USER MOD reduce.3.24.130724 H: found=0, std=0, add=1065, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1052 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 54 SER OG : rot -106:sc= 1.11 USER MOD Set 1.2: A 105 HIS : no HE2:sc= -0.703 K(o=0.41,f=-4.4) USER MOD Set 2.1: A 82 HIS : no HE2:sc= -0.9! C(o=0.37!,f=-6!) USER MOD Set 2.2: A 88 SER OG : rot -170:sc= 1.27 USER MOD Set 3.1: A 73 CYS SG : rot 180:sc= 0 USER MOD Set 3.2: A 91 HIS : no HD1:sc= 0.881 K(o=0.88,f=-10!) USER MOD Set 4.1: A 46 HIS : no HD1:sc= -1.27 X(o=-1.5,f=-1.6!) USER MOD Set 4.2: A 58 CYS SG : rot 50:sc= -0.197 USER MOD Set 5.1: A 9 MET CE :methyl -178:sc= -0.969 (180deg=-0.976) USER MOD Set 5.2: A 131 MET CE :methyl -164:sc= -0.051 (180deg=-0.437) USER MOD Single : A 3 LYS NZ :NH3+ 162:sc= 0.942 (180deg=0.212) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 TYR OH : rot 165:sc= -0.142 USER MOD Single : A 11 ASN : amide:sc= -0.0203 K(o=-0.02,f=-8.3!) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 ASN : amide:sc= -0.0493 K(o=-0.049,f=-1.5!) USER MOD Single : A 27 THR OG1 : rot 73:sc= 0.883 USER MOD Single : A 30 ASN : amide:sc= -0.0734 K(o=-0.073,f=-1.7!) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 ASN : amide:sc= -0.0712 K(o=-0.071,f=-1.7!) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 ASN : amide:sc= -1.07 K(o=-1.1,f=-5.9!) USER MOD Single : A 44 THR OG1 : rot -41:sc= 1.22 USER MOD Single : A 55 GLN : amide:sc= 0 K(o=0,f=-0.88) USER MOD Single : A 62 ASN : amide:sc= 0.42 K(o=0.42,f=-7.4!) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 ASN : amide:sc= -0.0898 X(o=-0.09,f=-0.58) USER MOD Single : A 78 ASN : amide:sc= -0.0256 K(o=-0.026,f=-1.4!) USER MOD Single : A 80 HIS : no HD1:sc= 0.587 K(o=0.59,f=-10!) USER MOD Single : A 84 THR OG1 : rot -69:sc= 0.294 USER MOD Single : A 87 MET CE :methyl 163:sc= -0.0516 (180deg=-0.411) USER MOD Single : A 89 MET CE :methyl -156:sc= -0.02 (180deg=-0.458) USER MOD Single : A 96 THR OG1 : rot -46:sc= 1.2 USER MOD Single : A 98 SER OG : rot 180:sc= 0.145 USER MOD Single : A 99 CYS SG : rot 82:sc= -1.13 USER MOD Single : A 100 GLN : amide:sc= 0.704 K(o=0.7,f=-0.93) USER MOD Single : A 108 GLN : amide:sc= -0.0563 X(o=-0.056,f=-0.17) USER MOD Single : A 110 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 115 HIS : no HD1:sc= -0.244 K(o=-0.24,f=-1.2) USER MOD Single : A 116 THR OG1 : rot -79:sc= 1.54 USER MOD Single : A 120 GLN : amide:sc= 0 K(o=0,f=-0.82) USER MOD Single : A 122 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 125 MET CE :methyl 149:sc= -1.25 (180deg=-1.44) USER MOD Single : A 130 THR OG1 : rot -78:sc= 1.29 USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 ASN : amide:sc= 0.648 K(o=0.65,f=-4.5!) USER MOD Single : A 137 MET CE :methyl -174:sc= 0 (180deg=-0.0748) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 18 N ALA A 2 -5.476 1.118 -13.596 1.00 0.00 N ATOM 19 CA ALA A 2 -5.141 0.458 -12.341 1.00 0.00 C ATOM 20 C ALA A 2 -3.843 1.004 -11.760 1.00 0.00 C ATOM 21 O ALA A 2 -2.991 1.513 -12.489 1.00 0.00 O ATOM 22 CB ALA A 2 -5.038 -1.046 -12.544 1.00 0.00 C ATOM 0 HA ALA A 2 -5.941 0.664 -11.630 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -4.787 -1.525 -11.597 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -5.992 -1.431 -12.904 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -4.261 -1.262 -13.277 1.00 0.00 H new ATOM 28 N LYS A 3 -3.696 0.894 -10.444 1.00 0.00 N ATOM 29 CA LYS A 3 -2.476 1.322 -9.771 1.00 0.00 C ATOM 30 C LYS A 3 -1.850 0.177 -8.984 1.00 0.00 C ATOM 31 O LYS A 3 -2.555 -0.684 -8.458 1.00 0.00 O ATOM 32 CB LYS A 3 -2.762 2.503 -8.842 1.00 0.00 C ATOM 33 CG LYS A 3 -3.246 3.760 -9.553 1.00 0.00 C ATOM 34 CD LYS A 3 -2.136 4.387 -10.384 1.00 0.00 C ATOM 35 CE LYS A 3 -2.558 5.737 -10.944 1.00 0.00 C ATOM 36 NZ LYS A 3 -3.070 6.644 -9.881 1.00 0.00 N ATOM 0 H LYS A 3 -4.408 0.511 -9.822 1.00 0.00 H new ATOM 0 HA LYS A 3 -1.767 1.638 -10.536 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -3.513 2.201 -8.112 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -1.855 2.741 -8.287 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -4.091 3.514 -10.197 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -3.605 4.481 -8.818 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -1.244 4.509 -9.770 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -1.870 3.718 -11.203 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -1.709 6.205 -11.442 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -3.330 5.591 -11.700 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -3.059 7.625 -10.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -4.044 6.375 -9.634 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -2.466 6.567 -9.038 1.00 0.00 H new ATOM 50 N LYS A 4 -0.524 0.174 -8.908 1.00 0.00 N ATOM 51 CA LYS A 4 0.196 -0.823 -8.124 1.00 0.00 C ATOM 52 C LYS A 4 1.345 -0.189 -7.351 1.00 0.00 C ATOM 53 O LYS A 4 1.702 0.965 -7.585 1.00 0.00 O ATOM 54 CB LYS A 4 0.721 -1.940 -9.028 1.00 0.00 C ATOM 55 CG LYS A 4 -0.364 -2.741 -9.733 1.00 0.00 C ATOM 56 CD LYS A 4 0.231 -3.875 -10.554 1.00 0.00 C ATOM 57 CE LYS A 4 -0.854 -4.712 -11.213 1.00 0.00 C ATOM 58 NZ LYS A 4 -0.302 -5.936 -11.854 1.00 0.00 N ATOM 0 H LYS A 4 0.075 0.851 -9.380 1.00 0.00 H new ATOM 0 HA LYS A 4 -0.503 -1.251 -7.405 1.00 0.00 H new ATOM 0 HB2 LYS A 4 1.379 -1.504 -9.779 1.00 0.00 H new ATOM 0 HB3 LYS A 4 1.327 -2.620 -8.430 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -1.056 -3.147 -8.995 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -0.941 -2.083 -10.383 1.00 0.00 H new ATOM 0 HD2 LYS A 4 0.891 -3.465 -11.319 1.00 0.00 H new ATOM 0 HD3 LYS A 4 0.842 -4.509 -9.912 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -1.596 -4.997 -10.467 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -1.370 -4.112 -11.962 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -1.075 -6.478 -12.291 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 0.387 -5.665 -12.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 0.168 -6.522 -11.135 1.00 0.00 H new ATOM 72 N GLY A 5 1.922 -0.952 -6.427 1.00 0.00 N ATOM 73 CA GLY A 5 3.066 -0.486 -5.654 1.00 0.00 C ATOM 74 C GLY A 5 3.949 -1.649 -5.219 1.00 0.00 C ATOM 75 O GLY A 5 3.512 -2.799 -5.202 1.00 0.00 O ATOM 0 H GLY A 5 1.615 -1.897 -6.196 1.00 0.00 H new ATOM 0 HA2 GLY A 5 3.650 0.214 -6.251 1.00 0.00 H new ATOM 0 HA3 GLY A 5 2.718 0.058 -4.776 1.00 0.00 H new ATOM 79 N TYR A 6 5.193 -1.341 -4.868 1.00 0.00 N ATOM 80 CA TYR A 6 6.135 -2.358 -4.417 1.00 0.00 C ATOM 81 C TYR A 6 7.121 -1.786 -3.407 1.00 0.00 C ATOM 82 O TYR A 6 7.732 -0.744 -3.645 1.00 0.00 O ATOM 83 CB TYR A 6 6.884 -2.961 -5.608 1.00 0.00 C ATOM 84 CG TYR A 6 7.980 -3.927 -5.214 1.00 0.00 C ATOM 85 CD1 TYR A 6 7.654 -5.195 -4.753 1.00 0.00 C ATOM 86 CD2 TYR A 6 9.309 -3.545 -5.312 1.00 0.00 C ATOM 87 CE1 TYR A 6 8.656 -6.077 -4.394 1.00 0.00 C ATOM 88 CE2 TYR A 6 10.310 -4.426 -4.953 1.00 0.00 C ATOM 89 CZ TYR A 6 9.987 -5.688 -4.495 1.00 0.00 C ATOM 90 OH TYR A 6 10.984 -6.566 -4.137 1.00 0.00 O ATOM 0 H TYR A 6 5.572 -0.394 -4.887 1.00 0.00 H new ATOM 0 HA TYR A 6 5.566 -3.146 -3.925 1.00 0.00 H new ATOM 0 HB2 TYR A 6 6.171 -3.478 -6.250 1.00 0.00 H new ATOM 0 HB3 TYR A 6 7.318 -2.154 -6.198 1.00 0.00 H new ATOM 0 HD1 TYR A 6 6.619 -5.492 -4.675 1.00 0.00 H new ATOM 0 HD2 TYR A 6 9.562 -2.558 -5.669 1.00 0.00 H new ATOM 0 HE1 TYR A 6 8.406 -7.065 -4.036 1.00 0.00 H new ATOM 0 HE2 TYR A 6 11.345 -4.128 -5.030 1.00 0.00 H new ATOM 0 HH TYR A 6 11.842 -6.245 -4.484 1.00 0.00 H new ATOM 100 N ILE A 7 7.272 -2.473 -2.280 1.00 0.00 N ATOM 101 CA ILE A 7 8.245 -2.081 -1.268 1.00 0.00 C ATOM 102 C ILE A 7 9.344 -3.126 -1.127 1.00 0.00 C ATOM 103 O ILE A 7 9.078 -4.279 -0.786 1.00 0.00 O ATOM 104 CB ILE A 7 7.564 -1.864 0.096 1.00 0.00 C ATOM 105 CG1 ILE A 7 6.582 -0.692 0.022 1.00 0.00 C ATOM 106 CG2 ILE A 7 8.605 -1.623 1.178 1.00 0.00 C ATOM 107 CD1 ILE A 7 5.647 -0.603 1.206 1.00 0.00 C ATOM 0 H ILE A 7 6.732 -3.306 -2.044 1.00 0.00 H new ATOM 0 HA ILE A 7 8.692 -1.143 -1.595 1.00 0.00 H new ATOM 0 HB ILE A 7 7.006 -2.765 0.352 1.00 0.00 H new ATOM 0 HG12 ILE A 7 7.146 0.238 -0.054 1.00 0.00 H new ATOM 0 HG13 ILE A 7 5.991 -0.782 -0.890 1.00 0.00 H new ATOM 0 HG21 ILE A 7 8.106 -1.472 2.135 1.00 0.00 H new ATOM 0 HG22 ILE A 7 9.266 -2.487 1.246 1.00 0.00 H new ATOM 0 HG23 ILE A 7 9.190 -0.737 0.929 1.00 0.00 H new ATOM 0 HD11 ILE A 7 4.982 0.252 1.081 1.00 0.00 H new ATOM 0 HD12 ILE A 7 5.056 -1.516 1.272 1.00 0.00 H new ATOM 0 HD13 ILE A 7 6.228 -0.480 2.120 1.00 0.00 H new ATOM 119 N LEU A 8 10.581 -2.717 -1.390 1.00 0.00 N ATOM 120 CA LEU A 8 11.742 -3.551 -1.102 1.00 0.00 C ATOM 121 C LEU A 8 12.374 -3.171 0.230 1.00 0.00 C ATOM 122 O LEU A 8 12.645 -1.998 0.488 1.00 0.00 O ATOM 123 CB LEU A 8 12.779 -3.421 -2.224 1.00 0.00 C ATOM 124 CG LEU A 8 14.099 -4.171 -2.000 1.00 0.00 C ATOM 125 CD1 LEU A 8 13.841 -5.672 -2.024 1.00 0.00 C ATOM 126 CD2 LEU A 8 15.099 -3.772 -3.074 1.00 0.00 C ATOM 0 H LEU A 8 10.805 -1.812 -1.803 1.00 0.00 H new ATOM 0 HA LEU A 8 11.405 -4.586 -1.040 1.00 0.00 H new ATOM 0 HB2 LEU A 8 12.331 -3.780 -3.151 1.00 0.00 H new ATOM 0 HB3 LEU A 8 13.003 -2.364 -2.366 1.00 0.00 H new ATOM 0 HG LEU A 8 14.516 -3.908 -1.028 1.00 0.00 H new ATOM 0 HD11 LEU A 8 14.778 -6.205 -1.865 1.00 0.00 H new ATOM 0 HD12 LEU A 8 13.137 -5.933 -1.234 1.00 0.00 H new ATOM 0 HD13 LEU A 8 13.423 -5.954 -2.990 1.00 0.00 H new ATOM 0 HD21 LEU A 8 16.036 -4.305 -2.914 1.00 0.00 H new ATOM 0 HD22 LEU A 8 14.699 -4.026 -4.056 1.00 0.00 H new ATOM 0 HD23 LEU A 8 15.279 -2.698 -3.023 1.00 0.00 H new ATOM 138 N MET A 9 12.610 -4.170 1.074 1.00 0.00 N ATOM 139 CA MET A 9 13.150 -3.936 2.408 1.00 0.00 C ATOM 140 C MET A 9 14.650 -4.194 2.448 1.00 0.00 C ATOM 141 O MET A 9 15.179 -4.962 1.643 1.00 0.00 O ATOM 142 CB MET A 9 12.430 -4.812 3.430 1.00 0.00 C ATOM 143 CG MET A 9 10.937 -4.543 3.552 1.00 0.00 C ATOM 144 SD MET A 9 10.578 -2.894 4.191 1.00 0.00 S ATOM 145 CE MET A 9 8.809 -3.008 4.443 1.00 0.00 C ATOM 0 H MET A 9 12.435 -5.151 0.857 1.00 0.00 H new ATOM 0 HA MET A 9 12.984 -2.889 2.662 1.00 0.00 H new ATOM 0 HB2 MET A 9 12.577 -5.858 3.161 1.00 0.00 H new ATOM 0 HB3 MET A 9 12.894 -4.666 4.406 1.00 0.00 H new ATOM 0 HG2 MET A 9 10.470 -4.659 2.574 1.00 0.00 H new ATOM 0 HG3 MET A 9 10.490 -5.289 4.210 1.00 0.00 H new ATOM 0 HE1 MET A 9 8.430 -2.051 4.803 1.00 0.00 H new ATOM 0 HE2 MET A 9 8.323 -3.259 3.500 1.00 0.00 H new ATOM 0 HE3 MET A 9 8.596 -3.783 5.179 1.00 0.00 H new ATOM 155 N GLU A 10 15.331 -3.550 3.389 1.00 0.00 N ATOM 156 CA GLU A 10 16.778 -3.688 3.518 1.00 0.00 C ATOM 157 C GLU A 10 17.159 -5.094 3.964 1.00 0.00 C ATOM 158 O GLU A 10 18.291 -5.533 3.764 1.00 0.00 O ATOM 159 CB GLU A 10 17.325 -2.661 4.511 1.00 0.00 C ATOM 160 CG GLU A 10 17.332 -1.229 3.996 1.00 0.00 C ATOM 161 CD GLU A 10 17.958 -0.262 4.962 1.00 0.00 C ATOM 162 OE1 GLU A 10 18.336 -0.680 6.030 1.00 0.00 O ATOM 163 OE2 GLU A 10 18.058 0.896 4.632 1.00 0.00 O ATOM 0 H GLU A 10 14.905 -2.927 4.075 1.00 0.00 H new ATOM 0 HA GLU A 10 17.219 -3.508 2.538 1.00 0.00 H new ATOM 0 HB2 GLU A 10 16.730 -2.703 5.423 1.00 0.00 H new ATOM 0 HB3 GLU A 10 18.343 -2.942 4.781 1.00 0.00 H new ATOM 0 HG2 GLU A 10 17.873 -1.191 3.050 1.00 0.00 H new ATOM 0 HG3 GLU A 10 16.308 -0.917 3.790 1.00 0.00 H new ATOM 170 N ASN A 11 16.206 -5.795 4.570 1.00 0.00 N ATOM 171 CA ASN A 11 16.441 -7.154 5.046 1.00 0.00 C ATOM 172 C ASN A 11 16.107 -8.180 3.970 1.00 0.00 C ATOM 173 O ASN A 11 16.081 -9.381 4.233 1.00 0.00 O ATOM 174 CB ASN A 11 15.642 -7.422 6.308 1.00 0.00 C ATOM 175 CG ASN A 11 14.158 -7.418 6.063 1.00 0.00 C ATOM 176 OD1 ASN A 11 13.704 -7.246 4.927 1.00 0.00 O ATOM 177 ND2 ASN A 11 13.393 -7.603 7.109 1.00 0.00 N ATOM 0 H ASN A 11 15.264 -5.445 4.743 1.00 0.00 H new ATOM 0 HA ASN A 11 17.501 -7.249 5.281 1.00 0.00 H new ATOM 0 HB2 ASN A 11 15.936 -8.387 6.722 1.00 0.00 H new ATOM 0 HB3 ASN A 11 15.885 -6.667 7.055 1.00 0.00 H new ATOM 0 HD21 ASN A 11 12.378 -7.609 7.004 1.00 0.00 H new ATOM 0 HD22 ASN A 11 13.811 -7.741 8.029 1.00 0.00 H new ATOM 184 N GLY A 12 15.851 -7.697 2.759 1.00 0.00 N ATOM 185 CA GLY A 12 15.620 -8.575 1.619 1.00 0.00 C ATOM 186 C GLY A 12 14.138 -8.894 1.460 1.00 0.00 C ATOM 187 O GLY A 12 13.750 -9.661 0.578 1.00 0.00 O ATOM 0 H GLY A 12 15.798 -6.702 2.542 1.00 0.00 H new ATOM 0 HA2 GLY A 12 15.992 -8.101 0.711 1.00 0.00 H new ATOM 0 HA3 GLY A 12 16.182 -9.500 1.749 1.00 0.00 H new ATOM 191 N GLY A 13 13.316 -8.302 2.319 1.00 0.00 N ATOM 192 CA GLY A 13 11.871 -8.485 2.246 1.00 0.00 C ATOM 193 C GLY A 13 11.306 -7.899 0.958 1.00 0.00 C ATOM 194 O GLY A 13 11.744 -6.843 0.501 1.00 0.00 O ATOM 0 H GLY A 13 13.626 -7.691 3.075 1.00 0.00 H new ATOM 0 HA2 GLY A 13 11.633 -9.547 2.300 1.00 0.00 H new ATOM 0 HA3 GLY A 13 11.398 -8.008 3.104 1.00 0.00 H new ATOM 198 N LYS A 14 10.331 -8.590 0.378 1.00 0.00 N ATOM 199 CA LYS A 14 9.731 -8.160 -0.880 1.00 0.00 C ATOM 200 C LYS A 14 8.212 -8.118 -0.779 1.00 0.00 C ATOM 201 O LYS A 14 7.554 -9.158 -0.738 1.00 0.00 O ATOM 202 CB LYS A 14 10.157 -9.084 -2.021 1.00 0.00 C ATOM 203 CG LYS A 14 11.653 -9.079 -2.309 1.00 0.00 C ATOM 204 CD LYS A 14 11.985 -9.938 -3.520 1.00 0.00 C ATOM 205 CE LYS A 14 13.479 -9.931 -3.812 1.00 0.00 C ATOM 206 NZ LYS A 14 13.822 -10.785 -4.981 1.00 0.00 N ATOM 0 H LYS A 14 9.939 -9.451 0.759 1.00 0.00 H new ATOM 0 HA LYS A 14 10.087 -7.152 -1.091 1.00 0.00 H new ATOM 0 HB2 LYS A 14 9.849 -10.102 -1.783 1.00 0.00 H new ATOM 0 HB3 LYS A 14 9.624 -8.793 -2.926 1.00 0.00 H new ATOM 0 HG2 LYS A 14 11.989 -8.057 -2.482 1.00 0.00 H new ATOM 0 HG3 LYS A 14 12.194 -9.449 -1.438 1.00 0.00 H new ATOM 0 HD2 LYS A 14 11.652 -10.961 -3.345 1.00 0.00 H new ATOM 0 HD3 LYS A 14 11.441 -9.570 -4.390 1.00 0.00 H new ATOM 0 HE2 LYS A 14 13.807 -8.909 -4.001 1.00 0.00 H new ATOM 0 HE3 LYS A 14 14.022 -10.283 -2.934 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 14.848 -10.752 -5.146 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 13.533 -11.766 -4.791 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 13.325 -10.435 -5.825 1.00 0.00 H new ATOM 220 N ILE A 15 7.659 -6.910 -0.739 1.00 0.00 N ATOM 221 CA ILE A 15 6.222 -6.730 -0.572 1.00 0.00 C ATOM 222 C ILE A 15 5.598 -6.100 -1.811 1.00 0.00 C ATOM 223 O ILE A 15 5.809 -4.921 -2.092 1.00 0.00 O ATOM 224 CB ILE A 15 5.917 -5.857 0.658 1.00 0.00 C ATOM 225 CG1 ILE A 15 6.504 -6.491 1.922 1.00 0.00 C ATOM 226 CG2 ILE A 15 4.417 -5.654 0.808 1.00 0.00 C ATOM 227 CD1 ILE A 15 6.428 -5.602 3.143 1.00 0.00 C ATOM 0 H ILE A 15 8.186 -6.040 -0.820 1.00 0.00 H new ATOM 0 HA ILE A 15 5.786 -7.718 -0.424 1.00 0.00 H new ATOM 0 HB ILE A 15 6.382 -4.882 0.514 1.00 0.00 H new ATOM 0 HG12 ILE A 15 5.976 -7.422 2.129 1.00 0.00 H new ATOM 0 HG13 ILE A 15 7.547 -6.750 1.737 1.00 0.00 H new ATOM 0 HG21 ILE A 15 4.219 -5.034 1.683 1.00 0.00 H new ATOM 0 HG22 ILE A 15 4.026 -5.161 -0.082 1.00 0.00 H new ATOM 0 HG23 ILE A 15 3.929 -6.621 0.931 1.00 0.00 H new ATOM 0 HD11 ILE A 15 6.863 -6.120 3.998 1.00 0.00 H new ATOM 0 HD12 ILE A 15 6.980 -4.681 2.957 1.00 0.00 H new ATOM 0 HD13 ILE A 15 5.386 -5.364 3.355 1.00 0.00 H new ATOM 239 N GLU A 16 4.828 -6.893 -2.548 1.00 0.00 N ATOM 240 CA GLU A 16 4.139 -6.405 -3.736 1.00 0.00 C ATOM 241 C GLU A 16 2.637 -6.311 -3.502 1.00 0.00 C ATOM 242 O GLU A 16 2.020 -7.243 -2.986 1.00 0.00 O ATOM 243 CB GLU A 16 4.423 -7.317 -4.931 1.00 0.00 C ATOM 244 CG GLU A 16 3.887 -6.799 -6.258 1.00 0.00 C ATOM 245 CD GLU A 16 4.232 -7.690 -7.418 1.00 0.00 C ATOM 246 OE1 GLU A 16 5.394 -7.958 -7.611 1.00 0.00 O ATOM 247 OE2 GLU A 16 3.334 -8.106 -8.111 1.00 0.00 O ATOM 0 H GLU A 16 4.665 -7.879 -2.343 1.00 0.00 H new ATOM 0 HA GLU A 16 4.516 -5.405 -3.952 1.00 0.00 H new ATOM 0 HB2 GLU A 16 5.500 -7.457 -5.018 1.00 0.00 H new ATOM 0 HB3 