 HD3 ARG A 84 15.118 11.434 -3.835 1.00 0.00 H new ATOM 0 HE ARG A 84 12.713 12.624 -4.822 1.00 0.00 H new ATOM 0 HH11 ARG A 84 14.258 11.654 -1.797 1.00 0.00 H new ATOM 0 HH12 ARG A 84 13.425 12.885 -0.842 1.00 0.00 H new ATOM 0 HH21 ARG A 84 11.646 14.202 -3.587 1.00 0.00 H new ATOM 0 HH22 ARG A 84 11.953 14.321 -1.851 1.00 0.00 H new ATOM 1357 N ILE A 85 13.115 7.368 -7.514 1.00 0.00 N ATOM 1358 CA ILE A 85 13.828 6.095 -7.562 1.00 0.00 C ATOM 1359 C ILE A 85 13.435 5.293 -8.805 1.00 0.00 C ATOM 1360 O ILE A 85 12.448 4.556 -8.786 1.00 0.00 O ATOM 1361 CB ILE A 85 13.541 5.247 -6.307 1.00 0.00 C ATOM 1362 CG1 ILE A 85 13.681 6.099 -5.043 1.00 0.00 C ATOM 1363 CG2 ILE A 85 14.479 4.049 -6.254 1.00 0.00 C ATOM 1364 CD1 ILE A 85 13.206 5.404 -3.784 1.00 0.00 C ATOM 0 H ILE A 85 12.114 7.283 -7.337 1.00 0.00 H new ATOM 0 HA ILE A 85 14.893 6.326 -7.602 1.00 0.00 H new ATOM 0 HB ILE A 85 12.516 4.880 -6.360 1.00 0.00 H new ATOM 0 HG12 ILE A 85 14.727 6.381 -4.919 1.00 0.00 H new ATOM 0 HG13 ILE A 85 13.116 7.022 -5.173 1.00 0.00 H new ATOM 0 HG21 ILE A 85 14.265 3.459 -5.363 1.00 0.00 H new ATOM 0 HG22 ILE A 85 14.333 3.433 -7.141 1.00 0.00 H new ATOM 0 HG23 ILE A 85 15.512 4.397 -6.220 1.00 0.00 H new ATOM 0 HD11 ILE A 85 13.336 6.069 -2.930 1.00 0.00 H new ATOM 0 HD12 ILE A 85 12.152 5.147 -3.886 1.00 0.00 H new ATOM 0 HD13 ILE A 85 13.788 4.495 -3.628 1.00 0.00 H new ATOM 1376 N PRO A 86 14.197 5.428 -9.909 1.00 0.00 N ATOM 1377 CA PRO A 86 13.911 4.711 -11.156 1.00 0.00 C ATOM 1378 C PRO A 86 14.306 3.240 -11.094 1.00 0.00 C ATOM 1379 O PRO A 86 14.017 2.469 -12.011 1.00 0.00 O ATOM 1380 CB PRO A 86 14.760 5.452 -12.186 1.00 0.00 C ATOM 1381 CG PRO A 86 15.917 5.977 -11.408 1.00 0.00 C ATOM 1382 CD PRO A 86 15.390 6.292 -10.033 1.00 0.00 C ATOM 0 HA PRO A 86 12.845 4.701 -11.384 1.00 0.00 H new ATOM 0 HB2 PRO A 86 15.088 4.785 -12.984 1.00 0.00 H new ATOM 0 HB3 PRO A 86 14.199 6.259 -12.656 1.00 0.00 H new ATOM 0 HG2 PRO A 86 16.719 5.241 -11.358 1.00 0.00 H new ATOM 0 HG3 PRO A 86 16.331 6.868 -11.880 1.00 0.00 H new ATOM 0 HD2 PRO A 86 16.127 6.070 -9.261 1.00 0.00 H new ATOM 0 HD3 PRO A 86 15.133 7.347 -9.935 1.00 0.00 H new ATOM 1390 N GLU A 87 14.965 2.857 -10.009 1.00 0.00 N ATOM 1391 CA GLU A 87 15.400 1.476 -9.820 1.00 0.00 C ATOM 1392 C GLU A 87 14.622 0.822 -8.685 1.00 0.00 C ATOM 1393 O GLU A 87 15.009 -0.232 -8.176 1.00 0.00 O ATOM 1394 CB GLU A 87 16.899 1.427 -9.517 1.00 0.00 C ATOM 1395 CG GLU A 87 17.746 2.211 -10.505 1.00 0.00 C ATOM 1396 CD GLU A 87 19.229 2.095 -10.220 1.00 0.00 C ATOM 1397 OE1 GLU A 87 19.711 2.782 -9.295 1.00 0.00 O ATOM 1398 OE2 GLU A 87 19.910 1.316 -10.920 1.00 0.00 O ATOM 0 H GLU A 87 15.212 3.484 -9.243 1.00 0.00 H new ATOM 0 HA GLU A 87 15.206 0.927 -10.742 1.00 0.00 H new ATOM 0 HB2 GLU A 87 17.071 1.817 -8.514 1.00 0.00 H new ATOM 0 HB3 GLU A 87 17.227 0.387 -9.515 1.00 0.00 H new ATOM 0 HG2 GLU A 87 17.545 1.853 -11.515 1.00 0.00 H new ATOM 0 HG3 GLU A 87 17.455 3.261 -10.475 1.00 0.00 H new ATOM 1405 N PHE A 88 13.520 1.454 -8.301 1.00 0.00 N ATOM 1406 CA PHE A 88 12.678 0.954 -7.222 1.00 0.00 C ATOM 1407 C PHE A 88 12.062 -0.397 -7.572 1.00 0.00 C ATOM 1408 O PHE A 88 11.790 -0.685 -8.737 1.00 0.00 O ATOM 1409 CB PHE A 88 11.566 1.957 -6.921 1.00 0.00 C ATOM 1410 CG PHE A 88 10.879 1.712 -5.608 1.00 0.00 C ATOM 1411 CD1 PHE A 88 11.468 2.110 -4.419 1.00 0.00 C ATOM 1412 CD2 PHE A 88 9.644 1.085 -5.566 1.00 0.00 C ATOM 1413 CE1 PHE A 88 10.837 1.884 -3.210 1.00 0.00 C ATOM 1414 CE2 PHE A 88 9.010 0.857 -4.358 1.00 0.00 C ATOM 1415 CZ PHE A 88 9.607 1.257 -3.179 1.00 0.00 C ATOM 0 H PHE A 88 13.187 2.320 -8.725 1.00 0.00 H new ATOM 0 HA PHE A 88 13.308 0.824 -6.342 1.00 0.00 H new ATOM 0 HB2 PHE A 88 11.985 2.963 -6.921 1.00 0.00 H new ATOM 0 HB3 PHE A 88 10.827 1.920 -7.721 1.00 0.00 H new ATOM 0 HD1 PHE A 88 12.429 2.602 -4.437 1.00 0.00 H new ATOM 0 HD2 PHE A 88 9.172 0.771 -6.485 1.00 0.00 H new ATOM 0 HE1 PHE A 88 11.306 2.198 -2.289 1.00 0.00 H new ATOM 0 HE2 PHE A 88 8.048 0.366 -4.337 1.00 0.00 H new ATOM 0 HZ PHE A 88 9.113 1.080 -2.235 1.00 0.00 H new ATOM 1425 N ASN A 89 11.850 -1.220 -6.550 1.00 0.00 N ATOM 1426 CA ASN A 89 11.252 -2.537 -6.730 1.00 0.00 C ATOM 1427 C ASN A 89 10.077 -2.719 -5.774 1.00 0.00 C ATOM 1428 O ASN A 89 10.257 -3.118 -4.624 1.00 0.00 O ATOM 1429 CB ASN A 89 12.295 -3.633 -6.501 1.00 0.00 C ATOM 1430 CG ASN A 89 13.411 -3.596 -7.526 1.00 0.00 C ATOM 1431 OD1 ASN A 89 14.558 -3.928 -7.225 1.00 0.00 O ATOM 1432 ND2 ASN A 89 13.082 -3.193 -8.749 1.00 0.00 N ATOM 0 H ASN A 89 12.085 -0.996 -5.583 1.00 0.00 H new ATOM 0 HA ASN A 89 10.886 -2.614 -7.754 1.00 0.00 H new ATOM 0 HB2 ASN A 89 12.719 -3.524 -5.503 1.00 0.00 H new ATOM 0 HB3 ASN A 89 11.807 -4.607 -6.535 1.00 0.00 H new ATOM 0 HD21 ASN A 89 13.792 -3.150 -9.480 1.00 0.00 H new ATOM 0 HD22 ASN A 89 12.120 -2.927 -8.957 1.00 0.00 H new ATOM 1439 N MET A 90 8.875 -2.412 -6.256 1.00 0.00 N ATOM 1440 CA MET A 90 7.667 -2.527 -5.444 1.00 0.00 C ATOM 1441 C MET A 90 7.436 -3.969 -5.003 1.00 0.00 C ATOM 1442 O MET A 90 6.915 -4.220 -3.915 1.00 0.00 O ATOM 1443 CB MET A 90 6.453 -2.019 -6.225 1.00 0.00 C ATOM 1444 CG MET A 90 5.527 -1.130 -5.409 1.00 0.00 C ATOM 1445 SD MET A 90 4.889 -1.949 -3.935 1.00 0.00 S ATOM 1446 CE MET A 90 3.958 -0.617 -3.182 1.00 0.00 C ATOM 0 H MET A 90 8.712 -2.081 -7.207 1.00 0.00 H new ATOM 0 HA MET A 90 7.802 -1.914 -4.553 1.00 0.00 H new ATOM 0 HB2 MET A 90 6.800 -1.464 -7.097 1.00 0.00 H new ATOM 0 HB3 MET A 90 5.887 -2.874 -6.596 1.00 0.00 H new ATOM 0 HG2 MET A 90 6.064 -0.228 -5.114 1.00 0.00 H new ATOM 0 HG3 MET A 90 4.691 -0.814 -6.033 1.00 0.00 H new ATOM 0 HE1 MET A 90 3.502 -0.970 -2.257 1.00 0.00 H new ATOM 0 HE2 MET A 90 4.627 0.215 -2.963 1.00 0.00 H new ATOM 0 HE3 MET A 90 3.178 -0.285 -3.868 1.00 0.00 H new ATOM 1456 N ALA A 91 7.826 -4.913 -5.852 1.00 0.00 N ATOM 1457 CA ALA A 91 7.658 -6.330 -5.550 1.00 0.00 C ATOM 1458 C ALA A 91 8.629 -6.785 -4.464 1.00 0.00 C ATOM 1459 O ALA A 91 8.224 -7.397 -3.475 1.00 0.00 O ATOM 1460 CB ALA A 91 7.844 -7.164 -6.809 1.00 0.00 C ATOM 0 H ALA A 91 8.261 -4.723 -6.755 1.00 0.00 H new ATOM 0 HA ALA A 91 6.645 -6.475 -5.175 1.00 0.00 H new ATOM 0 HB1 ALA A 91 7.716 -8.219 -6.569 1.00 0.00 H new ATOM 0 HB2 ALA A 91 7.104 -6.869 -7.553 1.00 0.00 H new ATOM 0 HB3 ALA A 91 8.845 -7.002 -7.208 1.00 0.00 H new ATOM 1466 N ALA A 92 9.908 -6.481 -4.655 1.00 0.00 N ATOM 1467 CA ALA A 92 10.938 -6.865 -3.694 1.00 0.00 C ATOM 1468 C ALA A 92 10.789 -6.101 -2.383 1.00 0.00 C ATOM 1469 O ALA A 92 11.189 -6.585 -1.324 1.00 0.00 O ATOM 1470 CB ALA A 92 12.320 -6.635 -4.285 1.00 0.00 C ATOM 0 H ALA A 92 10.257 -5.970 -5.466 1.00 0.00 H new ATOM 0 HA ALA A 92 10.815 -7.926 -3.477 1.00 0.00 H new ATOM 0 HB1 ALA A 92 13.079 -6.925 -3.559 1.00 0.00 H new ATOM 0 HB2 ALA A 92 12.434 -7.235 -5.188 1.00 0.00 H new ATOM 0 HB3 ALA A 92 12.439 -5.580 -4.532 1.00 0.00 H new ATOM 1476 N PHE A 93 10.210 -4.907 -2.458 1.00 0.00 N ATOM 1477 CA PHE A 93 10.017 -4.077 -1.273 1.00 0.00 C ATOM 1478 C PHE A 93 8.956 -4.672 -0.353 1.00 0.00 C ATOM 1479 O PHE A 93 9.202 -4.887 0.834 1.00 0.00 O ATOM 1480 CB PHE A 93 9.620 -2.655 -1.677 1.00 0.00 C ATOM 1481 CG PHE A 93 9.281 -1.772 -0.510 1.00 0.00 C ATOM 1482 CD1 PHE A 93 10.261 -1.380 0.387 1.00 0.00 C ATOM 1483 CD2 PHE A 93 7.981 -1.340 -0.308 1.00 0.00 C ATOM 1484 CE1 PHE A 93 9.951 -0.572 1.464 1.00 0.00 C ATOM 1485 CE2 PHE A 93 7.664 -0.532 0.766 1.00 0.00 C ATOM 1486 CZ PHE A 93 8.650 -0.148 1.654 1.00 0.00 C ATOM 0 H PHE A 93 9.867 -4.493 -3.325 1.00 0.00 H new ATOM 0 HA PHE A 93 10.962 -4.043 -0.730 1.00 0.00 H new ATOM 0 HB2 PHE A 93 10.438 -2.204 -2.238 1.00 0.00 H new ATOM 0 HB3 PHE A 93 8.762 -2.703 -2.347 1.00 0.00 H new ATOM 0 HD1 PHE A 93 11.279 -1.710 0.243 1.00 0.00 H new ATOM 0 HD2 PHE A 93 7.206 -1.638 -0.998 1.00 0.00 H new ATOM 0 HE1 PHE A 93 10.724 -0.272 2.156 1.00 0.00 H new ATOM 0 HE2 PHE A 93 6.646 -0.201 0.912 1.00 0.00 H new ATOM 0 HZ PHE A 93 8.404 0.483 2.496 1.00 0.00 H new ATOM 1496 N THR A 94 7.775 -4.932 -0.907 1.00 0.00 N ATOM 1497 CA THR A 94 6.677 -5.500 -0.134 1.00 0.00 C ATOM 1498 C THR A 94 7.065 -6.843 0.472 1.00 0.00 C ATOM 1499 O THR A 94 6.750 -7.127 1.628 1.00 0.00 O ATOM 1500 CB THR A 94 5.417 -5.689 -0.999 1.00 0.00 C ATOM 1501 OG1 THR A 94 5.719 -6.504 -2.137 1.00 0.00 O ATOM 1502 CG2 THR A 94 4.868 -4.347 -1.460 1.00 0.00 C ATOM 0 H THR A 94 7.555 -4.758 -1.888 1.00 0.00 H new ATOM 0 HA THR A 94 6.459 -4.792 0.666 1.00 0.00 H new ATOM 0 HB THR A 94 4.659 -6.183 -0.391 1.00 0.00 H new ATOM 0 HG1 THR A 94 6.119 -5.950 -2.839 1.00 0.00 H new ATOM 0 HG21 THR A 94 3.978 -4.508 -2.069 1.00 0.00 H new ATOM 0 HG22 THR A 94 4.608 -3.742 -0.591 1.00 0.00 H new ATOM 0 HG23 THR A 94 5.623 -3.828 -2.051 1.00 0.00 H new ATOM 1510 N THR A 95 7.753 -7.665 -0.316 1.00 0.00 N ATOM 1511 CA THR A 95 8.184 -8.983 0.138 1.00 0.00 C ATOM 1512 C THR A 95 9.072 -8.884 1.376 1.00 0.00 C ATOM 1513 O THR A 95 8.904 -9.641 2.333 1.00 0.00 O ATOM 1514 CB THR A 95 8.946 -9.734 -0.971 1.00 0.00 C ATOM 1515 OG1 THR A 95 8.112 -9.877 -2.127 1.00 0.00 O ATOM 1516 CG2 THR A 95 9.391 -11.108 -0.492 1.00 0.00 C ATOM 0 H THR A 95 8.024 -7.441 -1.273 1.00 0.00 H new ATOM 0 HA THR A 95 7.281 -9.539 0.392 1.00 0.00 H new ATOM 0 HB THR A 95 9.831 -9.152 -1.228 1.00 0.00 H new ATOM 0 HG1 THR A 95 8.124 -9.045 -2.644 1.00 0.00 H new ATOM 0 HG21 THR A 95 9.926 -11.617 -1.294 1.00 0.00 H new ATOM 0 HG22 THR A 95 10.048 -10.997 0.370 1.00 0.00 H new ATOM 0 HG23 THR A 95 8.517 -11.695 -0.209 1.00 0.00 H new ATOM 1524 N THR A 96 10.016 -7.949 1.350 1.00 0.00 N ATOM 1525 CA THR A 96 10.931 -7.754 2.470 1.00 0.00 C ATOM 1526 C THR A 96 10.228 -7.077 3.645 1.00 0.00 C ATOM 1527 O THR A 96 10.587 -7.288 4.802 1.00 0.00 O ATOM 1528 CB THR A 96 12.148 -6.908 2.055 1.00 0.00 C ATOM 1529 OG1 THR A 96 12.768 -7.479 0.895 1.00 0.00 O ATOM 1530 CG2 THR A 96 13.164 -6.824 3.183 1.00 0.00 C ATOM 0 H THR A 96 10.168 -7.314 0.566 1.00 0.00 H new ATOM 0 HA THR A 96 11.272 -8.742 2.778 1.00 0.00 H new ATOM 0 HB THR A 96 11.798 -5.901 1.827 1.00 0.00 H new ATOM 0 HG1 THR A 96 12.272 -7.211 0.094 1.00 0.00 H new ATOM 0 HG21 THR A 96 14.014 -6.221 2.863 1.00 0.00 H new ATOM 0 HG22 THR A 96 12.701 -6.365 4.056 1.00 0.00 H new ATOM 0 HG23 THR A 96 13.507 -7.826 3.439 1.00 0.00 H new ATOM 1538 N LEU A 97 9.227 -6.262 3.333 1.00 0.00 N ATOM 1539 CA LEU A 97 8.467 -5.541 4.350 1.00 0.00 C ATOM 1540 C LEU A 97 7.660 -6.502 5.223 1.00 0.00 C ATOM 1541 O LEU A 97 7.511 -6.287 6.426 1.00 0.00 O ATOM 1542 CB LEU A 97 7.529 -4.528 3.686 1.00 0.00 C ATOM 1543 CG LEU A 97 7.369 -3.192 4.420 1.00 0.00 C ATOM 1544 CD1 LEU A 97 6.437 -2.273 3.648 1.00 0.00 C ATOM 1545 CD2 LEU A 97 6.847 -3.406 5.834 1.00 0.00 C ATOM 0 H LEU A 97 8.920 -6.083 2.377 1.00 0.00 H new ATOM 0 HA LEU A 97 9.175 -5.014 4.989 1.00 0.00 H new ATOM 0 HB2 LEU A 97 7.895 -4.327 2.679 1.00 0.00 H new ATOM 0 HB3 LEU A 97 6.545 -4.985 3.582 1.00 0.00 H new ATOM 0 HG LEU A 97 8.350 -2.723 4.487 1.00 0.00 H new ATOM 0 HD11 LEU A 97 6.333 -1.328 4.182 1.00 0.00 H new ATOM 0 HD12 LEU A 97 6.849 -2.086 2.656 1.00 0.00 H new ATOM 0 HD13 LEU A 97 5.459 -2.744 3.551 1.00 0.00 H new ATOM 0 HD21 LEU A 97 6.742 -2.443 6.333 1.00 0.00 H new ATOM 0 HD22 LEU A 97 5.876 -3.900 5.793 1.00 0.00 H new ATOM 0 HD23 LEU A 97 7.548 -4.029 6.390 1.00 0.00 H new ATOM 1557 N GLN A 98 7.142 -7.562 4.607 1.00 0.00 N ATOM 1558 CA GLN A 98 6.327 -8.547 5.315 1.00 0.00 C ATOM 1559 C GLN A 98 7.006 -9.045 6.588 1.00 0.00 C ATOM 1560 O GLN A 98 6.343 -9.281 7.597 1.00 0.00 O ATOM 1561 CB GLN A 98 6.014 -9.733 4.399 1.00 0.00 C ATOM 1562 CG GLN A 98 5.090 -9.383 3.244 1.00 0.00 C ATOM 1563 CD GLN A 98 3.705 -8.970 3.706 1.00 0.00 C ATOM 1564 OE1 GLN A 98 3.047 -8.145 3.072 1.00 0.00 O ATOM 1565 NE2 GLN A 98 3.250 -9.547 4.813 1.00 0.00 N ATOM 0 H GLN A 98 7.273 -7.761 3.615 1.00 0.00 H new ATOM 0 HA GLN A 98 5.400 -8.051 5.604 1.00 0.00 H new ATOM 0 HB2 GLN A 98 6.948 -10.129 3.999 1.00 0.00 H new ATOM 0 HB3 GLN A 98 5.558 -10.527 4.990 1.00 0.00 H new ATOM 0 HG2 GLN A 98 5.531 -8.573 2.664 1.00 0.00 H new ATOM 0 HG3 GLN A 