GLU A 16 3.989 -8.298 -4.736 1.00 0.00 H new ATOM 0 HG2 GLU A 16 2.803 -6.700 -6.192 1.00 0.00 H new ATOM 0 HG3 GLU A 16 4.287 -5.802 -6.441 1.00 0.00 H new ATOM 254 N PHE A 17 2.052 -5.181 -3.884 1.00 0.00 N ATOM 255 CA PHE A 17 0.660 -4.890 -3.561 1.00 0.00 C ATOM 256 C PHE A 17 0.014 -4.029 -4.637 1.00 0.00 C ATOM 257 O PHE A 17 0.701 -3.440 -5.472 1.00 0.00 O ATOM 258 CB PHE A 17 0.563 -4.184 -2.208 1.00 0.00 C ATOM 259 CG PHE A 17 1.406 -2.945 -2.107 1.00 0.00 C ATOM 260 CD1 PHE A 17 2.744 -3.026 -1.748 1.00 0.00 C ATOM 261 CD2 PHE A 17 0.865 -1.696 -2.375 1.00 0.00 C ATOM 262 CE1 PHE A 17 3.521 -1.888 -1.655 1.00 0.00 C ATOM 263 CE2 PHE A 17 1.640 -0.556 -2.283 1.00 0.00 C ATOM 264 CZ PHE A 17 2.968 -0.651 -1.924 1.00 0.00 C ATOM 0 H PHE A 17 2.521 -4.450 -4.419 1.00 0.00 H new ATOM 0 HA PHE A 17 0.125 -5.839 -3.511 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -0.478 -3.920 -2.021 1.00 0.00 H new ATOM 0 HB3 PHE A 17 0.861 -4.880 -1.424 1.00 0.00 H new ATOM 0 HD1 PHE A 17 3.183 -3.990 -1.539 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -0.174 -1.614 -2.659 1.00 0.00 H new ATOM 0 HE1 PHE A 17 4.560 -1.965 -1.372 1.00 0.00 H new ATOM 0 HE2 PHE A 17 1.205 0.410 -2.492 1.00 0.00 H new ATOM 0 HZ PHE A 17 3.574 0.240 -1.853 1.00 0.00 H new ATOM 274 N GLU A 18 -1.313 -3.956 -4.613 1.00 0.00 N ATOM 275 CA GLU A 18 -2.053 -3.119 -5.548 1.00 0.00 C ATOM 276 C GLU A 18 -2.649 -1.905 -4.849 1.00 0.00 C ATOM 277 O GLU A 18 -2.906 -1.935 -3.646 1.00 0.00 O ATOM 278 CB GLU A 18 -3.164 -3.927 -6.225 1.00 0.00 C ATOM 279 CG GLU A 18 -2.666 -5.042 -7.134 1.00 0.00 C ATOM 280 CD GLU A 18 -3.783 -5.785 -7.812 1.00 0.00 C ATOM 281 OE1 GLU A 18 -4.921 -5.467 -7.562 1.00 0.00 O ATOM 282 OE2 GLU A 18 -3.498 -6.672 -8.582 1.00 0.00 O ATOM 0 H GLU A 18 -1.899 -4.469 -3.954 1.00 0.00 H new ATOM 0 HA GLU A 18 -1.352 -2.769 -6.306 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -3.802 -4.360 -5.455 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -3.785 -3.249 -6.809 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -2.005 -4.619 -7.891 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -2.072 -5.744 -6.548 1.00 0.00 H new ATOM 289 N LEU A 19 -2.866 -0.838 -5.610 1.00 0.00 N ATOM 290 CA LEU A 19 -3.482 0.371 -5.075 1.00 0.00 C ATOM 291 C LEU A 19 -4.853 0.612 -5.694 1.00 0.00 C ATOM 292 O LEU A 19 -5.055 0.385 -6.888 1.00 0.00 O ATOM 293 CB LEU A 19 -2.578 1.585 -5.333 1.00 0.00 C ATOM 294 CG LEU A 19 -1.209 1.553 -4.641 1.00 0.00 C ATOM 295 CD1 LEU A 19 -0.364 2.720 -5.134 1.00 0.00 C ATOM 296 CD2 LEU A 19 -1.402 1.616 -3.133 1.00 0.00 C ATOM 0 H LEU A 19 -2.624 -0.786 -6.600 1.00 0.00 H new ATOM 0 HA LEU A 19 -3.609 0.234 -4.001 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -2.420 1.675 -6.408 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -3.106 2.483 -5.012 1.00 0.00 H new ATOM 0 HG LEU A 19 -0.690 0.626 -4.883 1.00 0.00 H new ATOM 0 HD11 LEU A 19 0.609 2.698 -4.643 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -0.228 2.641 -6.213 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -0.867 3.658 -4.900 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -0.430 1.593 -2.641 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -1.920 2.538 -2.871 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -1.994 0.761 -2.806 1.00 0.00 H new ATOM 308 N PHE A 20 -5.793 1.073 -4.876 1.00 0.00 N ATOM 309 CA PHE A 20 -7.190 1.157 -5.284 1.00 0.00 C ATOM 310 C PHE A 20 -7.750 2.553 -5.047 1.00 0.00 C ATOM 311 O PHE A 20 -8.309 2.836 -3.987 1.00 0.00 O ATOM 312 CB PHE A 20 -8.031 0.128 -4.527 1.00 0.00 C ATOM 313 CG PHE A 20 -7.597 -1.293 -4.749 1.00 0.00 C ATOM 314 CD1 PHE A 20 -6.623 -1.869 -3.947 1.00 0.00 C ATOM 315 CD2 PHE A 20 -8.161 -2.056 -5.760 1.00 0.00 C ATOM 316 CE1 PHE A 20 -6.223 -3.176 -4.151 1.00 0.00 C ATOM 317 CE2 PHE A 20 -7.764 -3.362 -5.965 1.00 0.00 C ATOM 318 CZ PHE A 20 -6.793 -3.923 -5.159 1.00 0.00 C ATOM 0 H PHE A 20 -5.612 1.395 -3.925 1.00 0.00 H new ATOM 0 HA PHE A 20 -7.237 0.943 -6.352 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -7.985 0.349 -3.461 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -9.073 0.231 -4.830 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -6.172 -1.290 -3.155 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -8.920 -1.623 -6.395 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -5.463 -3.612 -3.520 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -8.213 -3.945 -6.756 1.00 0.00 H new ATOM 0 HZ PHE A 20 -6.481 -4.945 -5.318 1.00 0.00 H new ATOM 328 N PRO A 21 -7.598 3.422 -6.040 1.00 0.00 N ATOM 329 CA PRO A 21 -8.204 4.748 -5.997 1.00 0.00 C ATOM 330 C PRO A 21 -9.703 4.661 -5.743 1.00 0.00 C ATOM 331 O PRO A 21 -10.297 5.564 -5.155 1.00 0.00 O ATOM 332 CB PRO A 21 -7.898 5.312 -7.388 1.00 0.00 C ATOM 333 CG PRO A 21 -6.673 4.581 -7.818 1.00 0.00 C ATOM 334 CD PRO A 21 -6.866 3.183 -7.290 1.00 0.00 C ATOM 0 HA PRO A 21 -7.818 5.373 -5.192 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -8.725 5.143 -8.077 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -7.728 6.388 -7.353 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -6.568 4.585 -8.903 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -5.773 5.039 -7.409 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -7.434 2.561 -7.982 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -5.915 2.679 -7.115 1.00 0.00 H new ATOM 342 N ASN A 22 -10.310 3.566 -6.189 1.00 0.00 N ATOM 343 CA ASN A 22 -11.737 3.344 -5.984 1.00 0.00 C ATOM 344 C ASN A 22 -12.063 3.187 -4.505 1.00 0.00 C ATOM 345 O ASN A 22 -13.160 3.525 -4.061 1.00 0.00 O ATOM 346 CB ASN A 22 -12.206 2.130 -6.765 1.00 0.00 C ATOM 347 CG ASN A 22 -12.270 2.386 -8.246 1.00 0.00 C ATOM 348 OD1 ASN A 22 -12.342 3.539 -8.687 1.00 0.00 O ATOM 349 ND2 ASN A 22 -12.245 1.332 -9.022 1.00 0.00 N ATOM 0 H ASN A 22 -9.836 2.818 -6.695 1.00 0.00 H new ATOM 0 HA ASN A 22 -12.269 4.221 -6.353 1.00 0.00 H new ATOM 0 HB2 ASN A 22 -11.531 1.296 -6.573 1.00 0.00 H new ATOM 0 HB3 ASN A 22 -13.192 1.831 -6.408 1.00 0.00 H new ATOM 0 HD21 ASN A 22 -12.286 1.443 -10.035 1.00 0.00 H new ATOM 0 HD22 ASN A 22 -12.185 0.399 -8.614 1.00 0.00 H new ATOM 356 N GLU A 23 -11.102 2.672 -3.744 1.00 0.00 N ATOM 357 CA GLU A 23 -11.254 2.546 -2.299 1.00 0.00 C ATOM 358 C GLU A 23 -10.926 3.856 -1.594 1.00 0.00 C ATOM 359 O GLU A 23 -11.597 4.242 -0.637 1.00 0.00 O ATOM 360 CB GLU A 23 -10.357 1.428 -1.764 1.00 0.00 C ATOM 361 CG GLU A 23 -10.767 0.029 -2.202 1.00 0.00 C ATOM 362 CD GLU A 23 -9.812 -1.033 -1.734 1.00 0.00 C ATOM 363 OE1 GLU A 23 -8.814 -0.692 -1.144 1.00 0.00 O ATOM 364 OE2 GLU A 23 -10.079 -2.189 -1.966 1.00 0.00 O ATOM 0 H GLU A 23 -10.209 2.335 -4.105 1.00 0.00 H new ATOM 0 HA GLU A 23 -12.295 2.298 -2.094 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -9.333 1.612 -2.090 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -10.356 1.469 -0.675 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -11.763 -0.190 -1.817 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -10.832 -0.001 -3.290 1.00 0.00 H new ATOM 371 N ALA A 24 -9.889 4.535 -2.073 1.00 0.00 N ATOM 372 CA ALA A 24 -9.453 5.791 -1.473 1.00 0.00 C ATOM 373 C ALA A 24 -8.695 6.648 -2.478 1.00 0.00 C ATOM 374 O ALA A 24 -7.476 6.539 -2.607 1.00 0.00 O ATOM 375 CB ALA A 24 -8.588 5.521 -0.250 1.00 0.00 C ATOM 0 H ALA A 24 -9.335 4.237 -2.875 1.00 0.00 H new ATOM 0 HA ALA A 24 -10.341 6.342 -1.163 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -8.270 6.468 0.187 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -9.163 4.957 0.485 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -7.711 4.945 -0.545 1.00 0.00 H new ATOM 381 N PRO A 25 -9.424 7.501 -3.190 1.00 0.00 N ATOM 382 CA PRO A 25 -8.839 8.307 -4.254 1.00 0.00 C ATOM 383 C PRO A 25 -7.665 9.129 -3.740 1.00 0.00 C ATOM 384 O PRO A 25 -6.536 8.976 -4.206 1.00 0.00 O ATOM 385 CB PRO A 25 -10.005 9.199 -4.691 1.00 0.00 C ATOM 386 CG PRO A 25 -11.218 8.373 -4.427 1.00 0.00 C ATOM 387 CD PRO A 25 -10.904 7.648 -3.145 1.00 0.00 C ATOM 0 HA PRO A 25 -8.430 7.713 -5.071 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -10.027 10.131 -4.126 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -9.928 9.467 -5.745 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -12.108 8.994 -4.325 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -11.409 7.675 -5.242 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -11.226 8.216 -2.272 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -11.403 6.680 -3.097 1.00 0.00 H new ATOM 395 N VAL A 26 -7.937 10.002 -2.775 1.00 0.00 N ATOM 396 CA VAL A 26 -6.945 10.962 -2.308 1.00 0.00 C ATOM 397 C VAL A 26 -5.794 10.263 -1.596 1.00 0.00 C ATOM 398 O VAL A 26 -4.631 10.629 -1.766 1.00 0.00 O ATOM 399 CB VAL A 26 -7.594 11.980 -1.353 1.00 0.00 C ATOM 400 CG1 VAL A 26 -6.533 12.867 -0.719 1.00 0.00 C ATOM 401 CG2 VAL A 26 -8.618 12.816 -2.105 1.00 0.00 C ATOM 0 H VAL A 26 -8.838 10.064 -2.301 1.00 0.00 H new ATOM 0 HA VAL A 26 -6.550 11.481 -3.181 1.00 0.00 H new ATOM 0 HB VAL A 26 -8.104 11.441 -0.555 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -7.010 13.581 -0.047 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -5.832 12.250 -0.156 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -5.996 13.406 -1.499 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -9.073 13.534 -1.423 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -8.126 13.350 -2.918 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -9.390 12.164 -2.514 1.00 0.00 H new ATOM 411 N THR A 27 -6.126 9.255 -0.797 1.00 0.00 N ATOM 412 CA THR A 27 -5.124 8.519 -0.034 1.00 0.00 C ATOM 413 C THR A 27 -4.084 7.889 -0.952 1.00 0.00 C ATOM 414 O THR A 27 -2.881 8.023 -0.728 1.00 0.00 O ATOM 415 CB THR A 27 -5.778 7.427 0.834 1.00 0.00 C ATOM 416 OG1 THR A 27 -6.715 8.029 1.735 1.00 0.00 O ATOM 417 CG2 THR A 27 -4.722 6.677 1.632 1.00 0.00 C ATOM 0 H THR A 27 -7.083 8.928 -0.661 1.00 0.00 H new ATOM 0 HA THR A 27 -4.626 9.236 0.619 1.00 0.00 H new ATOM 0 HB THR A 27 -6.293 6.723 0.180 1.00 0.00 H new ATOM 0 HG1 THR A 27 -7.510 8.315 1.238 1.00 0.00 H new ATOM 0 HG21 THR A 27 -5.202 5.910 2.239 1.00 0.00 H new ATOM 0 HG22 THR A 27 -4.014 6.209 0.948 1.00 0.00 H new ATOM 0 HG23 THR A 27 -4.193 7.375 2.281 1.00 0.00 H new ATOM 425 N VAL A 28 -4.556 7.203 -1.987 1.00 0.00 N ATOM 426 CA VAL A 28 -3.669 6.574 -2.959 1.00 0.00 C ATOM 427 C VAL A 28 -2.813 7.612 -3.674 1.00 0.00 C ATOM 428 O VAL A 28 -1.617 7.407 -3.882 1.00 0.00 O ATOM 429 CB VAL A 28 -4.487 5.784 -3.998 1.00 0.00 C ATOM 430 CG1 VAL A 28 -3.599 5.346 -5.153 1.00 0.00 C ATOM 431 CG2 VAL A 28 -5.141 4.582 -3.334 1.00 0.00 C ATOM 0 H VAL A 28 -5.549 7.068 -2.175 1.00 0.00 H new ATOM 0 HA VAL A 28 -3.013 5.893 -2.417 1.00 0.00 H new ATOM 0 HB VAL A 28 -5.268 6.429 -4.400 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -4.193 4.789 -5.878 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -3.169 6.224 -5.635 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -2.798 4.710 -4.775 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -5.718 4.027 -4.074 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -4.371 3.935 -2.914 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -5.803 4.922 -2.538 1.00 0.00 H new ATOM 441 N ALA A 29 -3.432 8.726 -4.047 1.00 0.00 N ATOM 442 CA ALA A 29 -2.713 9.827 -4.678 1.00 0.00 C ATOM 443 C ALA A 29 -1.576 10.321 -3.794 1.00 0.00 C ATOM 444 O ALA A 29 -0.457 10.530 -4.263 1.00 0.00 O ATOM 445 CB ALA A 29 -3.667 10.968 -4.998 1.00 0.00 C ATOM 0 H ALA A 29 -4.431 8.891 -3.923 1.00 0.00 H new ATOM 0 HA ALA A 29 -2.281 9.457 -5.608 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -3.116 11.782 -5.468 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -4.442 10.614 -5.678 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -4.128 11.326 -4.077 1.00 0.00 H new ATOM 451 N ASN A 30 -1.867 10.505 -2.510 1.00 0.00 N ATOM 452 CA ASN A 30 -0.868 10.971 -1.556 1.00 0.00 C ATOM 453 C ASN A 30 0.238 9.940 -1.370 1.00 0.00 C ATOM 454 O ASN A 30 1.414 10.290 -1.270 1.00 0.00 O ATOM 455 CB ASN A 30 -1.515 11.306 -0.225 1.00 0.00 C ATOM 456 CG ASN A 30 -2.303 12.587 -0.272 1.00 0.00 C ATOM 457 OD1 ASN A 30 -2.105 13.419 -1.165 1.00 0.00 O ATOM 458 ND2 ASN A 30 -3.191 12.761 0.673 1.00 0.00 N ATOM 0 H ASN A 30 -2.789 10.338 -2.106 1.00 0.00 H new ATOM 0 HA ASN A 30 -0.417 11.878 -1.959 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -2.173 10.489 0.071 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -0.743 11.386 0.540 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -3.754 13.611 0.693 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -3.320 12.047 1.390 1.00 0.00 H new ATOM 465 N PHE A 31 -0.146 8.669 -1.324 1.00 0.00 N ATOM 466 CA PHE A 31 0.819 7.581 -1.225 1.00 0.00 C ATOM 467 C PHE A 31 1.830 7.637 -2.362 1.00 0.00 C ATOM 468 O PHE A 31 3.038 7.570 -2.136 1.00 0.00 O ATOM 469 CB PHE A 31 0.102 6.229 -1.240 1.00 0.00 C ATOM 470 CG PHE A 31 1.026 5.052 -1.109 1.00 0.00 C ATOM 471 CD1 PHE A 31 1.453 4.622 0.139 1.00 0.00 C ATOM 472 CD2 PHE A 31 1.471 4.372 -2.232 1.00 0.00 C ATOM 473 CE1 PHE A 31 2.304 3.540 0.261 1.00 0.00 C ATOM 474 CE2 PHE A 31 2.320 3.289 -2.114 1.00 0.00 C ATOM 475 CZ PHE A 31 2.736 2.873 -0.866 1.00 0.00 C ATOM 0 H PHE A 31 -1.120 8.367 -1.354 1.00 0.00 H new ATOM 0 HA PHE A 31 1.353 7.696 -0.282 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -0.622 6.203 -0.426 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -0.460 6.136 -2.169 1.00 0.00 H new ATOM 0 HD1 PHE A 31 1.116 5.139 1.026 1.00 0.00 H new ATOM 0 HD2 PHE A 31 1.150 4.693 -3.212 1.00 0.00 H new ATOM 0 HE1 PHE A 31 2.631 3.217 1.238 1.00 0.00 H new ATOM 0 HE2 PHE A 31 2.658 2.768 -2.998 1.00 0.00 H new ATOM 0 HZ PHE A 31 3.399 2.026 -0.772 1.00 0.00 H new ATOM 485 N GLU A 32 1.330 7.761 -3.588 1.00 0.00 N ATOM 486 CA GLU A 32 2.190 7.842 -4.762 1.00 0.00 C ATOM 487 C GLU A 32 3.095 9.066 -4.699 1.00 0.00 C ATOM 488 O GLU A 32 4.291 8.981 -4.976 1.00 0.00 O ATOM 489 CB GLU A 32 1.346 7.884 -6.038 1.00 0.00 C ATOM 490 CG GLU A 32 0.669 6.567 -6.388 1.00 0.00 C ATOM 491 CD GLU A 32 -0.081 6.623 -7.690 1.00 0.00 C ATOM 492 OE1 GLU A 32 0.532 6.885 -8.696 1.00 0.00 O ATOM 493 OE2 GLU A 32 -1.269 6.405 -7.678 1.00 0.00 O ATOM 0 H GLU A 32 0.332 7.808 -3.793 1.00 0.00 H new ATOM 0 HA GLU A 32 2.819 6.952 -4.777 1.00 0.00 H new ATOM 0 HB2 GLU A 32 0.582 8.653 -5.928 1.00 0.00 H new ATOM 0 HB3 GLU A 32 1.983 8.184 -6.870 1.00 0.00 H new ATOM 0 HG2 GLU A 32 1.422 5.780 -6.441 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -0.020 6.295 -5.589 1.00 0.00 H new ATOM 500 N LYS A 33 2.517 10.204 -4.331 1.00 0.00 N ATOM 501 CA LYS A 33 3.273 11.446 -4.216 1.00 0.00 C ATOM 502 C LYS A 33 4.441 11.292 -3.251 1.00 0.00 C ATOM 503 O LYS A 33 5.576 11.639 -3.576 1.00 0.00 O ATOM 504 CB LYS A 33 2.362 12.588 -3.761 1.00 0.00 C ATOM 505 CG LYS A 33 3.058 13.937 -3.643 1.00 0.00 C ATOM 506 CD LYS A 33 2.075 15.034 -3.263 1.00 0.00 C ATOM 507 CE LYS A 33 2.775 16.374 -3.096 1.00 0.00 C ATOM 508 NZ LYS A 33 1.824 17.459 -2.737 1.00 0.00 N ATOM 0 H LYS A 33 1.526 10.292 -4.107 1.00 0.00 H new ATOM 0 HA LYS A 33 3.674 11.684 -5.201 1.00 0.00 H new ATOM 0 HB2 LYS A 33 1.535 12.680 -4.465 1.00 0.00 H new ATOM 0 HB3 LYS A 33 1.930 12.329 -2.794 1.00 0.00 H new ATOM 0 HG2 LYS A 33 3.847 13.877 -2.894 1.00 0.00 H new ATOM 0 HG3 LYS A 33 3.536 14.186 -4.590 1.00 0.00 H new ATOM 0 HD2 LYS A 33 1.306 15.117 -4.031 1.00 0.00 H new ATOM 0 HD3 LYS A 33 1.571 14.767 -2.334 1.00 0.00 H new ATOM 0 HE2 LYS A 33 3.538 16.290 -2.322 1.00 0.00 H new ATOM 0 HE3 LYS A 33 3.287 16.633 -4.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 2.342 18.355 -2.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 1.110 17.557 -3.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 1.353 17.225 -1.840 1.00 0.00 H new ATOM 522 N LEU A 34 4.155 10.768 -2.063 1.00 0.00 N ATOM 523 CA LEU A 34 5.179 10.587 -1.041 1.00 0.00 C ATOM 524 C LEU A 34 6.269 9.635 -1.515 1.00 0.00 C ATOM 525 O LEU A 34 7.457 9.887 -1.316 1.00 0.00 O ATOM 526 CB LEU A 34 4.548 10.050 0.250 1.00 0.00 C ATOM 527 CG LEU A 34 3.692 11.050 1.037 1.00 0.00 C ATOM 528 CD1 LEU A 34 2.976 10.326 2.170 1.00 0.00 C ATOM 529 CD2 LEU A 34 4.577 12.165 1.575 1.00 0.00 C ATOM 0 H LEU A 34 3.223 10.462 -1.785 1.00 0.00 H new ATOM 0 HA LEU A 34 5.633 11.559 -0.846 1.00 0.00 H new ATOM 0 HB2 LEU A 34 3.929 9.188 -0.001 1.00 0.00 H new ATOM 0 HB3 LEU A 34 5.345 9.691 0.901 1.00 0.00 H new ATOM 0 HG LEU A 34 2.941 11.492 0.382 1.00 0.00 H new ATOM 0 HD11 LEU A 34 2.368 11.037 2.729 1.00 0.00 H new ATOM 0 HD12 LEU A 34 2.336 9.547 1.757 1.00 0.00 H new ATOM 0 HD13 LEU A 34 3.712 9.875 2.836 1.00 0.00 H new ATOM 0 HD21 LEU A 34 3.968 12.875 2.134 1.00 0.00 H new ATOM 0 HD22 LEU A 34 5.336 11.742 2.233 1.00 0.00 H new ATOM 0 HD23 LEU A 34 5.062 12.678 0.744 1.00 0.00 H new ATOM 541 N ALA A 35 5.857 8.538 -2.144 1.00 0.00 N ATOM 542 CA ALA A 35 6.799 7.565 -2.683 1.00 0.00 C ATOM 543 C ALA A 35 7.717 8.203 -3.719 1.00 0.00 C ATOM 544 O ALA A 35 8.921 7.948 -3.737 1.00 0.00 O ATOM 545 CB ALA A 35 6.054 6.386 -3.292 1.00 0.00 C ATOM 0 H ALA A 35 4.876 8.301 -2.293 1.00 0.00 H new ATOM 0 HA ALA A 35 7.417 7.204 -1.861 1.00 0.00 H new ATOM 0 HB1 ALA A 35 6.772 5.669 -3.690 1.00 0.00 H new ATOM 0 HB2 ALA A 35 5.446 5.905 -2.526 1.00 0.00 H new ATOM 0 HB3 ALA A 35 5.410 6.739 -4.097 1.00 0.00 H new ATOM 551 N ASN A 36 7.141 9.034 -4.580 1.00 0.00 N ATOM 552 CA ASN A 36 7.911 9.736 -5.600 1.00 0.00 C ATOM 553 C ASN A 36 8.884 10.725 -4.971 1.00 0.00 C ATOM 554 O ASN A 36 9.971 10.963 -5.500 1.00 0.00 O ATOM 555 CB ASN A 36 6.988 10.442 -6.576 1.00 0.00 C ATOM 556 CG ASN A 36 6.306 9.489 -7.518 1.00 0.00 C ATOM 557 OD1 ASN A 36 6.781 8.370 -7.740 1.00 0.00 O ATOM 558 ND2 ASN A 36 5.200 9.912 -8.076 1.00 0.00 N ATOM 0 H ASN A 36 6.142 9.238 -4.592 1.00 0.00 H new ATOM 0 HA ASN A 36 8.493 8.996 -6.149 1.00 0.00 H new ATOM 0 HB2 ASN A 36 6.234 10.999 -6.020 1.00 0.00 H new ATOM 0 HB3 ASN A 36 7.561 11.169 -7.152 1.00 0.00 H new ATOM 0 HD21 ASN A 36 4.693 9.309 -8.724 1.00 0.00 H new ATOM 0 HD22 ASN A 36 4.845 10.844 -7.863 1.00 0.00 H new ATOM 565 N GLU A 37 8.488 11.300 -3.841 1.00 0.00 N ATOM 566 CA GLU A 37 9.344 12.228 -3.112 1.00 0.00 C ATOM 567 C GLU A 37 10.420 11.487 -2.328 1.00 0.00 C ATOM 568 O GLU A 37 11.322 12.101 -1.760 1.00 0.00 O ATOM 569 CB GLU A 37 8.511 13.089 -2.161 1.00 0.00 C ATOM 570 CG GLU A 37 7.599 14.091 -2.857 1.00 0.00 C ATOM 571 CD GLU A 37 6.721 14.847 -1.898 1.00 0.00 C ATOM 572 OE1 GLU A 37 6.765 14.556 -0.727 1.00 0.00 O ATOM 573 OE2 GLU A 37 6.007 15.717 -2.337 1.00 0.00 O ATOM 0 H GLU A 37 7.578 11.139 -3.409 1.00 0.00 H new ATOM 0 HA GLU A 37 9.833 12.872 -3.843 1.00 0.00 H new ATOM 0 HB2 GLU A 37 7.903 12.435 -1.536 1.00 0.00 H new ATOM 0 HB3 GLU A 37 9.184 13.630 -1.496 1.00 0.00 H new ATOM 0 HG2 GLU A 37 8.208 14.799 -3.420 1.00 0.00 H new ATOM 0 HG3 GLU A 37 6.973 13.565 -3.578 1.00 0.00 H new ATOM 580 N GLY A 38 10.318 10.162 -2.303 1.00 0.00 N ATOM 581 CA GLY A 38 11.302 9.332 -1.618 1.00 0.00 C ATOM 582 C GLY A 38 11.034 9.284 -0.120 1.00 0.00 C ATOM 583 O GLY A 38 11.923 8.963 0.669 1.00 0.00 O ATOM 0 H GLY A 38 9.564 9.640 -2.749 1.00 0.00 H new ATOM 0 HA2 GLY A 38 11.278 8.322 -2.027 1.00 0.00 H new ATOM 0 HA3 GLY A 38 12.302 9.725 -1.799 1.00 0.00 H new ATOM 587 N PHE A 39 9.805 9.605 0.268 1.00 0.00 N ATOM 588 CA PHE A 39 9.411 9.574 1.671 1.00 0.00 C ATOM 589 C PHE A 39 9.394 8.149 2.208 1.00 0.00 C ATOM 590 O PHE A 39 9.983 7.861 3.250 1.00 0.00 O ATOM 591 CB PHE A 39 8.031 10.209 1.853 1.00 0.00 C ATOM 592 CG PHE A 39 7.495 10.107 3.252 1.00 0.00 C ATOM 593 CD1 PHE A 39 7.960 10.948 4.252 1.00 0.00 C ATOM 594 CD2 PHE A 39 6.527 9.168 3.573 1.00 0.00 C ATOM 595 CE1 PHE A 39 7.469 10.855 5.540 1.00 0.00 C ATOM 596 CE2 PHE A 39 6.033 9.073 4.860 1.00 0.00 C ATOM 597 CZ PHE A 39 6.506 9.917 5.843 1.00 0.00 C ATOM 0 H PHE A 39 9.063 9.890 -0.371 1.00 0.00 H new ATOM 0 HA PHE A 39 10.148 10.147 2.234 1.00 0.00 H new ATOM 0 HB2 PHE A 39 8.085 11.260 1.571 1.00 0.00 H new ATOM 0 HB3 PHE A 39 7.329 9.731 1.169 1.00 0.00 H new ATOM 0 HD1 PHE A 39 8.715 11.685 4.021 1.00 0.00 H new ATOM 0 HD2 PHE A 39 6.155 8.503 2.808 1.00 0.00 H new ATOM 0 HE1 PHE A 39 7.840 11.517 6.309 1.00 0.00 H new ATOM 0 HE2 PHE A 39 5.277 8.339 5.096 1.00 0.00 H new ATOM 0 HZ PHE A 39 6.122 9.843 6.850 1.00 0.00 H new ATOM 607 N TYR A 40 8.716 7.260 1.491 1.00 0.00 N ATOM 608 CA TYR A 40 8.611 5.864 1.901 1.00 0.00 C ATOM 609 C TYR A 40 9.937 5.138 1.721 1.00 0.00 C ATOM 610 O TYR A 40 10.189 4.118 2.364 1.00 0.00 O ATOM 611 CB TYR A 40 7.507 5.157 1.112 1.00 0.00 C ATOM 612 CG TYR A 40 6.109 5.490 1.585 1.00 0.00 C ATOM 613 CD1 TYR A 40 5.607 4.901 2.736 1.00 0.00 C ATOM 614 CD2 TYR A 40 5.329 6.387 0.869 1.00 0.00 C ATOM 615 CE1 TYR A 40 4.331 5.205 3.168 1.00 0.00 C ATOM 616 CE2 TYR A 40 4.053 6.691 1.301 1.00 0.00 C ATOM 617 CZ TYR A 40 3.556 6.096 2.455 1.00 0.00 C ATOM 618 OH TYR A 40 2.285 6.400 2.885 1.00 0.00 O ATOM 0 H TYR A 40 8.230 7.481 0.622 1.00 0.00 H new ATOM 0 HA TYR A 40 8.355 5.843 2.960 1.00 0.00 H new ATOM 0 HB2 TYR A 40 7.598 5.424 0.059 1.00 0.00 H new ATOM 0 HB3 TYR A 40 7.657 4.080 1.181 1.00 0.00 H new ATOM 0 HD1 TYR A 40 6.214 4.204 3.295 1.00 0.00 H new ATOM 0 HD2 TYR A 40 5.720 6.847 -0.026 1.00 0.00 H new ATOM 0 HE1 TYR A 40 3.940 4.745 4.064 1.00 0.00 H new ATOM 0 HE2 TYR A 40 3.444 7.388 0.745 1.00 0.00 H new ATOM 0 HH TYR A 40 1.877 7.044 2.270 1.00 0.00 H new ATOM 628 N ASN A 41 10.783 5.666 0.843 1.00 0.00 N ATOM 629 CA ASN A 41 12.112 5.108 0.627 1.00 0.00 C ATOM 630 C ASN A 41 13.014 5.352 1.831 1.00 0.00 C ATOM 631 O ASN A 41 13.541 6.449 2.011 1.00 0.00 O ATOM 632 CB ASN A 41 12.735 5.683 -0.631 1.00 0.00 C ATOM 633 CG ASN A 41 14.051 5.039 -0.970 1.00 0.00 C ATOM 634 OD1 ASN A 41 14.785 4.593 -0.082 1.00 0.00 O ATOM 635 ND2 ASN A 41 14.363 4.983 -2.240 1.00 0.00 N ATOM 0 H ASN A 41 10.571 6.482 0.268 1.00 0.00 H new ATOM 0 HA ASN A 41 12.006 4.031 0.500 1.00 0.00 H new ATOM 0 HB2 ASN A 41 12.046 5.554 -1.465 1.00 0.00 H new ATOM 0 HB3 ASN A 41 12.882 6.755 -0.502 1.00 0.00 H new ATOM 0 HD21 ASN A 41 15.243 4.558 -2.531 1.00 0.00 H new ATOM 0 HD22 ASN A 41 13.726 5.364 -2.939 1.00 0.00 H new ATOM 642 N GLY A 42 13.187 4.321 2.652 1.00 0.00 N ATOM 643 CA GLY A 42 13.979 4.437 3.871 1.00 0.00 C ATOM 644 C GLY A 42 13.087 4.536 5.101 1.00 0.00 C ATOM 645 O GLY A 42 13.572 4.568 6.232 1.00 0.00 O ATOM 0 H GLY A 42 12.789 3.395 2.495 1.00 0.00 H new ATOM 0 HA2 GLY A 42 14.636 3.573 3.964 1.00 0.00 H new ATOM 0 HA3 GLY A 42 14.618 5.318 3.810 1.00 0.00 H new ATOM 649 N LEU A 43 11.778 4.584 4.874 1.00 0.00 N ATOM 650 CA LEU A 43 10.815 4.695 5.964 1.00 0.00 C ATOM 651 C LEU A 43 10.787 3.426 6.804 1.00 0.00 C ATOM 652 O LEU A 43 10.979 2.324 6.290 1.00 0.00 O ATOM 653 CB LEU A 43 9.415 4.977 5.405 1.00 0.00 C ATOM 654 CG LEU A 43 8.450 5.693 6.360 1.00 0.00 C ATOM 655 CD1 LEU A 43 9.016 7.059 6.725 1.00 0.00 C ATOM 656 CD2 LEU A 43 7.086 5.825 5.700 1.00 0.00 C ATOM 0 H LEU A 43 11.360 4.548 3.944 1.00 0.00 H new ATOM 0 HA LEU A 43 11.124 5.523 6.602 1.00 0.00 H new ATOM 0 HB2 LEU A 43 9.519 5.580 4.503 1.00 0.00 H new ATOM 0 HB3 LEU A 43 8.966 4.030 5.106 1.00 0.00 H new ATOM 0 HG LEU A 43 8.334 5.113 7.276 1.00 0.00 H new ATOM 0 HD11 LEU A 43 8.331 7.567 7.403 1.00 0.00 H new ATOM 0 HD12 LEU A 43 9.983 6.934 7.213 1.00 0.00 H new ATOM 0 HD13 LEU A 43 9.140 7.655 5.821 1.00 0.00 H new ATOM 0 HD21 LEU A 43 6.401 6.333 6.379 1.00 0.00 H new ATOM 0 HD22 LEU A 43 7.181 6.402 4.780 1.00 0.00 H new ATOM 0 HD23 LEU A 43 6.697 4.834 5.467 1.00 0.00 H new ATOM 668 N THR A 44 10.546 3.586 8.102 1.00 0.00 N ATOM 669 CA THR A 44 10.663 2.482 9.045 1.00 0.00 C ATOM 670 C THR A 44 9.342 2.225 9.759 1.00 0.00 C ATOM 671 O THR A 44 8.469 3.093 9.802 1.00 0.00 O ATOM 672 CB THR A 44 11.768 2.753 10.083 1.00 0.00 C ATOM 673 OG1 THR A 44 11.378 3.844 10.927 1.00 0.00 O ATOM 674 CG2 THR A 44 13.078 3.098 9.390 1.00 0.00 C ATOM 0 H THR A 44 10.268 4.472 8.524 1.00 0.00 H new ATOM 0 HA THR A 44 10.930 1.595 8.471 1.00 0.00 H new ATOM 0 HB THR A 44 11.911 1.854 10.682 1.00 0.00 H new ATOM 0 HG1 THR A 44 10.956 4.543 10.385 1.00 0.00 H new ATOM 0 HG21 THR A 44 13.847 3.286 10.139 1.00 0.00 H new ATOM 0 HG22 THR A 44 13.385 2.266 8.756 1.00 0.00 H new ATOM 0 HG23 THR A 44 12.942 3.989 8.778 1.00 0.00 H new ATOM 682 N PHE A 45 9.201 1.030 10.322 1.00 0.00 N ATOM 683 CA PHE A 45 8.107 0.739 11.240 1.00 0.00 C ATOM 684 C PHE A 45 8.507 1.026 12.682 1.00 0.00 C ATOM 685 O PHE A 45 9.668 1.313 12.968 1.00 0.00 O ATOM 686 CB PHE A 45 7.672 -0.722 11.107 1.00 0.00 C ATOM 687 CG PHE A 45 6.985 -1.035 9.808 1.00 0.00 C ATOM 688 CD1 PHE A 45 7.684 -0.994 8.611 1.00 0.00 C ATOM 689 CD2 PHE A 45 5.640 -1.367 9.781 1.00 0.00 C ATOM 690 CE1 PHE A 45 7.053 -1.281 7.415 1.00 0.00 C ATOM 691 CE2 PHE A 45 5.007 -1.656 8.586 1.00 0.00 C ATOM 692 CZ PHE A 45 5.716 -1.611 7.403 1.00 0.00 C ATOM 0 H PHE A 45 9.832 0.246 10.158 1.00 0.00 H new ATOM 0 HA PHE A 45 7.272 1.388 10.977 1.00 0.00 H new ATOM 0 HB2 PHE A 45 8.548 -1.363 11.207 1.00 0.00 H new ATOM 0 HB3 PHE A 45 7.001 -0.968 11.930 1.00 0.00 H new ATOM 0 HD1 PHE A 45 8.733 -0.735 8.613 1.00 0.00 H new ATOM 0 HD2 PHE A 45 5.080 -1.400 10.704 1.00 0.00 H new ATOM 0 HE1 PHE A 45 7.609 -1.246 6.490 1.00 0.00 H new ATOM 0 HE2 PHE A 45 3.959 -1.917 8.579 1.00 0.00 H new ATOM 0 HZ PHE A 45 5.223 -1.834 6.469 1.00 0.00 H new ATOM 702 N HIS A 46 7.536 0.947 13.586 1.00 0.00 N ATOM 703 CA HIS A 46 7.773 1.252 14.992 1.00 0.00 C ATOM 704 C HIS A 46 6.980 0.319 15.899 1.00 0.00 C ATOM 705 O HIS A 46 7.348 0.101 17.053 1.00 0.00 O ATOM 706 CB HIS A 46 7.405 2.707 15.299 1.00 0.00 C ATOM 707 CG HIS A 46 5.985 3.052 14.970 1.00 0.00 C ATOM 708 ND1 HIS A 46 4.978 3.034 15.912 1.00 0.00 N ATOM 709 CD2 HIS A 46 5.405 3.421 13.804 1.00 0.00 C ATOM 710 CE1 HIS A 46 3.838 3.379 15.338 1.00 0.00 C ATOM 711 NE2 HIS A 46 4.070 3.618 14.061 1.00 0.00 N ATOM 0 H HIS A 46 6.577 0.674 13.370 1.00 0.00 H new ATOM 0 HA HIS A 46 8.835 1.104 15.186 1.00 0.00 H new ATOM 0 HB2 HIS A 46 7.581 2.901 16.357 1.00 0.00 H new ATOM 0 HB3 HIS A 46 8.069 3.366 14.739 1.00 0.00 H new ATOM 0 HD2 HIS A 46 5.899 3.538 12.851 1.00 0.00 H new ATOM 0 HE1 HIS A 46 2.880 3.453 15.831 1.00 0.00 H new ATOM 0 HE2 HIS A 46 3.371 3.903 13.375 1.00 0.00 H new ATOM 718 N ARG A 47 5.891 -0.227 15.371 1.00 0.00 N ATOM 719 CA ARG A 47 5.090 -1.200 16.102 1.00 0.00 C ATOM 720 C ARG A 47 4.615 -2.322 15.189 1.00 0.00 C ATOM 721 O ARG A 47 3.471 -2.322 14.733 1.00 0.00 O ATOM 722 CB ARG A 47 3.885 -0.528 16.744 1.00 0.00 C ATOM 723 CG ARG A 47 4.216 0.430 17.878 1.00 0.00 C ATOM 724 CD ARG A 47 4.742 -0.287 19.067 1.00 0.00 C ATOM 725 NE ARG A 47 4.895 0.598 20.210 1.00 0.00 N ATOM 726 CZ ARG A 47 5.985 1.352 20.453 1.00 0.00 C ATOM 727 NH1 ARG A 47 7.006 1.317 19.624 1.00 0.00 N ATOM 728 NH2 ARG A 47 6.029 2.126 21.523 1.00 0.00 N ATOM 0 H ARG A 47 5.542 -0.011 14.437 1.00 0.00 H new ATOM 0 HA ARG A 47 5.724 -1.626 16.880 1.00 0.00 H new ATOM 0 HB2 ARG A 47 3.339 0.017 15.975 1.00 0.00 H new ATOM 0 HB3 ARG A 47 3.216 -1.300 17.124 1.00 0.00 H new ATOM 0 HG2 ARG A 47 4.952 1.157 17.537 1.00 0.00 H new ATOM 0 HG3 ARG A 47 3.322 0.988 18.156 1.00 0.00 H new ATOM 0 HD2 ARG A 47 4.067 -1.102 19.327 1.00 0.00 H new ATOM 0 HD3 ARG A 47 5.705 -0.736 18.824 1.00 0.00 H new ATOM 0 HE ARG A 47 4.123 0.652 20.875 1.00 0.00 H new ATOM 0 HH11 ARG A 47 6.972 0.719 18.798 1.00 0.00 H new ATOM 0 HH12 ARG A 47 7.831 1.887 19.807 1.00 0.00 H new ATOM 0 HH21 ARG A 47 5.237 2.153 22.166 1.00 0.00 H new ATOM 0 HH22 ARG A 47 6.854 2.696 21.706 1.00 0.00 H new ATOM 742 N VAL A 48 5.499 -3.277 14.923 1.00 0.00 N ATOM 743 CA VAL A 48 5.146 -4.450 14.133 1.00 0.00 C ATOM 744 C VAL A 48 4.626 -5.575 15.018 1.00 0.00 C ATOM 745 O VAL A 48 5.257 -5.940 16.010 1.00 0.00 O ATOM 746 CB VAL A 48 6.368 -4.949 13.341 1.00 0.00 C ATOM 747 CG1 VAL A 48 6.027 -6.220 12.576 1.00 0.00 C ATOM 748 CG2 VAL A 48 6.851 -3.862 12.392 1.00 0.00 C ATOM 0 H VAL A 48 6.467 -3.261 15.244 1.00 0.00 H new ATOM 0 HA VAL A 48 4.356 -4.157 13.441 1.00 0.00 H new ATOM 0 HB VAL A 48 7.170 -5.182 14.041 1.00 0.00 H new ATOM 0 HG11 VAL A 48 6.903 -6.558 12.022 1.00 0.00 H new ATOM 0 HG12 VAL A 48 5.720 -6.996 13.278 1.00 0.00 H new ATOM 0 HG13 VAL A 48 5.213 -6.018 11.880 1.00 0.00 H new ATOM 0 HG21 VAL A 48 7.716 -4.223 11.835 1.00 0.00 H new ATOM 0 HG22 VAL A 48 6.052 -3.606 11.696 1.00 0.00 H new ATOM 0 HG23 VAL A 48 7.131 -2.978 12.964 1.00 0.00 H new ATOM 758 N ILE A 49 3.469 -6.120 14.656 1.00 0.00 N ATOM 759 CA ILE A 49 2.848 -7.187 15.431 1.00 0.00 C ATOM 760 C ILE A 49 2.517 -8.386 14.552 1.00 0.00 C ATOM 761 O ILE A 49 1.434 -8.464 13.973 1.00 0.00 O ATOM 762 CB ILE A 49 1.567 -6.688 16.124 1.00 0.00 C ATOM 763 CG1 ILE A 49 1.843 -5.388 16.884 1.00 0.00 C ATOM 764 CG2 ILE A 49 1.022 -7.753 17.064 1.00 0.00 C ATOM 765 CD1 ILE A 49 0.605 -4.753 17.476 1.00 0.00 C ATOM 0 H ILE A 49 2.942 -5.839 13.829 1.00 0.00 H new ATOM 0 HA ILE A 49 3.566 -7.497 16.190 1.00 0.00 H new ATOM 0 HB ILE A 49 0.815 -6.487 15.361 1.00 0.00 H new ATOM 0 HG12 ILE A 49 2.555 -5.590 17.685 1.00 0.00 H new ATOM 0 HG13 ILE A 49 2.317 -4.676 16.208 1.00 0.00 H new ATOM 0 HG21 ILE A 49 0.116 -7.384 17.546 1.00 0.00 H new ATOM 0 HG22 ILE A 49 0.790 -8.655 16.497 1.00 0.00 H new ATOM 0 HG23 ILE A 49 1.769 -7.984 17.824 1.00 0.00 H new ATOM 0 HD11 ILE A 49 0.880 -3.837 17.999 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -0.100 -4.518 16.679 1.00 0.00 H new ATOM 0 HD13 ILE A 49 0.141 -5.446 18.178 1.00 0.00 H new ATOM 777 N PRO A 50 3.457 -9.321 14.457 1.00 0.00 N ATOM 778 CA PRO A 50 3.271 -10.515 13.641 1.00 0.00 C ATOM 779 C PRO A 50 2.017 -11.275 14.055 1.00 0.00 C ATOM 780 O PRO A 50 1.811 -11.554 15.236 1.00 0.00 O ATOM 781 CB PRO A 50 4.540 -11.325 13.919 1.00 0.00 C ATOM 782 CG PRO A 50 5.563 -10.295 14.263 1.00 0.00 C ATOM 783 CD PRO A 50 4.804 -9.266 15.059 1.00 0.00 C ATOM 0 HA PRO A 50 3.132 -10.297 12.582 1.00 0.00 H new ATOM 0 HB2 PRO A 50 4.392 -12.029 14.738 1.00 0.00 H new ATOM 0 HB3 PRO A 50 4.839 -11.908 13.048 1.00 0.00 H new ATOM 0 HG2 PRO A 50 6.379 -10.724 14.844 1.00 0.00 H new ATOM 0 HG3 PRO A 50 6.004 -9.858 13.367 1.00 0.00 H new ATOM 0 HD2 PRO A 50 4.783 -9.510 16.121 1.00 0.00 H new ATOM 0 HD3 PRO A 50 5.248 -8.275 14.968 1.00 0.00 H new ATOM 791 N GLY A 51 1.184 -11.608 13.076 1.00 0.00 N ATOM 792 CA GLY A 51 -0.006 -12.414 13.323 1.00 0.00 C ATOM 793 C GLY A 51 -1.232 -11.537 13.539 1.00 0.00 C ATOM 794 O GLY A 51 -2.354 -12.034 13.636 1.00 0.00 O ATOM 0 H GLY A 51 1.311 -11.332 12.102 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -0.178 -13.081 12.479 1.00 0.00 H new ATOM 0 HA3 GLY A 51 0.153 -13.043 14.199 1.00 0.00 H new ATOM 798 N PHE A 52 -1.011 -10.229 13.614 1.00 0.00 N ATOM 799 CA PHE A 52 -2.098 -9.278 13.819 1.00 0.00 C ATOM 800 C PHE A 52 -2.043 -8.149 12.798 1.00 0.00 C ATOM 801 O PHE A 52 -2.670 -8.224 11.740 1.00 0.00 O ATOM 802 CB PHE A 52 -2.039 -8.697 15.232 1.00 0.00 C ATOM 803 CG PHE A 52 -2.331 -9.700 16.312 1.00 0.00 C ATOM 804 CD1 PHE A 52 -1.312 -10.465 16.862 1.00 0.00 C ATOM 805 CD2 PHE A 52 -3.623 -9.882 16.781 1.00 0.00 C ATOM 806 CE1 PHE A 52 -1.579 -11.388 17.856 1.00 0.00 C ATOM 807 CE2 PHE A 52 -3.892 -10.803 17.774 1.00 0.00 C ATOM 808 CZ PHE A 52 -2.869 -11.556 18.312 1.00 0.00 C ATOM 0 H PHE A 52 -0.088 -9.803 13.536 1.00 0.00 H new ATOM 0 HA PHE A 52 -3.037 -9.816 13.689 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -1.049 -8.274 15.400 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -2.753 -7.877 15.308 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -0.299 -10.338 16.510 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -4.429 -9.296 16.364 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -0.777 -11.977 18.275 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -4.903 -10.934 18.129 1.00 0.00 H new ATOM 0 HZ PHE A 52 -3.078 -12.276 19.089 1.00 0.00 H new ATOM 818 N VAL A 53 -1.288 -7.104 13.119 1.00 0.00 N ATOM 819 CA VAL A 53 -1.177 -5.942 12.246 1.00 0.00 C ATOM 820 C VAL A 53 0.072 -5.130 12.566 1.00 0.00 C ATOM 821 O VAL A 53 0.365 -4.857 13.730 1.00 0.00 O ATOM 822 CB VAL A 53 -2.420 -5.044 12.389 1.00 0.00 C ATOM 823 CG1 VAL A 53 -2.558 -4.550 13.821 1.00 0.00 C ATOM 824 CG2 VAL A 53 -2.328 -3.874 11.421 1.00 0.00 C ATOM 0 H VAL A 53 -0.743 -7.038 13.979 1.00 0.00 H new ATOM 0 HA VAL A 53 -1.105 -6.305 11.221 1.00 0.00 H new ATOM 0 HB VAL A 53 -3.308 -5.628 12.146 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -3.441 -3.917 13.904 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -2.659 -5.403 14.492 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -1.673 -3.976 14.095 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -3.211 -3.243 11.528 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -1.435 -3.289 11.641 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -2.272 -4.250 10.400 1.00 0.00 H new ATOM 834 N SER A 54 0.805 -4.746 11.526 1.00 0.00 N ATOM 835 CA SER A 54 2.025 -3.968 11.695 1.00 0.00 C ATOM 836 C SER A 54 1.778 -2.489 11.429 1.00 0.00 C ATOM 837 O SER A 54 1.165 -2.123 10.427 1.00 0.00 O ATOM 838 CB SER A 54 3.106 -4.484 10.765 1.00 0.00 C ATOM 839 OG SER A 54 2.622 -4.616 9.457 1.00 0.00 O ATOM 0 H SER A 54 0.574 -4.962 10.556 1.00 0.00 H new ATOM 0 HA SER A 54 2.353 -4.079 12.729 1.00 0.00 H new ATOM 0 HB2 SER A 54 3.956 -3.801 10.775 1.00 0.00 H new ATOM 0 HB3 SER A 54 3.468 -5.448 11.122 1.00 0.00 H new ATOM 0 HG SER A 54 2.491 -5.565 9.251 1.00 0.00 H new ATOM 845 N GLN A 55 2.259 -1.642 12.333 1.00 0.00 N ATOM 846 CA GLN A 55 2.114 -0.199 12.185 1.00 0.00 C ATOM 847 C GLN A 55 3.463 0.470 11.952 1.00 0.00 C ATOM 848 O GLN A 55 4.412 0.250 12.703 1.00 0.00 O ATOM 849 CB GLN A 55 1.439 0.402 13.420 1.00 0.00 C ATOM 850 CG GLN A 55 1.112 1.880 13.294 1.00 0.00 C ATOM 851 CD GLN A 55 0.468 2.440 14.549 1.00 0.00 C ATOM 852 OE1 GLN A 55 0.306 1.733 15.548 1.00 0.00 O ATOM 853 NE2 GLN A 55 0.099 3.715 14.505 1.00 0.00 N ATOM 0 H GLN A 55 2.753 -1.931 13.177 1.00 0.00 H new ATOM 0 HA GLN A 55 1.486 -0.017 11.313 1.00 0.00 H new ATOM 0 HB2 GLN A 55 0.519 -0.146 13.620 1.00 0.00 H new ATOM 0 HB3 GLN A 55 2.090 0.258 14.282 1.00 0.00 H new ATOM 0 HG2 GLN A 55 2.026 2.434 13.080 1.00 0.00 H new ATOM 0 HG3 GLN A 55 0.442 2.030 12.447 1.00 0.00 H new ATOM 0 HE21 GLN A 55 0.253 4.261 13.658 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -0.338 4.148 15.319 1.00 0.00 H new ATOM 862 N GLY A 56 3.540 1.286 10.907 1.00 0.00 N ATOM 863 CA GLY A 56 4.781 1.968 10.556 1.00 0.00 C ATOM 864 C GLY A 56 4.509 3.360 10.005 1.00 0.00 C ATOM 865 O GLY A 56 3.367 3.819 9.987 1.00 0.00 O ATOM 0 H GLY A 56 2.757 1.492 10.287 1.00 0.00 H new ATOM 0 HA2 GLY A 56 5.420 2.041 11.436 1.00 0.00 H new ATOM 0 HA3 GLY A 56 5.324 1.381 9.816 1.00 0.00 H new ATOM 869 N GLY A 57 5.565 4.030 9.555 1.00 0.00 N ATOM 870 CA GLY A 57 5.432 5.344 8.936 1.00 0.00 C ATOM 871 C GLY A 57 6.285 6.381 9.655 1.00 0.00 C ATOM 872 O GLY A 57 5.913 7.551 9.744 1.00 0.00 O ATOM 0 H GLY A 57 6.523 3.684 9.607 1.00 0.00 H new ATOM 0 HA2 GLY A 57 5.730 5.287 7.889 1.00 0.00 H new ATOM 0 HA3 GLY A 57 4.387 5.653 8.954 1.00 0.00 H new ATOM 876 N CYS A 58 7.430 5.944 10.168 1.00 0.00 N ATOM 877 CA CYS A 58 8.322 6.826 10.911 1.00 0.00 C ATOM 878 C CYS A 58 9.712 6.857 10.288 1.00 0.00 C ATOM 879 O CYS A 58 10.133 5.898 9.639 1.00 0.00 O ATOM 880 CB CYS A 58 8.433 6.376 12.369 1.00 0.00 C ATOM 881 SG CYS A 58 6.866 6.408 13.272 1.00 0.00 S ATOM 0 H CYS A 58 7.762 4.983 10.083 1.00 0.00 H new ATOM 0 HA CYS A 58 7.896 7.829 10.872 1.00 0.00 H new ATOM 0 HB2 CYS A 58 8.835 5.363 12.396 1.00 0.00 H new ATOM 0 HB3 CYS A 58 9.149 7.017 12.883 1.00 0.00 H new ATOM 0 HG CYS A 58 5.954 5.791 12.581 1.00 0.00 H new ATOM 887 N PRO A 59 10.420 7.963 10.487 1.00 0.00 N ATOM 888 CA PRO A 59 11.742 8.144 9.898 1.00 0.00 C ATOM 889 C PRO A 59 12.802 7.379 10.679 1.00 0.00 C ATOM 890 O PRO A 59 13.855 7.035 10.142 1.00 0.00 O ATOM 891 CB PRO A 59 11.956 9.658 9.988 1.00 0.00 C ATOM 892 CG PRO A 59 11.194 10.063 11.204 1.00 0.00 C ATOM 893 CD PRO A 59 9.966 9.192 11.184 1.00 0.00 C ATOM 0 HA PRO A 59 11.816 7.766 8.878 1.00 0.00 H new ATOM 0 HB2 PRO A 59 13.013 9.906 10.080 1.00 0.00 H new ATOM 0 HB3 PRO A 59 11.585 10.166 9.098 1.00 0.00 H new ATOM 0 HG2 PRO A 59 11.779 9.905 12.110 1.00 0.00 H new ATOM 0 HG3 PRO A 59 10.932 11.121 11.175 1.00 0.00 H new ATOM 0 HD2 PRO A 59 9.613 8.974 12.192 1.00 0.00 H new ATOM 0 HD3 PRO A 59 9.143 9.672 10.655 1.00 0.00 H new ATOM 901 N ARG A 60 12.519 7.117 11.950 1.00 0.00 N ATOM 902 CA ARG A 60 13.480 6.461 12.830 1.00 0.00 C ATOM 903 C ARG A 60 12.811 5.379 13.667 1.00 0.00 C ATOM 904 O ARG A 60 13.462 4.713 14.473 1.00 0.00 O ATOM 905 CB ARG A 60 14.141 7.476 13.751 1.00 0.00 C ATOM 906 CG ARG A 60 14.938 8.559 13.043 1.00 0.00 C ATOM 907 CD ARG A 60 16.171 8.014 12.418 1.00 0.00 C ATOM 908 NE ARG A 60 16.981 9.060 11.816 1.00 0.00 N ATOM 909 CZ ARG A 60 16.835 9.513 10.555 1.00 0.00 C ATOM 910 NH1 ARG A 60 15.904 9.002 9.778 1.00 0.00 N ATOM 911 NH2 ARG A 60 17.624 10.469 10.100 1.00 0.00 N ATOM 0 H ARG A 60 11.631 7.349 12.395 1.00 0.00 H new ATOM 0 HA ARG A 60 14.238 5.997 12.200 1.00 0.00 H new ATOM 0 HB2 ARG A 60 13.370 7.951 14.358 1.00 0.00 H new ATOM 0 HB3 ARG A 60 14.804 6.946 14.435 1.00 0.00 H new ATOM 0 HG2 ARG A 60 14.318 9.026 12.278 1.00 0.00 H new ATOM 0 HG3 ARG A 60 15.206 9.339 13.756 1.00 0.00 H new ATOM 0 HD2 ARG A 60 16.758 7.488 13.171 1.00 0.00 H new ATOM 0 HD3 ARG A 60 15.899 7.282 11.657 1.00 0.00 H new ATOM 0 HE ARG A 60 17.712 9.481 12.389 1.00 0.00 H new ATOM 0 HH11 ARG A 60 15.294 8.264 10.130 1.00 0.00 H new ATOM 0 HH12 ARG A 60 15.792 9.344 8.823 1.00 0.00 H new ATOM 0 HH21 ARG A 60 18.345 10.865 10.703 1.00 0.00 H new ATOM 0 HH22 ARG A 60 17.513 10.811 9.146 1.00 0.00 H new ATOM 925 N GLY A 61 11.508 5.208 13.473 1.00 0.00 N ATOM 926 CA GLY A 61 10.734 4.257 14.262 1.00 0.00 C ATOM 927 C GLY A 61 10.467 4.791 15.663 1.00 0.00 C ATOM 928 O GLY A 61 10.371 4.025 16.622 1.00 0.00 O ATOM 0 H GLY A 61 10.965 5.716 12.775 1.00 0.00 H new ATOM 0 HA2 GLY A 61 9.788 4.051 13.762 1.00 0.00 H new ATOM 0 HA3 GLY A 61 11.272 3.311 14.327 1.00 0.00 H new ATOM 932 N ASN A 62 10.349 6.109 15.776 1.00 0.00 N ATOM 933 CA ASN A 62 10.180 6.755 17.072 1.00 0.00 C ATOM 934 C ASN A 62 8.707 6.994 17.381 1.00 0.00 C ATOM 935 O ASN A 62 8.367 7.608 18.392 1.00 0.00 O ATOM 936 CB ASN A 62 10.955 8.059 17.125 1.00 0.00 C ATOM 937 CG ASN A 62 10.456 9.068 16.130 1.00 0.00 C ATOM 938 OD1 ASN A 62 9.547 8.785 15.342 1.00 0.00 O ATOM 939 ND2 ASN A 62 11.033 10.243 16.149 1.00 0.00 N ATOM 0 H ASN A 62 10.367 6.752 14.984 1.00 0.00 H new ATOM 0 HA ASN A 62 10.578 6.085 17.834 1.00 0.00 H new ATOM 0 HB2 ASN A 62 10.885 8.478 18.129 1.00 0.00 H new ATOM 0 HB3 ASN A 62 12.010 7.859 16.936 1.00 0.00 H new ATOM 0 HD21 ASN A 62 10.736 10.968 15.496 1.00 0.00 H new ATOM 0 HD22 ASN A 62 11.780 10.434 16.817 1.00 0.00 H new ATOM 946 N GLY A 63 7.839 6.506 16.503 1.00 0.00 N ATOM 947 CA GLY A 63 6.399 6.585 16.726 1.00 0.00 C ATOM 948 C GLY A 63 5.840 7.920 16.249 1.00 0.00 C ATOM 949 O GLY A 63 4.659 8.211 16.437 1.00 0.00 O ATOM 0 H GLY A 63 8.106 6.051 15.630 1.00 0.00 H new ATOM 0 HA2 GLY A 63 5.902 5.770 16.199 1.00 0.00 H new ATOM 0 HA3 GLY A 63 6.185 6.456 17.787 1.00 0.00 H new ATOM 953 N THR A 64 6.696 8.727 15.633 1.00 0.00 N ATOM 954 CA THR A 64 6.287 10.030 15.123 1.00 0.00 C ATOM 955 C THR A 64 6.597 10.162 13.637 1.00 0.00 C ATOM 956 O THR A 64 7.714 9.887 13.200 1.00 0.00 O ATOM 957 CB THR A 64 6.975 11.170 15.898 1.00 0.00 C ATOM 958 OG1 THR A 64 6.629 11.084 17.286 1.00 0.00 O ATOM 959 CG2 THR A 64 6.542 12.523 15.353 1.00 0.00 C ATOM 0 H THR A 64 7.678 8.502 15.475 1.00 0.00 H new ATOM 0 HA THR A 64 5.209 10.108 15.265 1.00 0.00 H new ATOM 0 HB THR A 64 8.054 11.071 15.779 1.00 0.00 H new ATOM 0 HG1 THR A 64 7.069 11.809 17.778 1.00 0.00 H new ATOM 0 HG21 THR A 64 7.038 13.316 15.912 1.00 0.00 H new ATOM 0 HG22 THR A 64 6.816 12.596 14.300 1.00 0.00 H new ATOM 0 HG23 THR A 64 5.462 12.628 15.455 1.00 0.00 H new ATOM 967 N GLY A 65 5.601 10.585 12.865 1.00 0.00 N ATOM 968 CA GLY A 65 5.755 10.717 11.421 1.00 0.00 C ATOM 969 C GLY A 65 6.609 11.928 11.067 1.00 0.00 C ATOM 970 O GLY A 65 6.737 12.862 11.858 1.00 0.00 O ATOM 0 H GLY A 65 4.678 10.842 13.216 1.00 0.00 H new ATOM 0 HA2 GLY A 65 6.214 9.814 11.017 1.00 0.00 H new ATOM 0 HA3 GLY A 65 4.774 10.812 10.955 1.00 0.00 H new ATOM 974 N ASP A 66 7.194 11.904 9.874 1.00 0.00 N ATOM 975 CA ASP A 66 8.083 12.973 9.436 1.00 0.00 C ATOM 976 C ASP A 66 7.447 13.799 8.326 1.00 0.00 C ATOM 977 O ASP A 66 8.046 14.751 7.825 1.00 0.00 O ATOM 978 CB ASP A 66 9.415 12.396 8.950 1.00 0.00 C ATOM 979 CG ASP A 66 10.564 13.391 9.054 1.00 0.00 C ATOM 980 OD1 ASP A 66 10.752 13.944 10.111 1.00 0.00 O ATOM 981 OD2 ASP A 66 11.243 13.588 8.074 1.00 0.00 O ATOM 0 H ASP A 66 7.068 11.155 9.193 1.00 0.00 H new ATOM 0 HA ASP A 66 8.263 13.624 10.291 1.00 0.00 H new ATOM 0 HB2 ASP A 66 9.656 11.508 9.535 1.00 0.00 H new ATOM 0 HB3 ASP A 66 9.310 12.076 7.913 1.00 0.00 H new ATOM 986 N ALA A 67 6.229 13.431 7.945 1.00 0.00 N ATOM 987 CA ALA A 67 5.523 14.114 6.868 1.00 0.00 C ATOM 988 C ALA A 67 4.960 15.449 7.338 1.00 0.00 C ATOM 989 O ALA A 67 5.207 16.489 6.725 1.00 0.00 O ATOM 990 CB ALA A 67 4.408 13.234 6.322 1.00 0.00 C ATOM 0 H ALA A 67 5.709 12.662 8.367 1.00 0.00 H new ATOM 0 HA ALA A 67 6.239 14.311 6.070 1.00 0.00 H new ATOM 0 HB1 ALA A 67 3.891 13.759 5.519 1.00 0.00 H new ATOM 0 HB2 ALA A 67 4.832 12.307 5.936 1.00 0.00 H new ATOM 0 HB3 ALA A 67 3.701 13.005 7.120 1.00 0.00 H new ATOM 996 N GLY A 68 4.203 15.416 8.430 1.00 0.00 N ATOM 997 CA GLY A 68 3.572 16.618 8.962 1.00 0.00 C ATOM 998 C GLY A 68 2.376 17.033 8.115 1.00 0.00 C ATOM 999 O GLY A 68 1.917 18.172 8.190 1.00 0.00 O ATOM 0 H GLY A 68 4.012 14.568 8.964 1.00 0.00 H new ATOM 0 HA2 GLY A 68 3.250 16.439 9.988 1.00 0.00 H new ATOM 0 HA3 GLY A 68 4.298 17.430 8.993 1.00 0.00 H new ATOM 1003 N TYR A 69 1.873 16.101 7.313 1.00 0.00 N ATOM 1004 CA TYR A 69 0.785 16.392 6.387 1.00 0.00 C ATOM 1005 C TYR A 69 -0.552 15.920 6.944 1.00 0.00 C ATOM 1006 O TYR A 69 -0.600 15.071 7.834 1.00 0.00 O ATOM 1007 CB TYR A 69 1.051 15.746 5.027 1.00 0.00 C ATOM 1008 CG TYR A 69 2.317 16.231 4.357 1.00 0.00 C ATOM 1009 CD1 TYR A 69 2.797 17.506 4.620 1.00 0.00 C ATOM 1010 CD2 TYR A 69 2.999 15.402 3.479 1.00 0.00 C ATOM 1011 CE1 TYR A 69 3.953 17.949 4.009 1.00 0.00 C ATOM 1012 CE2 TYR A 69 4.156 15.845 2.868 1.00 0.00 C ATOM 1013 CZ TYR A 69 4.633 17.114 3.130 1.00 0.00 C ATOM 1014 OH TYR A 69 5.784 17.555 2.521 1.00 0.00 O ATOM 0 H TYR A 69 2.202 15.136 7.286 1.00 0.00 H new ATOM 0 HA TYR A 69 0.736 17.473 6.258 1.00 0.00 H new ATOM 0 HB2 TYR A 69 1.110 14.665 5.154 1.00 0.00 H new ATOM 0 HB3 TYR A 69 0.204 15.944 4.370 1.00 0.00 H new ATOM 0 HD1 TYR A 69 2.266 18.152 5.303 1.00 0.00 H new ATOM 0 HD2 TYR A 69 2.625 14.410 3.273 1.00 0.00 H new ATOM 0 HE1 TYR A 69 4.328 18.941 4.213 1.00 0.00 H new ATOM 0 HE2 TYR A 69 4.688 15.199 2.185 1.00 0.00 H new ATOM 0 HH TYR A 69 6.136 16.850 1.938 1.00 0.00 H new ATOM 1024 N THR A 70 -1.637 16.476 6.415 1.00 0.00 N ATOM 1025 CA THR A 70 -2.978 16.105 6.851 1.00 0.00 C ATOM 1026 C THR A 70 -3.716 15.334 5.764 1.00 0.00 C ATOM 1027 O THR A 70 -3.929 15.843 4.663 1.00 0.00 O ATOM 1028 CB THR A 70 -3.796 17.347 7.250 1.00 0.00 C ATOM 1029 OG1 THR A 70 -3.152 18.015 8.343 1.00 0.00 O ATOM 1030 CG2 THR A 70 -5.205 16.949 7.662 1.00 0.00 C ATOM 0 H THR A 70 -1.614 17.186 5.683 1.00 0.00 H new ATOM 0 HA THR A 70 -2.867 15.462 7.724 1.00 0.00 H new ATOM 0 HB THR A 70 -3.856 18.015 6.391 1.00 0.00 H new ATOM 0 HG1 THR A 70 -3.672 18.806 8.595 1.00 0.00 H new ATOM 0 HG21 THR A 70 -5.768 17.840 7.941 1.00 0.00 H new ATOM 0 HG22 THR A 70 -5.701 16.452 6.828 1.00 0.00 H new ATOM 0 HG23 THR A 70 -5.157 16.269 8.513 1.00 0.00 H new ATOM 1038 N ILE A 71 -4.104 14.102 6.078 1.00 0.00 N ATOM 1039 CA ILE A 71 -4.865 13.278 5.147 1.00 0.00 C ATOM 1040 C ILE A 71 -6.316 13.143 5.591 1.00 0.00 C ATOM 1041 O ILE A 71 -6.595 12.789 6.737 1.00 0.00 O ATOM 1042 CB ILE A 71 -4.237 11.879 5.012 1.00 0.00 C ATOM 1043 CG1 ILE A 71 -2.810 11.985 4.466 1.00 0.00 C ATOM 1044 CG2 ILE A 71 -5.090 10.997 4.115 1.00 0.00 C ATOM 1045 CD1 ILE A 71 -2.055 10.676 4.475 1.00 0.00 C ATOM 0 H ILE A 71 -3.903 13.652 6.971 1.00 0.00 H new ATOM 0 HA ILE A 71 -4.839 13.775 4.177 1.00 0.00 H new ATOM 0 HB ILE A 71 -4.194 11.421 6.000 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -2.849 12.364 3.445 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -2.258 12.716 5.057 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -4.631 10.012 4.031 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -6.087 10.897 4.544 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -5.165 11.448 3.126 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -1.053 10.831 4.074 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -1.983 10.304 5.497 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -2.583 9.947 3.860 1.00 0.00 H new ATOM 1057 N PRO A 72 -7.238 13.427 4.677 1.00 0.00 N ATOM 1058 CA PRO A 72 -8.663 13.325 4.968 1.00 0.00 C ATOM 1059 C PRO A 72 -9.105 11.869 5.051 1.00 0.00 C ATOM 1060 O PRO A 72 -8.603 11.015 4.320 1.00 0.00 O ATOM 1061 CB PRO A 72 -9.309 14.044 3.780 1.00 0.00 C ATOM 1062 CG PRO A 72 -8.351 13.834 2.659 1.00 0.00 C ATOM 1063 CD PRO A 72 -6.993 13.931 3.303 1.00 0.00 C ATOM 0 HA PRO A 72 -8.940 13.759 5.929 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -10.290 13.628 3.549 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -9.453 15.104 3.987 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -8.498 12.863 2.187 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -8.477 14.588 1.882 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -6.253 13.327 2.778 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -6.622 14.956 3.309 1.00 0.00 H new ATOM 1071 N CYS A 73 -10.047 11.593 5.946 1.00 0.00 N ATOM 1072 CA CYS A 73 -10.632 10.262 6.057 1.00 0.00 C ATOM 1073 C CYS A 73 -11.607 9.993 4.918 1.00 0.00 C ATOM 1074 O CYS A 73 -12.587 10.716 4.742 1.00 0.00 O ATOM 1075 CB CYS A 73 -11.361 10.104 7.392 1.00 0.00 C ATOM 1076 SG CYS A 73 -12.162 8.497 7.610 1.00 0.00 S ATOM 0 H CYS A 73 -10.422 12.274 6.606 1.00 0.00 H new ATOM 0 HA CYS A 73 -9.817 9.541 6.001 1.00 0.00 H new ATOM 0 HB2 CYS A 73 -10.649 10.256 8.203 1.00 0.00 H new ATOM 0 HB3 CYS A 73 -12.114 10.888 7.478 1.00 0.00 H new ATOM 0 HG CYS A 73 -12.750 8.459 8.769 1.00 0.00 H new ATOM 1082 N GLU A 74 -11.331 8.947 4.145 1.00 0.00 N ATOM 1083 CA GLU A 74 -12.153 8.610 2.989 1.00 0.00 C ATOM 1084 C GLU A 74 -12.966 7.347 3.240 1.00 0.00 C ATOM 1085 O GLU A 74 -12.466 6.379 3.814 1.00 0.00 O ATOM 1086 CB GLU A 74 -11.279 8.428 1.748 1.00 0.00 C ATOM 1087 CG GLU A 74 -10.599 9.701 1.264 1.00 0.00 C ATOM 1088 CD GLU A 74 -9.822 9.503 -0.008 1.00 0.00 C ATOM 1089 OE1 GLU A 74 -8.856 8.779 0.016 1.00 0.00 O ATOM 1090 OE2 GLU A 74 -10.195 10.076 -1.005 1.00 0.00 O ATOM 0 H GLU A 74 -10.543 8.318 4.299 1.00 0.00 H new ATOM 0 HA GLU A 74 -12.845 9.435 2.821 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -10.514 7.682 1.964 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -11.894 8.030 0.941 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -11.353 