98 5.005 -10.242 2.579 1.00 0.00 H new ATOM 0 HE21 GLN A 98 3.828 -10.226 5.309 1.00 0.00 H new ATOM 0 HE22 GLN A 98 2.323 -9.311 5.167 1.00 0.00 H new ATOM 1574 N HIS A 99 8.322 -9.212 6.541 1.00 0.00 N ATOM 1575 CA HIS A 99 9.064 -9.682 7.707 1.00 0.00 C ATOM 1576 C HIS A 99 9.741 -8.519 8.426 1.00 0.00 C ATOM 1577 O HIS A 99 9.941 -8.559 9.642 1.00 0.00 O ATOM 1578 CB HIS A 99 10.105 -10.728 7.299 1.00 0.00 C ATOM 1579 CG HIS A 99 11.175 -10.198 6.395 1.00 0.00 C ATOM 1580 ND1 HIS A 99 12.256 -9.475 6.854 1.00 0.00 N ATOM 1581 CD2 HIS A 99 11.331 -10.293 5.054 1.00 0.00 C ATOM 1582 CE1 HIS A 99 13.031 -9.149 5.834 1.00 0.00 C ATOM 1583 NE2 HIS A 99 12.491 -9.634 4.731 1.00 0.00 N ATOM 0 H HIS A 99 8.894 -9.031 5.716 1.00 0.00 H new ATOM 0 HA HIS A 99 8.354 -10.145 8.392 1.00 0.00 H new ATOM 0 HB2 HIS A 99 10.570 -11.133 8.198 1.00 0.00 H new ATOM 0 HB3 HIS A 99 9.599 -11.555 6.801 1.00 0.00 H new ATOM 0 HD1 HIS A 99 12.430 -9.230 7.829 1.00 0.00 H new ATOM 0 HD2 HIS A 99 10.666 -10.794 4.366 1.00 0.00 H new ATOM 0 HE1 HIS A 99 13.949 -8.583 5.893 1.00 0.00 H new ATOM 1592 N HIS A 100 10.076 -7.478 7.673 1.00 0.00 N ATOM 1593 CA HIS A 100 10.737 -6.311 8.244 1.00 0.00 C ATOM 1594 C HIS A 100 9.770 -5.507 9.105 1.00 0.00 C ATOM 1595 O HIS A 100 10.174 -4.581 9.811 1.00 0.00 O ATOM 1596 CB HIS A 100 11.314 -5.426 7.137 1.00 0.00 C ATOM 1597 CG HIS A 100 12.354 -4.465 7.623 1.00 0.00 C ATOM 1598 ND1 HIS A 100 12.052 -3.329 8.345 1.00 0.00 N ATOM 1599 CD2 HIS A 100 13.702 -4.480 7.497 1.00 0.00 C ATOM 1600 CE1 HIS A 100 13.169 -2.686 8.639 1.00 0.00 C ATOM 1601 NE2 HIS A 100 14.184 -3.365 8.138 1.00 0.00 N ATOM 0 H HIS A 100 9.902 -7.418 6.670 1.00 0.00 H new ATOM 0 HA HIS A 100 11.553 -6.662 8.876 1.00 0.00 H new ATOM 0 HB2 HIS A 100 11.749 -6.061 6.365 1.00 0.00 H new ATOM 0 HB3 HIS A 100 10.503 -4.867 6.670 1.00 0.00 H new ATOM 0 HD2 HIS A 100 14.289 -5.229 6.987 1.00 0.00 H new ATOM 0 HE1 HIS A 100 13.239 -1.762 9.194 1.00 0.00 H new ATOM 0 HE2 HIS A 100 15.167 -3.104 8.214 1.00 0.00 H new ATOM 1610 N LYS A 101 8.490 -5.868 9.048 1.00 0.00 N ATOM 1611 CA LYS A 101 7.470 -5.177 9.828 1.00 0.00 C ATOM 1612 C LYS A 101 7.712 -5.374 11.321 1.00 0.00 C ATOM 1613 O LYS A 101 7.099 -4.702 12.151 1.00 0.00 O ATOM 1614 CB LYS A 101 6.071 -5.673 9.452 1.00 0.00 C ATOM 1615 CG LYS A 101 5.799 -7.114 9.857 1.00 0.00 C ATOM 1616 CD LYS A 101 4.420 -7.577 9.406 1.00 0.00 C ATOM 1617 CE LYS A 101 3.305 -6.793 10.085 1.00 0.00 C ATOM 1618 NZ LYS A 101 3.034 -5.495 9.406 1.00 0.00 N ATOM 0 H LYS A 101 8.137 -6.632 8.472 1.00 0.00 H new ATOM 0 HA LYS A 101 7.534 -4.113 9.600 1.00 0.00 H new ATOM 0 HB2 LYS A 101 5.329 -5.028 9.922 1.00 0.00 H new ATOM 0 HB3 LYS A 101 5.940 -5.578 8.374 1.00 0.00 H new ATOM 0 HG2 LYS A 101 6.560 -7.763 9.424 1.00 0.00 H new ATOM 0 HG3 LYS A 101 5.878 -7.208 10.940 1.00 0.00 H new ATOM 0 HD2 LYS A 101 4.336 -7.465 8.325 1.00 0.00 H new ATOM 0 HD3 LYS A 101 4.304 -8.638 9.627 1.00 0.00 H new ATOM 0 HE2 LYS A 101 2.395 -7.393 10.094 1.00 0.00 H new ATOM 0 HE3 LYS A 101 3.575 -6.608 11.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 3.304 -4.711 10.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 3.588 -5.441 8.527 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 2.021 -5.425 9.182 1.00 0.00 H new ATOM 1632 N ASP A 102 8.608 -6.302 11.653 1.00 0.00 N ATOM 1633 CA ASP A 102 8.938 -6.582 13.047 1.00 0.00 C ATOM 1634 C ASP A 102 9.388 -5.310 13.760 1.00 0.00 C ATOM 1635 O ASP A 102 9.276 -5.197 14.981 1.00 0.00 O ATOM 1636 CB ASP A 102 10.038 -7.642 13.130 1.00 0.00 C ATOM 1637 CG ASP A 102 10.375 -8.017 14.560 1.00 0.00 C ATOM 1638 OD1 ASP A 102 11.246 -7.352 15.159 1.00 0.00 O ATOM 1639 OD2 ASP A 102 9.766 -8.974 15.082 1.00 0.00 O ATOM 0 H ASP A 102 9.117 -6.871 10.976 1.00 0.00 H new ATOM 0 HA ASP A 102 8.042 -6.960 13.540 1.00 0.00 H new ATOM 0 HB2 ASP A 102 9.721 -8.533 12.589 1.00 0.00 H new ATOM 0 HB3 ASP A 102 10.935 -7.270 12.634 1.00 0.00 H new ATOM 1644 N GLU A 103 9.895 -4.353 12.986 1.00 0.00 N ATOM 1645 CA GLU A 103 10.359 -3.085 13.536 1.00 0.00 C ATOM 1646 C GLU A 103 9.513 -1.927 13.013 1.00 0.00 C ATOM 1647 O GLU A 103 9.307 -0.931 13.707 1.00 0.00 O ATOM 1648 CB GLU A 103 11.831 -2.860 13.181 1.00 0.00 C ATOM 1649 CG GLU A 103 12.424 -1.608 13.806 1.00 0.00 C ATOM 1650 CD GLU A 103 12.392 -1.640 15.321 1.00 0.00 C ATOM 1651 OE1 GLU A 103 13.366 -2.138 15.925 1.00 0.00 O ATOM 1652 OE2 GLU A 103 11.394 -1.168 15.904 1.00 0.00 O ATOM 0 H GLU A 103 9.994 -4.434 11.974 1.00 0.00 H new ATOM 0 HA GLU A 103 10.257 -3.126 14.620 1.00 0.00 H new ATOM 0 HB2 GLU A 103 12.410 -3.726 13.503 1.00 0.00 H new ATOM 0 HB3 GLU A 103 11.929 -2.796 12.097 1.00 0.00 H new ATOM 0 HG2 GLU A 103 13.455 -1.493 13.471 1.00 0.00 H new ATOM 0 HG3 GLU A 103 11.874 -0.735 13.453 1.00 0.00 H new ATOM 1659 N VAL A 104 9.026 -2.067 11.783 1.00 0.00 N ATOM 1660 CA VAL A 104 8.197 -1.039 11.164 1.00 0.00 C ATOM 1661 C VAL A 104 6.798 -1.030 11.769 1.00 0.00 C ATOM 1662 O VAL A 104 6.276 -2.074 12.161 1.00 0.00 O ATOM 1663 CB VAL A 104 8.092 -1.250 9.640 1.00 0.00 C ATOM 1664 CG1 VAL A 104 7.207 -0.188 9.002 1.00 0.00 C ATOM 1665 CG2 VAL A 104 9.476 -1.249 9.007 1.00 0.00 C ATOM 0 H VAL A 104 9.192 -2.884 11.195 1.00 0.00 H new ATOM 0 HA VAL A 104 8.677 -0.079 11.356 1.00 0.00 H new ATOM 0 HB VAL A 104 7.631 -2.221 9.462 1.00 0.00 H new ATOM 0 HG11 VAL A 104 7.150 -0.360 7.927 1.00 0.00 H new ATOM 0 HG12 VAL A 104 6.207 -0.242 9.432 1.00 0.00 H new ATOM 0 HG13 VAL A 104 7.630 0.799 9.190 1.00 0.00 H new ATOM 0 HG21 VAL A 104 9.384 -1.399 7.931 1.00 0.00 H new ATOM 0 HG22 VAL A 104 9.964 -0.293 9.200 1.00 0.00 H new ATOM 0 HG23 VAL A 104 10.073 -2.054 9.436 1.00 0.00 H new ATOM 1675 N ALA A 105 6.195 0.153 11.845 1.00 0.00 N ATOM 1676 CA ALA A 105 4.857 0.294 12.403 1.00 0.00 C ATOM 1677 C ALA A 105 3.854 -0.566 11.643 1.00 0.00 C ATOM 1678 O ALA A 105 3.487 -0.257 10.508 1.00 0.00 O ATOM 1679 CB ALA A 105 4.425 1.751 12.387 1.00 0.00 C ATOM 0 H ALA A 105 6.613 1.027 11.527 1.00 0.00 H new ATOM 0 HA ALA A 105 4.884 -0.051 