10.472 1.107 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -9.927 10.066 2.041 1.00 0.00 H new ATOM 1097 N THR A 75 -14.222 7.362 2.809 1.00 0.00 N ATOM 1098 CA THR A 75 -15.099 6.206 2.962 1.00 0.00 C ATOM 1099 C THR A 75 -15.635 5.740 1.614 1.00 0.00 C ATOM 1100 O THR A 75 -16.199 4.652 1.502 1.00 0.00 O ATOM 1101 CB THR A 75 -16.274 6.523 3.904 1.00 0.00 C ATOM 1102 OG1 THR A 75 -17.060 7.587 3.352 1.00 0.00 O ATOM 1103 CG2 THR A 75 -15.762 6.935 5.275 1.00 0.00 C ATOM 0 H THR A 75 -14.657 8.163 2.350 1.00 0.00 H new ATOM 0 HA THR A 75 -14.504 5.404 3.399 1.00 0.00 H new ATOM 0 HB THR A 75 -16.886 5.627 4.010 1.00 0.00 H new ATOM 0 HG1 THR A 75 -17.809 7.786 3.952 1.00 0.00 H new ATOM 0 HG21 THR A 75 -16.607 7.155 5.928 1.00 0.00 H new ATOM 0 HG22 THR A 75 -15.175 6.123 5.703 1.00 0.00 H new ATOM 0 HG23 THR A 75 -15.137 7.823 5.178 1.00 0.00 H new ATOM 1111 N ASP A 76 -15.455 6.570 0.592 1.00 0.00 N ATOM 1112 CA ASP A 76 -15.956 6.261 -0.743 1.00 0.00 C ATOM 1113 C ASP A 76 -14.812 5.958 -1.703 1.00 0.00 C ATOM 1114 O ASP A 76 -13.708 6.481 -1.553 1.00 0.00 O ATOM 1115 CB ASP A 76 -16.790 7.425 -1.285 1.00 0.00 C ATOM 1116 CG ASP A 76 -18.078 7.645 -0.503 1.00 0.00 C ATOM 1117 OD1 ASP A 76 -18.785 6.691 -0.283 1.00 0.00 O ATOM 1118 OD2 ASP A 76 -18.342 8.764 -0.135 1.00 0.00 O ATOM 0 H ASP A 76 -14.966 7.462 0.662 1.00 0.00 H new ATOM 0 HA ASP A 76 -16.586 5.375 -0.664 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -16.193 8.337 -1.257 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -17.033 7.235 -2.330 1.00 0.00 H new ATOM 1123 N ASN A 77 -15.084 5.109 -2.689 1.00 0.00 N ATOM 1124 CA ASN A 77 -16.430 4.591 -2.904 1.00 0.00 C ATOM 1125 C ASN A 77 -16.579 3.188 -2.328 1.00 0.00 C ATOM 1126 O ASN A 77 -17.645 2.819 -1.836 1.00 0.00 O ATOM 1127 CB ASN A 77 -16.775 4.601 -4.382 1.00 0.00 C ATOM 1128 CG ASN A 77 -16.943 5.993 -4.927 1.00 0.00 C ATOM 1129 OD1 ASN A 77 -17.898 6.696 -4.581 1.00 0.00 O ATOM 1130 ND2 ASN A 77 -16.032 6.402 -5.772 1.00 0.00 N ATOM 0 H ASN A 77 -14.389 4.765 -3.352 1.00 0.00 H new ATOM 0 HA ASN A 77 -17.128 5.244 -2.380 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -15.990 4.089 -4.938 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -17.696 4.039 -4.540 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -16.093 7.337 -6.175 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -15.261 5.786 -6.028 1.00 0.00 H new ATOM 1137 N ASN A 78 -15.504 2.411 -2.393 1.00 0.00 N ATOM 1138 CA ASN A 78 -15.526 1.031 -1.920 1.00 0.00 C ATOM 1139 C ASN A 78 -15.381 0.967 -0.405 1.00 0.00 C ATOM 1140 O ASN A 78 -14.746 1.828 0.205 1.00 0.00 O ATOM 1141 CB ASN A 78 -14.438 0.217 -2.595 1.00 0.00 C ATOM 1142 CG ASN A 78 -14.736 -0.057 -4.044 1.00 0.00 C ATOM 1143 OD1 ASN A 78 -15.892 0.024 -4.478 1.00 0.00 O ATOM 1144 ND2 ASN A 78 -13.718 -0.381 -4.799 1.00 0.00 N ATOM 0 H ASN A 78 -14.605 2.713 -2.769 1.00 0.00 H new ATOM 0 HA ASN A 78 -16.493 0.602 -2.183 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -13.490 0.749 -2.517 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -14.317 -0.729 -2.067 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -13.860 -0.579 -5.789 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -12.782 -0.435 -4.397 1.00 0.00 H new ATOM 1151 N PRO A 79 -15.972 -0.059 0.197 1.00 0.00 N ATOM 1152 CA PRO A 79 -15.885 -0.255 1.640 1.00 0.00 C ATOM 1153 C PRO A 79 -14.472 -0.644 2.056 1.00 0.00 C ATOM 1154 O PRO A 79 -13.669 -1.082 1.233 1.00 0.00 O ATOM 1155 CB PRO A 79 -16.881 -1.390 1.894 1.00 0.00 C ATOM 1156 CG PRO A 79 -16.909 -2.148 0.611 1.00 0.00 C ATOM 1157 CD PRO A 79 -16.804 -1.087 -0.452 1.00 0.00 C ATOM 0 HA PRO A 79 -16.112 0.644 2.214 1.00 0.00 H new ATOM 0 HB2 PRO A 79 -16.561 -2.022 2.723 1.00 0.00 H new ATOM 0 HB3 PRO A 79 -17.868 -1.004 2.150 1.00 0.00 H new ATOM 0 HG2 PRO A 79 -16.082 -2.856 0.549 1.00 0.00 H new ATOM 0 HG3 PRO A 79 -17.829 -2.723 0.509 1.00 0.00 H new ATOM 0 HD2 PRO A 79 -16.340 -1.469 -1.361 1.00 0.00 H new ATOM 0 HD3 PRO A 79 -17.782 -0.698 -0.733 1.00 0.00 H new ATOM 1165 N HIS A 80 -14.175 -0.482 3.342 1.00 0.00 N ATOM 1166 CA HIS A 80 -12.834 -0.733 3.855 1.00 0.00 C ATOM 1167 C HIS A 80 -12.791 -2.012 4.681 1.00 0.00 C ATOM 1168 O HIS A 80 -13.424 -2.105 5.733 1.00 0.00 O ATOM 1169 CB HIS A 80 -12.348 0.447 4.704 1.00 0.00 C ATOM 1170 CG HIS A 80 -12.257 1.734 3.946 1.00 0.00 C ATOM 1171 ND1 HIS A 80 -11.371 1.926 2.907 1.00 0.00 N ATOM 1172 CD2 HIS A 80 -12.940 2.896 4.077 1.00 0.00 C ATOM 1173 CE1 HIS A 80 -11.512 3.150 2.431 1.00 0.00 C ATOM 1174 NE2 HIS A 80 -12.458 3.759 3.124 1.00 0.00 N ATOM 0 H HIS A 80 -14.846 -0.178 4.047 1.00 0.00 H new ATOM 0 HA HIS A 80 -12.172 -0.851 2.997 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -13.025 0.579 5.548 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -11.368 0.208 5.116 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -13.718 3.105 4.796 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -10.950 3.580 1.615 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -12.778 4.716 2.975 1.00 0.00 H new ATOM 1181 N ARG A 81 -12.039 -2.997 4.201 1.00 0.00 N ATOM 1182 CA ARG A 81 -11.862 -4.249 4.926 1.00 0.00 C ATOM 1183 C ARG A 81 -10.428 -4.406 5.414 1.00 0.00 C ATOM 1184 O ARG A 81 -9.480 -4.069 4.706 1.00 0.00 O ATOM 1185 CB ARG A 81 -12.227 -5.435 4.043 1.00 0.00 C ATOM 1186 CG ARG A 81 -13.653 -5.428 3.520 1.00 0.00 C ATOM 1187 CD ARG A 81 -14.644 -5.497 4.626 1.00 0.00 C ATOM 1188 NE ARG A 81 -14.395 -6.629 5.506 1.00 0.00 N ATOM 1189 CZ ARG A 81 -14.816 -7.887 5.272 1.00 0.00 C ATOM 1190 NH1 ARG A 81 -15.502 -8.159 4.184 1.00 0.00 N ATOM 1191 NH2 ARG A 81 -14.537 -8.848 6.136 1.00 0.00 N ATOM 0 H ARG A 81 -11.542 -2.952 3.312 1.00 0.00 H new ATOM 0 HA ARG A 81 -12.525 -4.223 5.791 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -11.544 -5.461 3.194 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -12.067 -6.353 4.608 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -13.822 -4.523 2.936 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -13.798 -6.274 2.848 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -14.609 -4.573 5.204 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -15.648 -5.575 4.210 1.00 0.00 H new ATOM 0 HE ARG A 81 -13.864 -6.458 6.360 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -15.715 -7.417 3.517 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -15.821 -9.112 4.007 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -14.003 -8.637 6.979 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -14.855 -9.801 5.959 1.00 0.00 H new ATOM 1205 N HIS A 82 -10.275 -4.919 6.630 1.00 0.00 N ATOM 1206 CA HIS A 82 -8.955 -5.154 7.203 1.00 0.00 C ATOM 1207 C HIS A 82 -8.711 -6.640 7.432 1.00 0.00 C ATOM 1208 O HIS A 82 -9.017 -7.172 8.500 1.00 0.00 O ATOM 1209 CB HIS A 82 -8.793 -4.394 8.522 1.00 0.00 C ATOM 1210 CG HIS A 82 -8.589 -2.921 8.348 1.00 0.00 C ATOM 1211 ND1 HIS A 82 -9.603 -2.071 7.959 1.00 0.00 N ATOM 1212 CD2 HIS A 82 -7.490 -2.148 8.507 1.00 0.00 C ATOM 1213 CE1 HIS A 82 -9.135 -0.837 7.888 1.00 0.00 C ATOM 1214 NE2 HIS A 82 -7.856 -0.857 8.215 1.00 0.00 N ATOM 0 H HIS A 82 -11.051 -5.180 7.239 1.00 0.00 H new ATOM 0 HA HIS A 82 -8.218 -4.787 6.489 1.00 0.00 H new ATOM 0 HB2 HIS A 82 -9.678 -4.559 9.137 1.00 0.00 H new ATOM 0 HB3 HIS A 82 -7.944 -4.807 9.067 1.00 0.00 H new ATOM 0 HD1 HIS A 82 -10.563 -2.351 7.758 1.00 0.00 H new ATOM 0 HD2 HIS A 82 -6.508 -2.484 8.807 1.00 0.00 H new ATOM 0 HE1 HIS A 82 -9.702 0.039 7.610 1.00 0.00 H new ATOM 1221 N VAL A 83 -8.160 -7.307 6.424 1.00 0.00 N ATOM 1222 CA VAL A 83 -7.875 -8.734 6.514 1.00 0.00 C ATOM 1223 C VAL A 83 -6.453 -9.042 6.067 1.00 0.00 C ATOM 1224 O VAL A 83 -5.709 -8.145 5.667 1.00 0.00 O ATOM 1225 CB VAL A 83 -8.867 -9.532 5.647 1.00 0.00 C ATOM 1226 CG1 VAL A 83 -10.290 -9.341 6.150 1.00 0.00 C ATOM 1227 CG2 VAL A 83 -8.747 -9.100 4.193 1.00 0.00 C ATOM 0 H VAL A 83 -7.901 -6.881 5.534 1.00 0.00 H new ATOM 0 HA VAL A 83 -7.983 -9.028 7.558 1.00 0.00 H new ATOM 0 HB VAL A 83 -8.624 -10.592 5.718 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -10.977 -9.912 5.525 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -10.362 -9.690 7.180 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -10.553 -8.284 6.105 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -9.451 -9.668 3.585 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -8.971 -8.037 4.110 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -7.732 -9.285 3.841 1.00 0.00 H new ATOM 1237 N THR A 84 -6.077 -10.315 6.137 1.00 0.00 N ATOM 1238 CA THR A 84 -4.751 -10.748 5.714 1.00 0.00 C ATOM 1239 C THR A 84 -4.363 -10.116 4.384 1.00 0.00 C ATOM 1240 O THR A 84 -4.925 -10.450 3.341 1.00 0.00 O ATOM 1241 CB THR A 84 -4.678 -12.281 5.600 1.00 0.00 C ATOM 1242 OG1 THR A 84 -4.948 -12.872 6.878 1.00 0.00 O ATOM 1243 CG2 THR A 84 -3.300 -12.716 5.126 1.00 0.00 C ATOM 0 H THR A 84 -6.674 -11.066 6.484 1.00 0.00 H new ATOM 0 HA THR A 84 -4.046 -10.418 6.477 1.00 0.00 H new ATOM 0 HB THR A 84 -5.422 -12.611 4.875 1.00 0.00 H new ATOM 0 HG1 THR A 84 -4.204 -12.686 7.488 1.00 0.00 H new ATOM 0 HG21 THR A 84 -3.267 -13.803 5.051 1.00 0.00 H new ATOM 0 HG22 THR A 84 -3.097 -12.279 4.148 1.00 0.00 H new ATOM 0 HG23 THR A 84 -2.547 -12.378 5.838 1.00 0.00 H new ATOM 1251 N GLY A 85 -3.399 -9.203 4.426 1.00 0.00 N ATOM 1252 CA GLY A 85 -2.883 -8.577 3.215 1.00 0.00 C ATOM 1253 C GLY A 85 -3.704 -7.351 2.835 1.00 0.00 C ATOM 1254 O GLY A 85 -4.268 -7.284 1.743 1.00 0.00 O ATOM 0 H GLY A 85 -2.959 -8.880 5.287 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -1.843 -8.289 3.367 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -2.898 -9.296 2.396 1.00 0.00 H new ATOM 1258 N ALA A 86 -3.768 -6.383 3.743 1.00 0.00 N ATOM 1259 CA ALA A 86 -4.450 -5.124 3.473 1.00 0.00 C ATOM 1260 C ALA A 86 -3.644 -3.938 3.989 1.00 0.00 C ATOM 1261 O ALA A 86 -2.918 -4.053 4.978 1.00 0.00 O ATOM 1262 CB ALA A 86 -5.839 -5.128 4.093 1.00 0.00 C ATOM 0 H ALA A 86 -3.355 -6.447 4.673 1.00 0.00 H new ATOM 0 HA ALA A 86 -4.547 -5.021 2.392 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -6.334 -4.180 3.882 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -6.424 -5.945 3.671 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -5.756 -5.261 5.172 1.00 0.00 H new ATOM 1268 N MET A 87 -3.775 -2.801 3.317 1.00 0.00 N ATOM 1269 CA MET A 87 -3.006 -1.612 3.665 1.00 0.00 C ATOM 1270 C MET A 87 -3.913 -0.400 3.832 1.00 0.00 C ATOM 1271 O MET A 87 -4.633 -0.018 2.910 1.00 0.00 O ATOM 1272 CB MET A 87 -1.944 -1.339 2.601 1.00 0.00 C ATOM 1273 CG MET A 87 -0.966 -2.485 2.380 1.00 0.00 C ATOM 1274 SD MET A 87 0.230 -2.136 1.075 1.00 0.00 S ATOM 1275 CE MET A 87 1.161 -0.799 1.817 1.00 0.00 C ATOM 0 H MET A 87 -4.408 -2.677 2.527 1.00 0.00 H new ATOM 0 HA MET A 87 -2.512 -1.796 4.619 1.00 0.00 H new ATOM 0 HB2 MET A 87 -2.442 -1.115 1.657 1.00 0.00 H new ATOM 0 HB3 MET A 87 -1.383 -0.448 2.885 1.00 0.00 H new ATOM 0 HG2 MET A 87 -0.435 -2.688 3.310 1.00 0.00 H new ATOM 0 HG3 MET A 87 -1.522 -3.388 2.126 1.00 0.00 H new ATOM 0 HE1 MET A 87 2.105 -0.674 1.286 1.00 0.00 H new ATOM 0 HE2 MET A 87 0.585 0.124 1.754 1.00 0.00 H new ATOM 0 HE3 MET A 87 1.361 -1.032 2.863 1.00 0.00 H new ATOM 1285 N SER A 88 -3.873 0.203 5.017 1.00 0.00 N ATOM 1286 CA SER A 88 -4.680 1.383 5.302 1.00 0.00 C ATOM 1287 C SER A 88 -3.860 2.451 6.016 1.00 0.00 C ATOM 1288 O SER A 88 -2.817 2.159 6.599 1.00 0.00 O ATOM 1289 CB SER A 88 -5.879 1.004 6.149 1.00 0.00 C ATOM 1290 OG SER A 88 -5.479 0.575 7.422 1.00 0.00 O ATOM 0 H SER A 88 -3.290 -0.107 5.795 1.00 0.00 H new ATOM 0 HA SER A 88 -5.024 1.793 4.352 1.00 0.00 H new ATOM 0 HB2 SER A 88 -6.547 1.860 6.243 1.00 0.00 H new ATOM 0 HB3 SER A 88 -6.442 0.212 5.655 1.00 0.00 H new ATOM 0 HG SER A 88 -6.246 0.185 7.892 1.00 0.00 H new ATOM 1296 N MET A 89 -4.339 3.689 5.964 1.00 0.00 N ATOM 1297 CA MET A 89 -3.671 4.797 6.637 1.00 0.00 C ATOM 1298 C MET A 89 -4.302 5.078 7.994 1.00 0.00 C ATOM 1299 O MET A 89 -5.516 4.964 8.161 1.00 0.00 O ATOM 1300 CB MET A 89 -3.711 6.048 5.761 1.00 0.00 C ATOM 1301 CG MET A 89 -3.021 5.896 4.413 1.00 0.00 C ATOM 1302 SD MET A 89 -1.276 5.464 4.569 1.00 0.00 S ATOM 1303 CE MET A 89 -0.616 6.972 5.272 1.00 0.00 C ATOM 0 H MET A 89 -5.188 3.951 5.463 1.00 0.00 H new ATOM 0 HA MET A 89 -2.631 4.515 6.803 1.00 0.00 H new ATOM 0 HB2 MET A 89 -4.752 6.326 5.593 1.00 0.00 H new ATOM 0 HB3 MET A 89 -3.245 6.871 6.303 1.00 0.00 H new ATOM 0 HG2 MET A 89 -3.531 5.127 3.833 1.00 0.00 H new ATOM 0 HG3 MET A 89 -3.112 6.828 3.856 1.00 0.00 H new ATOM 0 HE1 MET A 89 0.447 7.046 5.042 1.00 0.00 H new ATOM 0 HE2 MET A 89 -1.139 7.830 4.849 1.00 0.00 H new ATOM 0 HE3 MET A 89 -0.754 6.960 6.353 1.00 0.00 H new ATOM 1313 N ALA A 90 -3.470 5.446 8.963 1.00 0.00 N ATOM 1314 CA ALA A 90 -3.942 5.717 10.316 1.00 0.00 C ATOM 1315 C ALA A 90 -4.567 7.103 10.415 1.00 0.00 C ATOM 1316 O ALA A 90 -4.049 8.069 9.855 1.00 0.00 O ATOM 1317 CB ALA A 90 -2.799 5.580 11.313 1.00 0.00 C ATOM 0 H ALA A 90 -2.465 5.563 8.836 1.00 0.00 H new ATOM 0 HA ALA A 90 -4.711 4.983 10.557 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -3.167 5.785 12.318 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -2.400 4.566 11.272 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -2.011 6.290 11.063 1.00 0.00 H new ATOM 1323 N HIS A 91 -5.684 7.192 11.129 1.00 0.00 N ATOM 1324 CA HIS A 91 -6.335 8.473 11.375 1.00 0.00 C ATOM 1325 C HIS A 91 -7.126 8.449 12.676 1.00 0.00 C ATOM 1326 O HIS A 91 -7.293 7.396 13.293 1.00 0.00 O ATOM 1327 CB HIS A 91 -7.264 8.841 10.213 1.00 0.00 C ATOM 1328 CG HIS A 91 -8.521 8.030 10.170 1.00 0.00 C ATOM 1329 ND1 HIS A 91 -9.646 8.363 10.895 1.00 0.00 N ATOM 1330 CD2 HIS A 91 -8.833 6.903 9.488 1.00 0.00 C ATOM 1331 CE1 HIS A 91 -10.596 7.473 10.661 1.00 0.00 C ATOM 1332 NE2 HIS A 91 -10.128 6.578 9.812 1.00 0.00 N ATOM 0 H HIS A 91 -6.158 6.391 11.548 1.00 0.00 H new ATOM 0 HA HIS A 91 -5.552 9.227 11.459 1.00 0.00 H new ATOM 0 HB2 HIS A 91 -7.525 9.897 10.288 1.00 0.00 H new ATOM 0 HB3 HIS A 91 -6.726 8.712 9.274 1.00 0.00 H new ATOM 0 HD2 HIS A 91 -8.185 6.361 8.815 1.00 0.00 H new ATOM 0 HE1 HIS A 91 -11.586 7.478 11.092 1.00 0.00 H new ATOM 0 HE2 HIS A 91 -10.644 5.774 9.454 1.00 0.00 H new ATOM 1339 N ARG A 92 -7.612 9.614 13.089 1.00 0.00 N ATOM 1340 CA ARG A 92 -8.453 9.716 14.276 1.00 0.00 C ATOM 1341 C ARG A 92 -9.691 10.561 14.006 1.00 0.00 C ATOM 1342 O ARG A 92 -10.150 11.303 14.874 1.00 0.00 O ATOM 1343 CB ARG A 92 -7.672 10.322 15.434 1.00 0.00 C ATOM 1344 CG ARG A 92 -6.444 9.533 15.859 1.00 0.00 C ATOM 1345 CD ARG A 92 -6.813 8.247 16.504 1.00 0.00 C ATOM 1346 NE ARG A 92 -5.647 7.539 17.009 1.00 0.00 N ATOM 1347 CZ ARG A 92 -4.922 6.655 16.298 1.00 0.00 C ATOM 1348 NH1 ARG A 92 -5.254 6.379 15.056 1.00 0.00 N ATOM 1349 NH2 ARG A 92 -3.877 6.063 16.849 1.00 0.00 N ATOM 0 H ARG A 92 -7.438 10.502 12.619 1.00 0.00 H new ATOM 0 HA ARG A 92 -8.769 8.707 14.540 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -7.361 11.329 15.156 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -8.338 10.419 16.291 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -5.818 9.337 14.988 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -5.850 10.130 16.551 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -7.505 8.438 17.324 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -7.337 7.617 15.785 1.00 0.00 H new ATOM 0 HE ARG A 92 -5.358 7.725 17.969 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -6.061 6.835 14.631 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -4.704 5.709 14.518 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -3.620 6.276 17.813 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -3.328 5.393 16.311 1.00 0.00 H new ATOM 1363 N