13.437 1.00 0.00 H new ATOM 0 HB1 ALA A 105 3.423 1.838 12.807 1.00 0.00 H new ATOM 0 HB2 ALA A 105 5.121 2.343 12.981 1.00 0.00 H new ATOM 0 HB3 ALA A 105 4.421 2.118 11.361 1.00 0.00 H new ATOM 1685 N GLY A 106 3.415 -1.647 12.278 1.00 0.00 N ATOM 1686 CA GLY A 106 2.458 -2.539 11.652 1.00 0.00 C ATOM 1687 C GLY A 106 1.122 -1.871 11.397 1.00 0.00 C ATOM 1688 O GLY A 106 0.426 -2.210 10.442 1.00 0.00 O ATOM 0 H GLY A 106 3.706 -1.921 13.216 1.00 0.00 H new ATOM 0 HA2 GLY A 106 2.866 -2.900 10.708 1.00 0.00 H new ATOM 0 HA3 GLY A 106 2.309 -3.411 12.289 1.00 0.00 H new ATOM 1692 N ASP A 107 0.766 -0.919 12.254 1.00 0.00 N ATOM 1693 CA ASP A 107 -0.498 -0.203 12.124 1.00 0.00 C ATOM 1694 C ASP A 107 -0.564 0.584 10.818 1.00 0.00 C ATOM 1695 O ASP A 107 -1.602 0.615 10.155 1.00 0.00 O ATOM 1696 CB ASP A 107 -0.695 0.742 13.309 1.00 0.00 C ATOM 1697 CG ASP A 107 -1.972 1.552 13.199 1.00 0.00 C ATOM 1698 OD1 ASP A 107 -3.023 1.069 13.672 1.00 0.00 O ATOM 1699 OD2 ASP A 107 -1.922 2.667 12.638 1.00 0.00 O ATOM 0 H ASP A 107 1.336 -0.625 13.047 1.00 0.00 H new ATOM 0 HA ASP A 107 -1.298 -0.944 12.114 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -0.714 0.163 14.232 1.00 0.00 H new ATOM 0 HB3 ASP A 107 0.157 1.419 13.375 1.00 0.00 H new ATOM 1704 N ILE A 108 0.545 1.221 10.451 1.00 0.00 N ATOM 1705 CA ILE A 108 0.597 2.012 9.226 1.00 0.00 C ATOM 1706 C ILE A 108 0.566 1.122 7.987 1.00 0.00 C ATOM 1707 O ILE A 108 -0.230 1.345 7.073 1.00 0.00 O ATOM 1708 CB ILE A 108 1.861 2.897 9.182 1.00 0.00 C ATOM 1709 CG1 ILE A 108 1.871 3.862 10.370 1.00 0.00 C ATOM 1710 CG2 ILE A 108 1.928 3.662 7.865 1.00 0.00 C ATOM 1711 CD1 ILE A 108 3.153 4.659 10.496 1.00 0.00 C ATOM 0 H ILE A 108 1.416 1.205 10.982 1.00 0.00 H new ATOM 0 HA ILE A 108 -0.286 2.651 9.227 1.00 0.00 H new ATOM 0 HB ILE A 108 2.741 2.257 9.250 1.00 0.00 H new ATOM 0 HG12 ILE A 108 1.033 4.552 10.273 1.00 0.00 H new ATOM 0 HG13 ILE A 108 1.714 3.296 11.288 1.00 0.00 H new ATOM 0 HG21 ILE A 108 2.825 4.281 7.849 1.00 0.00 H new ATOM 0 HG22 ILE A 108 1.960 2.956 7.035 1.00 0.00 H new ATOM 0 HG23 ILE A 108 1.047 4.296 7.768 1.00 0.00 H new ATOM 0 HD11 ILE A 108 3.087 5.321 11.360 1.00 0.00 H new ATOM 0 HD12 ILE A 108 3.994 3.978 10.625 1.00 0.00 H new ATOM 0 HD13 ILE A 108 3.302 5.253 9.594 1.00 0.00 H new ATOM 1723 N PHE A 109 1.427 0.108 7.962 1.00 0.00 N ATOM 1724 CA PHE A 109 1.486 -0.807 6.827 1.00 0.00 C ATOM 1725 C PHE A 109 0.194 -1.604 6.699 1.00 0.00 C ATOM 1726 O PHE A 109 -0.187 -2.002 5.599 1.00 0.00 O ATOM 1727 CB PHE A 109 2.677 -1.761 6.944 1.00 0.00 C ATOM 1728 CG PHE A 109 2.768 -2.736 5.800 1.00 0.00 C ATOM 1729 CD1 PHE A 109 2.708 -2.292 4.487 1.00 0.00 C ATOM 1730 CD2 PHE A 109 2.902 -4.096 6.037 1.00 0.00 C ATOM 1731 CE1 PHE A 109 2.780 -3.184 3.432 1.00 0.00 C ATOM 1732 CE2 PHE A 109 2.973 -4.992 4.987 1.00 0.00 C ATOM 1733 CZ PHE A 109 2.913 -4.536 3.684 1.00 0.00 C ATOM 0 H PHE A 109 2.089 -0.100 8.710 1.00 0.00 H new ATOM 0 HA PHE A 109 1.615 -0.202 5.930 1.00 0.00 H new ATOM 0 HB2 PHE A 109 3.597 -1.179 6.992 1.00 0.00 H new ATOM 0 HB3 PHE A 109 2.601 -2.314 7.880 1.00 0.00 H new ATOM 0 HD1 PHE A 109 2.604 -1.236 4.286 1.00 0.00 H new ATOM 0 HD2 PHE A 109 2.951 -4.459 7.053 1.00 0.00 H new ATOM 0 HE1 PHE A 109 2.732 -2.825 2.415 1.00 0.00 H new ATOM 0 HE2 PHE A 109 3.075 -6.049 5.185 1.00 0.00 H new ATOM 0 HZ PHE A 109 2.970 -5.236 2.863 1.00 0.00 H new ATOM 1743 N ASP A 110 -0.477 -1.832 7.828 1.00 0.00 N ATOM 1744 CA ASP A 110 -1.722 -2.597 7.839 1.00 0.00 C ATOM 1745 C ASP A 110 -2.681 -2.099 6.763 1.00 0.00 C ATOM 1746 O ASP A 110 -3.505 -2.858 6.255 1.00 0.00 O ATOM 1747 CB ASP A 110 -2.388 -2.509 9.213 1.00 0.00 C ATOM 1748 CG ASP A 110 -3.664 -3.324 9.287 1.00 0.00 C ATOM 1749 OD1 ASP A 110 -3.581 -4.525 9.621 1.00 0.00 O ATOM 1750 OD2 ASP A 110 -4.745 -2.762 9.012 1.00 0.00 O ATOM 0 H ASP A 110 -0.179 -1.498 8.745 1.00 0.00 H new ATOM 0 HA ASP A 110 -1.478 -3.638 7.627 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -1.691 -2.859 9.975 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -2.612 -1.467 9.440 1.00 0.00 H new ATOM 1755 N MET A 111 -2.566 -0.820 6.418 1.00 0.00 N ATOM 1756 CA MET A 111 -3.410 -0.234 5.385 1.00 0.00 C ATOM 1757 C MET A 111 -2.989 -0.755 4.016 1.00 0.00 C ATOM 1758 O MET A 111 -3.806 -1.263 3.246 1.00 0.00 O ATOM 1759 CB MET A 111 -3.308 1.293 5.420 1.00 0.00 C ATOM 1760 CG MET A 111 -4.117 1.986 4.335 1.00 0.00 C ATOM 1761 SD MET A 111 -3.788 3.757 4.243 1.00 0.00 S ATOM 1762 CE MET A 111 -2.070 3.757 3.737 1.00 0.00 C ATOM 0 H MET A 111 -1.899 -0.173 6.838 1.00 0.00 H new ATOM 0 HA MET A 111 -4.445 -0.519 5.572 1.00 0.00 H new ATOM 0 HB2 MET A 111 -3.644 1.648 6.394 1.00 0.00 H new ATOM 0 HB3 MET A 111 -2.261 1.581 5.320 1.00 0.00 H new ATOM 0 HG2 MET A 111 -3.892 1.529 3.372 1.00 0.00 H new ATOM 0 HG3 MET A 111 -5.179 1.827 4.522 1.00 0.00 H new ATOM 0 HE1 MET A 111 -1.903 4.557 3.016 1.00 0.00 H new ATOM 0 HE2 MET A 111 -1.434 3.915 4.608 1.00 0.00 H new ATOM 0 HE3 MET A 111 -1.826 2.799 3.279 1.00 0.00 H new ATOM 1772 N LEU A 112 -1.698 -0.634 3.733 1.00 0.00 N ATOM 1773 CA LEU A 112 -1.136 -1.089 2.469 1.00 0.00 C ATOM 1774 C LEU A 112 -1.229 -2.605 2.354 1.00 0.00 C ATOM 1775 O LEU A 112 -1.216 -3.156 1.256 1.00 0.00 O ATOM 1776 CB LEU A 112 0.322 -0.641 2.347 1.00 0.00 C ATOM 1777 CG LEU A 112 0.546 0.874 2.392 1.00 0.00 C ATOM 1778 CD1 LEU A 112 2.031 1.194 2.308 1.00 0.00 C ATOM 1779 CD2 LEU A 112 -0.211 1.562 1.266 1.00 0.00 C ATOM 0 H LEU A 112 -1.016 -0.221 4.369 1.00 0.00 H new ATOM 0 HA LEU A 112 -1.712 -0.645 1.657 1.00 0.00 H new ATOM 0 HB2 LEU A 112 0.895 -1.101 3.152 1.00 0.00 H new ATOM 0 HB3 LEU A 112 0.726 -1.024 1.410 1.00 0.00 H new ATOM 0 HG LEU A 112 0.164 1.249 3.341 1.00 0.00 H new ATOM 0 HD11 LEU A 112 2.173 2.274 2.341 1.00 0.00 H new ATOM 0 HD12 LEU A 112 2.550 0.734 3.148 1.00 0.00 H new ATOM 0 HD13 LEU A 112 2.435 0.804 1.374 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -0.039 2.637 1.316 1.00 0.00 H new ATOM 0 HD22 LEU A 112 0.140 1.182 0.306 