GLY A 93 -10.226 10.445 12.795 1.00 0.00 N ATOM 1364 CA GLY A 93 -11.368 11.251 12.382 1.00 0.00 C ATOM 1365 C GLY A 93 -11.132 11.884 11.017 1.00 0.00 C ATOM 1366 O GLY A 93 -10.166 11.555 10.329 1.00 0.00 O ATOM 0 H GLY A 93 -9.886 9.800 12.082 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -12.262 10.628 12.347 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -11.552 12.031 13.121 1.00 0.00 H new ATOM 1370 N ARG A 94 -12.020 12.793 10.631 1.00 0.00 N ATOM 1371 CA ARG A 94 -11.907 13.478 9.348 1.00 0.00 C ATOM 1372 C ARG A 94 -10.775 14.497 9.366 1.00 0.00 C ATOM 1373 O ARG A 94 -10.684 15.322 10.274 1.00 0.00 O ATOM 1374 CB ARG A 94 -13.211 14.178 8.998 1.00 0.00 C ATOM 1375 CG ARG A 94 -13.238 14.831 7.625 1.00 0.00 C ATOM 1376 CD ARG A 94 -14.596 15.325 7.279 1.00 0.00 C ATOM 1377 NE ARG A 94 -14.635 15.914 5.950 1.00 0.00 N ATOM 1378 CZ ARG A 94 -14.349 17.201 5.675 1.00 0.00 C ATOM 1379 NH1 ARG A 94 -14.003 18.019 6.644 1.00 0.00 N ATOM 1380 NH2 ARG A 94 -14.414 17.642 4.430 1.00 0.00 N ATOM 0 H ARG A 94 -12.827 13.073 11.188 1.00 0.00 H new ATOM 0 HA ARG A 94 -11.688 12.724 8.592 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -14.023 13.453 9.055 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -13.411 14.940 9.751 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -12.532 15.661 7.603 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -12.909 14.113 6.874 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -15.307 14.500 7.332 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -14.911 16.066 8.014 1.00 0.00 H new ATOM 0 HE ARG A 94 -14.897 15.310 5.171 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -13.951 17.679 7.604 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -13.786 18.994 6.436 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -14.681 17.007 3.677 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -14.197 18.617 4.222 1.00 0.00 H new ATOM 1394 N ASP A 95 -9.915 14.436 8.354 1.00 0.00 N ATOM 1395 CA ASP A 95 -8.793 15.360 8.247 1.00 0.00 C ATOM 1396 C ASP A 95 -7.864 15.242 9.449 1.00 0.00 C ATOM 1397 O ASP A 95 -7.386 16.246 9.976 1.00 0.00 O ATOM 1398 CB ASP A 95 -9.295 16.801 8.122 1.00 0.00 C ATOM 1399 CG ASP A 95 -9.993 17.072 6.797 1.00 0.00 C ATOM 1400 OD1 ASP A 95 -9.420 16.779 5.774 1.00 0.00 O ATOM 1401 OD2 ASP A 95 -11.093 17.571 6.819 1.00 0.00 O ATOM 0 H ASP A 95 -9.974 13.756 7.596 1.00 0.00 H new ATOM 0 HA ASP A 95 -8.232 15.096 7.350 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -9.984 17.013 8.940 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -8.453 17.484 8.230 1.00 0.00 H new ATOM 1406 N THR A 96 -7.612 14.010 9.875 1.00 0.00 N ATOM 1407 CA THR A 96 -6.665 13.751 10.954 1.00 0.00 C ATOM 1408 C THR A 96 -5.665 12.671 10.562 1.00 0.00 C ATOM 1409 O THR A 96 -4.817 12.276 11.362 1.00 0.00 O ATOM 1410 CB THR A 96 -7.394 13.337 12.245 1.00 0.00 C ATOM 1411 OG1 THR A 96 -8.145 12.139 12.008 1.00 0.00 O ATOM 1412 CG2 THR A 96 -8.336 14.439 12.703 1.00 0.00 C ATOM 0 H THR A 96 -8.050 13.174 9.490 1.00 0.00 H new ATOM 0 HA THR A 96 -6.124 14.679 11.138 1.00 0.00 H new ATOM 0 HB THR A 96 -6.652 13.162 13.024 1.00 0.00 H new ATOM 0 HG1 THR A 96 -8.640 12.224 11.166 1.00 0.00 H new ATOM 0 HG21 THR A 96 -8.842 14.128 13.617 1.00 0.00 H new ATOM 0 HG22 THR A 96 -7.766 15.348 12.895 1.00 0.00 H new ATOM 0 HG23 THR A 96 -9.076 14.632 11.926 1.00 0.00 H new ATOM 1420 N GLY A 97 -5.770 12.196 9.325 1.00 0.00 N ATOM 1421 CA GLY A 97 -4.928 11.104 8.851 1.00 0.00 C ATOM 1422 C GLY A 97 -3.465 11.523 8.783 1.00 0.00 C ATOM 1423 O GLY A 97 -3.148 12.639 8.369 1.00 0.00 O ATOM 0 H GLY A 97 -6.430 12.550 8.633 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -5.032 10.246 9.516 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -5.264 10.785 7.864 1.00 0.00 H new ATOM 1427 N SER A 98 -2.578 10.624 9.195 1.00 0.00 N ATOM 1428 CA SER A 98 -1.147 10.903 9.190 1.00 0.00 C ATOM 1429 C SER A 98 -0.421 10.041 8.165 1.00 0.00 C ATOM 1430 O SER A 98 -1.045 9.279 7.427 1.00 0.00 O ATOM 1431 CB SER A 98 -0.564 10.662 10.570 1.00 0.00 C ATOM 1432 OG SER A 98 -0.469 9.291 10.842 1.00 0.00 O ATOM 0 H SER A 98 -2.825 9.695 9.537 1.00 0.00 H new ATOM 0 HA SER A 98 -1.009 11.949 8.916 1.00 0.00 H new ATOM 0 HB2 SER A 98 0.423 11.119 10.637 1.00 0.00 H new ATOM 0 HB3 SER A 98 -1.189 11.143 11.322 1.00 0.00 H new ATOM 0 HG SER A 98 -0.089 9.160 11.736 1.00 0.00 H new ATOM 1438 N CYS A 99 0.902 10.167 8.125 1.00 0.00 N ATOM 1439 CA CYS A 99 1.720 9.364 7.224 1.00 0.00 C ATOM 1440 C CYS A 99 1.950 7.967 7.785 1.00 0.00 C ATOM 1441 O CYS A 99 2.535 7.110 7.124 1.00 0.00 O ATOM 1442 CB CYS A 99 3.070 10.038 6.980 1.00 0.00 C ATOM 1443 SG CYS A 99 4.053 10.289 8.478 1.00 0.00 S ATOM 0 H CYS A 99 1.430 10.818 8.706 1.00 0.00 H new ATOM 0 HA CYS A 99 1.180 9.279 6.281 1.00 0.00 H new ATOM 0 HB2 CYS A 99 3.644 9.433 6.279 1.00 0.00 H new ATOM 0 HB3 CYS A 99 2.901 11.004 6.503 1.00 0.00 H new ATOM 0 HG CYS A 99 4.676 9.188 8.778 1.00 0.00 H new ATOM 1449 N GLN A 100 1.486 7.743 9.011 1.00 0.00 N ATOM 1450 CA GLN A 100 1.530 6.419 9.617 1.00 0.00 C ATOM 1451 C GLN A 100 0.422 5.526 9.074 1.00 0.00 C ATOM 1452 O GLN A 100 -0.668 6.000 8.753 1.00 0.00 O ATOM 1453 CB GLN A 100 1.419 6.523 11.140 1.00 0.00 C ATOM 1454 CG GLN A 100 2.606 7.198 11.807 1.00 0.00 C ATOM 1455 CD GLN A 100 2.456 7.275 13.314 1.00 0.00 C ATOM 1456 OE1 GLN A 100 1.449 6.833 13.876 1.00 0.00 O ATOM 1457 NE2 GLN A 100 3.458 7.838 13.980 1.00 0.00 N ATOM 0 H GLN A 100 1.075 8.464 9.604 1.00 0.00 H new ATOM 0 HA GLN A 100 2.489 5.968 9.360 1.00 0.00 H new ATOM 0 HB2 GLN A 100 0.513 7.076 11.390 1.00 0.00 H new ATOM 0 HB3 GLN A 100 1.305 5.521 11.554 1.00 0.00 H new ATOM 0 HG2 GLN A 100 3.516 6.650 11.563 1.00 0.00 H new ATOM 0 HG3 GLN A 100 2.722 8.204 11.404 1.00 0.00 H new ATOM 0 HE21 GLN A 100 4.272 8.190 13.476 1.00 0.00 H new ATOM 0 HE22 GLN A 100 3.414 7.918 14.996 1.00 0.00 H new ATOM 1466 N PHE A 101 0.707 4.232 8.973 1.00 0.00 N ATOM 1467 CA PHE A 101 -0.160 3.311 8.248 1.00 0.00 C ATOM 1468 C PHE A 101 -0.179 1.938 8.906 1.00 0.00 C ATOM 1469 O PHE A 101 0.740 1.580 9.644 1.00 0.00 O ATOM 1470 CB PHE A 101 0.298 3.180 6.794 1.00 0.00 C ATOM 1471 CG PHE A 101 1.703 2.670 6.646 1.00 0.00 C ATOM 1472 CD1 PHE A 101 1.958 1.309 6.569 1.00 0.00 C ATOM 1473 CD2 PHE A 101 2.773 3.550 6.583 1.00 0.00 C ATOM 1474 CE1 PHE A 101 3.251 0.838 6.432 1.00 0.00 C ATOM 1475 CE2 PHE A 101 4.066 3.083 6.445 1.00 0.00 C ATOM 1476 CZ PHE A 101 4.304 1.726 6.369 1.00 0.00 C ATOM 0 H PHE A 101 1.533 3.797 9.385 1.00 0.00 H new ATOM 0 HA PHE A 101 -1.171 3.719 8.272 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -0.380 2.508 6.268 1.00 0.00 H new ATOM 0 HB3 PHE A 101 0.221 4.153 6.309 1.00 0.00 H new ATOM 0 HD1 PHE A 101 1.137 0.609 6.617 1.00 0.00 H new ATOM 0 HD2 PHE A 101 2.593 4.613 6.643 1.00 0.00 H new ATOM 0 HE1 PHE A 101 3.436 -0.224 6.374 1.00 0.00 H new ATOM 0 HE2 PHE A 101 4.890 3.780 6.397 1.00 0.00 H new ATOM 0 HZ PHE A 101 5.314 1.360 6.260 1.00 0.00 H new ATOM 1486 N PHE A 102 -1.229 1.171 8.636 1.00 0.00 N ATOM 1487 CA PHE A 102 -1.305 -0.212 9.087 1.00 0.00 C ATOM 1488 C PHE A 102 -1.207 -1.181 7.915 1.00 0.00 C ATOM 1489 O PHE A 102 -1.800 -0.956 6.860 1.00 0.00 O ATOM 1490 CB PHE A 102 -2.609 -0.457 9.849 1.00 0.00 C ATOM 1491 CG PHE A 102 -2.700 0.289 11.149 1.00 0.00 C ATOM 1492 CD1 PHE A 102 -2.183 -0.256 12.315 1.00 0.00 C ATOM 1493 CD2 PHE A 102 -3.303 1.536 11.210 1.00 0.00 C ATOM 1494 CE1 PHE A 102 -2.266 0.428 13.512 1.00 0.00 C ATOM 1495 CE2 PHE A 102 -3.386 2.223 12.407 1.00 0.00 C ATOM 1496 CZ PHE A 102 -2.869 1.669 13.558 1.00 0.00 C ATOM 0 H PHE A 102 -2.041 1.485 8.105 1.00 0.00 H new ATOM 0 HA PHE A 102 -0.461 -0.388 9.753 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -3.448 -0.169 9.216 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -2.709 -1.524 10.045 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -1.710 -1.227 12.287 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -3.712 1.976 10.313 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -1.859 -0.008 14.412 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -3.856 3.195 12.440 1.00 0.00 H new ATOM 0 HZ PHE A 102 -2.935 2.204 14.494 1.00 0.00 H new ATOM 1506 N ILE A 103 -0.453 -2.259 8.106 1.00 0.00 N ATOM 1507 CA ILE A 103 -0.513 -3.405 7.206 1.00 0.00 C ATOM 1508 C ILE A 103 -1.011 -4.649 7.931 1.00 0.00 C ATOM 1509 O ILE A 103 -0.366 -5.140 8.857 1.00 0.00 O ATOM 1510 CB ILE A 103 0.867 -3.689 6.586 1.00 0.00 C ATOM 1511 CG1 ILE A 103 1.368 -2.465 5.815 1.00 0.00 C ATOM 1512 CG2 ILE A 103 0.800 -4.906 5.676 1.00 0.00 C ATOM 1513 CD1 ILE A 103 2.742 -2.643 5.212 1.00 0.00 C ATOM 0 H ILE A 103 0.207 -2.363 8.877 1.00 0.00 H new ATOM 0 HA ILE A 103 -1.216 -3.157 6.411 1.00 0.00 H new ATOM 0 HB ILE A 103 1.572 -3.900 7.390 1.00 0.00 H new ATOM 0 HG12 ILE A 103 0.660 -2.234 5.019 1.00 0.00 H new ATOM 0 HG13 ILE A 103 1.385 -1.606 6.486 1.00 0.00 H new ATOM 0 HG21 ILE A 103 1.784 -5.093 5.246 1.00 0.00 H new ATOM 0 HG22 ILE A 103 0.485 -5.775 6.253 1.00 0.00 H new ATOM 0 HG23 ILE A 103 0.083 -4.723 4.876 1.00 0.00 H new ATOM 0 HD11 ILE A 103 3.027 -1.734 4.682 1.00 0.00 H new ATOM 0 HD12 ILE A 103 3.464 -2.843 6.004 1.00 0.00 H new ATOM 0 HD13 ILE A 103 2.727 -3.480 4.514 1.00 0.00 H new ATOM 1525 N VAL A 104 -2.163 -5.155 7.504 1.00 0.00 N ATOM 1526 CA VAL A 104 -2.894 -6.153 8.275 1.00 0.00 C ATOM 1527 C VAL A 104 -2.401 -7.560 7.961 1.00 0.00 C ATOM 1528 O VAL A 104 -2.275 -7.941 6.797 1.00 0.00 O ATOM 1529 CB VAL A 104 -4.402 -6.061 7.974 1.00 0.00 C ATOM 1530 CG1 VAL A 104 -5.167 -7.122 8.753 1.00 0.00 C ATOM 1531 CG2 VAL A 104 -4.913 -4.669 8.311 1.00 0.00 C ATOM 0 H VAL A 104 -2.611 -4.890 6.627 1.00 0.00 H new ATOM 0 HA VAL A 104 -2.719 -5.950 9.332 1.00 0.00 H new ATOM 0 HB VAL A 104 -4.563 -6.243 6.911 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -6.231 -7.042 8.528 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -4.809 -8.111 8.468 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -5.010 -6.973 9.821 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -5.980 -4.611 8.096 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -4.745 -4.466 9.369 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -4.381 -3.931 7.711 1.00 0.00 H new ATOM 1541 N HIS A 105 -2.125 -8.331 9.008 1.00 0.00 N ATOM 1542 CA HIS A 105 -1.622 -9.690 8.846 1.00 0.00 C ATOM 1543 C HIS A 105 -2.745 -10.711 8.962 1.00 0.00 C ATOM 1544 O HIS A 105 -2.766 -11.709 8.242 1.00 0.00 O ATOM 1545 CB HIS A 105 -0.539 -9.993 9.888 1.00 0.00 C ATOM 1546 CG HIS A 105 0.590 -9.009 9.887 1.00 0.00 C ATOM 1547 ND1 HIS A 105 1.550 -8.979 10.875 1.00 0.00 N ATOM 1548 CD2 HIS A 105 0.910 -8.021 9.019 1.00 0.00 C ATOM 1549 CE1 HIS A 105 2.414 -8.013 10.615 1.00 0.00 C ATOM 1550 NE2 HIS A 105 2.048 -7.417 9.495 1.00 0.00 N ATOM 0 H HIS A 105 -2.241 -8.037 9.978 1.00 0.00 H new ATOM 0 HA HIS A 105 -1.189 -9.763 7.848 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -0.994 -10.009 10.878 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -0.140 -10.991 9.705 1.00 0.00 H new ATOM 0 HD1 HIS A 105 1.588 -9.604 11.680 1.00 0.00 H new ATOM 0 HD2 HIS A 105 0.372 -7.757 8.121 1.00 0.00 H new ATOM 0 HE1 HIS A 105 3.273 -7.755 11.216 1.00 0.00 H new ATOM 1557 N GLU A 106 -3.679 -10.456 9.873 1.00 0.00 N ATOM 1558 CA GLU A 106 -4.885 -11.266 9.981 1.00 0.00 C ATOM 1559 C GLU A 106 -6.123 -10.393 10.149 1.00 0.00 C ATOM 1560 O GLU A 106 -6.025 -9.231 10.543 1.00 0.00 O ATOM 1561 CB GLU A 106 -4.772 -12.238 11.157 1.00 0.00 C ATOM 1562 CG GLU A 106 -3.753 -13.351 10.957 1.00 0.00 C ATOM 1563 CD GLU A 106 -3.739 -14.342 12.087 1.00 0.00 C ATOM 1564 OE1 GLU A 106 -4.479 -14.157 13.024 1.00 0.00 O ATOM 1565 OE2 GLU A 106 -2.988 -15.286 12.015 1.00 0.00 O ATOM 0 H GLU A 106 -3.623 -9.693 10.548 1.00 0.00 H new ATOM 0 HA GLU A 106 -4.988 -11.833 9.056 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -4.507 -11.676 12.053 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -5.749 -12.685 11.338 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -3.971 -13.873 10.025 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -2.760 -12.913 10.852 1.00 0.00 H new ATOM 1572 N PRO A 107 -7.286 -10.959 9.847 1.00 0.00 N ATOM 1573 CA PRO A 107 -8.546 -10.237 9.974 1.00 0.00 C ATOM 1574 C PRO A 107 -8.664 -9.570 11.338 1.00 0.00 C ATOM 1575 O PRO A 107 -8.505 -10.218 12.372 1.00 0.00 O ATOM 1576 CB PRO A 107 -9.595 -11.338 9.791 1.00 0.00 C ATOM 1577 CG PRO A 107 -8.947 -12.311 8.866 1.00 0.00 C ATOM 1578 CD PRO A 107 -7.504 -12.332 9.297 1.00 0.00 C ATOM 0 HA PRO A 107 -8.653 -9.426 9.254 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -9.853 -11.804 10.742 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -10.519 -10.942 9.369 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -9.400 -13.299 8.947 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -9.047 -11.998 7.827 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -7.320 -13.100 10.049 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -6.838 -12.540 8.460 1.00 0.00 H new ATOM 1586 N GLN A 108 -8.942 -8.271 11.334 1.00 0.00 N ATOM 1587 CA GLN A 108 -9.111 -7.519 12.571 1.00 0.00 C ATOM 1588 C GLN A 108 -10.367 -6.658 12.527 1.00 0.00 C ATOM 1589 O GLN A 108 -10.327 -5.505 12.099 1.00 0.00 O ATOM 1590 CB GLN A 108 -7.886 -6.641 12.837 1.00 0.00 C ATOM 1591 CG GLN A 108 -6.628 -7.416 13.190 1.00 0.00 C ATOM 1592 CD GLN A 108 -6.748 -8.140 14.518 1.00 0.00 C ATOM 1593 OE1 GLN A 108 -7.163 -7.556 15.523 1.00 0.00 O ATOM 1594 NE2 GLN A 108 -6.384 -9.417 14.530 1.00 0.00 N ATOM 0 H GLN A 108 -9.055 -7.716 10.486 1.00 0.00 H new ATOM 0 HA GLN A 108 -9.217 -8.238 13.383 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -7.689 -6.034 11.953 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -8.116 -5.953 13.651 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -6.417 -8.140 12.403 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -5.781 -6.731 13.228 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -6.047 -9.859 13.675 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -6.442 -9.956 15.394 1.00 0.00 H new ATOM 1603 N PRO A 109 -11.483 -7.226 12.970 1.00 0.00 N ATOM 1604 CA PRO A 109 -12.746 -6.498 13.022 1.00 0.00 C ATOM 1605 C PRO A 109 -12.593 -5.184 13.776 1.00 0.00 C ATOM 1606 O PRO A 109 -13.292 -4.210 13.494 1.00 0.00 O ATOM 1607 CB PRO A 109 -13.673 -7.468 13.761 1.00 0.00 C ATOM 1608 CG PRO A 109 -13.128 -8.817 13.434 1.00 0.00 C ATOM 1609 CD PRO A 109 -11.635 -8.625 13.430 1.00 0.00 C ATOM 0 HA PRO A 109 -13.123 -6.217 12.039 1.00 0.00 H new ATOM 0 HB2 PRO A 109 -13.665 -7.285 14.836 1.00 0.00 H new ATOM 0 HB3 PRO A 109 -14.705 -7.364 13.427 1.00 0.00 H new ATOM 0 HG2 PRO A 109 -13.432 -9.558 14.173 1.00 0.00 H new ATOM 0 HG3 PRO A 109 -13.487 -9.167 12.466 1.00 0.00 H new ATOM 0 HD2 PRO A 109 -11.206 -8.773 14.421 1.00 0.00 H new ATOM 0 HD3 PRO A 109 -11.139 -9.327 12.760 1.00 0.00 H new ATOM 1617 N HIS A 110 -11.674 -5.161 14.735 1.00 0.00 N ATOM 1618 CA HIS A 110 -11.410 -3.957 15.515 1.00 0.00 C ATOM 1619 C HIS A 110 -11.036 -2.788 14.612 1.00 0.00 C ATOM 1620 O HIS A 110 -11.456 -1.655 14.843 1.00 0.00 O ATOM 1621 CB HIS A 110 -10.290 -4.204 16.529 1.00 0.00 C ATOM 1622 CG HIS A 110 -9.910 -2.988 17.316 1.00 0.00 C ATOM 1623 ND1 HIS A 110 -10.726 -2.446 18.286 1.00 0.00 N ATOM 1624 CD2 HIS A 110 -8.804 -2.209 17.274 1.00 0.00 C ATOM 1625 CE1 HIS A 110 -10.136 -1.384 18.809 1.00 0.00 C ATOM 1626 NE2 HIS A 110 -8.970 -1.219 18.212 1.00 0.00 N ATOM 0 H HIS A 110 -11.099 -5.963 14.991 1.00 0.00 H new ATOM 0 HA HIS A 110 -12.326 -3.704 16.050 1.00 0.00 H new ATOM 0 HB2 HIS A 110 -10.603 -4.989 17.218 1.00 0.00 H new ATOM 0 HB3 HIS A 110 -9.410 -4.574 16.002 1.00 0.00 H new ATOM 0 HD2 HIS A 110 -7.951 -2.341 16.625 1.00 0.00 H new ATOM 0 HE1 HIS A 110 -10.539 -0.758 19.591 1.00 0.00 H new ATOM 0 HE2 HIS A 110 -8.301 -0.476 18.414 1.00 0.00 H new ATOM 1633 N LEU A 111 -10.244 -3.071 13.584 1.00 0.00 N ATOM 1634 CA LEU A 111 -9.775 -2.036 12.670 1.00 0.00 C ATOM 1635 C LEU A 111 -10.610 -2.005 11.397 1.00 0.00 C ATOM 1636 O LEU A 111 -10.616 -1.011 10.671 1.00 0.00 O ATOM 1637 CB LEU A 111 -8.301 -2.269 12.316 1.00 0.00 C ATOM 1638 CG LEU A 111 -7.318 -2.224 13.493 1.00 0.00 C ATOM 1639 CD1 LEU A 111 -5.916 -2.549 12.998 1.00 0.00 C ATOM 1640 CD2 LEU A 111 -7.365 -0.849 14.142 1.00 0.00 C ATOM 0 H LEU A 111 -9.913 -4.010 13.362 1.00 0.00 H new ATOM 0 HA LEU A 111 -9.879 -1.075 13.173 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -8.213 -3.241 11.830 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -7.999 -1.518 11.586 1.00 0.00 H new ATOM 0 HG LEU A 111 -7.598 -2.966 14.241 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -5.218 -2.517 13.835 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -5.908 -3.546 12.557 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -5.616 -1.818 12.247 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -6.667 -0.817 14.978 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -7.088 -0.091 13.409 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -8.374 -0.652 14.504 1.00 0.00 H new ATOM 1652 N ASP A 112 -11.316 -3.099 11.131 1.00 0.00 N ATOM 1653 CA ASP A 112 -12.103 -3.226 9.911 1.00 0.00 C ATOM 1654 C ASP A 112 -13.187 -2.158 9.841 1.00 0.00 C ATOM 1655 O ASP A 112 -14.060 -2.090 10.705 1.00 0.00 O ATOM 1656 CB ASP A 112 -12.739 -4.615 9.825 1.00 0.00 C ATOM 1657 CG ASP A 112 -13.336 -4.910 8.455 1.00 0.00 C ATOM 1658 OD1 ASP A 112 -14.303 -4.278 8.102 1.00 0.00 O ATOM 1659 OD2 ASP A 112 -12.819 -5.765 7.776 1.00 0.00 O ATOM 0 H ASP A 112 -11.359 -3.912 11.746 1.00 0.00 H new ATOM 0 HA ASP A 112 -11.428 -3.089 9.066 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -11.987 -5.369 10.058 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -13.519 -4.699 10.581 1.00 0.00 H new ATOM 1664 N GLY A 113 -13.124 -1.327 8.806 1.00 0.00 N ATOM 1665 CA GLY A 113 -14.143 -0.308 8.579 1.00 0.00 C ATOM 1666 C GLY A 113 -13.846 0.955 9.378 1.00 0.00 C ATOM 1667 O GLY A 113 -14.638 1.898 9.383 1.00 0.00 O ATOM 0 H GLY A 113 -12.378 -1.339 8.111 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -14.190 -0.067 7.517 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -15.121 -0.698 8.861 1.00 0.00 H new ATOM 1671 N VAL A 114 -12.702 0.968 10.052 1.00 0.00 N ATOM 1672 CA VAL A 114 -12.303 2.112 10.863 1.00 0.00 C ATOM 1673 C VAL A 114 -11.368 3.035 10.093 1.00 0.00 C ATOM 1674 O VAL A 114 -11.591 4.244 10.026 1.00 0.00 O ATOM 1675 CB VAL A 114 -11.604 1.636 12.151 1.00 0.00 C ATOM 1676 CG1 VAL A 114 -11.106 2.826 12.958 1.00 0.00 C ATOM 1677 CG2 VAL A 114 -12.558 0.786 12.975 1.00 0.00 C ATOM 0 H VAL A 114 -12.033 0.198 10.053 1.00 0.00 H new ATOM 0 HA VAL A 114 -13.206 2.666 11.120 1.00 0.00 H new ATOM 0 HB VAL A 114 -10.741 1.027 11.880 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -10.615 2.471 13.864 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -10.396 3.399 12.361 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -11.950 3.462 13.227 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -12.056 0.453 13.884 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -13.435 1.376 13.240 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -12.867 -0.082 12.393 1.00 0.00 H new ATOM 1687 N HIS A 115 -10.322 2.458 9.511 1.00 0.00 N ATOM 1688 CA HIS A 115 -9.312 3.237 8.806 1.00 0.00 C ATOM 1689 C HIS A 115 -9.510 3.158 7.297 1.00 0.00 C ATOM 1690 O HIS A 115 -10.084 2.197 6.786 1.00 0.00 O ATOM 1691 CB HIS A 115 -7.904 2.753 9.167 1.00 0.00 C ATOM 1692 CG HIS A 115 -7.548 2.962 10.607 1.00 0.00 C ATOM 1693 ND1 HIS A 115 -7.127 4.181 11.099 1.00 0.00 N ATOM 1694 CD2 HIS A 115 -7.548 2.111 11.659 1.00 0.00 C ATOM 1695 CE1 HIS A 115 -6.885 4.069 12.394 1.00 0.00 C ATOM 1696 NE2 HIS A 115 -7.133 2.824 12.757 1.00 0.00 N ATOM 0 H HIS A 115 -10.152 1.452 9.514 1.00 0.00 H new ATOM 0 HA HIS A 115 -9.423 4.276 9.118 1.00 0.00 H new ATOM 0 HB2 HIS A 115 -7.822 1.692 8.932 1.00 0.00 H new ATOM 0 HB3 HIS A 115 -7.179 3.275 8.543 1.00 0.00 H new ATOM 0 HD2 HIS A 115 -7.823 1.067 11.639 1.00 0.00 H new ATOM 0 HE1 HIS A 115 -6.543 4.861 13.044 1.00 0.00 H new ATOM 0 HE2 HIS A 115 -7.033 2.452 13.701 1.00 0.00 H new ATOM 1703 N THR A 116 -9.030 4.175 6.589 1.00 0.00 N ATOM 1704 CA THR A 116 -9.170 4.231 5.138 1.00 0.00 C ATOM 1705 C THR A 116 -8.184 3.294 4.453 1.00 0.00 C ATOM 1706 O THR A 116 -6.977 3.538 4.455 1.00 0.00 O ATOM 1707 CB THR A 116 -8.967 5.666 4.617 1.00 0.00 C ATOM 1708 OG1 THR A 116 -10.020 6.507 5.104 1.00 0.00 O ATOM 1709 CG2 THR A 116 -8.970 5.687 3.096 1.00 0.00 C ATOM 0 H THR A 116 -8.541 4.972 6.996 1.00 0.00 H new ATOM 0 HA THR A 116 -10.183 3.909 4.899 1.00 0.00 H new ATOM 0 HB THR A 116 -8.004 6.033 4.974 1.00 0.00 H new ATOM 0 HG1 THR A 116 -10.826 6.368 4.564 1.00 0.00 H new ATOM 0 HG21 THR A 116 -8.825 6.709 2.746 1.00 0.00 H new ATOM 0 HG22 THR A 116 -8.163 5.058 2.722 1.00 0.00 H new ATOM 0 HG23 THR A 116 -9.924 5.309 2.729 1.00 0.00 H new ATOM 1717 N VAL A 117 -8.704 2.221 3.868 1.00 0.00 N ATOM 1718 CA VAL A 117 -7.883 1.294 3.098 1.00 0.00 C ATOM 1719 C VAL A 117 -7.595 1.839 1.706 1.00 0.00 C ATOM 1720 O VAL A 117 -8.480 2.385 1.047 1.00 0.00 O ATOM 1721 CB VAL A 117 -8.588 -0.070 2.976 1.00 0.00 C ATOM 1722 CG1 VAL A 117 -7.788 -1.005 2.080 1.00 0.00 C ATOM 1723 CG2 VAL A 117 -8.778 -0.679 4.357 1.00 0.00 C ATOM 0 H VAL A 117 -9.692 1.971 3.912 1.00 0.00 H new ATOM 0 HA VAL A 117 -6.938 1.171 3.627 1.00 0.00 H new ATOM 0 HB VAL A 117 -9.568 0.077 2.521 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -8.301 -1.964 2.005 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -7.694 -0.565 1.087 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -6.796 -1.156 2.505 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -9.277 -1.644 4.264 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -7.806 -0.818 4.830 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -9.387 -0.013 4.968 1.00 0.00 H new ATOM 1733 N PHE A 118 -6.351 1.690 1.262 1.00 0.00 N ATOM 1734 CA PHE A 118 -5.909 2.284 0.006 1.00 0.00 C ATOM 1735 C PHE A 118 -5.164 1.269 -0.851 1.00 0.00 C ATOM 1736 O PHE A 118 -5.039 1.439 -2.064 1.00 0.00 O ATOM 1737 CB PHE A 118 -5.009 3.491 0.274 1.00 0.00 C ATOM 1738 CG PHE A 118 -3.668 3.133 0.849 1.00 0.00 C ATOM 1739 CD1 PHE A 118 -3.498 2.996 2.218 1.00 0.00 C ATOM 1740 CD2 PHE A 118 -2.575 2.929 0.020 1.00 0.00 C ATOM 1741 CE1 PHE A 118 -2.265 2.666 2.749 1.00 0.00 C ATOM 1742 CE2 PHE A 118 -1.341 2.599 0.548 1.00 0.00 C ATOM 1743 CZ PHE A 118 -1.186 2.467 1.912 1.00 0.00 C ATOM 0 H PHE A 118 -5.630 1.162 1.754 1.00 0.00 H new ATOM 0 HA PHE A 118 -6.796 2.610 -0.537 1.00 0.00 H new ATOM 0 HB2 PHE A 118 -4.860 4.035 -0.659 1.00 0.00 H new ATOM 0 HB3 PHE A 118 -5.519 4.167 0.960 1.00 0.00 H new ATOM 0 HD1 PHE A 118 -4.339 3.149 2.878 1.00 0.00 H new ATOM 0 HD2 PHE A 118 -2.689 3.029 -1.049 1.00 0.00 H new ATOM 0 HE1 PHE A 118 -2.146 2.564 3.818 1.00 0.00 H new ATOM 0 HE2 PHE A 118 -0.497 2.444 -0.108 1.00 0.00 H new ATOM 0 HZ PHE A 118 -0.222 2.208 2.324 1.00 0.00 H new ATOM 1753 N GLY A 119 -4.669 0.213 -0.214 1.00 0.00 N ATOM 1754 CA GLY A 119 -3.856 -0.784 -0.899 1.00 0.00 C ATOM 1755 C GLY A 119 -4.151 -2.186 -0.382 1.00 0.00 C ATOM 1756 O GLY A 119 -4.772 -2.353 0.667 1.00 0.00 O ATOM 0 H GLY A 119 -4.817 0.026 0.778 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -4.050 -0.741 -1.971 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -2.800 -0.556 -0.756 1.00 0.00 H new ATOM 1760 N GLN A 120 -3.702 -3.191 -1.125 1.00 0.00 N ATOM 1761 CA GLN A 120 -3.874 -4.581 -0.719 1.00 0.00 C ATOM 1762 C GLN A 120 -2.686 -5.432 -1.149 1.00 0.00 C ATOM 1763 O GLN A 120 -2.297 -5.428 -2.316 1.00 0.00 O ATOM 1764 CB GLN A 120 -5.167 -5.154 -1.306 1.00 0.00 C ATOM 1765 CG GLN A 120 -5.484 -6.568 -0.850 1.00 0.00 C ATOM 1766 CD GLN A 120 -6.648 -7.174 -1.610 1.00 0.00 C ATOM 1767 OE1 GLN A 120 -7.311 -6.497 -2.400 1.00 0.00 O ATOM 1768 NE2 GLN A 120 -6.903 -8.456 -1.375 1.00 0.00 N ATOM 0 H GLN A 120 -3.215 -3.069 -2.013 1.00 0.00 H new ATOM 0 HA GLN A 120 -3.936 -4.604 0.369 1.00 0.00 H new ATOM 0 HB2 GLN A 120 -5.997 -4.502 -1.034 1.00 0.00 H new ATOM 0 HB3 GLN A 120 -5.096 -5.142 -2.394 1.00 0.00 H new ATOM 0 HG2 GLN A 120 -4.602 -7.195 -0.981 1.00 0.00 H new ATOM 0 HG3 GLN A 120 -5.714 -6.560 0.215 1.00 0.00 H new ATOM 0 HE21 GLN A 120 -6.328 -8.977 -0.713 1.00 0.00 H new ATOM 0 HE22 GLN A 120 -7.674 -8.919 -1.857 1.00 0.00 H new ATOM 1777 N VAL A 121 -2.112 -6.161 -0.197 1.00 0.00 N ATOM 1778 CA VAL A 121 -0.953 -7.003 -0.471 1.00 0.00 C ATOM 1779 C VAL A 121 -1.342 -8.223 -1.297 1.00 0.00 C ATOM 1780 O VAL A 121 -2.313 -8.911 -0.986 1.00 0.00 O ATOM 1781 CB VAL A 121 -0.304 -7.464 0.847 1.00 0.00 C ATOM 1782 CG1 VAL A 121 0.845 -8.421 0.570 1.00 0.00 C ATOM 1783 CG2 VAL A 121 0.179 -6.257 1.637 1.00 0.00 C ATOM 0 H VAL A 121 -2.431 -6.185 0.772 1.00 0.00 H new ATOM 0 HA VAL A 121 -0.239 -6.409 -1.041 1.00 0.00 H new ATOM 0 HB VAL A 121 -1.049 -7.994 1.440 1.00 0.00 H new ATOM 0 HG11 VAL A 121 1.291 -8.736 1.513 1.00 0.00 H new ATOM 0 HG12 VAL A 121 0.470 -9.294 0.036 1.00 0.00 H new ATOM 0 HG13 VAL A 121 1.598 -7.919 -0.038 1.00 0.00 H new ATOM 0 HG21 VAL A 121 0.637 -6.591 2.568 1.00 0.00 H new ATOM 0 HG22 VAL A 121 0.913 -5.707 1.048 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -0.667 -5.607 1.861 1.00 0.00 H new ATOM 1793 N THR A 122 -0.575 -8.487 -2.350 1.00 0.00 N ATOM 1794 CA THR A 122 -0.894 -9.564 -3.279 1.00 0.00 C ATOM 1795 C THR A 122 0.204 -10.619 -3.296 1.00 0.00 C ATOM 1796 O THR A 122 -0.053 -11.793 -3.563 1.00 0.00 O ATOM 1797 CB THR A 122 -1.112 -9.021 -4.704 1.00 0.00 C ATOM 1798 OG1 THR A 122 0.093 -8.399 -5.170 1.00 0.00 O ATOM 1799 CG2 THR A 122 -2.242 -8.004 -4.720 1.00 0.00 C ATOM 0 H THR A 122 0.273 -7.969 -2.581 1.00 0.00 H new ATOM 0 HA THR A 122 -1.819 -10.026 -2.933 1.00 0.00 H new ATOM 0 HB THR A 122 -1.376 -9.852 -5.357 1.00 0.00 H new ATOM 0 HG1 THR A 122 -0.046 -8.055 -6.077 1.00 0.00 H new ATOM 0 HG21 THR A 122 -2.382 -7.631 -5.735 1.00 0.00 H new ATOM 0 HG22 THR A 122 -3.162 -8.477 -4.377 1.00 0.00 H new ATOM 0 HG23 THR A 122 -1.993 -7.173 -4.059 1.00 0.00 H new ATOM 1807 N SER A 123 1.431 -10.196 -3.008 1.00 0.00 N ATOM 1808 CA SER A 123 2.568 -11.107 -2.970 1.00 0.00 C ATOM 1809 C SER A 123 3.590 -10.670 -1.928 1.00 0.00 C ATOM 1810 O SER A 123 3.846 -9.478 -1.758 1.00 0.00 O ATOM 1811 CB SER A 123 3.223 -11.181 -4.335 1.00 0.00 C ATOM 1812 OG SER A 123 4.328 -12.042 -4.315 1.00 0.00 O ATOM 0 H SER A 123 1.663 -9.225 -2.797 1.00 0.00 H new ATOM 0 HA SER A 123 2.199 -12.094 -2.692 1.00 0.00 H new ATOM 0 HB2 SER A 123 2.499 -11.530 -5.071 1.00 0.00 H new ATOM 0 HB3 SER A 123 3.539 -10.185 -4.645 1.00 0.00 H new ATOM 0 HG SER A 123 4.733 -12.075 -5.207 1.00 0.00 H new ATOM 1818 N GLY A 124 4.172 -11.641 -1.233 1.00 0.00 N ATOM 1819 CA GLY A 124 5.080 -11.355 -0.130 1.00 0.00 C ATOM 1820 C GLY A 124 4.338 -11.324 1.200 1.00 0.00 C ATOM 1821 O GLY A 124 4.889 -10.907 2.220 1.00 0.00 O ATOM 0 H GLY A 124 4.030 -12.635 -1.415 1.00 0.00 H new ATOM 0 HA2 GLY A 124 5.864 -12.112 -0.095 1.00 0.00 H new ATOM 0 HA3 GLY A 124 5.570 -10.396 -0.298 1.00 0.00 H new ATOM 1825 N MET A 125 3.086 -11.767 1.184 1.00 0.00 N ATOM 1826 CA MET A 125 2.285 -11.848 2.400 1.00 0.00 C ATOM 1827 C MET A 125 3.071 -12.492 3.536 1.00 0.00 C ATOM 1828 O MET A 125 2.984 -12.061 4.685 1.00 0.00 O ATOM 1829 CB MET A 125 0.998 -12.624 2.134 1.00 0.00 C ATOM 1830 CG MET A 125 0.039 -12.677 3.316 1.00 0.00 C ATOM 1831 SD MET A 125 -0.658 -11.063 3.716 1.00 0.00 S ATOM 1832 CE MET A 125 0.078 -10.765 5.321 1.00 0.00 C ATOM 0 H MET A 125 2.603 -12.076 0.341 1.00 0.00 H new ATOM 0 HA MET A 125 2.028 -10.833 2.705 1.00 0.00 H new ATOM 0 HB2 MET A 125 0.485 -12.172 1.285 1.00 0.00 H new ATOM 0 HB3 MET A 125 1.256 -13.643 1.845 1.00 0.00 H new ATOM 0 HG2 MET A 125 -0.770 -13.373 3.092 1.00 0.00 H new ATOM 0 HG3 MET A 125 0.564 -13.068 4.188 1.00 0.00 H new ATOM 0 HE1 MET A 125 0.224 -9.694 5.461 1.00 0.00 H new ATOM 0 HE2 MET A 125 -0.582 -11.147 6.100 1.00 0.00 H new ATOM 0 HE3 MET A 125 1.041 -11.273 5.380 1.00 0.00 H new ATOM 1842 N ASP A 126 3.837 -13.526 3.205 1.00 0.00 N ATOM 1843 CA ASP A 126 4.678 -14.201 4.187 1.00 0.00 C ATOM 1844 C ASP A 126 5.649 -13.226 4.843 1.00 0.00 C ATOM 1845 O ASP A 126 5.759 -13.176 6.068 1.00 0.00 O ATOM 1846 CB ASP A 126 5.458 -15.342 3.530 1.00 0.00 C ATOM 1847 CG ASP A 126 4.580 -16.536 3.183 1.00 0.00 C ATOM 1848 OD1 ASP A 126 3.464 -16.583 3.643 1.00 0.00 O ATOM 1849 OD2 ASP A 126 5.033 -17.391 2.458 1.00 0.00 O ATOM 0 H ASP A 126 3.893 -13.915 2.264 1.00 0.00 H new ATOM 0 HA ASP A 126 4.025 -14.610 4.958 1.00 0.00 H new ATOM 0 HB2 ASP A 126 5.936 -14.973 2.623 1.00 0.00 H new ATOM 0 HB3 ASP A 126 6.254 -15.665 4.201 1.00 0.00 H new ATOM 1854 N VAL A 127 6.349 -12.453 4.021 1.00 0.00 N ATOM 1855 CA VAL A 127 7.281 -11.450 4.521 1.00 0.00 C ATOM 1856 C VAL A 127 6.568 -10.420 5.390 1.00 0.00 C ATOM 1857 O VAL A 127 7.089 -9.997 6.422 1.00 0.00 O ATOM 1858 CB VAL A 127 7.976 -10.734 3.348 1.00 0.00 C ATOM 1859 CG1 VAL A 127 8.786 -9.548 3.851 1.00 0.00 C ATOM 1860 CG2 VAL A 127 8.865 -11.714 2.597 1.00 0.00 C ATOM 0 H VAL A 127 6.289 -12.502 3.004 1.00 0.00 H new ATOM 0 HA VAL A 127 8.026 -11.964 5.128 1.00 0.00 H new ATOM 0 HB VAL A 127 7.216 -10.357 2.664 1.00 0.00 H new ATOM 0 HG11 VAL A 127 9.270 -9.054 3.008 1.00 0.00 H new ATOM 0 HG12 VAL A 127 8.124 -8.843 4.354 1.00 0.00 H new ATOM 0 HG13 VAL A 127 9.545 -9.896 4.552 1.00 0.00 H new ATOM 0 HG21 VAL A 127 9.353 -11.201 1.769 1.00 0.00 H new ATOM 0 HG22 VAL A 127 9.621 -12.112 3.274 1.00 0.00 H new ATOM 0 HG23 VAL A 127 8.258 -12.532 2.210 1.00 0.00 H new ATOM 1870 N VAL A 128 5.375 -10.021 4.966 1.00 0.00 N ATOM 1871 CA VAL A 128 4.582 -9.052 5.711 1.00 0.00 C ATOM 1872 C VAL A 128 4.229 -9.576 7.097 1.00 0.00 C ATOM 1873 O VAL A 128 4.427 -8.891 8.101 1.00 0.00 O ATOM 1874 CB VAL A 128 3.286 -8.719 4.947 1.00 0.00 C ATOM 1875 CG1 VAL A 128 2.353 -7.889 5.815 1.00 0.00 C ATOM 1876 CG2 VAL A 128 3.620 -7.984 3.657 1.00 0.00 C ATOM 0 H VAL A 128 4.935 -10.355 4.108 1.00 0.00 H new ATOM 0 HA VAL A 128 5.183 -8.150 5.822 1.00 0.00 H new ATOM 0 HB VAL A 128 2.775 -9.648 4.697 1.00 0.00 H new ATOM 0 HG11 VAL A 128 1.443 -7.663 5.259 1.00 0.00 H new ATOM 0 HG12 VAL A 128 2.099 -8.449 6.715 1.00 0.00 H new ATOM 0 HG13 VAL A 128 2.847 -6.959 6.094 1.00 0.00 H new ATOM 0 HG21 VAL A 128 2.699 -7.752 3.122 1.00 0.00 H new ATOM 0 HG22 VAL A 128 4.147 -7.059 3.891 1.00 0.00 H new ATOM 0 HG23 VAL A 128 4.253 -8.614 3.033 1.00 0.00 H new ATOM 1886 N ARG A 129 3.706 -10.797 7.146 1.00 0.00 N ATOM 1887 CA ARG A 129 3.226 -11.375 8.395 1.00 0.00 C ATOM 1888 C ARG A 129 4.377 -11.646 9.356 1.00 0.00 C ATOM 1889 O ARG A 129 4.239 -11.483 10.568 1.00 0.00 O ATOM 1890 CB ARG A 129 2.474 -12.672 8.132 1.00 0.00 C ATOM 1891 CG ARG A 129 1.820 -13.292 9.356 1.00 0.00 C ATOM 1892 CD ARG A 129 0.983 -14.464 8.997 1.00 0.00 C ATOM 1893 NE ARG A 129 0.176 -14.920 10.118 1.00 0.00 N ATOM 1894 CZ ARG A 129 0.617 -15.736 11.095 1.00 0.00 C ATOM 1895 NH1 ARG A 129 1.855 -16.177 11.075 1.00 0.00 N ATOM 1896 NH2 ARG A 129 -0.196 -16.093 12.075 1.00 0.00 N ATOM 0 H ARG A 129 3.604 -11.406 6.334 1.00 0.00 H new ATOM 0 HA ARG A 129 2.551 -10.651 8.851 1.00 0.00 H new ATOM 0 HB2 ARG A 129 1.705 -12.483 7.383 1.00 0.00 H new ATOM 0 HB3 ARG A 129 3.167 -13.396 7.702 1.00 0.00 H new ATOM 0 HG2 ARG A 129 2.590 -13.598 10.064 1.00 0.00 H new ATOM 0 HG3 ARG A 129 1.204 -12.545 9.857 1.00 0.00 H new ATOM 0 