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -1.277 1.360 1.368 1.00 0.00 H new ATOM 1791 N LEU A 113 -1.331 -3.270 3.500 1.00 0.00 N ATOM 1792 CA LEU A 113 -1.414 -4.726 3.547 1.00 0.00 C ATOM 1793 C LEU A 113 -2.490 -5.249 2.602 1.00 0.00 C ATOM 1794 O LEU A 113 -2.404 -6.376 2.115 1.00 0.00 O ATOM 1795 CB LEU A 113 -1.699 -5.194 4.976 1.00 0.00 C ATOM 1796 CG LEU A 113 -1.697 -6.712 5.178 1.00 0.00 C ATOM 1797 CD1 LEU A 113 -0.358 -7.306 4.764 1.00 0.00 C ATOM 1798 CD2 LEU A 113 -2.005 -7.057 6.627 1.00 0.00 C ATOM 0 H LEU A 113 -1.358 -2.820 4.415 1.00 0.00 H new ATOM 0 HA LEU A 113 -0.454 -5.127 3.223 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -0.955 -4.754 5.640 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -2.670 -4.804 5.282 1.00 0.00 H new ATOM 0 HG LEU A 113 -2.474 -7.142 4.547 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -0.376 -8.385 4.915 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -0.174 -7.090 3.712 1.00 0.00 H new ATOM 0 HD13 LEU A 113 0.437 -6.869 5.369 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -1.999 -8.140 6.752 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -1.250 -6.613 7.275 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -2.987 -6.666 6.893 1.00 0.00 H new ATOM 1810 N THR A 114 -3.505 -4.426 2.347 1.00 0.00 N ATOM 1811 CA THR A 114 -4.598 -4.808 1.458 1.00 0.00 C ATOM 1812 C THR A 114 -4.097 -5.142 0.050 1.00 0.00 C ATOM 1813 O THR A 114 -4.888 -5.498 -0.825 1.00 0.00 O ATOM 1814 CB THR A 114 -5.656 -3.695 1.359 1.00 0.00 C ATOM 1815 OG1 THR A 114 -5.071 -2.509 0.809 1.00 0.00 O ATOM 1816 CG2 THR A 114 -6.246 -3.387 2.726 1.00 0.00 C ATOM 0 H THR A 114 -3.593 -3.490 2.744 1.00 0.00 H new ATOM 0 HA THR A 114 -5.049 -5.699 1.894 1.00 0.00 H new ATOM 0 HB THR A 114 -6.456 -4.042 0.705 1.00 0.00 H new ATOM 0 HG1 THR A 114 -4.621 -2.006 1.520 1.00 0.00 H new ATOM 0 HG21 THR A 114 -6.991 -2.597 2.631 1.00 0.00 H new ATOM 0 HG22 THR A 114 -6.717 -4.284 3.130 1.00 0.00 H new ATOM 0 HG23 THR A 114 -5.454 -3.059 3.399 1.00 0.00 H new ATOM 1824 N PHE A 115 -2.787 -5.027 -0.168 1.00 0.00 N ATOM 1825 CA PHE A 115 -2.201 -5.325 -1.473 1.00 0.00 C ATOM 1826 C PHE A 115 -2.371 -6.801 -1.821 1.00 0.00 C ATOM 1827 O PHE A 115 -2.318 -7.180 -2.991 1.00 0.00 O ATOM 1828 CB PHE A 115 -0.710 -4.963 -1.496 1.00 0.00 C ATOM 1829 CG PHE A 115 -0.427 -3.496 -1.693 1.00 0.00 C ATOM 1830 CD1 PHE A 115 -1.163 -2.745 -2.599 1.00 0.00 C ATOM 1831 CD2 PHE A 115 0.588 -2.872 -0.982 1.00 0.00 C ATOM 1832 CE1 PHE A 115 -0.896 -1.402 -2.787 1.00 0.00 C ATOM 1833 CE2 PHE A 115 0.857 -1.529 -1.165 1.00 0.00 C ATOM 1834 CZ PHE A 115 0.115 -0.793 -2.069 1.00 0.00 C ATOM 0 H PHE A 115 -2.115 -4.731 0.539 1.00 0.00 H new ATOM 0 HA PHE A 115 -2.725 -4.723 -2.215 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -0.256 -5.285 -0.559 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -0.225 -5.524 -2.295 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -1.954 -3.216 -3.164 1.00 0.00 H new ATOM 0 HD2 PHE A 115 1.175 -3.443 -0.277 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -1.477 -0.829 -3.495 1.00 0.00 H new ATOM 0 HE2 PHE A 115 1.647 -1.055 -0.602 1.00 0.00 H new ATOM 0 HZ PHE A 115 0.325 0.256 -2.214 1.00 0.00 H new ATOM 1844 N THR A 116 -2.574 -7.631 -0.801 1.00 0.00 N ATOM 1845 CA THR A 116 -2.747 -9.064 -1.009 1.00 0.00 C ATOM 1846 C THR A 116 -3.744 -9.657 -0.018 1.00 0.00 C ATOM 1847 O THR A 116 -4.411 -10.648 -0.316 1.00 0.00 O ATOM 1848 CB THR A 116 -1.409 -9.816 -0.882 1.00 0.00 C ATOM 1849 OG1 THR A 116 -1.629 -11.229 -0.982 1.00 0.00 O ATOM 1850 CG2 THR A 116 -0.730 -9.496 0.441 1.00 0.00 C ATOM 0 H THR A 116 -2.622 -7.336 0.174 1.00 0.00 H new ATOM 0 HA THR A 116 -3.133 -9.186 -2.021 1.00 0.00 H new ATOM 0 HB THR A 116 -0.758 -9.491 -1.694 1.00 0.00 H new ATOM 0 HG1 THR A 116 -0.773 -11.700 -0.902 1.00 0.00 H new ATOM 0 HG21 THR A 116 0.213 -10.039 0.507 1.00 0.00 H new ATOM 0 HG22 THR A 116 -0.537 -8.425 0.501 1.00 0.00 H new ATOM 0 HG23 THR A 116 -1.379 -9.794 1.264 1.00 0.00 H new ATOM 1858 N ASP A 117 -3.840 -9.050 1.160 1.00 0.00 N ATOM 1859 CA ASP A 117 -4.756 -9.527 2.191 1.00 0.00 C ATOM 1860 C ASP A 117 -6.196 -9.148 1.853 1.00 0.00 C ATOM 1861 O ASP A 117 -6.717 -8.144 2.340 1.00 0.00 O ATOM 1862 CB ASP A 117 -4.363 -8.954 3.554 1.00 0.00 C ATOM 1863 CG ASP A 117 -4.932 -9.760 4.706 1.00 0.00 C ATOM 1864 OD1 ASP A 117 -6.088 -9.501 5.098 1.00 0.00 O ATOM 1865 OD2 ASP A 117 -4.220 -10.651 5.214 1.00 0.00 O ATOM 0 H ASP A 117 -3.296 -8.229 1.425 1.00 0.00 H new ATOM 0 HA ASP A 117 -4.689 -10.614 2.233 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -3.276 -8.928 3.634 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -4.713 -7.924 3.627 1.00 0.00 H new ATOM 1870 N PHE A 118 -6.831 -9.961 1.011 1.00 0.00 N ATOM 1871 CA PHE A 118 -8.210 -9.719 0.595 1.00 0.00 C ATOM 1872 C PHE A 118 -9.151 -9.681 1.797 1.00 0.00 C ATOM 1873 O PHE A 118 -10.193 -9.027 1.760 1.00 0.00 O ATOM 1874 CB PHE A 118 -8.659 -10.805 -0.388 1.00 0.00 C ATOM 1875 CG PHE A 118 -10.071 -10.637 -0.879 1.00 0.00 C ATOM 1876 CD1 PHE A 118 -10.377 -9.685 -1.838 1.00 0.00 C ATOM 1877 CD2 PHE A 118 -11.091 -11.433 -0.382 1.00 0.00 C ATOM 1878 CE1 PHE A 118 -11.673 -9.531 -2.292 1.00 0.00 C ATOM 1879 CE2 PHE A 118 -12.388 -11.283 -0.832 1.00 0.00 C ATOM 1880 CZ PHE A 118 -12.681 -10.331 -1.788 1.00 0.00 C ATOM 0 H PHE A 118 -6.410 -10.796 0.603 1.00 0.00 H new ATOM 0 HA PHE A 118 -8.250 -8.747 0.103 1.00 0.00 H new ATOM 0 HB2 PHE A 118 -7.985 -10.807 -1.244 1.00 0.00 H new ATOM 0 HB3 PHE A 118 -8.566 -11.778 0.094 1.00 0.00 H new ATOM 0 HD1 PHE A 118 -9.594 -9.056 -2.235 1.00 0.00 H new ATOM 0 HD2 PHE A 118 -10.869 -12.180 0.366 1.00 0.00 H new ATOM 0 HE1 PHE A 118 -11.898 -8.786 -3.040 1.00 0.00 H new ATOM 0 HE2 PHE A 118 -13.173 -11.910 -0.436 1.00 0.00 H new ATOM 0 HZ PHE A 118 -13.695 -10.212 -2.141 1.00 0.00 H new ATOM 1890 N LEU A 119 -8.774 -10.382 2.861 1.00 0.00 N ATOM 1891 CA LEU A 119 -9.586 -10.431 4.071 1.00 0.00 C ATOM 1892 C LEU A 119 -9.664 -9.061 4.740 1.00 0.00 C ATOM 1893 O LEU A 119 -10.720 -8.660 5.231 1.00 0.00 O ATOM 1894 CB LEU A 119 -9.021 -11.462 5.054 1.00 0.00 C ATOM 1895 CG LEU A 119 -9.276 -12.931 4.694 1.00 0.00 C ATOM 1896 CD1 LEU A 119 -10.768 -13.204 4.564 1.00 0.00 C ATOM 1897 CD2 LEU A 119 -8.549 -13.306 3.410 1.00 0.00 C ATOM 0 H LEU A 119 -7.911 -10.924 2.910 1.00 0.00 H new ATOM 0 HA LEU A 119 -10.594 -10.729 3.783 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -7.945 -11.308 5.135 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -9.446 -11.269 6.039 1.00 0.00 H new ATOM 0 HG LEU A 119 -8.885 -13.550 5.501 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -10.925 -14.252 4.308 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -11.262 -12.983 5.510 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -11.186 -12.573 3.780 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -8.744 -14.352 3.174 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -8.905 -12.677 2.594 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -7.477 -13.157 3.542 1.00 0.00 H new ATOM 1909 N ALA A 120 -8.544 -8.344 4.754 1.00 0.00 N ATOM 1910 CA ALA A 120 -8.492 -7.021 5.365 1.00 0.00 C ATOM 1911 C ALA A 120 -9.152 -5.980 4.471 1.00 0.00 C ATOM 1912 O ALA A 120 -9.733 -5.009 4.955 1.00 0.00 O ATOM 1913 CB ALA A 120 -7.050 -6.629 5.657 1.00 0.00 C ATOM 0 H ALA A 120 -7.662 -8.657 4.350 1.00 0.00 H new ATOM 0 HA ALA A 120 -9.043 -7.060 6.304 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -7.027 -5.639 6.113 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -6.607 -7.354 6.340 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -6.482 -6.613 4.727 1.00 0.00 H new ATOM 1919 N PHE A 121 -9.057 -6.194 3.165 1.00 0.00 N ATOM 1920 CA PHE A 121 -9.640 -5.282 2.186 1.00 0.00 C ATOM 1921 C PHE A 121 -11.160 -5.243 2.322 1.00 0.00 C ATOM 1922 O PHE A 121 -11.757 -4.176 2.492 1.00 0.00 O ATOM 1923 CB PHE A 121 -9.248 -5.728 0.775 1.00 0.00 C ATOM 1924 CG PHE A 121 -9.430 -4.676 -0.284 1.00 0.00 C ATOM 1925 CD1 PHE A 121 -8.924 -3.397 -0.109 1.00 0.00 C ATOM 1926 CD2 PHE A 121 -10.101 -4.973 -1.459 1.00 0.00 C ATOM 1927 CE1 PHE A 121 -9.086 -2.435 -1.087 1.00 0.00 C ATOM 1928 CE2 PHE A 121 -10.264 -4.014 -2.441 1.00 0.00 C ATOM 1929 CZ PHE A 121 -9.756 -2.744 -2.255 1.00 0.00 C ATOM 0 H PHE A 121 -8.579 -6.997 2.756 1.00 0.00 H new ATOM 0 HA PHE A 121 -9.257 -4.278 2.368 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -8.204 -6.041 0.783 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -9.840 -6.603 0.506 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -8.398 -3.150 0.801 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -10.501 -5.965 -1.609 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -8.689 -1.442 -0.939 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -10.788 -4.258 -3.353 1.00 0.00 H new ATOM 0 HZ PHE A 121 -9.882 -1.993 -3.021 1.00 0.00 H new ATOM 1939 N LYS A 122 -11.778 -6.417 2.260 1.00 0.00 N ATOM 1940 CA LYS A 122 -13.225 -6.526 2.374 1.00 0.00 C ATOM 1941 C LYS A 122 -13.703 -6.007 3.726 1.00 0.00 C ATOM 1942 O LYS A 122 -14.632 -5.203 3.797 1.00 0.00 O ATOM 1943 CB LYS A 122 -13.670 -7.977 2.183 1.00 0.00 C ATOM 1944 CG LYS A 122 -15.179 -8.153 2.163 1.00 0.00 C ATOM 1945 CD LYS A 122 -15.571 -9.606 1.948 1.00 0.00 C ATOM 1946 CE LYS A 122 -17.075 -9.758 1.798 1.00 0.00 C ATOM 1947 NZ LYS A 122 -17.601 -8.969 0.650 1.00 0.00 N ATOM 0 H LYS A 122 -11.297 -7.307 2.131 1.00 0.00 H new ATOM 0 HA LYS A 122 -13.672 -5.914 1.590 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -13.256 -8.355 1.248 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -13.252 -8.585 2.986 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -15.600 -7.798 3.104 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -15.607 -7.539 1.370 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -15.074 -9.990 1.057 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -15.225 -10.206 2.790 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -17.321 -10.811 1.658 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -17.566 -9.435 2.716 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -18.537 -9.333 0.378 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -17.685 -7.970 0.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -16.949 -9.053 -0.156 1.00 0.00 H new ATOM 1961 N GLU A 123 -13.060 -6.469 4.795 1.00 0.00 N ATOM 1962 CA GLU A 123 -13.426 -6.048 6.143 1.00 0.00 C ATOM 1963 C GLU A 123 -13.235 -4.545 6.314 1.00 0.00 C ATOM 1964 O GLU A 123 -13.935 -3.908 7.102 1.00 0.00 O ATOM 1965 CB GLU A 123 -12.597 -6.804 7.184 1.00 0.00 C ATOM 1966 CG GLU A 123 -13.017 -6.518 8.617 1.00 0.00 C ATOM 1967 CD GLU A 123 -12.210 -7.305 9.631 1.00 0.00 C ATOM 1968 OE1 GLU A 123 -12.516 -8.498 9.835 1.00 0.00 O ATOM 1969 OE2 GLU A 123 -11.273 -6.727 10.222 1.00 0.00 O ATOM 0 H GLU A 123 -12.286 -7.132 4.754 1.00 0.00 H new ATOM 0 HA GLU A 123 -14.480 -6.281 6.294 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -12.681 -7.874 6.996 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -11.547 -6.540 7.062 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -12.906 -5.453 8.818 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -14.074 -6.756 8.736 1.00 0.00 H new ATOM 1976 N MET A 124 -12.283 -3.982 5.574 1.00 0.00 N ATOM 1977 CA MET A 124 -12.011 -2.550 5.647 1.00 0.00 C ATOM 1978 C MET A 124 -13.233 -1.753 5.213 1.00 0.00 C ATOM 1979 O MET A 124 -13.631 -0.797 5.878 1.00 0.00 O ATOM 1980 CB MET A 124 -10.809 -2.182 4.774 1.00 0.00 C ATOM 1981 CG MET A 124 -10.429 -0.711 4.855 1.00 0.00 C ATOM 1982 SD MET A 124 -8.938 -0.323 3.917 1.00 0.00 S ATOM 1983 CE MET A 124 -9.444 -0.786 2.263 1.00 0.00 C ATOM 0 H MET A 124 -11.690 -4.493 4.920 1.00 0.00 H new ATOM 0 HA MET A 124 -11.778 -2.302 6.682 1.00 0.00 H new ATOM 0 HB2 MET A 124 -9.953 -2.787 5.073 1.00 0.00 H new ATOM 0 HB3 MET A 124 -11.031 -2.435 3.737 1.00 0.00 H new ATOM 0 HG2 MET A 124 -11.255 -0.106 4.482 1.00 0.00 H new ATOM 0 HG3 MET A 124 -10.278 -0.436 5.899 1.00 0.00 H new ATOM 0 HE1 MET A 124 -8.718 -0.411 1.542 1.00 0.00 H