HD2 ARG A 129 0.331 -14.202 8.163 1.00 0.00 H new ATOM 0 HD3 ARG A 129 1.624 -15.277 8.657 1.00 0.00 H new ATOM 0 HE ARG A 129 -0.791 -14.600 10.168 1.00 0.00 H new ATOM 0 HH11 ARG A 129 2.482 -15.901 10.319 1.00 0.00 H new ATOM 0 HH12 ARG A 129 2.188 -16.795 11.815 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -1.157 -15.751 12.091 1.00 0.00 H new ATOM 0 HH22 ARG A 129 0.138 -16.711 12.815 1.00 0.00 H new ATOM 1910 N THR A 130 5.515 -12.058 8.806 1.00 0.00 N ATOM 1911 CA THR A 130 6.695 -12.346 9.612 1.00 0.00 C ATOM 1912 C THR A 130 7.625 -11.142 9.677 1.00 0.00 C ATOM 1913 O THR A 130 8.813 -11.278 9.969 1.00 0.00 O ATOM 1914 CB THR A 130 7.460 -13.562 9.059 1.00 0.00 C ATOM 1915 OG1 THR A 130 7.867 -13.301 7.709 1.00 0.00 O ATOM 1916 CG2 THR A 130 6.583 -14.804 9.089 1.00 0.00 C ATOM 0 H THR A 130 5.644 -12.200 7.804 1.00 0.00 H new ATOM 0 HA THR A 130 6.349 -12.576 10.620 1.00 0.00 H new ATOM 0 HB THR A 130 8.337 -13.734 9.683 1.00 0.00 H new ATOM 0 HG1 THR A 130 7.102 -13.419 7.108 1.00 0.00 H new ATOM 0 HG21 THR A 130 7.141 -15.653 8.694 1.00 0.00 H new ATOM 0 HG22 THR A 130 6.283 -15.013 10.116 1.00 0.00 H new ATOM 0 HG23 THR A 130 5.696 -14.638 8.478 1.00 0.00 H new ATOM 1924 N MET A 131 7.078 -9.962 9.404 1.00 0.00 N ATOM 1925 CA MET A 131 7.845 -8.725 9.483 1.00 0.00 C ATOM 1926 C MET A 131 8.440 -8.532 10.872 1.00 0.00 C ATOM 1927 O MET A 131 7.801 -8.837 11.879 1.00 0.00 O ATOM 1928 CB MET A 131 6.965 -7.533 9.110 1.00 0.00 C ATOM 1929 CG MET A 131 7.703 -6.205 9.034 1.00 0.00 C ATOM 1930 SD MET A 131 6.618 -4.832 8.596 1.00 0.00 S ATOM 1931 CE MET A 131 6.216 -5.245 6.900 1.00 0.00 C ATOM 0 H MET A 131 6.105 -9.837 9.126 1.00 0.00 H new ATOM 0 HA MET A 131 8.669 -8.792 8.773 1.00 0.00 H new ATOM 0 HB2 MET A 131 6.497 -7.730 8.145 1.00 0.00 H new ATOM 0 HB3 MET A 131 6.162 -7.447 9.842 1.00 0.00 H new ATOM 0 HG2 MET A 131 8.173 -5.999 9.996 1.00 0.00 H new ATOM 0 HG3 MET A 131 8.503 -6.280 8.298 1.00 0.00 H new ATOM 0 HE1 MET A 131 5.796 -4.371 6.402 1.00 0.00 H new ATOM 0 HE2 MET A 131 7.120 -5.560 6.378 1.00 0.00 H new ATOM 0 HE3 MET A 131 5.487 -6.055 6.886 1.00 0.00 H new ATOM 1941 N LYS A 132 9.667 -8.025 10.919 1.00 0.00 N ATOM 1942 CA LYS A 132 10.333 -7.748 12.186 1.00 0.00 C ATOM 1943 C LYS A 132 10.082 -6.316 12.638 1.00 0.00 C ATOM 1944 O LYS A 132 9.906 -5.417 11.816 1.00 0.00 O ATOM 1945 CB LYS A 132 11.836 -8.007 12.069 1.00 0.00 C ATOM 1946 CG LYS A 132 12.207 -9.464 11.828 1.00 0.00 C ATOM 1947 CD LYS A 132 13.710 -9.632 11.660 1.00 0.00 C ATOM 1948 CE LYS A 132 14.084 -11.091 11.447 1.00 0.00 C ATOM 1949 NZ LYS A 132 15.553 -11.271 11.289 1.00 0.00 N ATOM 0 H LYS A 132 10.221 -7.797 10.093 1.00 0.00 H new ATOM 0 HA LYS A 132 9.916 -8.420 12.936 1.00 0.00 H new ATOM 0 HB2 LYS A 132 12.234 -7.404 11.253 1.00 0.00 H new ATOM 0 HB3 LYS A 132 12.323 -7.667 12.983 1.00 0.00 H new ATOM 0 HG2 LYS A 132 11.862 -10.072 12.664 1.00 0.00 H new ATOM 0 HG3 LYS A 132 11.696 -9.829 10.937 1.00 0.00 H new ATOM 0 HD2 LYS A 132 14.051 -9.039 10.811 1.00 0.00 H new ATOM 0 HD3 LYS A 132 14.222 -9.249 12.543 1.00 0.00 H new ATOM 0 HE2 LYS A 132 13.735 -11.682 12.294 1.00 0.00 H new ATOM 0 HE3 LYS A 132 13.575 -11.471 10.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 15.766 -12.279 11.146 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 15.883 -10.727 10.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 16.038 -10.933 12.144 1.00 0.00 H new ATOM 1963 N ASN A 133 10.066 -6.108 13.950 1.00 0.00 N ATOM 1964 CA ASN A 133 9.799 -4.791 14.515 1.00 0.00 C ATOM 1965 C ASN A 133 10.899 -3.802 14.149 1.00 0.00 C ATOM 1966 O ASN A 133 12.083 -4.072 14.352 1.00 0.00 O ATOM 1967 CB ASN A 133 9.640 -4.878 16.022 1.00 0.00 C ATOM 1968 CG ASN A 133 8.982 -3.659 16.605 1.00 0.00 C ATOM 1969 OD1 ASN A 133 8.224 -2.961 15.921 1.00 0.00 O ATOM 1970 ND2 ASN A 133 9.257 -3.389 17.856 1.00 0.00 N ATOM 0 H ASN A 133 10.235 -6.837 14.643 1.00 0.00 H new ATOM 0 HA ASN A 133 8.864 -4.427 14.089 1.00 0.00 H new ATOM 0 HB2 ASN A 133 9.049 -5.759 16.271 1.00 0.00 H new ATOM 0 HB3 ASN A 133 10.620 -5.011 16.480 1.00 0.00 H new ATOM 0 HD21 ASN A 133 8.840 -2.574 18.305 1.00 0.00 H new ATOM 0 HD22 ASN A 133 9.888 -3.994 18.381 1.00 0.00 H new ATOM 1977 N GLY A 134 10.500 -2.656 13.609 1.00 0.00 N ATOM 1978 CA GLY A 134 11.452 -1.632 13.194 1.00 0.00 C ATOM 1979 C GLY A 134 11.968 -1.897 11.786 1.00 0.00 C ATOM 1980 O GLY A 134 12.976 -1.328 11.367 1.00 0.00 O ATOM 0 H GLY A 134 9.523 -2.412 13.448 1.00 0.00 H new ATOM 0 HA2 GLY A 134 10.975 -0.652 13.231 1.00 0.00 H new ATOM 0 HA3 GLY A 134 12.289 -1.606 13.892 1.00 0.00 H new ATOM 1984 N ASP A 135 11.271 -2.763 11.058 1.00 0.00 N ATOM 1985 CA ASP A 135 11.613 -3.048 9.671 1.00 0.00 C ATOM 1986 C ASP A 135 11.931 -1.768 8.908 1.00 0.00 C ATOM 1987 O ASP A 135 11.176 -0.797 8.964 1.00 0.00 O ATOM 1988 CB ASP A 135 10.469 -3.791 8.978 1.00 0.00 C ATOM 1989 CG ASP A 135 10.844 -4.295 7.590 1.00 0.00 C ATOM 1990 OD1 ASP A 135 11.952 -4.058 7.172 1.00 0.00 O ATOM 1991 OD2 ASP A 135 10.017 -4.910 6.960 1.00 0.00 O ATOM 0 H ASP A 135 10.464 -3.280 11.407 1.00 0.00 H new ATOM 0 HA ASP A 135 12.501 -3.680 9.673 1.00 0.00 H new ATOM 0 HB2 ASP A 135 10.164 -4.636 9.596 1.00 0.00 H new ATOM 0 HB3 ASP A 135 9.608 -3.128 8.898 1.00 0.00 H new ATOM 1996 N VAL A 136 13.051 -1.773 8.193 1.00 0.00 N ATOM 1997 CA VAL A 136 13.489 -0.600 7.448 1.00 0.00 C ATOM 1998 C VAL A 136 13.341 -0.813 5.947 1.00 0.00 C ATOM 1999 O VAL A 136 13.822 -1.806 5.401 1.00 0.00 O ATOM 2000 CB VAL A 136 14.960 -0.278 7.775 1.00 0.00 C ATOM 2001 CG1 VAL A 136 15.416 0.958 7.015 1.00 0.00 C ATOM 2002 CG2 VAL A 136 15.126 -0.082 9.275 1.00 0.00 C ATOM 0 H VAL A 136 13.672 -2.578 8.114 1.00 0.00 H new ATOM 0 HA VAL A 136 12.856 0.236 7.746 1.00 0.00 H new ATOM 0 HB VAL A 136 15.584 -1.115 7.462 1.00 0.00 H new ATOM 0 HG11 VAL A 136 16.457 1.171 7.258 1.00 0.00 H new ATOM 0 HG12 VAL A 136 15.322 0.782 5.943 1.00 0.00 H new ATOM 0 HG13 VAL A 136 14.796 1.809 7.298 1.00 0.00 H new ATOM 0 HG21 VAL A 136 16.168 0.145 9.499 1.00 0.00 H new ATOM 0 HG22 VAL A 136 14.495 0.743 9.606 1.00 0.00 H new ATOM 0 HG23 VAL A 136 14.833 -0.994 9.796 1.00 0.00 H new ATOM 2012 N MET A 137 12.674 0.125 5.285 1.00 0.00 N ATOM 2013 CA MET A 137 12.516 0.076 3.836 1.00 0.00 C ATOM 2014 C MET A 137 13.819 0.424 3.128 1.00 0.00 C ATOM 2015 O MET A 137 14.601 1.242 3.613 1.00 0.00 O ATOM 2016 CB MET A 137 11.401 1.020 3.394 1.00 0.00 C ATOM 2017 CG MET A 137 10.013 0.626 3.879 1.00 0.00 C ATOM 2018 SD MET A 137 8.734 1.777 3.336 1.00 0.00 S ATOM 2019 CE MET A 137 7.341 1.222 4.314 1.00 0.00 C ATOM 0 H MET A 137 12.233 0.930 5.729 1.00 0.00 H new ATOM 0 HA MET A 137 12.246 -0.943 3.559 1.00 0.00 H new ATOM 0 HB2 MET A 137 11.627 2.023 3.755 1.00 0.00 H new ATOM 0 HB3 MET A 137 11.392 1.067 2.305 1.00 0.00 H new ATOM 0 HG2 MET A 137 9.775 -0.373 3.515 1.00 0.00 H new ATOM 0 HG3 MET A 137 10.013 0.577 4.968 1.00 0.00 H new ATOM 0 HE1 MET A 137 6.446 1.766 4.013 1.00 0.00 H new ATOM 0 HE2 MET A 137 7.187 0.155 4.155 1.00 0.00 H new ATOM 0 HE3 MET A 137 7.541 1.407 5.369 1.00 0.00 H new ATOM 2029 N LYS A 138 14.048 -0.203 1.979 1.00 0.00 N ATOM 2030 CA LYS A 138 15.231 0.078 1.175 1.00 0.00 C ATOM 2031 C LYS A 138 14.884 0.933 -0.037 1.00 0.00 C ATOM 2032 O LYS A 138 15.572 1.910 -0.337 1.00 0.00 O ATOM 2033 CB LYS A 138 15.895 -1.225 0.726 1.00 0.00 C ATOM 2034 CG LYS A 138 17.165 -1.034 -0.092 1.00 0.00 C ATOM 2035 CD LYS A 138 17.790 -2.371 -0.463 1.00 0.00 C ATOM 2036 CE LYS A 138 19.089 -2.181 -1.233 1.00 0.00 C ATOM 2037 NZ LYS A 138 19.741 -3.479 -1.552 1.00 0.00 N ATOM 0 H LYS A 138 13.429 -0.910 1.583 1.00 0.00 H new ATOM 0 HA LYS A 138 15.931 0.637 1.797 1.00 0.00 H new ATOM 0 HB2 LYS A 138 16.131 -1.821 1.608 1.00 0.00 H new ATOM 0 HB3 LYS A 138 15.180 -1.798 0.136 1.00 0.00 H new ATOM 0 HG2 LYS A 138 16.936 -0.473 -0.998 1.00 0.00 H new ATOM 0 HG3 LYS A 138 17.881 -0.441 0.477 1.00 0.00 H new ATOM 0 HD2 LYS A 138 17.982 -2.948 0.441 1.00 0.00 H new ATOM 0 HD3 LYS A 138 17.089 -2.948 -1.066 1.00 0.00 H new ATOM 0 HE2 LYS A 138 18.887 -1.640 -2.157 1.00 0.00 H new ATOM 0 HE3 LYS A 138 19.772 -1.566 -0.646 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 20.622 -3.305 -2.076 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 19.957 -3.985 -0.670 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 19.100 -4.056 -2.133 1.00 0.00 H new ATOM 2051 N GLU A 139 13.814 0.562 -0.730 1.00 0.00 N ATOM 2052 CA GLU A 139 13.385 1.282 -1.923 1.00 0.00 C ATOM 2053 C GLU A 139 11.919 1.013 -2.232 1.00 0.00 C ATOM 2054 O GLU A 139 11.484 -0.138 -2.275 1.00 0.00 O ATOM 2055 CB GLU A 139 14.250 0.888 -3.122 1.00 0.00 C ATOM 2056 CG GLU A 139 14.014 1.728 -4.370 1.00 0.00 C ATOM 2057 CD GLU A 139 14.946 1.376 -5.497 1.00 0.00 C ATOM 2058 OE1 GLU A 139 15.753 0.496 -5.322 1.00 0.00 O ATOM 2059 OE2 GLU A 139 14.851 1.991 -6.533 1.00 0.00 O ATOM 0 H GLU A 139 13.226 -0.235 -0.486 1.00 0.00 H new ATOM 0 HA GLU A 139 13.504 2.348 -1.730 1.00 0.00 H new ATOM 0 HB2 GLU A 139 15.300 0.967 -2.839 1.00 0.00 H new ATOM 0 HB3 GLU A 139 14.062 -0.158 -3.362 1.00 0.00 H new ATOM 0 HG2 GLU A 139 12.984 1.595 -4.702 1.00 0.00 H new ATOM 0 HG3 GLU A 139 14.135 2.782 -4.121 1.00 0.00 H new ATOM 2066 N VAL A 140 11.158 2.082 -2.446 1.00 0.00 N ATOM 2067 CA VAL A 140 9.721 1.968 -2.664 1.00 0.00 C ATOM 2068 C VAL A 140 9.315 2.578 -4.000 1.00 0.00 C ATOM 2069 O VAL A 140 9.686 3.709 -4.315 1.00 0.00 O ATOM 2070 CB VAL A 140 8.953 2.670 -1.529 1.00 0.00 C ATOM 2071 CG1 VAL A 140 7.453 2.582 -1.767 1.00 0.00 C ATOM 2072 CG2 VAL A 140 9.324 2.049 -0.190 1.00 0.00 C ATOM 0 H VAL A 140 11.514 3.038 -2.473 1.00 0.00 H new ATOM 0 HA VAL A 140 9.471 0.907 -2.675 1.00 0.00 H new ATOM 0 HB VAL A 140 9.231 3.724 -1.513 1.00 0.00 H new ATOM 0 HG11 VAL A 140 6.926 3.083 -0.955 1.00 0.00 H new ATOM 0 HG12 VAL A 140 7.206 3.064 -2.713 1.00 0.00 H new ATOM 0 HG13 VAL A 140 7.151 1.535 -1.804 1.00 0.00 H new ATOM 0 HG21 VAL A 140 8.777 2.551 0.608 1.00 0.00 H new ATOM 0 HG22 VAL A 140 9.066 0.990 -0.196 1.00 0.00 H new ATOM 0 HG23 VAL A 140 10.395 2.161 -0.021 1.00 0.00 H new ATOM 2082 N LYS A 141 8.553 1.822 -4.782 1.00 0.00 N ATOM 2083 CA LYS A 141 8.122 2.274 -6.100 1.00 0.00 C ATOM 2084 C LYS A 141 6.609 2.188 -6.245 1.00 0.00 C ATOM 2085 O LYS A 141 5.960 1.360 -5.604 1.00 0.00 O ATOM 2086 CB LYS A 141 8.803 1.454 -7.197 1.00 0.00 C ATOM 2087 CG LYS A 141 10.314 1.629 -7.268 1.00 0.00 C ATOM 2088 CD LYS A 141 10.909 0.834 -8.420 1.00 0.00 C ATOM 2089 CE LYS A 141 12.421 0.999 -8.485 1.00 0.00 C ATOM 2090 NZ LYS A 141 13.014 0.250 -9.626 1.00 0.00 N ATOM 0 H LYS A 141 8.221 0.892 -4.526 1.00 0.00 H new ATOM 0 HA LYS A 141 8.415 3.319 -6.206 1.00 0.00 H new ATOM 0 HB2 LYS A 141 8.579 0.399 -7.037 1.00 0.00 H new ATOM 0 HB3 LYS A 141 8.372 1.729 -8.160 1.00 0.00 H new ATOM 0 HG2 LYS A 141 10.555 2.685 -7.390 1.00 0.00 H new ATOM 0 HG3 LYS A 141 10.764 1.306 -6.329 1.00 0.00 H new ATOM 0 HD2 LYS A 141 10.661 -0.221 -8.303 1.00 0.00 H new ATOM 0 HD3 LYS A 141 10.465 1.163 -9.359 1.00 0.00 H new ATOM 0 HE2 LYS A 141 12.667 2.057 -8.579 1.00 0.00 H new ATOM 0 HE3 LYS A 141 12.864 0.650 -7.552 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 14.045 0.389 -9.634 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 12.802 -0.763 -9.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 12.610 0.600 -10.518 1.00 0.00 H new ATOM 2104 N VAL A 142 6.050 3.048 -7.089 1.00 0.00 N ATOM 2105 CA VAL A 142 4.649 2.940 -7.477 1.00 0.00 C ATOM 2106 C VAL A 142 4.501 2.862 -8.991 1.00 0.00 C ATOM 2107 O VAL A 142 5.354 3.347 -9.734 1.00 0.00 O ATOM 2108 CB VAL A 142 3.853 4.149 -6.948 1.00 0.00 C ATOM 2109 CG1 VAL A 142 3.849 4.160 -5.427 1.00 0.00 C ATOM 2110 CG2 VAL A 142 4.447 5.439 -7.495 1.00 0.00 C ATOM 0 H VAL A 142 6.547 3.829 -7.518 1.00 0.00 H new ATOM 0 HA VAL A 142 4.254 2.023 -7.040 1.00 0.00 H new ATOM 0 HB VAL A 142 2.820 4.069 -7.288 1.00 0.00 H new ATOM 0 HG11 VAL A 142 3.282 5.020 -5.071 1.00 0.00 H new ATOM 0 HG12 VAL A 142 3.388 3.244 -5.058 1.00 0.00 H new ATOM 0 HG13 VAL A 142 4.874 4.224 -5.061 1.00 0.00 H new ATOM 0 HG21 VAL A 142 3.880 6.290 -7.117 1.00 0.00 H new ATOM 0 HG22 VAL A 142 5.486 5.525 -7.176 1.00 0.00 H new ATOM 0 HG23 VAL A 142 4.402 5.427 -8.584 1.00 0.00 H new ATOM 2120 N PHE A 143 3.412 2.248 -9.443 1.00 0.00 N ATOM 2121 CA PHE A 143 3.250 1.916 -10.854 1.00 0.00 C ATOM 2122 C PHE A 143 1.872 2.321 -11.359 1.00 0.00 C ATOM 2123 O PHE A 143 0.852 1.943 -10.783 1.00 0.00 O ATOM 2124 CB PHE A 143 3.461 0.417 -11.077 1.00 0.00 C ATOM 2125 CG PHE A 143 4.764 -0.099 -10.538 1.00 0.00 C ATOM 2126 CD1 PHE A 143 5.921 -0.037 -11.301 1.00 0.00 C ATOM 2127 CD2 PHE A 143 4.837 -0.648 -9.267 1.00 0.00 C ATOM 2128 CE1 PHE A 143 7.121 -0.512 -10.807 1.00 0.00 C ATOM 2129 CE2 PHE A 143 6.036 -1.122 -8.769 1.00 0.00 C ATOM 2130 CZ PHE A 143 7.177 -1.055 -9.539 1.00 0.00 C ATOM 0 H PHE A 143 2.628 1.970 -8.852 1.00 0.00 H new ATOM 0 HA PHE A 143 4.001 2.472 -11.415 1.00 0.00 H new ATOM 0 HB2 PHE A 143 2.643 -0.129 -10.608 1.00 0.00 H new ATOM 0 HB3 PHE A 143 3.412 0.208 -12.146 1.00 0.00 H new ATOM 0 HD1 PHE A 143 5.883 0.388 -12.293 1.00 0.00 H new ATOM 0 HD2 PHE A 143 3.946 -0.706 -8.659 1.00 0.00 H new ATOM 0 HE1 PHE A 143 8.014 -0.458 -11.412 1.00 0.00 H new ATOM 0 HE2 PHE A 143 6.079 -1.545 -7.776 1.00 0.00 H new ATOM 0 HZ PHE A 143 8.114 -1.427 -9.151 1.00 0.00 H new ATOM 2140 N ASP A 144 1.849 3.093 -12.441 1.00 0.00 N ATOM 2141 CA ASP A 144 0.597 3.455 -13.097 1.00 0.00 C ATOM 2142 C ASP A 144 0.306 2.535 -14.275 1.00 0.00 C ATOM 2143 O ASP A 144 0.984 2.592 -15.301 1.00 0.00 O ATOM 2144 CB ASP A 144 0.642 4.908 -13.574 1.00 0.00 C ATOM 2145 CG ASP A 144 -0.659 5.358 -14.227 1.00 0.00 C ATOM 2146 OD1 ASP A 144 -1.530 4.539 -14.393 1.00 0.00 O ATOM 2147 OD2 ASP A 144 -0.767 6.517 -14.551 1.00 0.00 O ATOM 0 H ASP A 144 2.683 3.480 -12.882 1.00 0.00 H new ATOM 0 HA ASP A 144 -0.204 3.343 -12.366 1.00 0.00 H new ATOM 0 HB2 ASP A 144 0.860 5.557 -12.726 1.00 0.00 H new ATOM 0 HB3 ASP A 144 1.460 5.027 -14.285 1.00 0.00 H new ATOM 2152 N GLU A 145 -0.706 1.688 -14.123 1.00 0.00 N ATOM 2153 CA GLU A 145 -1.035 0.697 -15.140 1.00 0.00 C ATOM 2154 C GLU A 145 -2.151 1.193 -16.052 1.00 0.00 C ATOM 2155 O GLU A 145 -2.992 1.991 -15.640 1.00 0.00 O ATOM 2156 CB GLU A 145 -1.447 -0.624 -14.486 1.00 0.00 C ATOM 2157 CG GLU A 145 -0.368 -1.262 -13.624 1.00 0.00 C ATOM 2158 CD GLU A 145 0.892 -1.560 -14.389 1.00 0.00 C ATOM 2159 OE1 GLU A 145 0.814 -2.245 -15.381 1.00 0.00 O ATOM 2160 OE2 GLU A 145 1.933 -1.102 -13.982 1.00 0.00 O ATOM 0 H GLU A 145 -1.313 1.668 -13.304 1.00 0.00 H new ATOM 0 HA GLU A 145 -0.143 0.534 -15.745 1.00 0.00 H new ATOM 0 HB2 GLU A 145 -2.331 -0.451 -13.872 1.00 0.00 H new ATOM 0 HB3 GLU A 145 -1.734 -1.328 -15.267 1.00 0.00 H new ATOM 0 HG2 GLU A 145 -0.134 -0.597 -12.793 1.00 0.00 H new ATOM 0 HG3 GLU A 145 -0.753 -2.187 -13.194 1.00 0.00 H new ATOM 2167 N PRO A 146 -2.151 0.715 -17.292 1.00 0.00 N ATOM 2168 CA PRO A 146 -3.144 1.135 -18.274 1.00 0.00 C ATOM 2169 C PRO A 146 -4.475 0.431 -18.047 1.00 0.00 C ATOM 2170 O PRO A 146 -5.297 0.967 -17.855 1.00 0.00 O ATOM 2171 CB PRO A 146 -2.506 0.723 -19.605 1.00 0.00 C ATOM 2172 CG PRO A 146 -1.692 -0.478 -19.264 1.00 0.00 C ATOM 2173 CD PRO A 146 -1.136 -0.178 -17.898 1.00 0.00 C ATOM 2174 OXT PRO A 146 -4.537 -0.766 -18.098 1.00 0.00 O ATOM 0 HA PRO A 146 -3.377 2.199 -18.226 1.00 0.00 H new ATOM 0 HB2 PRO A 146 -3.263 0.491 -20.355 1.00 0.00 H new ATOM 0 HB3 PRO A 146 -1.886 1.521 -20.014 1.00 0.00 H new ATOM 0 HG2 PRO A 146 -2.301 -1.382 -19.255 1.00 0.00 H new ATOM 0 HG3 PRO A 146 -0.896 -0.638 -19.991 1.00 0.00 H new ATOM 0 HD2 PRO A 146 -1.002 -1.087 -17.312 1.00 0.00 H new ATOM 0 HD3 PRO A 146 -0.162 0.307 -17.960 1.00 0.00 H new