new ATOM 0 HE2 MET A 124 -9.500 -1.872 2.190 1.00 0.00 H new ATOM 0 HE3 MET A 124 -10.423 -0.357 2.048 1.00 0.00 H new ATOM 1993 N PHE A 125 -13.826 -2.150 4.090 1.00 0.00 N ATOM 1994 CA PHE A 125 -15.010 -1.468 3.573 1.00 0.00 C ATOM 1995 C PHE A 125 -16.214 -1.692 4.483 1.00 0.00 C ATOM 1996 O PHE A 125 -16.942 -0.752 4.806 1.00 0.00 O ATOM 1997 CB PHE A 125 -15.333 -1.950 2.158 1.00 0.00 C ATOM 1998 CG PHE A 125 -14.300 -1.561 1.140 1.00 0.00 C ATOM 1999 CD1 PHE A 125 -14.043 -0.227 0.866 1.00 0.00 C ATOM 2000 CD2 PHE A 125 -13.588 -2.532 0.455 1.00 0.00 C ATOM 2001 CE1 PHE A 125 -13.093 0.131 -0.071 1.00 0.00 C ATOM 2002 CE2 PHE A 125 -12.639 -2.179 -0.483 1.00 0.00 C ATOM 2003 CZ PHE A 125 -12.390 -0.846 -0.748 1.00 0.00 C ATOM 0 H PHE A 125 -13.508 -2.936 3.523 1.00 0.00 H new ATOM 0 HA PHE A 125 -14.792 -0.400 3.544 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -15.432 -3.035 2.167 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -16.299 -1.544 1.857 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -14.591 0.541 1.391 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -13.777 -3.576 0.657 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -12.900 1.174 -0.274 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -12.091 -2.945 -1.010 1.00 0.00 H new ATOM 0 HZ PHE A 125 -11.648 -0.569 -1.482 1.00 0.00 H new ATOM 2013 N LEU A 126 -16.422 -2.941 4.892 1.00 0.00 N ATOM 2014 CA LEU A 126 -17.542 -3.285 5.762 1.00 0.00 C ATOM 2015 C LEU A 126 -17.500 -2.473 7.054 1.00 0.00 C ATOM 2016 O LEU A 126 -18.539 -2.081 7.586 1.00 0.00 O ATOM 2017 CB LEU A 126 -17.525 -4.780 6.087 1.00 0.00 C ATOM 2018 CG LEU A 126 -17.580 -5.715 4.876 1.00 0.00 C ATOM 2019 CD1 LEU A 126 -17.525 -7.168 5.321 1.00 0.00 C ATOM 2020 CD2 LEU A 126 -18.835 -5.458 4.053 1.00 0.00 C ATOM 0 H LEU A 126 -15.830 -3.731 4.635 1.00 0.00 H new ATOM 0 HA LEU A 126 -18.464 -3.045 5.233 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -16.621 -5.001 6.655 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -18.372 -5.003 6.736 1.00 0.00 H new ATOM 0 HG LEU A 126 -16.712 -5.512 4.249 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -17.565 -7.818 4.447 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -16.597 -7.347 5.864 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -18.373 -7.382 5.971 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -18.854 -6.133 3.198 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -19.717 -5.630 4.670 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -18.834 -4.426 3.701 1.00 0.00 H new ATOM 2032 N ASP A 127 -16.294 -2.223 7.552 1.00 0.00 N ATOM 2033 CA ASP A 127 -16.115 -1.458 8.780 1.00 0.00 C ATOM 2034 C ASP A 127 -16.448 0.015 8.557 1.00 0.00 C ATOM 2035 O ASP A 127 -17.058 0.660 9.411 1.00 0.00 O ATOM 2036 CB ASP A 127 -14.680 -1.598 9.289 1.00 0.00 C ATOM 2037 CG ASP A 127 -14.439 -0.817 10.566 1.00 0.00 C ATOM 2038 OD1 ASP A 127 -14.064 0.370 10.475 1.00 0.00 O ATOM 2039 OD2 ASP A 127 -14.627 -1.394 11.658 1.00 0.00 O ATOM 0 H ASP A 127 -15.424 -2.540 7.123 1.00 0.00 H new ATOM 0 HA ASP A 127 -16.798 -1.857 9.530 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -14.461 -2.651 9.464 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -13.989 -1.253 8.520 1.00 0.00 H new ATOM 2044 N TYR A 128 -16.041 0.537 7.404 1.00 0.00 N ATOM 2045 CA TYR A 128 -16.294 1.934 7.063 1.00 0.00 C ATOM 2046 C TYR A 128 -17.792 2.228 7.042 1.00 0.00 C ATOM 2047 O TYR A 128 -18.244 3.229 7.595 1.00 0.00 O ATOM 2048 CB TYR A 128 -15.676 2.266 5.702 1.00 0.00 C ATOM 2049 CG TYR A 128 -15.818 3.721 5.306 1.00 0.00 C ATOM 2050 CD1 TYR A 128 -14.877 4.664 5.703 1.00 0.00 C ATOM 2051 CD2 TYR A 128 -16.890 4.149 4.534 1.00 0.00 C ATOM 2052 CE1 TYR A 128 -15.003 5.992 5.343 1.00 0.00 C ATOM 2053 CE2 TYR A 128 -17.021 5.475 4.168 1.00 0.00 C ATOM 2054 CZ TYR A 128 -16.075 6.392 4.574 1.00 0.00 C ATOM 2055 OH TYR A 128 -16.203 7.713 4.213 1.00 0.00 O ATOM 0 H TYR A 128 -15.535 0.014 6.690 1.00 0.00 H new ATOM 0 HA TYR A 128 -15.832 2.559 7.827 1.00 0.00 H new ATOM 0 HB2 TYR A 128 -14.618 2.006 5.720 1.00 0.00 H new ATOM 0 HB3 TYR A 128 -16.144 1.644 4.939 1.00 0.00 H new ATOM 0 HD1 TYR A 128 -14.034 4.354 6.302 1.00 0.00 H new ATOM 0 HD2 TYR A 128 -17.633 3.434 4.214 1.00 0.00 H new ATOM 0 HE1 TYR A 128 -14.265 6.713 5.662 1.00 0.00 H new ATOM 0 HE2 TYR A 128 -17.860 5.792 3.567 1.00 0.00 H new ATOM 0 HH TYR A 128 -17.012 7.827 3.671 1.00 0.00 H new ATOM 2065 N ARG A 129 -18.554 1.347 6.402 1.00 0.00 N ATOM 2066 CA ARG A 129 -20.000 1.511 6.305 1.00 0.00 C ATOM 2067 C ARG A 129 -20.648 1.520 7.687 1.00 0.00 C ATOM 2068 O ARG A 129 -21.398 2.436 8.026 1.00 0.00 O ATOM 2069 CB ARG A 129 -20.602 0.391 5.454 1.00 0.00 C ATOM 2070 CG ARG A 129 -22.112 0.478 5.312 1.00 0.00 C ATOM 2071 CD ARG A 129 -22.654 -0.655 4.457 1.00 0.00 C ATOM 2072 NE ARG A 129 -24.109 -0.618 4.359 1.00 0.00 N ATOM 2073 CZ ARG A 129 -24.846 -1.650 3.961 1.00 0.00 C ATOM 2074 NH1 ARG A 129 -24.265 -2.794 3.628 1.00 0.00 N ATOM 2075 NH2 ARG A 129 -26.165 -1.538 3.898 1.00 0.00 N ATOM 0 H ARG A 129 -18.193 0.511 5.942 1.00 0.00 H new ATOM 0 HA ARG A 129 -20.199 2.471 5.829 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -20.150 0.417 4.462 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -20.342 -0.570 5.897 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -22.574 0.445 6.299 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -22.383 1.435 4.865 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -22.222 -0.594 3.458 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -22.343 -1.610 4.881 1.00 0.00 H new ATOM 0 HE ARG A 129 -24.587 0.247 4.610 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -23.250 -2.884 3.677 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -24.833 -3.585 3.323 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -26.615 -0.659 4.155 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -26.730 -2.330 3.592 1.00 0.00 H new ATOM 2089 N ALA A 130 -20.355 0.492 8.479 1.00 0.00 N ATOM 2090 CA ALA A 130 -20.912 0.376 9.822 1.00 0.00 C ATOM 2091 C ALA A 130 -20.599 1.606 10.668 1.00 0.00 C ATOM 2092 O ALA A 130 -21.338 1.935 11.596 1.00 0.00 O ATOM 2093 CB ALA A 130 -20.383 -0.877 10.503 1.00 0.00 C ATOM 0 H ALA A 130 -19.735 -0.273 8.213 1.00 0.00 H new ATOM 0 HA ALA A 130 -21.996 0.304 9.727 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -20.806 -0.953 11.505 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -20.667 -1.754 9.922 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -19.296 -0.823 10.571 1.00 0.00 H new ATOM 2099 N GLU A 131 -19.501 2.282 10.343 1.00 0.00 N ATOM 2100 CA GLU A 131 -19.091 3.473 11.079 1.00 0.00 C ATOM 2101 C GLU A 131 -20.128 4.589 10.952 1.00 0.00 C ATOM 2102 O GLU A 131 -20.362 5.336 11.902 1.00 0.00 O ATOM 2103 CB GLU A 131 -17.730 3.963 10.577 1.00 0.00 C ATOM 2104 CG GLU A 131 -17.171 5.132 11.372 1.00 0.00 C ATOM 2105 CD GLU A 131 -15.791 5.548 10.900 1.00 0.00 C ATOM 2106 OE1 GLU A 131 -15.706 6.368 9.962 1.00 0.00 O ATOM 2107 OE2 GLU A 131 -14.795 5.051 11.466 1.00 0.00 O ATOM 0 H GLU A 131 -18.880 2.026 9.576 1.00 0.00 H new ATOM 0 HA GLU A 131 -19.010 3.204 12.132 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -17.020 3.137 10.614 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -17.822 4.257 9.531 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -17.850 5.980 11.291 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -17.124 4.861 12.427 1.00 0.00 H new ATOM 2114 N LYS A 132 -20.748 4.699 9.778 1.00 0.00 N ATOM 2115 CA LYS A 132 -21.756 5.729 9.546 1.00 0.00 C ATOM 2116 C LYS A 132 -23.028 5.444 10.338 1.00 0.00 C ATOM 2117 O LYS A 132 -23.707 6.366 10.790 1.00 0.00 O ATOM 2118 CB LYS A 132 -22.086 5.845 8.054 1.00 0.00 C ATOM 2119 CG LYS A 132 -21.007 6.546 7.243 1.00 0.00 C ATOM 2120 CD LYS A 132 -19.985 5.563 6.696 1.00 0.00 C ATOM 2121 CE LYS A 132 -20.411 5.009 5.345 1.00 0.00 C ATOM 2122 NZ LYS A 132 -21.742 4.343 5.409 1.00 0.00 N ATOM 0 H LYS A 132 -20.571 4.091 8.978 1.00 0.00 H new ATOM 0 HA LYS A 132 -21.340 6.676 9.889 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -22.243 4.846 7.647 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -23.025 6.387 7.939 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -21.468 7.089 6.418 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -20.504 7.284 7.868 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -19.019 6.058 6.599 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -19.854 4.743 7.402 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -20.445 5.818 4.616 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -19.665 4.296 4.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -21.919 3.835 4.519 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -21.755 3.669 6.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -22.482 5.059 5.552 1.00 0.00 H new ATOM 2136 N GLU A 133 -23.348 4.164 10.503 1.00 0.00 N ATOM 2137 CA GLU A 133 -24.539 3.764 11.246 1.00 0.00 C ATOM 2138 C GLU A 133 -24.344 3.965 12.744 1.00 0.00 C ATOM 2139 O GLU A 133 -25.271 3.770 13.532 1.00 0.00 O ATOM 2140 CB GLU A 133 -24.884 2.301 10.957 1.00 0.00 C ATOM 2141 CG GLU A 133 -25.508 2.078 9.588 1.00 0.00 C ATOM 2142 CD GLU A 133 -24.574 2.435 8.449 1.00 0.00 C ATOM 2143 OE1 GLU A 133 -24.500 3.630 8.094 1.00 0.00 O ATOM 2144 OE2 GLU A 133 -23.918 1.519 7.910 1.00 0.00 O ATOM 0 H GLU A 133 -22.800 3.387 10.133 1.00 0.00 H new ATOM 0 HA GLU A 133 -25.365 4.396 10.918 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -23.977 1.701 11.035 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -25.571 1.941 11.723 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -25.804 1.033 9.495 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -26.417 2.675 9.507 1.00 0.00 H new ATOM 2151 N GLY A 134 -23.135 4.357 13.132 1.00 0.00 N ATOM 2152 CA GLY A 134 -22.838 4.579 14.536 1.00 0.00 C ATOM 2153 C GLY A 134 -22.943 3.311 15.361 1.00 0.00 C ATOM 2154 O GLY A 134 -23.729 3.243 16.305 1.00 0.00 O ATOM 0 H GLY A 134 -22.354 4.525 12.498 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -21.832 4.988 14.631 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -23.524 5.326 14.935 1.00 0.00 H new ATOM 2158 N ARG A 135 -22.147 2.305 15.000 1.00 0.00 N ATOM 2159 CA ARG A 135 -22.144 1.027 15.709 1.00 0.00 C ATOM 2160 C ARG A 135 -23.514 0.358 15.644 1.00 0.00 C ATOM 2161 O ARG A 135 -24.439 0.741 16.361 1.00 0.00 O ATOM 2162 CB ARG A 135 -21.727 1.217 17.171 1.00 0.00 C ATOM 2163 CG ARG A 135 -20.255 1.558 17.357 1.00 0.00 C ATOM 2164 CD ARG A 135 -19.942 2.979 16.912 1.00 0.00 C ATOM 2165 NE ARG A 135 -18.538 3.321 17.125 1.00 0.00 N ATOM 2166 CZ ARG A 135 -18.013 4.505 16.824 1.00 0.00 C ATOM 2167 NH1 ARG A 135 -18.772 5.463 16.308 1.00 0.00 N ATOM 2168 NH2 ARG A 135 -16.725 4.734 17.043 1.00 0.00 N ATOM 0 H ARG A 135 -21.494 2.351 14.218 1.00 0.00 H new ATOM 0 HA ARG A 135 -21.419 0.380 15.216 1.00 0.00 H new ATOM 0 HB2 ARG A 135 -22.331 2.011 17.610 1.00 0.00 H new ATOM 0 HB3 ARG A 135 -21.950 0.304 17.723 1.00 0.00 H new ATOM 0 HG2 ARG A 135 -19.984 1.438 18.406 1.00 0.00 H new ATOM 0 HG3 ARG A 135 -19.645 0.857 16.788 1.00 0.00 H new ATOM 0 HD2 ARG A 135 -20.186 3.090 15.856 1.00 0.00 H new ATOM 0 HD3 ARG A 135 -20.573 3.678 17.461 1.00 0.00 H new ATOM 0 HE ARG A 135 -17.926 2.611 17.527 1.00 0.00 H new ATOM 0 HH11 ARG A 135 -19.764 5.293 16.140 1.00 0.00 H new ATOM 0 HH12 ARG A 135 -18.364 6.369 16.079 1.00 0.00 H new ATOM 0 HH21 ARG A 135 -16.138 4.002 17.442 1.00 0.00 H new ATOM 0 HH22 ARG A 135 -16.322 5.642 16.812 1.00 0.00 H new ATOM 2182 N GLY A 136 -23.635 -0.648 14.781 1.00 0.00 N ATOM 2183 CA GLY A 136 -24.895 -1.355 14.641 1.00 0.00 C ATOM 2184 C GLY A 136 -24.771 -2.606 13.793 1.00 0.00 C ATOM 2185 O GLY A 136 -23.676 -3.206 13.774 1.00 0.00 O ATOM 2186 OXT GLY A 136 -25.772 -2.990 13.152 1.00 0.00 O ATOM 0 H GLY A 136 -22.884 -0.985 14.178 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -25.267 -1.626 15.629 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -25.633 -0.689 14.194 1.00 0.00 H new TER 2190 GLY A 136